Browse entries in the PDBbind-CN Database
HEADER DE NOVO PROTEIN 08-AUG-16 5SWK TITLE CRYSTAL STRUCTURE OF P53 EPITOPE-SCAFFOLD BASED ON A INHIBITOR OF TITLE 2 CYSTEINE PROTEASES IN COMPLEX WITH HUMAN MDM2 COMPND MOL_ID: 1; COMPND 2 MOLECULE: E3 UBIQUITIN-PROTEIN LIGASE MDM2; COMPND 3 CHAIN: A, B; COMPND 4 FRAGMENT: UNP RESIDUES 1-150; COMPND 5 SYNONYM: DOUBLE MINUTE 2 PROTEIN,HDM2,ONCOPROTEIN MDM2,P53-BINDING COMPND 6 PROTEIN MDM2; COMPND 7 EC: 6.3.2.-; COMPND 8 ENGINEERED: YES; COMPND 9 MOL_ID: 2; COMPND 10 MOLECULE: DE NOVO PROTEIN BASED ON THE INHIBITOR AMOEBIASIN-1; COMPND 11 CHAIN: C, D; COMPND 12 SYNONYM: CYSTEINE PROTEASE INHIBITOR 1,EHICP1,ICP-1; COMPND 13 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: MDM2; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 MOL_ID: 2; SOURCE 9 ORGANISM_SCIENTIFIC: ENTAMOEBA HISTOLYTICA; SOURCE 10 ORGANISM_TAXID: 5759; SOURCE 11 GENE: AMS, ICP1; SOURCE 12 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 13 EXPRESSION_SYSTEM_TAXID: 562 KEYWDS PEPTIDOMIMETICS, BIOSENSOR, SCAFFOLD, DESIGNED, DE NOVO PROTEIN EXPDTA X-RAY DIFFRACTION AUTHOR P.JIMENEZ-SANDOVAL,L.G.BRIEBA REVDAT 3 15-JAN-20 5SWK 1 REMARK REVDAT 2 01-MAY-19 5SWK 1 JRNL REVDAT 1 18-OCT-17 5SWK 0 JRNL AUTH P.JIMENEZ-SANDOVAL,E.A.MADRIGAL-CARRILLO, JRNL AUTH 2 H.A.SANTAMARIA-SUAREZ,D.MATURANA,I.RENTERIA-GONZALEZ, JRNL AUTH 3 C.G.BENITEZ-CARDOZA,A.TORRES-LARIOS,L.G.BRIEBA JRNL TITL MIMICKING A P53-MDM2 INTERACTION BASED ON A STABLE JRNL TITL 2 IMMUNOGLOBULIN-LIKE DOMAIN SCAFFOLD. JRNL REF PROTEINS V. 86 802 2018 JRNL REFN ESSN 1097-0134 JRNL PMID 29696695 JRNL DOI 10.1002/PROT.25519 REMARK 2 REMARK 2 RESOLUTION. 1.92 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX 1.9-1692 REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE, REMARK 3 : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER, REMARK 3 : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY, REMARK 3 : REETAL PAI,RANDY READ,JANE RICHARDSON, REMARK 3 : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI, REMARK 3 : NICHOLAS SAUTER,JACOB SMITH,LAURENT REMARK 3 : STORONI,TOM TERWILLIGER,PETER ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : NULL REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.92 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 48.99 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.340 REMARK 3 COMPLETENESS FOR RANGE (%) : 100.0 REMARK 3 NUMBER OF REFLECTIONS : 48093 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.223 REMARK 3 R VALUE (WORKING SET) : 0.221 REMARK 3 FREE R VALUE : 0.249 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.140 REMARK 3 FREE R VALUE TEST SET COUNT : 2474 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 49.0049 - 5.0381 1.00 2762 170 0.2215 0.2512 REMARK 3 2 5.0381 - 3.9995 1.00 2609 140 0.1703 0.2069 REMARK 3 3 3.9995 - 3.4941 1.00 2574 134 0.1907 0.2153 REMARK 3 4 3.4941 - 3.1747 1.00 2583 131 0.2121 0.2337 REMARK 3 5 3.1747 - 2.9472 1.00 2532 140 0.2272 0.2476 REMARK 3 6 2.9472 - 2.7734 1.00 2550 130 0.2272 0.2345 REMARK 3 7 2.7734 - 2.6345 1.00 2506 145 0.2275 0.2562 REMARK 3 8 2.6345 - 2.5198 1.00 2521 143 0.2377 0.2792 REMARK 3 9 2.5198 - 2.4228 1.00 2510 129 0.2227 0.2482 REMARK 3 10 2.4228 - 2.3392 1.00 2522 138 0.2318 0.2446 REMARK 3 11 2.3392 - 2.2661 1.00 2499 132 0.2319 0.2638 REMARK 3 12 2.2661 - 2.2013 1.00 2509 124 0.2423 0.2965 REMARK 3 13 2.2013 - 2.1434 1.00 2519 110 0.2549 0.2959 REMARK 3 14 2.1434 - 2.0911 1.00 2481 143 0.2697 0.2991 REMARK 3 15 2.0911 - 2.0435 1.00 2507 142 0.2923 0.3088 REMARK 3 16 2.0435 - 2.0000 1.00 2463 159 0.3028 0.3142 REMARK 3 17 2.0000 - 1.9600 1.00 2488 132 0.3102 0.3642 REMARK 3 18 1.9600 - 1.9231 1.00 2484 132 0.3297 0.3270 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : NULL REMARK 3 SOLVENT RADIUS : 1.11 REMARK 3 SHRINKAGE RADIUS : 0.90 REMARK 3 K_SOL : NULL REMARK 3 B_SOL : NULL REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.250 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 24.790 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 29.46 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 32.32 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 TWINNING INFORMATION. REMARK 3 FRACTION: NULL REMARK 3 OPERATOR: NULL REMARK 3 REMARK 3 DEVIATIONS FROM IDEAL VALUES. REMARK 3 RMSD COUNT REMARK 3 BOND : 0.005 2960 REMARK 3 ANGLE : 0.832 4031 REMARK 3 CHIRALITY : 0.033 471 REMARK 3 PLANARITY : 0.005 501 REMARK 3 DIHEDRAL : 11.945 1033 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 5SWK COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 24-AUG-16. REMARK 100 THE DEPOSITION ID IS D_1000222782. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 15-MAR-15 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 8.0 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 21-ID-F REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.97872 REMARK 200 MONOCHROMATOR : DIAMOND [111] REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARMOSAIC 225 MM CCD REMARK 200 INTENSITY-INTEGRATION SOFTWARE : IMOSFLM REMARK 200 DATA SCALING SOFTWARE : AIMLESS 0.5.25 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 48192 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.920 REMARK 200 RESOLUTION RANGE LOW (A) : 61.770 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 100.0 REMARK 200 DATA REDUNDANCY : 7.300 REMARK 200 R MERGE (I) : 0.14800 REMARK 200 R SYM (I) : 0.16000 REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 9.8000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.92 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.97 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : 7.10 REMARK 200 R MERGE FOR SHELL (I) : 2.20100 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER 2.5.6 REMARK 200 STARTING MODEL: MODIFIED 3EQS AND 3M86 REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 53.06 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.62 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.1 M NACL 0.1 M HEPES PH 7.5 1.6 M REMARK 280 (NH4)2SO4, PH 8.0, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE REMARK 280 292K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 43 21 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z+1/2 REMARK 290 3555 -Y+1/2,X+1/2,Z+3/4 REMARK 290 4555 Y+1/2,-X+1/2,Z+1/4 REMARK 290 5555 -X+1/2,Y+1/2,-Z+3/4 REMARK 290 6555 X+1/2,-Y+1/2,-Z+1/4 REMARK 290 7555 Y,X,-Z REMARK 290 8555 -Y,-X,-Z+1/2 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 80.42000 REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 43.68050 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 43.68050 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 120.63000 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 43.68050 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 43.68050 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 40.21000 REMARK 290 SMTRY1 5 -1.000000 0.000000 0.000000 43.68050 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 43.68050 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 120.63000 REMARK 290 SMTRY1 6 1.000000 0.000000 0.000000 43.68050 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 43.68050 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 40.21000 REMARK 290 SMTRY1 7 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 7 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 8 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 80.42000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TETRAMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TETRAMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 8850 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 18920 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -128.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B, C, D 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 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLY A -2 REMARK 465 PRO A -1 REMARK 465 HIS A 0 REMARK 465 MET A 1 REMARK 465 CYS A 2 REMARK 465 ASN A 3 REMARK 465 THR A 4 REMARK 465 ASN A 5 REMARK 465 MET A 6 REMARK 465 SER A 7 REMARK 465 VAL A 8 REMARK 465 PRO A 9 REMARK 465 THR A 10 REMARK 465 ASP A 11 REMARK 465 GLY A 12 REMARK 465 ALA A 13 REMARK 465 VAL A 14 REMARK 465 THR A 15 REMARK 465 THR A 16 REMARK 465 SER A 17 REMARK 465 GLN A 18 REMARK 465 ILE A 19 REMARK 465 PRO A 20 REMARK 465 ALA A 21 REMARK 465 SER A 22 REMARK 465 GLU A 23 REMARK 465 GLN A 24 REMARK 465 GLU A 25 REMARK 465 THR A 26 REMARK 465 ASN A 111 REMARK 465 GLN A 112 REMARK 465 GLN A 113 REMARK 465 GLU A 114 REMARK 465 SER A 115 REMARK 465 SER A 116 REMARK 465 ASP A 117 REMARK 465 SER A 118 REMARK 465 GLY A 119 REMARK 465 THR A 120 REMARK 465 SER A 121 REMARK 465 VAL A 122 REMARK 465 SER A 123 REMARK 465 GLU A 124 REMARK 465 ASN A 125 REMARK 465 ARG A 126 REMARK 465 CYS A 127 REMARK 465 HIS A 128 REMARK 465 LEU A 129 REMARK 465 GLU A 130 REMARK 465 GLY A 131 REMARK 465 GLY A 132 REMARK 465 SER A 133 REMARK 465 ASP A 134 REMARK 465 GLN A 135 REMARK 465 LYS A 136 REMARK 465 ASP A 137 REMARK 465 LEU A 138 REMARK 465 VAL A 139 REMARK 465 GLN A 140 REMARK 465 GLU A 141 REMARK 465 LEU A 142 REMARK 465 GLN A 143 REMARK 465 GLU A 144 REMARK 465 GLU A 145 REMARK 465 LYS A 146 REMARK 465 PRO A 147 REMARK 465 SER A 148 REMARK 465 SER A 149 REMARK 465 SER A 150 REMARK 465 GLY B -2 REMARK 465 PRO B -1 REMARK 465 HIS B 0 REMARK 465 MET B 1 REMARK 465 CYS B 2 REMARK 465 ASN B 3 REMARK 465 THR B 4 REMARK 465 ASN B 5 REMARK 465 MET B 6 REMARK 465 SER B 7 REMARK 465 VAL B 8 REMARK 465 PRO B 9 REMARK 465 THR B 10 REMARK 465 ASP B 11 REMARK 465 GLY B 12 REMARK 465 ALA B 13 REMARK 465 VAL B 14 REMARK 465 THR B 15 REMARK 465 THR B 16 REMARK 465 SER B 17 REMARK 465 GLN B 18 REMARK 465 ILE B 19 REMARK 465 PRO B 20 REMARK 465 ALA B 21 REMARK 465 SER B 22 REMARK 465 GLU B 23 REMARK 465 GLN B 24 REMARK 465 GLU B 25 REMARK 465 ASN B 111 REMARK 465 GLN B 112 REMARK 465 GLN B 113 REMARK 465 GLU B 114 REMARK 465 SER B 115 REMARK 465 SER B 116 REMARK 465 ASP B 117 REMARK 465 SER B 118 REMARK 465 GLY B 119 REMARK 465 THR B 120 REMARK 465 SER B 121 REMARK 465 VAL B 122 REMARK 465 SER B 123 REMARK 465 GLU B 124 REMARK 465 ASN B 125 REMARK 465 ARG B 126 REMARK 465 CYS B 127 REMARK 465 HIS B 128 REMARK 465 LEU B 129 REMARK 465 GLU B 130 REMARK 465 GLY B 131 REMARK 465 GLY B 132 REMARK 465 SER B 133 REMARK 465 ASP B 134 REMARK 465 GLN B 135 REMARK 465 LYS B 136 REMARK 465 ASP B 137 REMARK 465 LEU B 138 REMARK 465 VAL B 139 REMARK 465 GLN B 140 REMARK 465 GLU B 141 REMARK 465 LEU B 142 REMARK 465 GLN B 143 REMARK 465 GLU B 144 REMARK 465 GLU B 145 REMARK 465 LYS B 146 REMARK 465 PRO B 147 REMARK 465 SER B 148 REMARK 465 SER B 149 REMARK 465 SER B 150 REMARK 465 GLY C -2 REMARK 465 PRO C -1 REMARK 465 HIS C 0 REMARK 465 MET C 1 REMARK 465 ALA C 54 REMARK 465 PRO C 55 REMARK 465 GLY C 56 REMARK 465 ILE C 57 REMARK 465 SER C 58 REMARK 465 GLY C 59 REMARK 465 GLY D -2 REMARK 465 PRO D -1 REMARK 465 HIS D 0 REMARK 465 ALA D 54 REMARK 465 PRO D 55 REMARK 465 GLY D 56 REMARK 465 ILE D 57 REMARK 465 SER D 58 REMARK 465 GLY D 59 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 LEU A 27 CG CD1 CD2 REMARK 470 ARG A 29 CG CD NE CZ NH1 NH2 REMARK 470 LYS A 36 CE NZ REMARK 470 LEU A 37 CG CD1 CD2 REMARK 470 GLN A 44 CG CD OE1 NE2 REMARK 470 LYS A 51 CG CD CE NZ REMARK 470 GLU A 69 CD OE1 OE2 REMARK 470 GLU A 95 CD OE1 OE2 REMARK 470 ARG A 97 CG CD NE CZ NH1 NH2 REMARK 470 LYS A 98 CG CD CE NZ REMARK 470 VAL A 108 CG1 CG2 REMARK 470 VAL A 109 CG1 CG2 REMARK 470 VAL A 110 CG1 CG2 REMARK 470 THR B 26 OG1 CG2 REMARK 470 LEU B 27 CD1 CD2 REMARK 470 ARG B 29 CG CD NE CZ NH1 NH2 REMARK 470 LYS B 36 CG CD CE NZ REMARK 470 SER C 2 OG REMARK 470 THR C 13 OG1 CG2 REMARK 470 LYS C 16 CG CD CE NZ REMARK 470 LYS C 20 CD CE NZ REMARK 470 GLU C 40 CG CD OE1 OE2 REMARK 470 GLU C 47 CG CD OE1 OE2 REMARK 470 SER C 60 OG REMARK 470 LYS C 63 CD CE NZ REMARK 470 LYS C 67 CG CD CE NZ REMARK 470 GLN C 72 CG CD OE1 NE2 REMARK 470 GLU C 75 CG CD OE1 OE2 REMARK 470 ARG C 83 NE CZ NH1 NH2 REMARK 470 ARG C 98 CG CD NE CZ NH1 NH2 REMARK 470 LYS C 103 CD CE NZ REMARK 470 GLU D 40 CG CD OE1 OE2 REMARK 470 GLU D 47 CG CD OE1 OE2 REMARK 470 SER D 60 OG REMARK 470 LYS D 67 CD CE NZ REMARK 470 GLU D 75 CG CD OE1 OE2 REMARK 470 LYS D 77 CE NZ REMARK 470 ARG D 83 NE CZ NH1 NH2 REMARK 470 LYS D 103 CD CE NZ REMARK 470 GLN D 107 CG CD OE1 NE2 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 CYS B 77 15.68 -145.15 REMARK 500 SER C 39 66.37 -156.54 REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue CL A 201 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue CL A 202 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue SO4 B 201 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue CL B 202 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue CL B 203 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue CL B 204 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue CL B 205 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue SO4 C 201 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC9 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue CL D 201 REMARK 800 REMARK 800 SITE_IDENTIFIER: AD1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue GOL D 202 DBREF 5SWK A 1 150 UNP Q00987 MDM2_HUMAN 1 150 DBREF 5SWK B 1 150 UNP Q00987 MDM2_HUMAN 1 150 DBREF 5SWK C -2 107 PDB 5SWK 5SWK -2 107 DBREF 5SWK D -2 107 PDB 5SWK 5SWK -2 107 SEQADV 5SWK GLY A -2 UNP Q00987 EXPRESSION TAG SEQADV 5SWK PRO A -1 UNP Q00987 EXPRESSION TAG SEQADV 5SWK HIS A 0 UNP Q00987 EXPRESSION TAG SEQADV 5SWK GLY B -2 UNP Q00987 EXPRESSION TAG SEQADV 5SWK PRO B -1 UNP Q00987 EXPRESSION TAG SEQADV 5SWK HIS B 0 UNP Q00987 EXPRESSION TAG SEQRES 1 A 153 GLY PRO HIS MET CYS ASN THR ASN MET SER VAL PRO THR SEQRES 2 A 153 ASP GLY ALA VAL THR THR SER GLN ILE PRO ALA SER GLU SEQRES 3 A 153 GLN GLU THR LEU VAL ARG PRO LYS PRO LEU LEU LEU LYS SEQRES 4 A 153 LEU LEU LYS SER VAL GLY ALA GLN LYS ASP THR TYR THR SEQRES 5 A 153 MET LYS GLU VAL LEU PHE TYR LEU GLY GLN TYR ILE MET SEQRES 6 A 153 THR LYS ARG LEU TYR ASP GLU LYS GLN GLN HIS ILE VAL SEQRES 7 A 153 TYR CYS SER ASN ASP LEU LEU GLY ASP LEU PHE GLY VAL SEQRES 8 A 153 PRO SER PHE SER VAL LYS GLU HIS ARG LYS ILE TYR THR SEQRES 9 A 153 MET ILE TYR ARG ASN LEU VAL VAL VAL ASN GLN GLN GLU SEQRES 10 A 153 SER SER ASP SER GLY THR SER VAL SER GLU ASN ARG CYS SEQRES 11 A 153 HIS LEU GLU GLY GLY SER ASP GLN LYS ASP LEU VAL GLN SEQRES 12 A 153 GLU LEU GLN GLU GLU LYS PRO SER SER SER SEQRES 1 B 153 GLY PRO HIS MET CYS ASN THR ASN MET SER VAL PRO THR SEQRES 2 B 153 ASP GLY ALA VAL THR THR SER GLN ILE PRO ALA SER GLU SEQRES 3 B 153 GLN GLU THR LEU VAL ARG PRO LYS PRO LEU LEU LEU LYS SEQRES 4 B 153 LEU LEU LYS SER VAL GLY ALA GLN LYS ASP THR TYR THR SEQRES 5 B 153 MET LYS GLU VAL LEU PHE TYR LEU GLY GLN TYR ILE MET SEQRES 6 B 153 THR LYS ARG LEU TYR ASP GLU LYS GLN GLN HIS ILE VAL SEQRES 7 B 153 TYR CYS SER ASN ASP LEU LEU GLY ASP LEU PHE GLY VAL SEQRES 8 B 153 PRO SER PHE SER VAL LYS GLU HIS ARG LYS ILE TYR THR SEQRES 9 B 153 MET ILE TYR ARG ASN LEU VAL VAL VAL ASN GLN GLN GLU SEQRES 10 B 153 SER SER ASP SER GLY THR SER VAL SER GLU ASN ARG CYS SEQRES 11 B 153 HIS LEU GLU GLY GLY SER ASP GLN LYS ASP LEU VAL GLN SEQRES 12 B 153 GLU LEU GLN GLU GLU LYS PRO SER SER SER SEQRES 1 C 110 GLY PRO HIS MET SER LEU THR GLU ASP ASN ASN ASN THR SEQRES 2 C 110 THR ILE THR ILE ALA LYS GLY GLU ASN LYS GLU ILE ILE SEQRES 3 C 110 LEU HIS GLY ASN PRO THR THR GLY TYR SER TRP VAL VAL SEQRES 4 C 110 ASP SER SER GLU GLY LEU SER ASN THR VAL GLU TYR VAL SEQRES 5 C 110 ALA ASP GLN HIS ALA PRO GLY ILE SER GLY SER GLY GLY SEQRES 6 C 110 LYS TYR HIS ILE LYS ILE THR GLY THR GLN THR GLY GLU SEQRES 7 C 110 GLY LYS ILE VAL LEU VAL TYR ARG ARG THR SER PHE ALA SEQRES 8 C 110 GLU TYR TRP ASN LEU LEU SER PRO ASP ARG THR PHE THR SEQRES 9 C 110 LEU LYS VAL ASN VAL GLN SEQRES 1 D 110 GLY PRO HIS MET SER LEU THR GLU ASP ASN ASN ASN THR SEQRES 2 D 110 THR ILE THR ILE ALA LYS GLY GLU ASN LYS GLU ILE ILE SEQRES 3 D 110 LEU HIS GLY ASN PRO THR THR GLY TYR SER TRP VAL VAL SEQRES 4 D 110 ASP SER SER GLU GLY LEU SER ASN THR VAL GLU TYR VAL SEQRES 5 D 110 ALA ASP GLN HIS ALA PRO GLY ILE SER GLY SER GLY GLY SEQRES 6 D 110 LYS TYR HIS ILE LYS ILE THR GLY THR GLN THR GLY GLU SEQRES 7 D 110 GLY LYS ILE VAL LEU VAL TYR ARG ARG THR SER PHE ALA SEQRES 8 D 110 GLU TYR TRP ASN LEU LEU SER PRO ASP ARG THR PHE THR SEQRES 9 D 110 LEU LYS VAL ASN VAL GLN HET CL A 201 1 HET CL A 202 1 HET SO4 B 201 10 HET CL B 202 1 HET CL B 203 1 HET CL B 204 1 HET CL B 205 1 HET SO4 C 201 5 HET CL D 201 1 HET GOL D 202 6 HETNAM CL CHLORIDE ION HETNAM SO4 SULFATE ION HETNAM GOL GLYCEROL HETSYN GOL GLYCERIN; PROPANE-1,2,3-TRIOL FORMUL 5 CL 7(CL 1-) FORMUL 7 SO4 2(O4 S 2-) FORMUL 14 GOL C3 H8 O3 FORMUL 15 HOH *157(H2 O) HELIX 1 AA1 LYS A 31 SER A 40 1 10 HELIX 2 AA2 THR A 49 LYS A 64 1 16 HELIX 3 AA3 ASP A 80 GLY A 87 1 8 HELIX 4 AA4 GLU A 95 ARG A 105 1 11 HELIX 5 AA5 LYS B 31 VAL B 41 1 11 HELIX 6 AA6 MET B 50 LYS B 64 1 15 HELIX 7 AA7 ASP B 80 GLY B 87 1 8 HELIX 8 AA8 GLU B 95 ARG B 105 1 11 HELIX 9 AA9 THR C 4 ASN C 8 5 5 HELIX 10 AB1 ASN C 27 GLY C 31 5 5 HELIX 11 AB2 SER C 86 LEU C 93 1 8 HELIX 12 AB3 THR D 4 ASN D 8 5 5 HELIX 13 AB4 ASN D 27 GLY D 31 5 5 HELIX 14 AB5 SER D 86 LEU D 93 1 8 SHEET 1 AA1 2 VAL A 28 PRO A 30 0 SHEET 2 AA1 2 LEU A 107 VAL A 109 -1 O VAL A 108 N ARG A 29 SHEET 1 AA2 2 ILE A 74 TYR A 76 0 SHEET 2 AA2 2 SER A 90 SER A 92 -1 O PHE A 91 N VAL A 75 SHEET 1 AA3 3 TYR B 48 THR B 49 0 SHEET 2 AA3 3 LEU B 27 PRO B 30 -1 N VAL B 28 O TYR B 48 SHEET 3 AA3 3 LEU B 107 VAL B 109 -1 O VAL B 108 N ARG B 29 SHEET 1 AA4 2 ILE B 74 TYR B 76 0 SHEET 2 AA4 2 SER B 90 SER B 92 -1 O PHE B 91 N VAL B 75 SHEET 1 AA5 4 THR C 10 ILE C 14 0 SHEET 2 AA5 4 ARG D 98 VAL D 106 1 O ASN D 105 N ILE C 12 SHEET 3 AA5 4 GLY C 74 ARG C 83 -1 N LEU C 80 O PHE D 100 SHEET 4 AA5 4 SER C 33 GLU C 40 -1 N ASP C 37 O VAL C 79 SHEET 1 AA6 3 ASN C 19 GLY C 26 0 SHEET 2 AA6 3 GLY C 62 GLY C 70 -1 O TYR C 64 N LEU C 24 SHEET 3 AA6 3 LEU C 42 ALA C 50 -1 N GLU C 47 O HIS C 65 SHEET 1 AA7 4 THR D 10 ALA D 15 0 SHEET 2 AA7 4 ARG C 98 GLN C 107 1 N ASN C 105 O ILE D 12 SHEET 3 AA7 4 GLY D 74 ARG D 83 -1 O LEU D 80 N PHE C 100 SHEET 4 AA7 4 SER D 33 GLU D 40 -1 N SER D 38 O VAL D 79 SHEET 1 AA8 3 ASN D 19 GLY D 26 0 SHEET 2 AA8 3 GLY D 62 GLY D 70 -1 O TYR D 64 N LEU D 24 SHEET 3 AA8 3 LEU D 42 ALA D 50 -1 N GLU D 47 O HIS D 65 SITE 1 AC1 3 LYS A 45 ASP A 46 THR A 47 SITE 1 AC2 2 GLN A 71 HIS A 73 SITE 1 AC3 5 LYS B 94 GLU B 95 HIS B 96 ARG B 97 SITE 2 AC3 5 LYS B 98 SITE 1 AC4 2 ASP B 46 THR B 47 SITE 1 AC5 2 MET B 62 HOH B 329 SITE 1 AC6 2 GLU B 95 LYS B 98 SITE 1 AC7 2 GLN B 71 HIS B 73 SITE 1 AC8 5 GLU C 40 GLY C 41 GLY D 41 HOH D 302 SITE 2 AC8 5 HOH D 325 SITE 1 AC9 1 THR D 11 SITE 1 AD1 4 THR C 73 LYS D 16 GLN D 72 THR D 73 CRYST1 87.361 87.361 160.840 90.00 90.00 90.00 P 43 21 2 16 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 0.011447 0.000000 0.000000 0.00000 SCALE2 0.000000 0.011447 0.000000 0.00000 SCALE3 0.000000 0.000000 0.006217 0.00000 ATOM 1 N LEU A 27 20.880 -6.859 13.497 1.00 48.06 N ATOM 2 CA LEU A 27 21.476 -8.168 13.742 1.00 46.00 C ATOM 3 C LEU A 27 21.478 -9.010 12.469 1.00 46.79 C ATOM 4 O LEU A 27 20.439 -9.187 11.837 1.00 45.81 O ATOM 5 CB LEU A 27 20.734 -8.902 14.858 1.00 44.26 C ATOM 6 N VAL A 28 22.647 -9.528 12.100 1.00 44.40 N ATOM 7 CA VAL A 28 22.802 -10.248 10.838 1.00 43.19 C ATOM 8 C VAL A 28 23.518 -11.581 11.017 1.00 41.35 C ATOM 9 O VAL A 28 24.242 -11.786 11.991 1.00 39.78 O ATOM 10 CB VAL A 28 23.577 -9.408 9.811 1.00 39.10 C ATOM 11 CG1 VAL A 28 22.817 -8.143 9.486 1.00 40.08 C ATOM 12 CG2 VAL A 28 24.968 -9.078 10.341 1.00 38.28 C ATOM 13 N ARG A 29 23.300 -12.487 10.072 1.00 38.21 N ATOM 14 CA ARG A 29 23.967 -13.783 10.079 1.00 38.88 C ATOM 15 C ARG A 29 24.812 -13.960 8.815 1.00 37.90 C ATOM 16 O ARG A 29 24.273 -14.195 7.735 1.00 35.35 O ATOM 17 CB ARG A 29 22.941 -14.915 10.190 1.00 40.88 C ATOM 18 N PRO A 30 26.140 -13.837 8.951 1.00 39.84 N ATOM 19 CA PRO A 30 27.056 -13.983 7.813 1.00 33.69 C ATOM 20 C PRO A 30 26.947 -15.344 7.142 1.00 35.41 C ATOM 21 O PRO A 30 26.915 -16.363 7.827 1.00 32.33 O ATOM 22 CB PRO A 30 28.439 -13.813 8.448 1.00 31.77 C ATOM 23 CG PRO A 30 28.190 -12.987 9.666 1.00 37.16 C ATOM 24 CD PRO A 30 26.850 -13.446 10.180 1.00 35.43 C ATOM 25 N LYS A 31 26.903 -15.352 5.813 1.00 33.23 N ATOM 26 CA LYS A 31 26.936 -16.599 5.067 1.00 32.61 C ATOM 27 C LYS A 31 28.329 -17.225 5.208 1.00 31.80 C ATOM 28 O LYS A 31 29.264 -16.538 5.613 1.00 31.89 O ATOM 29 CB LYS A 31 26.551 -16.338 3.610 1.00 32.89 C ATOM 30 CG LYS A 31 25.137 -15.816 3.478 1.00 31.76 C ATOM 31 CD LYS A 31 24.717 -15.675 2.025 1.00 36.46 C ATOM 32 CE LYS A 31 23.351 -15.032 1.934 1.00 34.49 C ATOM 33 NZ LYS A 31 22.983 -14.741 0.526 1.00 44.92 N1+ ATOM 34 N PRO A 32 28.469 -18.531 4.900 1.00 34.25 N ATOM 35 CA PRO A 32 29.686 -19.289 5.228 1.00 30.06 C ATOM 36 C PRO A 32 31.026 -18.659 4.852 1.00 32.55 C ATOM 37 O PRO A 32 31.945 -18.691 5.666 1.00 29.62 O ATOM 38 CB PRO A 32 29.494 -20.590 4.447 1.00 35.63 C ATOM 39 CG PRO A 32 28.031 -20.792 4.456 1.00 37.09 C ATOM 40 CD PRO A 32 27.432 -19.414 4.328 1.00 33.32 C ATOM 41 N LEU A 33 31.156 -18.120 3.647 1.00 31.11 N ATOM 42 CA LEU A 33 32.443 -17.575 3.229 1.00 29.57 C ATOM 43 C LEU A 33 32.793 -16.325 4.043 1.00 26.16 C ATOM 44 O LEU A 33 33.929 -16.161 4.490 1.00 24.93 O ATOM 45 CB LEU A 33 32.426 -17.267 1.722 1.00 30.09 C ATOM 46 CG LEU A 33 33.759 -16.893 1.079 1.00 30.91 C ATOM 47 CD1 LEU A 33 34.790 -17.971 1.347 1.00 35.88 C ATOM 48 CD2 LEU A 33 33.589 -16.680 -0.433 1.00 30.68 C ATOM 49 N LEU A 34 31.816 -15.445 4.234 1.00 23.81 N ATOM 50 CA LEU A 34 32.027 -14.248 5.037 1.00 24.85 C ATOM 51 C LEU A 34 32.323 -14.639 6.479 1.00 27.27 C ATOM 52 O LEU A 34 33.175 -14.041 7.133 1.00 25.00 O ATOM 53 CB LEU A 34 30.806 -13.321 4.985 1.00 23.94 C ATOM 54 CG LEU A 34 30.884 -12.076 5.871 1.00 28.80 C ATOM 55 CD1 LEU A 34 32.169 -11.292 5.591 1.00 26.50 C ATOM 56 CD2 LEU A 34 29.658 -11.194 5.687 1.00 27.43 C ATOM 57 N LEU A 35 31.618 -15.651 6.968 1.00 26.74 N ATOM 58 CA LEU A 35 31.816 -16.091 8.344 1.00 28.98 C ATOM 59 C LEU A 35 33.246 -16.579 8.533 1.00 29.23 C ATOM 60 O LEU A 35 33.897 -16.235 9.519 1.00 28.90 O ATOM 61 CB LEU A 35 30.822 -17.186 8.714 1.00 29.31 C ATOM 62 CG LEU A 35 30.760 -17.538 10.207 1.00 33.54 C ATOM 63 CD1 LEU A 35 30.403 -16.318 11.043 1.00 32.36 C ATOM 64 CD2 LEU A 35 29.762 -18.660 10.442 1.00 33.73 C ATOM 65 N LYS A 36 33.737 -17.353 7.567 1.00 26.89 N ATOM 66 CA LYS A 36 35.110 -17.854 7.598 1.00 27.03 C ATOM 67 C LYS A 36 36.143 -16.717 7.666 1.00 29.81 C ATOM 68 O LYS A 36 37.124 -16.803 8.407 1.00 30.27 O ATOM 69 CB LYS A 36 35.376 -18.741 6.381 1.00 29.63 C ATOM 70 CG LYS A 36 36.797 -19.293 6.303 1.00 31.00 C ATOM 71 CD LYS A 36 37.043 -20.015 4.979 1.00 35.49 C ATOM 72 N LEU A 37 35.916 -15.648 6.908 1.00 28.44 N ATOM 73 CA LEU A 37 36.807 -14.492 6.961 1.00 26.37 C ATOM 74 C LEU A 37 36.829 -13.851 8.349 1.00 26.47 C ATOM 75 O LEU A 37 37.895 -13.644 8.923 1.00 26.20 O ATOM 76 CB LEU A 37 36.403 -13.447 5.912 1.00 26.82 C ATOM 77 N LEU A 38 35.655 -13.536 8.881 1.00 23.73 N ATOM 78 CA LEU A 38 35.571 -12.900 10.191 1.00 30.71 C ATOM 79 C LEU A 38 36.243 -13.748 11.272 1.00 32.51 C ATOM 80 O LEU A 38 36.926 -13.224 12.155 1.00 29.92 O ATOM 81 CB LEU A 38 34.114 -12.637 10.568 1.00 26.89 C ATOM 82 CG LEU A 38 33.267 -11.889 9.535 1.00 30.07 C ATOM 83 CD1 LEU A 38 31.872 -11.631 10.071 1.00 28.60 C ATOM 84 CD2 LEU A 38 33.929 -10.575 9.094 1.00 28.52 C ATOM 85 N LYS A 39 36.062 -15.061 11.196 1.00 29.91 N ATOM 86 CA LYS A 39 36.586 -15.937 12.238 1.00 31.11 C ATOM 87 C LYS A 39 38.102 -16.091 12.140 1.00 33.38 C ATOM 88 O LYS A 39 38.762 -16.400 13.132 1.00 30.11 O ATOM 89 CB LYS A 39 35.907 -17.309 12.179 1.00 33.08 C ATOM 90 CG LYS A 39 34.430 -17.277 12.566 1.00 33.47 C ATOM 91 CD LYS A 39 33.931 -18.653 13.003 1.00 38.25 C ATOM 92 CE LYS A 39 32.528 -18.572 13.601 1.00 44.63 C ATOM 93 NZ LYS A 39 32.088 -19.859 14.234 1.00 45.99 N1+ ATOM 94 N SER A 40 38.658 -15.858 10.952 1.00 29.75 N ATOM 95 CA SER A 40 40.103 -15.965 10.771 1.00 29.14 C ATOM 96 C SER A 40 40.829 -14.814 11.467 1.00 26.36 C ATOM 97 O SER A 40 42.043 -14.844 11.609 1.00 30.21 O ATOM 98 CB SER A 40 40.474 -15.994 9.288 1.00 32.05 C ATOM 99 OG SER A 40 40.246 -14.735 8.685 1.00 29.13 O ATOM 100 N VAL A 41 40.081 -13.803 11.901 1.00 27.88 N ATOM 101 CA VAL A 41 40.673 -12.697 12.634 1.00 26.56 C ATOM 102 C VAL A 41 40.001 -12.505 13.998 1.00 29.44 C ATOM 103 O VAL A 41 39.943 -11.392 14.516 1.00 31.06 O ATOM 104 CB VAL A 41 40.606 -11.374 11.830 1.00 28.13 C ATOM 105 CG1 VAL A 41 41.595 -11.403 10.666 1.00 24.86 C ATOM 106 CG2 VAL A 41 39.196 -11.109 11.339 1.00 26.58 C ATOM 107 N GLY A 42 39.484 -13.594 14.566 1.00 32.66 N ATOM 108 CA GLY A 42 39.072 -13.598 15.961 1.00 33.12 C ATOM 109 C GLY A 42 37.589 -13.671 16.280 1.00 38.56 C ATOM 110 O GLY A 42 37.223 -13.892 17.436 1.00 40.00 O ATOM 111 N ALA A 43 36.730 -13.473 15.282 1.00 30.77 N ATOM 112 CA ALA A 43 35.290 -13.536 15.516 1.00 35.15 C ATOM 113 C ALA A 43 34.905 -14.917 16.050 1.00 39.29 C ATOM 114 O ALA A 43 35.444 -15.937 15.615 1.00 35.63 O ATOM 115 CB ALA A 43 34.517 -13.217 14.244 1.00 34.77 C ATOM 116 N GLN A 44 33.983 -14.943 17.007 1.00 40.80 N ATOM 117 CA GLN A 44 33.628 -16.191 17.675 1.00 45.20 C ATOM 118 C GLN A 44 32.223 -16.663 17.327 1.00 46.52 C ATOM 119 O GLN A 44 31.992 -17.859 17.153 1.00 53.57 O ATOM 120 CB GLN A 44 33.758 -16.032 19.193 1.00 40.87 C ATOM 121 N LYS A 45 31.288 -15.724 17.217 1.00 42.35 N ATOM 122 CA LYS A 45 29.874 -16.068 17.118 1.00 42.00 C ATOM 123 C LYS A 45 29.379 -16.298 15.692 1.00 46.85 C ATOM 124 O LYS A 45 30.161 -16.345 14.742 1.00 42.56 O ATOM 125 CB LYS A 45 29.033 -14.978 17.788 1.00 46.68 C ATOM 126 CG LYS A 45 29.518 -13.561 17.540 1.00 45.12 C ATOM 127 CD LYS A 45 29.061 -12.618 18.655 1.00 43.09 C ATOM 128 CE LYS A 45 28.936 -11.185 18.159 1.00 43.00 C ATOM 129 NZ LYS A 45 28.650 -10.225 19.266 1.00 47.23 N ATOM 130 N ASP A 46 28.065 -16.453 15.560 1.00 47.38 N ATOM 131 CA ASP A 46 27.442 -16.668 14.263 1.00 45.40 C ATOM 132 C ASP A 46 26.523 -15.511 13.901 1.00 43.96 C ATOM 133 O ASP A 46 26.212 -15.300 12.728 1.00 43.57 O ATOM 134 CB ASP A 46 26.656 -17.979 14.257 1.00 48.83 C ATOM 135 CG ASP A 46 27.556 -19.198 14.266 1.00 51.98 C ATOM 136 OD1 ASP A 46 27.022 -20.325 14.205 1.00 60.33 O ATOM 137 OD2 ASP A 46 28.794 -19.031 14.321 1.00 51.55 O1- ATOM 138 N THR A 47 26.088 -14.768 14.913 1.00 38.57 N ATOM 139 CA THR A 47 25.202 -13.627 14.699 1.00 39.98 C ATOM 140 C THR A 47 25.894 -12.332 15.120 1.00 38.38 C ATOM 141 O THR A 47 26.612 -12.299 16.116 1.00 41.33 O ATOM 142 CB THR A 47 23.874 -13.797 15.468 1.00 43.44 C ATOM 143 OG1 THR A 47 23.284 -15.056 15.119 1.00 45.68 O ATOM 144 CG2 THR A 47 22.899 -12.684 15.120 1.00 41.43 C ATOM 145 N TYR A 48 25.686 -11.267 14.352 1.00 36.00 N ATOM 146 CA TYR A 48 26.440 -10.033 14.546 1.00 36.46 C ATOM 147 C TYR A 48 25.569 -8.815 14.297 1.00 36.25 C ATOM 148 O TYR A 48 24.503 -8.919 13.696 1.00 39.27 O ATOM 149 CB TYR A 48 27.656 -9.980 13.600 1.00 31.40 C ATOM 150 CG TYR A 48 28.657 -11.102 13.756 1.00 31.83 C ATOM 151 CD1 TYR A 48 29.804 -10.933 14.522 1.00 37.82 C ATOM 152 CD2 TYR A 48 28.466 -12.326 13.131 1.00 35.01 C ATOM 153 CE1 TYR A 48 30.726 -11.953 14.663 1.00 38.65 C ATOM 154 CE2 TYR A 48 29.384 -13.352 13.265 1.00 35.86 C ATOM 155 CZ TYR A 48 30.513 -13.160 14.032 1.00 37.83 C ATOM 156 OH TYR A 48 31.430 -14.176 14.178 1.00 40.47 O ATOM 157 N THR A 49 26.032 -7.657 14.755 1.00 33.35 N ATOM 158 CA THR A 49 25.519 -6.394 14.250 1.00 32.80 C ATOM 159 C THR A 49 26.378 -6.020 13.041 1.00 33.60 C ATOM 160 O THR A 49 27.484 -6.542 12.876 1.00 32.08 O ATOM 161 CB THR A 49 25.576 -5.270 15.297 1.00 34.88 C ATOM 162 OG1 THR A 49 26.941 -4.899 15.526 1.00 33.36 O ATOM 163 CG2 THR A 49 24.947 -5.722 16.618 1.00 36.42 C ATOM 164 N MET A 50 25.871 -5.126 12.202 1.00 33.50 N ATOM 165 CA MET A 50 26.634 -4.624 11.066 1.00 34.67 C ATOM 166 C MET A 50 27.932 -3.972 11.529 1.00 34.66 C ATOM 167 O MET A 50 28.959 -4.074 10.857 1.00 31.01 O ATOM 168 CB MET A 50 25.808 -3.623 10.260 1.00 37.30 C ATOM 169 CG MET A 50 24.853 -4.260 9.261 1.00 43.70 C ATOM 170 SD MET A 50 25.703 -5.207 7.978 1.00 44.20 S ATOM 171 CE MET A 50 26.711 -3.934 7.223 1.00 41.91 C ATOM 172 N LYS A 51 27.879 -3.305 12.681 1.00 35.61 N ATOM 173 CA LYS A 51 29.049 -2.621 13.214 1.00 32.48 C ATOM 174 C LYS A 51 30.163 -3.620 13.461 1.00 29.96 C ATOM 175 O LYS A 51 31.322 -3.365 13.123 1.00 31.70 O ATOM 176 CB LYS A 51 28.712 -1.872 14.504 1.00 34.09 C ATOM 177 N GLU A 52 29.803 -4.766 14.031 1.00 27.48 N ATOM 178 CA GLU A 52 30.766 -5.830 14.288 1.00 29.73 C ATOM 179 C GLU A 52 31.315 -6.423 12.994 1.00 25.90 C ATOM 180 O GLU A 52 32.512 -6.669 12.886 1.00 26.06 O ATOM 181 CB GLU A 52 30.137 -6.939 15.126 1.00 26.66 C ATOM 182 CG GLU A 52 29.938 -6.577 16.593 1.00 35.74 C ATOM 183 CD GLU A 52 29.219 -7.668 17.368 1.00 38.01 C ATOM 184 OE1 GLU A 52 28.228 -8.216 16.840 1.00 36.71 O ATOM 185 OE2 GLU A 52 29.649 -7.985 18.497 1.00 40.77 O1- ATOM 186 N VAL A 53 30.434 -6.678 12.032 1.00 29.12 N ATOM 187 CA VAL A 53 30.866 -7.226 10.746 1.00 27.14 C ATOM 188 C VAL A 53 31.886 -6.285 10.115 1.00 24.39 C ATOM 189 O VAL A 53 32.959 -6.716 9.672 1.00 25.11 O ATOM 190 CB VAL A 53 29.680 -7.450 9.795 1.00 28.37 C ATOM 191 CG1 VAL A 53 30.180 -7.795 8.389 1.00 26.24 C ATOM 192 CG2 VAL A 53 28.786 -8.567 10.332 1.00 28.68 C ATOM 193 N LEU A 54 31.562 -4.995 10.110 1.00 24.23 N ATOM 194 CA LEU A 54 32.474 -3.985 9.582 1.00 27.56 C ATOM 195 C LEU A 54 33.788 -3.964 10.365 1.00 25.66 C ATOM 196 O LEU A 54 34.860 -3.790 9.786 1.00 24.68 O ATOM 197 CB LEU A 54 31.819 -2.600 9.600 1.00 25.92 C ATOM 198 CG LEU A 54 30.766 -2.334 8.518 1.00 30.28 C ATOM 199 CD1 LEU A 54 29.940 -1.103 8.871 1.00 32.81 C ATOM 200 CD2 LEU A 54 31.445 -2.155 7.155 1.00 28.86 C ATOM 201 N PHE A 55 33.719 -4.149 11.678 1.00 24.57 N ATOM 202 CA PHE A 55 34.947 -4.185 12.466 1.00 25.34 C ATOM 203 C PHE A 55 35.868 -5.330 12.039 1.00 22.70 C ATOM 204 O PHE A 55 37.054 -5.124 11.812 1.00 21.79 O ATOM 205 CB PHE A 55 34.659 -4.314 13.966 1.00 24.38 C ATOM 206 CG PHE A 55 35.906 -4.510 14.787 1.00 24.02 C ATOM 207 CD1 PHE A 55 36.733 -3.437 15.070 1.00 27.25 C ATOM 208 CD2 PHE A 55 36.269 -5.765 15.239 1.00 24.99 C ATOM 209 CE1 PHE A 55 37.886 -3.605 15.798 1.00 23.60 C ATOM 210 CE2 PHE A 55 37.421 -5.943 15.969 1.00 26.29 C ATOM 211 CZ PHE A 55 38.234 -4.859 16.250 1.00 25.53 C ATOM 212 N TYR A 56 35.334 -6.542 11.949 1.00 23.65 N ATOM 213 CA TYR A 56 36.182 -7.692 11.645 1.00 21.95 C ATOM 214 C TYR A 56 36.652 -7.682 10.189 1.00 21.35 C ATOM 215 O TYR A 56 37.717 -8.221 9.863 1.00 20.39 O ATOM 216 CB TYR A 56 35.451 -8.993 11.963 1.00 26.70 C ATOM 217 CG TYR A 56 35.365 -9.278 13.453 1.00 26.20 C ATOM 218 CD1 TYR A 56 36.470 -9.742 14.150 1.00 28.22 C ATOM 219 CD2 TYR A 56 34.181 -9.083 14.155 1.00 28.33 C ATOM 220 CE1 TYR A 56 36.405 -10.004 15.512 1.00 30.13 C ATOM 221 CE2 TYR A 56 34.100 -9.349 15.524 1.00 31.94 C ATOM 222 CZ TYR A 56 35.219 -9.808 16.194 1.00 33.40 C ATOM 223 OH TYR A 56 35.160 -10.072 17.550 1.00 34.87 O ATOM 224 N LEU A 57 35.859 -7.068 9.320 1.00 21.95 N ATOM 225 CA LEU A 57 36.243 -6.936 7.913 1.00 23.06 C ATOM 226 C LEU A 57 37.466 -6.013 7.839 1.00 22.58 C ATOM 227 O LEU A 57 38.442 -6.307 7.150 1.00 21.34 O ATOM 228 CB LEU A 57 35.069 -6.398 7.095 1.00 25.25 C ATOM 229 CG LEU A 57 34.737 -7.001 5.733 1.00 36.56 C ATOM 230 CD1 LEU A 57 35.024 -8.498 5.665 1.00 28.82 C ATOM 231 CD2 LEU A 57 33.260 -6.740 5.465 1.00 37.00 C ATOM 232 N GLY A 58 37.415 -4.918 8.596 1.00 24.10 N ATOM 233 CA GLY A 58 38.555 -4.027 8.765 1.00 21.59 C ATOM 234 C GLY A 58 39.788 -4.727 9.319 1.00 19.87 C ATOM 235 O GLY A 58 40.896 -4.543 8.803 1.00 19.55 O ATOM 236 N GLN A 59 39.601 -5.516 10.379 1.00 22.25 N ATOM 237 CA GLN A 59 40.674 -6.340 10.941 1.00 21.66 C ATOM 238 C GLN A 59 41.314 -7.227 9.877 1.00 21.85 C ATOM 239 O GLN A 59 42.542 -7.371 9.811 1.00 23.29 O ATOM 240 CB GLN A 59 40.144 -7.233 12.068 1.00 23.49 C ATOM 241 CG GLN A 59 39.647 -6.483 13.286 1.00 24.05 C ATOM 242 CD GLN A 59 40.735 -5.646 13.903 1.00 23.63 C ATOM 243 OE1 GLN A 59 40.803 -4.437 13.670 1.00 22.32 O ATOM 244 NE2 GLN A 59 41.607 -6.285 14.689 1.00 21.47 N ATOM 245 N TYR A 60 40.462 -7.840 9.065 1.00 20.86 N ATOM 246 CA TYR A 60 40.898 -8.777 8.035 1.00 21.41 C ATOM 247 C TYR A 60 41.768 -8.058 7.010 1.00 19.76 C ATOM 248 O TYR A 60 42.890 -8.484 6.711 1.00 20.94 O ATOM 249 CB TYR A 60 39.681 -9.424 7.355 1.00 22.84 C ATOM 250 CG TYR A 60 40.028 -10.441 6.276 1.00 25.32 C ATOM 251 CD1 TYR A 60 40.279 -11.768 6.602 1.00 27.16 C ATOM 252 CD2 TYR A 60 40.103 -10.070 4.936 1.00 20.64 C ATOM 253 CE1 TYR A 60 40.593 -12.705 5.623 1.00 24.13 C ATOM 254 CE2 TYR A 60 40.417 -10.998 3.946 1.00 24.04 C ATOM 255 CZ TYR A 60 40.663 -12.313 4.298 1.00 26.02 C ATOM 256 OH TYR A 60 40.974 -13.244 3.333 1.00 27.23 O ATOM 257 N ILE A 61 41.252 -6.947 6.496 1.00 19.13 N ATOM 258 CA ILE A 61 41.951 -6.170 5.472 1.00 18.25 C ATOM 259 C ILE A 61 43.272 -5.621 5.993 1.00 20.74 C ATOM 260 O ILE A 61 44.299 -5.696 5.327 1.00 20.52 O ATOM 261 CB ILE A 61 41.065 -5.018 4.963 1.00 20.73 C ATOM 262 CG1 ILE A 61 39.856 -5.592 4.209 1.00 21.91 C ATOM 263 CG2 ILE A 61 41.847 -4.089 4.041 1.00 20.03 C ATOM 264 CD1 ILE A 61 38.755 -4.589 3.949 1.00 18.32 C ATOM 265 N MET A 62 43.250 -5.090 7.210 1.00 22.50 N ATOM 266 CA MET A 62 44.469 -4.582 7.823 1.00 22.03 C ATOM 267 C MET A 62 45.497 -5.681 8.092 1.00 20.04 C ATOM 268 O MET A 62 46.681 -5.487 7.833 1.00 22.73 O ATOM 269 CB MET A 62 44.138 -3.849 9.120 1.00 22.06 C ATOM 270 CG MET A 62 43.416 -2.546 8.880 1.00 23.55 C ATOM 271 SD MET A 62 43.152 -1.528 10.346 1.00 29.20 S ATOM 272 CE MET A 62 42.072 -2.586 11.320 1.00 27.44 C ATOM 273 N THR A 63 45.049 -6.823 8.609 1.00 18.45 N ATOM 274 CA THR A 63 45.962 -7.912 8.965 1.00 18.75 C ATOM 275 C THR A 63 46.664 -8.477 7.721 1.00 23.76 C ATOM 276 O THR A 63 47.866 -8.714 7.725 1.00 22.28 O ATOM 277 CB THR A 63 45.221 -9.055 9.719 1.00 25.16 C ATOM 278 OG1 THR A 63 44.660 -8.538 10.936 1.00 25.04 O ATOM 279 CG2 THR A 63 46.179 -10.164 10.086 1.00 23.23 C ATOM 280 N LYS A 64 45.916 -8.663 6.644 1.00 23.69 N ATOM 281 CA LYS A 64 46.508 -9.210 5.424 1.00 22.75 C ATOM 282 C LYS A 64 47.068 -8.111 4.524 1.00 23.91 C ATOM 283 O LYS A 64 47.582 -8.389 3.437 1.00 27.23 O ATOM 284 CB LYS A 64 45.477 -10.049 4.685 1.00 23.36 C ATOM 285 CG LYS A 64 44.966 -11.212 5.533 1.00 24.48 C ATOM 286 CD LYS A 64 44.158 -12.198 4.724 1.00 25.31 C ATOM 287 CE LYS A 64 45.052 -13.073 3.856 1.00 29.91 C ATOM 288 NZ LYS A 64 44.241 -13.934 2.938 1.00 25.25 N1+ ATOM 289 N ARG A 65 46.964 -6.866 4.990 1.00 22.05 N ATOM 290 CA ARG A 65 47.526 -5.708 4.296 1.00 24.35 C ATOM 291 C ARG A 65 47.113 -5.665 2.813 1.00 25.60 C ATOM 292 O ARG A 65 47.958 -5.583 1.915 1.00 21.36 O ATOM 293 CB ARG A 65 49.048 -5.714 4.436 1.00 21.90 C ATOM 294 CG ARG A 65 49.498 -5.766 5.905 1.00 26.64 C ATOM 295 CD ARG A 65 50.969 -6.099 6.006 1.00 26.14 C ATOM 296 NE ARG A 65 51.764 -5.083 5.331 1.00 34.79 N ATOM 297 CZ ARG A 65 53.084 -5.139 5.188 1.00 41.17 C ATOM 298 NH1 ARG A 65 53.761 -6.172 5.674 1.00 41.95 N ATOM 299 NH2 ARG A 65 53.725 -4.162 4.556 1.00 39.60 N ATOM 300 N LEU A 66 45.806 -5.706 2.576 1.00 22.22 N ATOM 301 CA LEU A 66 45.262 -5.722 1.218 1.00 21.48 C ATOM 302 C LEU A 66 45.092 -4.330 0.629 1.00 25.45 C ATOM 303 O LEU A 66 44.844 -4.185 -0.569 1.00 24.42 O ATOM 304 CB LEU A 66 43.909 -6.436 1.200 1.00 20.30 C ATOM 305 CG LEU A 66 43.917 -7.874 1.726 1.00 21.58 C ATOM 306 CD1 LEU A 66 42.509 -8.444 1.692 1.00 23.64 C ATOM 307 CD2 LEU A 66 44.863 -8.735 0.901 1.00 24.11 C ATOM 308 N TYR A 67 45.196 -3.304 1.465 1.00 22.96 N ATOM 309 CA TYR A 67 44.992 -1.949 0.981 1.00 21.14 C ATOM 310 C TYR A 67 46.257 -1.446 0.297 1.00 21.70 C ATOM 311 O TYR A 67 47.356 -1.871 0.627 1.00 19.06 O ATOM 312 CB TYR A 67 44.575 -1.014 2.117 1.00 22.62 C ATOM 313 CG TYR A 67 45.569 -0.941 3.263 1.00 21.53 C ATOM 314 CD1 TYR A 67 46.621 -0.027 3.247 1.00 20.87 C ATOM 315 CD2 TYR A 67 45.450 -1.784 4.363 1.00 22.55 C ATOM 316 CE1 TYR A 67 47.536 0.040 4.305 1.00 19.98 C ATOM 317 CE2 TYR A 67 46.358 -1.727 5.416 1.00 22.26 C ATOM 318 CZ TYR A 67 47.397 -0.810 5.379 1.00 23.84 C ATOM 319 OH TYR A 67 48.301 -0.746 6.422 1.00 25.37 O ATOM 320 N ASP A 68 46.095 -0.557 -0.674 1.00 20.91 N ATOM 321 CA ASP A 68 47.242 0.016 -1.376 1.00 23.52 C ATOM 322 C ASP A 68 48.019 0.963 -0.460 1.00 22.08 C ATOM 323 O ASP A 68 47.418 1.719 0.282 1.00 21.69 O ATOM 324 CB ASP A 68 46.786 0.767 -2.629 1.00 22.19 C ATOM 325 CG ASP A 68 47.952 1.324 -3.417 1.00 26.83 C ATOM 326 OD1 ASP A 68 48.640 0.526 -4.085 1.00 31.72 O ATOM 327 OD2 ASP A 68 48.198 2.548 -3.353 1.00 23.81 O1- ATOM 328 N GLU A 69 49.344 0.931 -0.526 1.00 22.04 N ATOM 329 CA GLU A 69 50.170 1.775 0.345 1.00 25.06 C ATOM 330 C GLU A 69 49.977 3.277 0.098 1.00 27.82 C ATOM 331 O GLU A 69 49.874 4.062 1.042 1.00 23.95 O ATOM 332 CB GLU A 69 51.649 1.414 0.176 1.00 28.60 C ATOM 333 CG GLU A 69 52.604 2.245 1.026 1.00 30.85 C ATOM 334 N LYS A 70 49.913 3.674 -1.170 1.00 24.69 N ATOM 335 CA LYS A 70 49.879 5.094 -1.521 1.00 25.70 C ATOM 336 C LYS A 70 48.474 5.677 -1.499 1.00 24.51 C ATOM 337 O LYS A 70 48.282 6.857 -1.199 1.00 26.71 O ATOM 338 CB LYS A 70 50.505 5.310 -2.908 1.00 25.42 C ATOM 339 CG LYS A 70 51.935 4.790 -3.010 1.00 26.63 C ATOM 340 CD LYS A 70 52.571 5.138 -4.343 1.00 26.97 C ATOM 341 CE LYS A 70 53.978 4.547 -4.454 1.00 31.15 C ATOM 342 NZ LYS A 70 54.621 4.876 -5.774 1.00 33.96 N1+ ATOM 343 N GLN A 71 47.491 4.855 -1.839 1.00 22.19 N ATOM 344 CA GLN A 71 46.098 5.278 -1.800 1.00 23.56 C ATOM 345 C GLN A 71 45.327 4.274 -0.966 1.00 25.96 C ATOM 346 O GLN A 71 44.810 3.286 -1.490 1.00 19.68 O ATOM 347 CB GLN A 71 45.515 5.379 -3.211 1.00 24.48 C ATOM 348 CG GLN A 71 46.053 6.558 -4.006 1.00 24.56 C ATOM 349 CD GLN A 71 45.778 6.401 -5.481 1.00 24.26 C ATOM 350 OE1 GLN A 71 46.292 5.486 -6.107 1.00 25.96 O ATOM 351 NE2 GLN A 71 44.948 7.275 -6.034 1.00 24.94 N ATOM 352 N GLN A 72 45.250 4.528 0.338 1.00 20.70 N ATOM 353 CA GLN A 72 44.927 3.454 1.268 1.00 23.45 C ATOM 354 C GLN A 72 43.445 3.132 1.308 1.00 24.21 C ATOM 355 O GLN A 72 43.025 2.225 2.026 1.00 24.23 O ATOM 356 CB GLN A 72 45.462 3.809 2.665 1.00 20.70 C ATOM 357 CG GLN A 72 46.941 4.152 2.601 1.00 18.70 C ATOM 358 CD GLN A 72 47.736 3.706 3.817 1.00 25.47 C ATOM 359 OE1 GLN A 72 47.174 3.412 4.864 1.00 23.57 O ATOM 360 NE2 GLN A 72 49.052 3.646 3.671 1.00 22.55 N ATOM 361 N HIS A 73 42.655 3.851 0.517 1.00 21.88 N ATOM 362 CA HIS A 73 41.247 3.507 0.361 1.00 23.91 C ATOM 363 C HIS A 73 41.066 2.390 -0.679 1.00 24.47 C ATOM 364 O HIS A 73 40.005 1.775 -0.766 1.00 24.08 O ATOM 365 CB HIS A 73 40.421 4.736 -0.030 1.00 24.12 C ATOM 366 CG HIS A 73 40.795 5.329 -1.354 1.00 25.63 C ATOM 367 ND1 HIS A 73 40.100 5.060 -2.514 1.00 27.83 N ATOM 368 CD2 HIS A 73 41.789 6.183 -1.701 1.00 26.55 C ATOM 369 CE1 HIS A 73 40.649 5.721 -3.519 1.00 26.88 C ATOM 370 NE2 HIS A 73 41.677 6.409 -3.053 1.00 28.23 N ATOM 371 N ILE A 74 42.108 2.114 -1.451 1.00 22.67 N ATOM 372 CA ILE A 74 42.013 1.058 -2.455 1.00 21.79 C ATOM 373 C ILE A 74 42.360 -0.283 -1.841 1.00 20.20 C ATOM 374 O ILE A 74 43.445 -0.456 -1.300 1.00 24.65 O ATOM 375 CB ILE A 74 42.946 1.312 -3.655 1.00 23.87 C ATOM 376 CG1 ILE A 74 42.666 2.690 -4.257 1.00 23.50 C ATOM 377 CG2 ILE A 74 42.762 0.209 -4.693 1.00 25.61 C ATOM 378 CD1 ILE A 74 43.559 3.041 -5.425 1.00 27.83 C ATOM 379 N VAL A 75 41.427 -1.224 -1.898 1.00 21.04 N ATOM 380 CA VAL A 75 41.680 -2.567 -1.396 1.00 21.16 C ATOM 381 C VAL A 75 41.817 -3.546 -2.562 1.00 20.19 C ATOM 382 O VAL A 75 40.855 -3.742 -3.300 1.00 21.92 O ATOM 383 CB VAL A 75 40.550 -3.052 -0.457 1.00 18.57 C ATOM 384 CG1 VAL A 75 40.829 -4.472 0.022 1.00 18.88 C ATOM 385 CG2 VAL A 75 40.382 -2.103 0.764 1.00 19.17 C ATOM 386 N TYR A 76 43.001 -4.144 -2.721 1.00 25.33 N ATOM 387 CA TYR A 76 43.235 -5.187 -3.730 1.00 28.47 C ATOM 388 C TYR A 76 42.909 -6.551 -3.170 1.00 26.93 C ATOM 389 O TYR A 76 43.497 -6.961 -2.178 1.00 31.01 O ATOM 390 CB TYR A 76 44.690 -5.227 -4.199 1.00 29.47 C ATOM 391 CG TYR A 76 45.249 -3.937 -4.701 1.00 33.74 C ATOM 392 CD1 TYR A 76 44.728 -3.321 -5.827 1.00 36.88 C ATOM 393 CD2 TYR A 76 46.336 -3.347 -4.062 1.00 40.46 C ATOM 394 CE1 TYR A 76 45.256 -2.135 -6.285 1.00 42.61 C ATOM 395 CE2 TYR A 76 46.870 -2.166 -4.513 1.00 35.39 C ATOM 396 CZ TYR A 76 46.327 -1.561 -5.620 1.00 39.21 C ATOM 397 OH TYR A 76 46.874 -0.380 -6.065 1.00 41.29 O ATOM 398 N CYS A 77 42.010 -7.276 -3.815 1.00 25.24 N ATOM 399 CA CYS A 77 41.611 -8.561 -3.266 1.00 27.56 C ATOM 400 C CYS A 77 41.474 -9.642 -4.329 1.00 26.30 C ATOM 401 O CYS A 77 40.900 -10.694 -4.063 1.00 24.08 O ATOM 402 CB CYS A 77 40.298 -8.409 -2.489 1.00 25.48 C ATOM 403 SG CYS A 77 39.027 -7.426 -3.317 1.00 27.16 S ATOM 404 N SER A 78 42.030 -9.405 -5.517 1.00 25.86 N ATOM 405 CA SER A 78 41.791 -10.306 -6.648 1.00 28.39 C ATOM 406 C SER A 78 42.422 -11.677 -6.428 1.00 30.73 C ATOM 407 O SER A 78 42.041 -12.647 -7.077 1.00 31.03 O ATOM 408 CB SER A 78 42.313 -9.696 -7.958 1.00 24.76 C ATOM 409 OG SER A 78 43.723 -9.797 -8.041 1.00 29.08 O ATOM 410 N ASN A 79 43.383 -11.753 -5.510 1.00 23.92 N ATOM 411 CA ASN A 79 44.017 -13.023 -5.166 1.00 29.31 C ATOM 412 C ASN A 79 43.710 -13.417 -3.720 1.00 28.32 C ATOM 413 O ASN A 79 44.488 -14.114 -3.084 1.00 30.14 O ATOM 414 CB ASN A 79 45.534 -12.946 -5.371 1.00 29.90 C ATOM 415 CG ASN A 79 45.917 -12.611 -6.806 1.00 38.57 C ATOM 416 OD1 ASN A 79 45.399 -13.200 -7.753 1.00 36.48 O ATOM 417 ND2 ASN A 79 46.824 -11.651 -6.968 1.00 37.04 N ATOM 418 N ASP A 80 42.574 -12.958 -3.212 1.00 26.75 N ATOM 419 CA ASP A 80 42.191 -13.197 -1.826 1.00 27.02 C ATOM 420 C ASP A 80 40.752 -13.666 -1.799 1.00 27.83 C ATOM 421 O ASP A 80 39.967 -13.294 -2.662 1.00 25.92 O ATOM 422 CB ASP A 80 42.362 -11.917 -0.993 1.00 24.87 C ATOM 423 CG ASP A 80 42.262 -12.165 0.497 1.00 24.47 C ATOM 424 OD1 ASP A 80 43.310 -12.335 1.149 1.00 23.15 O ATOM 425 OD2 ASP A 80 41.133 -12.184 1.013 1.00 24.07 O1- ATOM 426 N LEU A 81 40.393 -14.464 -0.801 1.00 27.57 N ATOM 427 CA LEU A 81 39.011 -14.913 -0.674 1.00 27.82 C ATOM 428 C LEU A 81 38.021 -13.743 -0.574 1.00 28.44 C ATOM 429 O LEU A 81 36.857 -13.884 -0.947 1.00 28.42 O ATOM 430 CB LEU A 81 38.868 -15.842 0.535 1.00 33.02 C ATOM 431 CG LEU A 81 39.529 -17.212 0.316 1.00 33.04 C ATOM 432 CD1 LEU A 81 39.405 -18.104 1.543 1.00 34.65 C ATOM 433 CD2 LEU A 81 38.942 -17.905 -0.920 1.00 33.84 C ATOM 434 N LEU A 82 38.474 -12.590 -0.086 1.00 22.71 N ATOM 435 CA LEU A 82 37.594 -11.417 -0.031 1.00 22.75 C ATOM 436 C LEU A 82 37.160 -11.016 -1.439 1.00 23.56 C ATOM 437 O LEU A 82 36.037 -10.556 -1.648 1.00 23.99 O ATOM 438 CB LEU A 82 38.280 -10.241 0.659 1.00 21.13 C ATOM 439 CG LEU A 82 37.472 -8.952 0.739 1.00 24.05 C ATOM 440 CD1 LEU A 82 36.159 -9.168 1.494 1.00 21.31 C ATOM 441 CD2 LEU A 82 38.308 -7.832 1.376 1.00 22.78 C ATOM 442 N GLY A 83 38.054 -11.201 -2.402 1.00 23.65 N ATOM 443 CA GLY A 83 37.721 -10.938 -3.795 1.00 28.48 C ATOM 444 C GLY A 83 36.631 -11.861 -4.314 1.00 26.68 C ATOM 445 O GLY A 83 35.681 -11.421 -4.965 1.00 26.96 O ATOM 446 N ASP A 84 36.775 -13.151 -4.031 1.00 26.06 N ATOM 447 CA ASP A 84 35.758 -14.138 -4.387 1.00 28.32 C ATOM 448 C ASP A 84 34.416 -13.790 -3.763 1.00 25.18 C ATOM 449 O ASP A 84 33.379 -13.817 -4.422 1.00 25.59 O ATOM 450 CB ASP A 84 36.192 -15.531 -3.937 1.00 28.96 C ATOM 451 CG ASP A 84 37.382 -16.049 -4.717 1.00 34.72 C ATOM 452 OD1 ASP A 84 37.292 -16.136 -5.962 1.00 38.25 O ATOM 453 OD2 ASP A 84 38.410 -16.360 -4.081 1.00 39.98 O1- ATOM 454 N LEU A 85 34.455 -13.468 -2.475 1.00 24.90 N ATOM 455 CA LEU A 85 33.261 -13.114 -1.716 1.00 24.71 C ATOM 456 C LEU A 85 32.549 -11.888 -2.283 1.00 27.43 C ATOM 457 O LEU A 85 31.343 -11.925 -2.555 1.00 26.48 O ATOM 458 CB LEU A 85 33.638 -12.869 -0.249 1.00 24.39 C ATOM 459 CG LEU A 85 32.525 -12.440 0.705 1.00 26.28 C ATOM 460 CD1 LEU A 85 31.654 -13.632 1.065 1.00 33.52 C ATOM 461 CD2 LEU A 85 33.102 -11.806 1.947 1.00 27.56 C ATOM 462 N PHE A 86 33.292 -10.797 -2.452 1.00 24.08 N ATOM 463 CA PHE A 86 32.705 -9.565 -2.963 1.00 24.21 C ATOM 464 C PHE A 86 32.508 -9.613 -4.474 1.00 24.36 C ATOM 465 O PHE A 86 31.707 -8.861 -5.017 1.00 26.04 O ATOM 466 CB PHE A 86 33.564 -8.355 -2.599 1.00 25.62 C ATOM 467 CG PHE A 86 33.334 -7.841 -1.200 1.00 23.76 C ATOM 468 CD1 PHE A 86 32.550 -8.551 -0.298 1.00 26.25 C ATOM 469 CD2 PHE A 86 33.898 -6.649 -0.791 1.00 23.96 C ATOM 470 CE1 PHE A 86 32.342 -8.077 0.991 1.00 27.57 C ATOM 471 CE2 PHE A 86 33.694 -6.169 0.502 1.00 28.62 C ATOM 472 CZ PHE A 86 32.911 -6.886 1.388 1.00 24.17 C ATOM 473 N GLY A 87 33.242 -10.492 -5.149 1.00 25.70 N ATOM 474 CA GLY A 87 33.122 -10.624 -6.593 1.00 27.98 C ATOM 475 C GLY A 87 33.778 -9.490 -7.359 1.00 27.28 C ATOM 476 O GLY A 87 33.252 -9.038 -8.375 1.00 25.45 O ATOM 477 N VAL A 88 34.932 -9.036 -6.867 1.00 25.05 N ATOM 478 CA VAL A 88 35.651 -7.906 -7.454 1.00 23.57 C ATOM 479 C VAL A 88 37.152 -8.131 -7.360 1.00 23.41 C ATOM 480 O VAL A 88 37.623 -8.883 -6.493 1.00 24.25 O ATOM 481 CB VAL A 88 35.303 -6.569 -6.747 1.00 23.50 C ATOM 482 CG1 VAL A 88 33.809 -6.246 -6.864 1.00 22.15 C ATOM 483 CG2 VAL A 88 35.736 -6.612 -5.270 1.00 22.72 C ATOM 484 N PRO A 89 37.914 -7.497 -8.257 1.00 22.68 N ATOM 485 CA PRO A 89 39.377 -7.562 -8.170 1.00 22.48 C ATOM 486 C PRO A 89 39.902 -6.567 -7.143 1.00 22.35 C ATOM 487 O PRO A 89 40.956 -6.784 -6.559 1.00 24.05 O ATOM 488 CB PRO A 89 39.841 -7.181 -9.587 1.00 20.52 C ATOM 489 CG PRO A 89 38.582 -7.279 -10.453 1.00 22.42 C ATOM 490 CD PRO A 89 37.462 -6.936 -9.545 1.00 21.93 C ATOM 491 N SER A 90 39.162 -5.483 -6.956 1.00 23.40 N ATOM 492 CA SER A 90 39.503 -4.441 -5.990 1.00 23.14 C ATOM 493 C SER A 90 38.275 -3.586 -5.771 1.00 23.46 C ATOM 494 O SER A 90 37.339 -3.622 -6.568 1.00 23.03 O ATOM 495 CB SER A 90 40.678 -3.577 -6.477 1.00 25.78 C ATOM 496 OG SER A 90 40.264 -2.637 -7.463 1.00 24.74 O ATOM 497 N PHE A 91 38.257 -2.837 -4.674 1.00 22.62 N ATOM 498 CA PHE A 91 37.204 -1.866 -4.451 1.00 23.38 C ATOM 499 C PHE A 91 37.789 -0.709 -3.666 1.00 23.44 C ATOM 500 O PHE A 91 38.861 -0.838 -3.070 1.00 25.03 O ATOM 501 CB PHE A 91 36.016 -2.492 -3.713 1.00 21.91 C ATOM 502 CG PHE A 91 36.373 -3.081 -2.361 1.00 21.28 C ATOM 503 CD1 PHE A 91 36.838 -4.380 -2.249 1.00 23.31 C ATOM 504 CD2 PHE A 91 36.241 -2.325 -1.207 1.00 25.90 C ATOM 505 CE1 PHE A 91 37.172 -4.920 -1.006 1.00 22.23 C ATOM 506 CE2 PHE A 91 36.562 -2.857 0.036 1.00 23.04 C ATOM 507 CZ PHE A 91 37.034 -4.152 0.136 1.00 21.40 C ATOM 508 N SER A 92 37.094 0.421 -3.675 1.00 25.94 N ATOM 509 CA SER A 92 37.515 1.575 -2.890 1.00 26.67 C ATOM 510 C SER A 92 36.676 1.740 -1.632 1.00 26.01 C ATOM 511 O SER A 92 35.455 1.631 -1.678 1.00 24.00 O ATOM 512 CB SER A 92 37.426 2.860 -3.713 1.00 29.01 C ATOM 513 OG SER A 92 37.495 3.985 -2.839 1.00 28.69 O ATOM 514 N VAL A 93 37.335 2.041 -0.515 1.00 24.65 N ATOM 515 CA VAL A 93 36.642 2.222 0.762 1.00 23.52 C ATOM 516 C VAL A 93 35.756 3.481 0.735 1.00 25.96 C ATOM 517 O VAL A 93 34.809 3.610 1.512 1.00 28.43 O ATOM 518 CB VAL A 93 37.659 2.287 1.931 1.00 22.41 C ATOM 519 CG1 VAL A 93 36.967 2.538 3.277 1.00 25.31 C ATOM 520 CG2 VAL A 93 38.457 1.001 1.990 1.00 22.93 C ATOM 521 N LYS A 94 36.037 4.393 -0.187 1.00 25.22 N ATOM 522 CA LYS A 94 35.212 5.595 -0.326 1.00 27.01 C ATOM 523 C LYS A 94 33.782 5.300 -0.799 1.00 31.55 C ATOM 524 O LYS A 94 32.866 6.090 -0.561 1.00 30.24 O ATOM 525 CB LYS A 94 35.860 6.576 -1.298 1.00 29.58 C ATOM 526 CG LYS A 94 37.185 7.164 -0.852 1.00 26.47 C ATOM 527 CD LYS A 94 37.682 8.127 -1.929 1.00 33.53 C ATOM 528 CE LYS A 94 38.960 8.833 -1.536 1.00 37.18 C ATOM 529 NZ LYS A 94 39.361 9.804 -2.598 1.00 41.06 N1+ ATOM 530 N GLU A 95 33.586 4.174 -1.478 1.00 30.48 N ATOM 531 CA GLU A 95 32.260 3.860 -2.019 1.00 30.44 C ATOM 532 C GLU A 95 31.410 3.138 -0.976 1.00 31.23 C ATOM 533 O GLU A 95 31.272 1.917 -1.012 1.00 27.66 O ATOM 534 CB GLU A 95 32.391 3.020 -3.288 1.00 31.04 C ATOM 535 CG GLU A 95 33.249 3.675 -4.370 1.00 30.85 C ATOM 536 N HIS A 96 30.839 3.906 -0.051 1.00 33.07 N ATOM 537 CA HIS A 96 30.179 3.344 1.121 1.00 33.44 C ATOM 538 C HIS A 96 28.977 2.463 0.784 1.00 33.20 C ATOM 539 O HIS A 96 28.841 1.365 1.324 1.00 35.59 O ATOM 540 CB HIS A 96 29.748 4.470 2.068 1.00 34.33 C ATOM 541 CG HIS A 96 30.894 5.242 2.646 1.00 33.16 C ATOM 542 ND1 HIS A 96 30.722 6.266 3.553 1.00 37.23 N ATOM 543 CD2 HIS A 96 32.231 5.139 2.444 1.00 31.75 C ATOM 544 CE1 HIS A 96 31.903 6.760 3.886 1.00 34.51 C ATOM 545 NE2 HIS A 96 32.835 6.095 3.225 1.00 34.23 N ATOM 546 N ARG A 97 28.104 2.948 -0.093 1.00 34.93 N ATOM 547 CA ARG A 97 26.908 2.205 -0.477 1.00 33.58 C ATOM 548 C ARG A 97 27.269 0.867 -1.117 1.00 33.36 C ATOM 549 O ARG A 97 26.690 -0.170 -0.781 1.00 34.61 O ATOM 550 CB ARG A 97 26.046 3.035 -1.437 1.00 35.49 C ATOM 551 N LYS A 98 28.230 0.899 -2.036 1.00 32.71 N ATOM 552 CA LYS A 98 28.721 -0.308 -2.696 1.00 30.98 C ATOM 553 C LYS A 98 29.219 -1.350 -1.695 1.00 30.02 C ATOM 554 O LYS A 98 28.908 -2.536 -1.801 1.00 28.13 O ATOM 555 CB LYS A 98 29.842 0.043 -3.671 1.00 32.46 C ATOM 556 N ILE A 99 29.992 -0.903 -0.716 1.00 30.50 N ATOM 557 CA ILE A 99 30.529 -1.818 0.279 1.00 26.14 C ATOM 558 C ILE A 99 29.417 -2.425 1.123 1.00 28.48 C ATOM 559 O ILE A 99 29.395 -3.642 1.339 1.00 28.13 O ATOM 560 CB ILE A 99 31.565 -1.108 1.163 1.00 27.59 C ATOM 561 CG1 ILE A 99 32.831 -0.874 0.336 1.00 23.23 C ATOM 562 CG2 ILE A 99 31.879 -1.935 2.402 1.00 26.54 C ATOM 563 CD1 ILE A 99 33.853 -0.004 1.010 1.00 24.69 C ATOM 564 N TYR A 100 28.483 -1.593 1.583 1.00 29.64 N ATOM 565 CA TYR A 100 27.338 -2.107 2.329 1.00 29.71 C ATOM 566 C TYR A 100 26.579 -3.129 1.482 1.00 30.20 C ATOM 567 O TYR A 100 26.219 -4.207 1.959 1.00 29.34 O ATOM 568 CB TYR A 100 26.415 -0.968 2.768 1.00 31.19 C ATOM 569 CG TYR A 100 26.805 -0.379 4.107 1.00 32.79 C ATOM 570 CD1 TYR A 100 26.199 -0.810 5.279 1.00 36.19 C ATOM 571 CD2 TYR A 100 27.796 0.590 4.198 1.00 33.61 C ATOM 572 CE1 TYR A 100 26.559 -0.280 6.509 1.00 36.55 C ATOM 573 CE2 TYR A 100 28.170 1.123 5.423 1.00 32.79 C ATOM 574 CZ TYR A 100 27.545 0.682 6.574 1.00 36.37 C ATOM 575 OH TYR A 100 27.900 1.211 7.792 1.00 36.85 O ATOM 576 N THR A 101 26.368 -2.791 0.215 1.00 30.62 N ATOM 577 CA THR A 101 25.697 -3.702 -0.704 1.00 30.99 C ATOM 578 C THR A 101 26.430 -5.039 -0.817 1.00 28.96 C ATOM 579 O THR A 101 25.801 -6.093 -0.734 1.00 32.59 O ATOM 580 CB THR A 101 25.547 -3.076 -2.098 1.00 30.81 C ATOM 581 OG1 THR A 101 24.707 -1.919 -2.000 1.00 33.41 O ATOM 582 CG2 THR A 101 24.909 -4.071 -3.063 1.00 31.42 C ATOM 583 N MET A 102 27.753 -5.006 -0.974 1.00 27.74 N ATOM 584 CA MET A 102 28.515 -6.246 -1.137 1.00 28.23 C ATOM 585 C MET A 102 28.454 -7.089 0.129 1.00 27.48 C ATOM 586 O MET A 102 28.388 -8.323 0.075 1.00 27.98 O ATOM 587 CB MET A 102 29.973 -5.952 -1.517 1.00 26.21 C ATOM 588 CG MET A 102 30.123 -5.428 -2.951 1.00 28.63 C ATOM 589 SD MET A 102 31.833 -5.192 -3.504 1.00 28.42 S ATOM 590 CE MET A 102 32.330 -3.791 -2.509 1.00 26.37 C ATOM 591 N ILE A 103 28.470 -6.421 1.274 1.00 27.77 N ATOM 592 CA ILE A 103 28.347 -7.112 2.545 1.00 27.31 C ATOM 593 C ILE A 103 26.956 -7.733 2.719 1.00 29.22 C ATOM 594 O ILE A 103 26.840 -8.907 3.071 1.00 32.45 O ATOM 595 CB ILE A 103 28.634 -6.162 3.716 1.00 28.15 C ATOM 596 CG1 ILE A 103 30.112 -5.745 3.704 1.00 26.59 C ATOM 597 CG2 ILE A 103 28.263 -6.827 5.037 1.00 28.64 C ATOM 598 CD1 ILE A 103 30.422 -4.622 4.658 1.00 29.72 C ATOM 599 N TYR A 104 25.912 -6.941 2.473 1.00 31.17 N ATOM 600 CA TYR A 104 24.523 -7.412 2.565 1.00 31.29 C ATOM 601 C TYR A 104 24.236 -8.652 1.714 1.00 34.22 C ATOM 602 O TYR A 104 23.464 -9.522 2.121 1.00 32.62 O ATOM 603 CB TYR A 104 23.559 -6.301 2.154 1.00 36.11 C ATOM 604 CG TYR A 104 23.294 -5.280 3.230 1.00 38.62 C ATOM 605 CD1 TYR A 104 23.077 -5.668 4.545 1.00 42.52 C ATOM 606 CD2 TYR A 104 23.261 -3.923 2.932 1.00 38.77 C ATOM 607 CE1 TYR A 104 22.833 -4.732 5.532 1.00 43.02 C ATOM 608 CE2 TYR A 104 23.022 -2.983 3.908 1.00 40.61 C ATOM 609 CZ TYR A 104 22.809 -3.392 5.207 1.00 43.92 C ATOM 610 OH TYR A 104 22.568 -2.451 6.181 1.00 52.48 O ATOM 611 N ARG A 105 24.850 -8.726 0.532 1.00 31.22 N ATOM 612 CA ARG A 105 24.667 -9.875 -0.353 1.00 31.46 C ATOM 613 C ARG A 105 25.176 -11.154 0.289 1.00 34.68 C ATOM 614 O ARG A 105 24.796 -12.254 -0.113 1.00 34.24 O ATOM 615 CB ARG A 105 25.387 -9.663 -1.692 1.00 33.18 C ATOM 616 CG ARG A 105 24.784 -8.598 -2.588 1.00 35.35 C ATOM 617 CD ARG A 105 25.381 -8.682 -3.997 1.00 37.63 C ATOM 618 NE ARG A 105 24.894 -7.621 -4.873 1.00 43.29 N ATOM 619 CZ ARG A 105 25.679 -6.738 -5.483 1.00 45.50 C ATOM 620 NH1 ARG A 105 26.998 -6.792 -5.320 1.00 42.35 N1+ ATOM 621 NH2 ARG A 105 25.146 -5.801 -6.258 1.00 47.60 N ATOM 622 N ASN A 106 26.035 -11.012 1.294 1.00 32.98 N ATOM 623 CA ASN A 106 26.696 -12.172 1.873 1.00 30.87 C ATOM 624 C ASN A 106 26.300 -12.441 3.320 1.00 32.36 C ATOM 625 O ASN A 106 27.055 -13.043 4.079 1.00 33.21 O ATOM 626 CB ASN A 106 28.206 -12.011 1.765 1.00 29.66 C ATOM 627 CG ASN A 106 28.692 -12.166 0.346 1.00 35.33 C ATOM 628 OD1 ASN A 106 28.641 -13.261 -0.215 1.00 35.41 O ATOM 629 ND2 ASN A 106 29.152 -11.069 -0.253 1.00 30.84 N ATOM 630 N LEU A 107 25.105 -12.001 3.688 1.00 33.50 N ATOM 631 CA LEU A 107 24.558 -12.308 4.999 1.00 35.59 C ATOM 632 C LEU A 107 23.042 -12.416 4.930 1.00 37.46 C ATOM 633 O LEU A 107 22.424 -11.965 3.966 1.00 35.74 O ATOM 634 CB LEU A 107 24.975 -11.246 6.023 1.00 35.20 C ATOM 635 CG LEU A 107 24.754 -9.766 5.704 1.00 32.62 C ATOM 636 CD1 LEU A 107 23.302 -9.347 5.911 1.00 39.35 C ATOM 637 CD2 LEU A 107 25.674 -8.912 6.561 1.00 31.69 C ATOM 638 N VAL A 108 22.453 -13.020 5.957 1.00 37.58 N ATOM 639 CA VAL A 108 21.005 -13.028 6.120 1.00 41.82 C ATOM 640 C VAL A 108 20.639 -12.136 7.296 1.00 42.01 C ATOM 641 O VAL A 108 21.147 -12.317 8.400 1.00 42.69 O ATOM 642 CB VAL A 108 20.455 -14.451 6.357 1.00 43.55 C ATOM 643 N VAL A 109 19.777 -11.156 7.049 1.00 45.48 N ATOM 644 CA VAL A 109 19.339 -10.249 8.100 1.00 46.71 C ATOM 645 C VAL A 109 18.451 -10.997 9.090 1.00 51.19 C ATOM 646 O VAL A 109 17.303 -11.323 8.785 1.00 50.82 O ATOM 647 CB VAL A 109 18.581 -9.039 7.524 1.00 45.82 C ATOM 648 N VAL A 110 19.000 -11.285 10.268 1.00 50.40 N ATOM 649 CA VAL A 110 18.279 -12.026 11.296 1.00 49.03 C ATOM 650 C VAL A 110 17.154 -11.188 11.893 1.00 56.27 C ATOM 651 O VAL A 110 16.025 -11.209 11.405 1.00 60.09 O ATOM 652 CB VAL A 110 19.218 -12.485 12.427 1.00 52.03 C TER 653 VAL A 110 ATOM 654 N THR B 26 67.536 5.599 9.870 1.00 46.37 N ATOM 655 CA THR B 26 67.799 4.876 11.112 1.00 39.61 C ATOM 656 C THR B 26 67.499 3.380 10.976 1.00 39.43 C ATOM 657 O THR B 26 66.347 2.950 11.096 1.00 38.23 O ATOM 658 CB THR B 26 66.976 5.448 12.281 1.00 42.37 C ATOM 659 N LEU B 27 68.544 2.594 10.726 1.00 40.53 N ATOM 660 CA LEU B 27 68.415 1.144 10.613 1.00 33.95 C ATOM 661 C LEU B 27 68.714 0.450 11.941 1.00 34.06 C ATOM 662 O LEU B 27 69.656 0.811 12.651 1.00 32.64 O ATOM 663 CB LEU B 27 69.337 0.602 9.526 1.00 32.61 C ATOM 664 CG LEU B 27 68.869 0.822 8.079 1.00 39.39 C ATOM 665 N VAL B 28 67.902 -0.549 12.271 1.00 29.80 N ATOM 666 CA VAL B 28 68.016 -1.232 13.550 1.00 30.86 C ATOM 667 C VAL B 28 67.928 -2.746 13.379 1.00 26.56 C ATOM 668 O VAL B 28 67.292 -3.239 12.452 1.00 29.42 O ATOM 669 CB VAL B 28 66.912 -0.768 14.535 1.00 27.95 C ATOM 670 CG1 VAL B 28 66.923 0.745 14.681 1.00 28.79 C ATOM 671 CG2 VAL B 28 65.535 -1.234 14.069 1.00 28.86 C ATOM 672 N ARG B 29 68.574 -3.479 14.277 1.00 28.94 N ATOM 673 CA ARG B 29 68.417 -4.928 14.333 1.00 28.05 C ATOM 674 C ARG B 29 67.704 -5.317 15.631 1.00 27.95 C ATOM 675 O ARG B 29 68.266 -5.183 16.712 1.00 24.63 O ATOM 676 CB ARG B 29 69.772 -5.634 14.238 1.00 28.61 C ATOM 677 N PRO B 30 66.451 -5.778 15.518 1.00 26.35 N ATOM 678 CA PRO B 30 65.673 -6.177 16.696 1.00 26.92 C ATOM 679 C PRO B 30 66.283 -7.381 17.392 1.00 29.31 C ATOM 680 O PRO B 30 66.780 -8.302 16.736 1.00 27.56 O ATOM 681 CB PRO B 30 64.293 -6.521 16.115 1.00 24.43 C ATOM 682 CG PRO B 30 64.237 -5.777 14.799 1.00 30.56 C ATOM 683 CD PRO B 30 65.650 -5.821 14.281 1.00 27.22 C ATOM 684 N LYS B 31 66.247 -7.358 18.719 1.00 27.44 N ATOM 685 CA LYS B 31 66.687 -8.481 19.533 1.00 30.44 C ATOM 686 C LYS B 31 65.689 -9.632 19.340 1.00 30.64 C ATOM 687 O LYS B 31 64.647 -9.434 18.706 1.00 28.92 O ATOM 688 CB LYS B 31 66.820 -8.036 20.990 1.00 29.03 C ATOM 689 CG LYS B 31 67.914 -6.992 21.170 1.00 29.19 C ATOM 690 CD LYS B 31 68.084 -6.565 22.615 1.00 30.69 C ATOM 691 CE LYS B 31 69.186 -5.523 22.735 1.00 31.29 C ATOM 692 NZ LYS B 31 69.268 -4.961 24.117 1.00 34.53 N1+ ATOM 693 N PRO B 32 66.012 -10.842 19.837 1.00 30.45 N ATOM 694 CA PRO B 32 65.217 -12.006 19.410 1.00 30.45 C ATOM 695 C PRO B 32 63.713 -11.989 19.741 1.00 30.05 C ATOM 696 O PRO B 32 62.935 -12.466 18.915 1.00 27.90 O ATOM 697 CB PRO B 32 65.902 -13.171 20.136 1.00 35.18 C ATOM 698 CG PRO B 32 67.309 -12.743 20.256 1.00 33.17 C ATOM 699 CD PRO B 32 67.253 -11.259 20.520 1.00 31.10 C ATOM 700 N LEU B 33 63.299 -11.492 20.904 1.00 28.78 N ATOM 701 CA LEU B 33 61.866 -11.473 21.206 1.00 25.99 C ATOM 702 C LEU B 33 61.141 -10.542 20.243 1.00 22.81 C ATOM 703 O LEU B 33 60.098 -10.886 19.700 1.00 26.58 O ATOM 704 CB LEU B 33 61.596 -11.033 22.653 1.00 26.89 C ATOM 705 CG LEU B 33 61.990 -11.986 23.781 1.00 31.38 C ATOM 706 CD1 LEU B 33 61.482 -11.460 25.130 1.00 31.60 C ATOM 707 CD2 LEU B 33 61.462 -13.377 23.509 1.00 27.41 C ATOM 708 N LEU B 34 61.694 -9.353 20.043 1.00 24.86 N ATOM 709 CA LEU B 34 61.044 -8.377 19.182 1.00 25.23 C ATOM 710 C LEU B 34 61.010 -8.901 17.749 1.00 26.98 C ATOM 711 O LEU B 34 60.019 -8.741 17.037 1.00 25.74 O ATOM 712 CB LEU B 34 61.756 -7.025 19.258 1.00 22.67 C ATOM 713 CG LEU B 34 61.198 -5.931 18.334 1.00 24.88 C ATOM 714 CD1 LEU B 34 59.700 -5.767 18.530 1.00 24.79 C ATOM 715 CD2 LEU B 34 61.912 -4.600 18.549 1.00 22.59 C ATOM 716 N LEU B 35 62.089 -9.558 17.342 1.00 28.14 N ATOM 717 CA LEU B 35 62.150 -10.140 16.001 1.00 29.99 C ATOM 718 C LEU B 35 61.065 -11.203 15.821 1.00 28.91 C ATOM 719 O LEU B 35 60.396 -11.238 14.794 1.00 31.74 O ATOM 720 CB LEU B 35 63.532 -10.737 15.743 1.00 29.33 C ATOM 721 CG LEU B 35 63.842 -11.221 14.325 1.00 32.73 C ATOM 722 CD1 LEU B 35 63.783 -10.068 13.327 1.00 33.22 C ATOM 723 CD2 LEU B 35 65.207 -11.876 14.320 1.00 35.24 C ATOM 724 N LYS B 36 60.879 -12.053 16.832 1.00 29.18 N ATOM 725 CA LYS B 36 59.820 -13.066 16.792 1.00 27.81 C ATOM 726 C LYS B 36 58.431 -12.436 16.659 1.00 29.65 C ATOM 727 O LYS B 36 57.564 -12.955 15.952 1.00 30.51 O ATOM 728 CB LYS B 36 59.871 -13.949 18.046 1.00 30.57 C ATOM 729 N LEU B 37 58.220 -11.314 17.341 1.00 27.07 N ATOM 730 CA LEU B 37 56.962 -10.578 17.232 1.00 26.94 C ATOM 731 C LEU B 37 56.755 -10.021 15.821 1.00 29.64 C ATOM 732 O LEU B 37 55.665 -10.136 15.244 1.00 26.92 O ATOM 733 CB LEU B 37 56.924 -9.438 18.259 1.00 27.66 C ATOM 734 CG LEU B 37 55.678 -8.544 18.343 1.00 27.56 C ATOM 735 CD1 LEU B 37 55.531 -8.002 19.758 1.00 22.82 C ATOM 736 CD2 LEU B 37 55.728 -7.380 17.335 1.00 26.93 C ATOM 737 N LEU B 38 57.789 -9.383 15.284 1.00 29.02 N ATOM 738 CA LEU B 38 57.689 -8.778 13.957 1.00 31.11 C ATOM 739 C LEU B 38 57.451 -9.840 12.888 1.00 29.55 C ATOM 740 O LEU B 38 56.661 -9.630 11.966 1.00 33.97 O ATOM 741 CB LEU B 38 58.948 -7.967 13.622 1.00 28.08 C ATOM 742 CG LEU B 38 59.335 -6.820 14.565 1.00 32.63 C ATOM 743 CD1 LEU B 38 60.478 -6.021 13.978 1.00 30.34 C ATOM 744 CD2 LEU B 38 58.152 -5.908 14.885 1.00 27.19 C ATOM 745 N LYS B 39 58.122 -10.982 13.010 1.00 30.33 N ATOM 746 CA LYS B 39 57.974 -12.036 12.006 1.00 35.52 C ATOM 747 C LYS B 39 56.616 -12.723 12.111 1.00 37.23 C ATOM 748 O LYS B 39 56.125 -13.281 11.134 1.00 31.54 O ATOM 749 CB LYS B 39 59.096 -13.074 12.120 1.00 36.60 C ATOM 750 CG LYS B 39 60.465 -12.578 11.668 1.00 38.91 C ATOM 751 CD LYS B 39 61.383 -13.747 11.328 1.00 43.69 C ATOM 752 CE LYS B 39 62.835 -13.310 11.199 1.00 43.43 C ATOM 753 NZ LYS B 39 63.079 -12.488 9.991 1.00 44.15 N1+ ATOM 754 N SER B 40 55.996 -12.671 13.287 1.00 32.10 N ATOM 755 CA SER B 40 54.694 -13.307 13.459 1.00 29.82 C ATOM 756 C SER B 40 53.595 -12.548 12.712 1.00 30.44 C ATOM 757 O SER B 40 52.513 -13.087 12.479 1.00 33.69 O ATOM 758 CB SER B 40 54.333 -13.427 14.946 1.00 28.47 C ATOM 759 OG SER B 40 53.940 -12.172 15.474 1.00 27.80 O ATOM 760 N VAL B 41 53.858 -11.301 12.333 1.00 28.27 N ATOM 761 CA VAL B 41 52.875 -10.552 11.549 1.00 30.69 C ATOM 762 C VAL B 41 53.375 -10.238 10.129 1.00 35.30 C ATOM 763 O VAL B 41 52.917 -9.284 9.492 1.00 36.69 O ATOM 764 CB VAL B 41 52.470 -9.240 12.243 1.00 29.57 C ATOM 765 CG1 VAL B 41 51.627 -9.537 13.504 1.00 25.10 C ATOM 766 CG2 VAL B 41 53.696 -8.424 12.587 1.00 30.98 C ATOM 767 N GLY B 42 54.317 -11.038 9.643 1.00 32.80 N ATOM 768 CA GLY B 42 54.655 -11.022 8.229 1.00 39.73 C ATOM 769 C GLY B 42 55.973 -10.389 7.825 1.00 44.69 C ATOM 770 O GLY B 42 56.294 -10.325 6.637 1.00 46.55 O ATOM 771 N ALA B 43 56.736 -9.906 8.797 1.00 36.42 N ATOM 772 CA ALA B 43 58.056 -9.372 8.505 1.00 41.86 C ATOM 773 C ALA B 43 59.006 -10.528 8.215 1.00 44.55 C ATOM 774 O ALA B 43 58.896 -11.593 8.822 1.00 44.07 O ATOM 775 CB ALA B 43 58.565 -8.525 9.658 1.00 35.99 C ATOM 776 N GLN B 44 59.932 -10.326 7.283 1.00 45.36 N ATOM 777 CA GLN B 44 60.807 -11.414 6.857 1.00 48.54 C ATOM 778 C GLN B 44 62.289 -11.053 6.899 1.00 47.90 C ATOM 779 O GLN B 44 63.127 -11.804 6.398 1.00 51.16 O ATOM 780 CB GLN B 44 60.429 -11.856 5.443 1.00 50.19 C ATOM 781 CG GLN B 44 58.959 -12.202 5.286 1.00 52.03 C ATOM 782 CD GLN B 44 58.410 -11.777 3.945 1.00 57.66 C ATOM 783 OE1 GLN B 44 58.627 -12.445 2.933 1.00 60.17 O ATOM 784 NE2 GLN B 44 57.695 -10.656 3.925 1.00 57.40 N ATOM 785 N LYS B 45 62.614 -9.913 7.496 1.00 43.76 N ATOM 786 CA LYS B 45 63.996 -9.448 7.529 1.00 44.32 C ATOM 787 C LYS B 45 64.587 -9.492 8.931 1.00 43.41 C ATOM 788 O LYS B 45 63.879 -9.754 9.901 1.00 39.70 O ATOM 789 CB LYS B 45 64.088 -8.026 6.985 1.00 43.26 C ATOM 790 CG LYS B 45 63.593 -7.878 5.566 1.00 47.75 C ATOM 791 CD LYS B 45 63.731 -6.442 5.101 1.00 48.61 C ATOM 792 CE LYS B 45 62.957 -5.501 6.003 1.00 38.68 C ATOM 793 NZ LYS B 45 63.145 -4.090 5.578 1.00 40.88 N1+ ATOM 794 N ASP B 46 65.887 -9.232 9.029 1.00 41.90 N ATOM 795 CA ASP B 46 66.562 -9.157 10.322 1.00 39.55 C ATOM 796 C ASP B 46 66.896 -7.709 10.643 1.00 38.54 C ATOM 797 O ASP B 46 67.211 -7.371 11.784 1.00 35.91 O ATOM 798 CB ASP B 46 67.838 -10.000 10.331 1.00 44.16 C ATOM 799 CG ASP B 46 67.563 -11.484 10.184 1.00 49.02 C ATOM 800 OD1 ASP B 46 66.519 -11.955 10.681 1.00 51.06 O ATOM 801 OD2 ASP B 46 68.396 -12.183 9.566 1.00 56.09 O1- ATOM 802 N THR B 47 66.835 -6.863 9.619 1.00 38.73 N ATOM 803 CA THR B 47 67.143 -5.445 9.756 1.00 35.32 C ATOM 804 C THR B 47 65.950 -4.629 9.280 1.00 36.20 C ATOM 805 O THR B 47 65.305 -4.983 8.295 1.00 34.29 O ATOM 806 CB THR B 47 68.405 -5.057 8.955 1.00 39.33 C ATOM 807 OG1 THR B 47 69.510 -5.857 9.392 1.00 41.80 O ATOM 808 CG2 THR B 47 68.744 -3.584 9.155 1.00 37.34 C ATOM 809 N TYR B 48 65.652 -3.549 9.996 1.00 31.12 N ATOM 810 CA TYR B 48 64.454 -2.758 9.742 1.00 33.43 C ATOM 811 C TYR B 48 64.751 -1.284 9.910 1.00 29.43 C ATOM 812 O TYR B 48 65.739 -0.910 10.537 1.00 35.08 O ATOM 813 CB TYR B 48 63.312 -3.161 10.695 1.00 31.23 C ATOM 814 CG TYR B 48 62.864 -4.598 10.553 1.00 32.58 C ATOM 815 CD1 TYR B 48 61.768 -4.930 9.764 1.00 35.78 C ATOM 816 CD2 TYR B 48 63.537 -5.623 11.203 1.00 31.90 C ATOM 817 CE1 TYR B 48 61.360 -6.251 9.622 1.00 36.45 C ATOM 818 CE2 TYR B 48 63.141 -6.940 11.064 1.00 33.14 C ATOM 819 CZ TYR B 48 62.052 -7.248 10.279 1.00 36.29 C ATOM 820 OH TYR B 48 61.662 -8.561 10.146 1.00 42.04 O ATOM 821 N THR B 49 63.891 -0.446 9.345 1.00 29.99 N ATOM 822 CA THR B 49 63.866 0.957 9.717 1.00 28.58 C ATOM 823 C THR B 49 62.972 1.080 10.948 1.00 26.01 C ATOM 824 O THR B 49 62.202 0.174 11.242 1.00 25.07 O ATOM 825 CB THR B 49 63.328 1.839 8.596 1.00 30.03 C ATOM 826 OG1 THR B 49 61.933 1.571 8.418 1.00 29.16 O ATOM 827 CG2 THR B 49 64.077 1.566 7.282 1.00 31.78 C ATOM 828 N MET B 50 63.074 2.188 11.666 1.00 28.71 N ATOM 829 CA MET B 50 62.214 2.397 12.821 1.00 26.05 C ATOM 830 C MET B 50 60.765 2.493 12.362 1.00 28.52 C ATOM 831 O MET B 50 59.855 2.019 13.041 1.00 25.89 O ATOM 832 CB MET B 50 62.634 3.644 13.586 1.00 28.74 C ATOM 833 CG MET B 50 63.754 3.380 14.579 1.00 33.18 C ATOM 834 SD MET B 50 63.267 2.161 15.820 1.00 32.75 S ATOM 835 CE MET B 50 61.842 2.940 16.575 1.00 27.89 C ATOM 836 N LYS B 51 60.562 3.075 11.184 1.00 26.13 N ATOM 837 CA LYS B 51 59.231 3.177 10.612 1.00 26.08 C ATOM 838 C LYS B 51 58.592 1.803 10.463 1.00 26.58 C ATOM 839 O LYS B 51 57.420 1.616 10.798 1.00 25.12 O ATOM 840 CB LYS B 51 59.289 3.884 9.256 1.00 30.89 C ATOM 841 CG LYS B 51 57.943 4.096 8.592 1.00 35.53 C ATOM 842 CD LYS B 51 58.132 4.852 7.276 1.00 40.33 C ATOM 843 CE LYS B 51 56.853 5.522 6.822 1.00 42.60 C ATOM 844 NZ LYS B 51 55.867 4.542 6.298 1.00 46.27 N ATOM 845 N GLU B 52 59.372 0.843 9.971 1.00 24.57 N ATOM 846 CA GLU B 52 58.902 -0.529 9.825 1.00 21.82 C ATOM 847 C GLU B 52 58.619 -1.185 11.186 1.00 23.40 C ATOM 848 O GLU B 52 57.620 -1.875 11.348 1.00 22.97 O ATOM 849 CB GLU B 52 59.922 -1.369 9.057 1.00 23.55 C ATOM 850 CG GLU B 52 60.026 -1.022 7.571 1.00 28.51 C ATOM 851 CD GLU B 52 61.168 -1.752 6.888 1.00 31.91 C ATOM 852 OE1 GLU B 52 62.241 -1.909 7.508 1.00 26.74 O ATOM 853 OE2 GLU B 52 60.992 -2.169 5.730 1.00 31.39 O1- ATOM 854 N VAL B 53 59.514 -0.986 12.145 1.00 20.61 N ATOM 855 CA VAL B 53 59.322 -1.560 13.480 1.00 21.62 C ATOM 856 C VAL B 53 57.996 -1.079 14.075 1.00 23.19 C ATOM 857 O VAL B 53 57.187 -1.882 14.558 1.00 24.30 O ATOM 858 CB VAL B 53 60.481 -1.202 14.422 1.00 20.66 C ATOM 859 CG1 VAL B 53 60.207 -1.721 15.827 1.00 21.19 C ATOM 860 CG2 VAL B 53 61.793 -1.767 13.888 1.00 24.04 C ATOM 861 N LEU B 54 57.756 0.227 14.005 1.00 20.93 N ATOM 862 CA LEU B 54 56.511 0.774 14.536 1.00 23.59 C ATOM 863 C LEU B 54 55.307 0.236 13.785 1.00 23.95 C ATOM 864 O LEU B 54 54.260 -0.026 14.381 1.00 19.25 O ATOM 865 CB LEU B 54 56.516 2.302 14.482 1.00 24.67 C ATOM 866 CG LEU B 54 57.426 3.046 15.460 1.00 26.61 C ATOM 867 CD1 LEU B 54 57.517 4.515 15.055 1.00 31.20 C ATOM 868 CD2 LEU B 54 56.954 2.910 16.915 1.00 24.74 C ATOM 869 N PHE B 55 55.447 0.066 12.474 1.00 21.08 N ATOM 870 CA PHE B 55 54.327 -0.433 11.687 1.00 18.73 C ATOM 871 C PHE B 55 53.936 -1.845 12.114 1.00 23.22 C ATOM 872 O PHE B 55 52.757 -2.142 12.333 1.00 23.88 O ATOM 873 CB PHE B 55 54.654 -0.412 10.178 1.00 22.49 C ATOM 874 CG PHE B 55 53.635 -1.128 9.343 1.00 20.57 C ATOM 875 CD1 PHE B 55 52.444 -0.510 9.004 1.00 27.35 C ATOM 876 CD2 PHE B 55 53.849 -2.434 8.930 1.00 24.54 C ATOM 877 CE1 PHE B 55 51.487 -1.173 8.250 1.00 24.56 C ATOM 878 CE2 PHE B 55 52.898 -3.102 8.180 1.00 25.54 C ATOM 879 CZ PHE B 55 51.715 -2.467 7.842 1.00 26.01 C ATOM 880 N TYR B 56 54.926 -2.724 12.221 1.00 20.71 N ATOM 881 CA TYR B 56 54.638 -4.123 12.514 1.00 23.50 C ATOM 882 C TYR B 56 54.172 -4.303 13.947 1.00 20.31 C ATOM 883 O TYR B 56 53.359 -5.174 14.240 1.00 18.70 O ATOM 884 CB TYR B 56 55.866 -4.986 12.245 1.00 23.66 C ATOM 885 CG TYR B 56 56.089 -5.217 10.768 1.00 28.56 C ATOM 886 CD1 TYR B 56 55.192 -5.969 10.026 1.00 28.29 C ATOM 887 CD2 TYR B 56 57.197 -4.690 10.120 1.00 30.91 C ATOM 888 CE1 TYR B 56 55.388 -6.184 8.670 1.00 34.48 C ATOM 889 CE2 TYR B 56 57.403 -4.897 8.769 1.00 34.22 C ATOM 890 CZ TYR B 56 56.498 -5.646 8.050 1.00 36.82 C ATOM 891 OH TYR B 56 56.709 -5.857 6.707 1.00 39.41 O ATOM 892 N LEU B 57 54.691 -3.470 14.836 1.00 19.50 N ATOM 893 CA LEU B 57 54.281 -3.536 16.238 1.00 19.60 C ATOM 894 C LEU B 57 52.813 -3.110 16.338 1.00 21.08 C ATOM 895 O LEU B 57 52.028 -3.712 17.073 1.00 18.80 O ATOM 896 CB LEU B 57 55.193 -2.663 17.089 1.00 21.42 C ATOM 897 CG LEU B 57 55.168 -2.796 18.606 1.00 27.54 C ATOM 898 CD1 LEU B 57 55.395 -4.247 19.041 1.00 25.32 C ATOM 899 CD2 LEU B 57 56.240 -1.887 19.185 1.00 29.19 C ATOM 900 N GLY B 58 52.432 -2.100 15.556 1.00 19.45 N ATOM 901 CA GLY B 58 51.032 -1.703 15.463 1.00 19.40 C ATOM 902 C GLY B 58 50.141 -2.781 14.870 1.00 21.38 C ATOM 903 O GLY B 58 49.035 -3.020 15.356 1.00 19.13 O ATOM 904 N GLN B 59 50.614 -3.425 13.803 1.00 21.02 N ATOM 905 CA GLN B 59 49.893 -4.539 13.190 1.00 22.39 C ATOM 906 C GLN B 59 49.614 -5.633 14.217 1.00 19.35 C ATOM 907 O GLN B 59 48.506 -6.158 14.302 1.00 23.04 O ATOM 908 CB GLN B 59 50.692 -5.143 12.031 1.00 22.44 C ATOM 909 CG GLN B 59 50.841 -4.241 10.815 1.00 24.46 C ATOM 910 CD GLN B 59 49.511 -3.903 10.184 1.00 22.44 C ATOM 911 OE1 GLN B 59 48.988 -2.810 10.379 1.00 26.31 O ATOM 912 NE2 GLN B 59 48.964 -4.835 9.404 1.00 24.40 N ATOM 913 N TYR B 60 50.654 -5.981 14.967 1.00 19.35 N ATOM 914 CA TYR B 60 50.576 -7.015 15.993 1.00 21.23 C ATOM 915 C TYR B 60 49.495 -6.705 17.028 1.00 20.50 C ATOM 916 O TYR B 60 48.626 -7.531 17.307 1.00 22.03 O ATOM 917 CB TYR B 60 51.941 -7.161 16.670 1.00 21.12 C ATOM 918 CG TYR B 60 52.024 -8.241 17.731 1.00 25.16 C ATOM 919 CD1 TYR B 60 52.338 -9.554 17.389 1.00 22.62 C ATOM 920 CD2 TYR B 60 51.818 -7.943 19.080 1.00 22.55 C ATOM 921 CE1 TYR B 60 52.427 -10.542 18.357 1.00 26.27 C ATOM 922 CE2 TYR B 60 51.900 -8.925 20.050 1.00 23.52 C ATOM 923 CZ TYR B 60 52.207 -10.220 19.687 1.00 25.53 C ATOM 924 OH TYR B 60 52.295 -11.200 20.656 1.00 25.10 O ATOM 925 N ILE B 61 49.551 -5.506 17.593 1.00 19.05 N ATOM 926 CA ILE B 61 48.580 -5.092 18.616 1.00 18.92 C ATOM 927 C ILE B 61 47.154 -5.047 18.058 1.00 20.38 C ATOM 928 O ILE B 61 46.188 -5.437 18.725 1.00 18.95 O ATOM 929 CB ILE B 61 48.978 -3.722 19.193 1.00 18.73 C ATOM 930 CG1 ILE B 61 50.325 -3.845 19.904 1.00 18.15 C ATOM 931 CG2 ILE B 61 47.907 -3.179 20.150 1.00 19.61 C ATOM 932 CD1 ILE B 61 50.996 -2.504 20.222 1.00 18.14 C ATOM 933 N MET B 62 47.029 -4.605 16.807 1.00 18.23 N ATOM 934 CA MET B 62 45.732 -4.553 16.139 1.00 20.67 C ATOM 935 C MET B 62 45.178 -5.958 15.916 1.00 20.09 C ATOM 936 O MET B 62 44.020 -6.234 16.208 1.00 24.52 O ATOM 937 CB MET B 62 45.851 -3.806 14.790 1.00 18.93 C ATOM 938 CG MET B 62 44.621 -3.904 13.865 1.00 23.73 C ATOM 939 SD MET B 62 44.539 -5.343 12.758 1.00 27.73 S ATOM 940 CE MET B 62 46.029 -5.151 11.756 1.00 21.47 C ATOM 941 N THR B 63 46.019 -6.838 15.385 1.00 20.35 N ATOM 942 CA THR B 63 45.585 -8.174 14.986 1.00 23.98 C ATOM 943 C THR B 63 45.131 -9.005 16.175 1.00 24.75 C ATOM 944 O THR B 63 44.154 -9.759 16.098 1.00 26.44 O ATOM 945 CB THR B 63 46.711 -8.931 14.263 1.00 26.29 C ATOM 946 OG1 THR B 63 47.160 -8.148 13.149 1.00 34.37 O ATOM 947 CG2 THR B 63 46.206 -10.258 13.758 1.00 29.93 C ATOM 948 N LYS B 64 45.849 -8.868 17.276 1.00 22.28 N ATOM 949 CA LYS B 64 45.526 -9.635 18.471 1.00 23.41 C ATOM 950 C LYS B 64 44.585 -8.862 19.382 1.00 23.94 C ATOM 951 O LYS B 64 44.193 -9.364 20.433 1.00 24.71 O ATOM 952 CB LYS B 64 46.803 -10.017 19.207 1.00 22.25 C ATOM 953 CG LYS B 64 47.772 -10.794 18.337 1.00 26.75 C ATOM 954 CD LYS B 64 48.941 -11.318 19.145 1.00 27.49 C ATOM 955 CE LYS B 64 48.508 -12.424 20.087 1.00 29.54 C ATOM 956 NZ LYS B 64 49.674 -13.041 20.785 1.00 29.54 N1+ ATOM 957 N AARG B 65 44.229 -7.647 18.968 0.53 21.79 N ATOM 958 N BARG B 65 44.236 -7.645 18.967 0.47 21.72 N ATOM 959 CA AARG B 65 43.294 -6.800 19.703 0.53 22.59 C ATOM 960 CA BARG B 65 43.305 -6.789 19.696 0.47 22.50 C ATOM 961 C AARG B 65 43.697 -6.667 21.169 0.53 22.59 C ATOM 962 C BARG B 65 43.698 -6.666 21.165 0.47 22.57 C ATOM 963 O AARG B 65 42.891 -6.908 22.069 0.53 20.64 O ATOM 964 O BARG B 65 42.889 -6.913 22.060 0.47 20.89 O ATOM 965 CB AARG B 65 41.869 -7.350 19.597 0.53 24.57 C ATOM 966 CB BARG B 65 41.877 -7.323 19.570 0.47 24.60 C ATOM 967 CG AARG B 65 41.320 -7.419 18.173 0.53 25.54 C ATOM 968 CG BARG B 65 41.298 -7.239 18.158 0.47 25.49 C ATOM 969 CD AARG B 65 39.924 -8.026 18.161 0.53 26.94 C ATOM 970 CD BARG B 65 40.079 -8.137 18.025 0.47 26.93 C ATOM 971 NE AARG B 65 38.952 -7.157 18.819 0.53 31.31 N ATOM 972 NE BARG B 65 40.427 -9.535 18.260 0.47 29.08 N ATOM 973 CZ AARG B 65 37.697 -7.503 19.086 0.53 30.92 C ATOM 974 CZ BARG B 65 39.561 -10.472 18.630 0.47 32.05 C ATOM 975 NH1AARG B 65 37.252 -8.709 18.757 0.53 29.35 N ATOM 976 NH1BARG B 65 39.973 -11.718 18.822 0.47 33.23 N ATOM 977 NH2AARG B 65 36.886 -6.641 19.686 0.53 28.29 N ATOM 978 NH2BARG B 65 38.284 -10.162 18.814 0.47 31.45 N ATOM 979 N LEU B 66 44.950 -6.289 21.401 1.00 20.60 N ATOM 980 CA LEU B 66 45.478 -6.191 22.755 1.00 22.02 C ATOM 981 C LEU B 66 45.052 -4.897 23.438 1.00 21.85 C ATOM 982 O LEU B 66 45.161 -4.771 24.653 1.00 21.62 O ATOM 983 CB LEU B 66 47.005 -6.292 22.737 1.00 16.42 C ATOM 984 CG LEU B 66 47.570 -7.612 22.216 1.00 20.36 C ATOM 985 CD1 LEU B 66 49.095 -7.584 22.264 1.00 20.30 C ATOM 986 CD2 LEU B 66 47.009 -8.791 23.014 1.00 25.62 C ATOM 987 N TYR B 67 44.575 -3.934 22.655 1.00 22.26 N ATOM 988 CA TYR B 67 44.186 -2.642 23.206 1.00 20.34 C ATOM 989 C TYR B 67 42.820 -2.716 23.879 1.00 23.35 C ATOM 990 O TYR B 67 41.993 -3.557 23.550 1.00 19.56 O ATOM 991 CB TYR B 67 44.173 -1.558 22.123 1.00 21.33 C ATOM 992 CG TYR B 67 43.230 -1.837 20.966 1.00 19.79 C ATOM 993 CD1 TYR B 67 41.891 -1.436 21.015 1.00 21.09 C ATOM 994 CD2 TYR B 67 43.682 -2.486 19.813 1.00 19.67 C ATOM 995 CE1 TYR B 67 41.023 -1.690 19.953 1.00 20.03 C ATOM 996 CE2 TYR B 67 42.818 -2.746 18.749 1.00 18.29 C ATOM 997 CZ TYR B 67 41.494 -2.341 18.823 1.00 22.05 C ATOM 998 OH TYR B 67 40.643 -2.598 17.772 1.00 19.67 O ATOM 999 N ASP B 68 42.592 -1.816 24.825 1.00 22.28 N ATOM 1000 CA ASP B 68 41.316 -1.741 25.516 1.00 22.07 C ATOM 1001 C ASP B 68 40.229 -1.141 24.628 1.00 21.33 C ATOM 1002 O ASP B 68 40.456 -0.141 23.963 1.00 21.74 O ATOM 1003 CB ASP B 68 41.458 -0.905 26.782 1.00 21.61 C ATOM 1004 CG ASP B 68 40.190 -0.889 27.598 1.00 24.11 C ATOM 1005 OD1 ASP B 68 39.425 0.097 27.516 1.00 23.17 O ATOM 1006 OD2 ASP B 68 39.955 -1.883 28.306 1.00 27.70 O1- ATOM 1007 N GLU B 69 39.041 -1.733 24.632 1.00 24.63 N ATOM 1008 CA GLU B 69 37.977 -1.257 23.744 1.00 25.67 C ATOM 1009 C GLU B 69 37.503 0.160 24.063 1.00 24.90 C ATOM 1010 O GLU B 69 37.219 0.945 23.159 1.00 23.65 O ATOM 1011 CB GLU B 69 36.784 -2.211 23.792 1.00 27.51 C ATOM 1012 CG GLU B 69 35.670 -1.840 22.817 1.00 33.61 C ATOM 1013 CD GLU B 69 34.604 -2.914 22.719 1.00 40.01 C ATOM 1014 OE1 GLU B 69 34.304 -3.553 23.752 1.00 45.41 O ATOM 1015 OE2 GLU B 69 34.076 -3.127 21.608 1.00 49.67 O ATOM 1016 N LYS B 70 37.410 0.489 25.351 1.00 23.70 N ATOM 1017 CA LYS B 70 36.838 1.767 25.763 1.00 21.91 C ATOM 1018 C LYS B 70 37.884 2.881 25.789 1.00 23.32 C ATOM 1019 O LYS B 70 37.575 4.053 25.563 1.00 27.63 O ATOM 1020 CB LYS B 70 36.170 1.622 27.147 1.00 23.56 C ATOM 1021 CG LYS B 70 35.119 0.508 27.207 1.00 24.95 C ATOM 1022 CD LYS B 70 34.527 0.349 28.617 1.00 30.24 C ATOM 1023 CE LYS B 70 33.493 -0.771 28.661 1.00 35.89 C ATOM 1024 NZ LYS B 70 32.873 -0.935 30.022 1.00 39.51 N1+ ATOM 1025 N GLN B 71 39.126 2.505 26.068 1.00 22.33 N ATOM 1026 CA GLN B 71 40.247 3.441 26.117 1.00 21.96 C ATOM 1027 C GLN B 71 41.381 2.891 25.284 1.00 22.23 C ATOM 1028 O GLN B 71 42.300 2.253 25.809 1.00 18.86 O ATOM 1029 CB GLN B 71 40.723 3.662 27.560 1.00 21.44 C ATOM 1030 CG GLN B 71 39.837 4.574 28.358 1.00 19.45 C ATOM 1031 CD GLN B 71 40.180 4.538 29.827 1.00 24.28 C ATOM 1032 OE1 GLN B 71 40.101 3.491 30.455 1.00 24.96 O ATOM 1033 NE2 GLN B 71 40.572 5.680 30.375 1.00 23.22 N ATOM 1034 N GLN B 72 41.335 3.157 23.984 1.00 18.14 N ATOM 1035 CA GLN B 72 42.066 2.325 23.048 1.00 20.32 C ATOM 1036 C GLN B 72 43.553 2.650 22.986 1.00 18.94 C ATOM 1037 O GLN B 72 44.295 2.057 22.195 1.00 19.20 O ATOM 1038 CB GLN B 72 41.412 2.428 21.657 1.00 18.85 C ATOM 1039 CG GLN B 72 39.901 2.151 21.710 1.00 20.07 C ATOM 1040 CD GLN B 72 39.369 1.510 20.438 1.00 24.85 C ATOM 1041 OE1 GLN B 72 40.021 1.547 19.393 1.00 19.80 O ATOM 1042 NE2 GLN B 72 38.191 0.892 20.531 1.00 20.34 N ATOM 1043 N HIS B 73 43.991 3.593 23.812 1.00 19.96 N ATOM 1044 CA HIS B 73 45.419 3.828 23.974 1.00 19.14 C ATOM 1045 C HIS B 73 46.041 2.877 25.004 1.00 20.57 C ATOM 1046 O HIS B 73 47.268 2.797 25.115 1.00 21.80 O ATOM 1047 CB HIS B 73 45.691 5.279 24.376 1.00 20.79 C ATOM 1048 CG HIS B 73 45.114 5.657 25.703 1.00 23.41 C ATOM 1049 ND1 HIS B 73 45.804 5.498 26.888 1.00 21.50 N ATOM 1050 CD2 HIS B 73 43.911 6.184 26.035 1.00 23.17 C ATOM 1051 CE1 HIS B 73 45.051 5.919 27.891 1.00 26.54 C ATOM 1052 NE2 HIS B 73 43.895 6.331 27.402 1.00 22.75 N ATOM 1053 N ILE B 74 45.204 2.162 25.754 1.00 20.80 N ATOM 1054 CA ILE B 74 45.710 1.224 26.757 1.00 21.03 C ATOM 1055 C ILE B 74 45.883 -0.153 26.159 1.00 21.60 C ATOM 1056 O ILE B 74 44.927 -0.748 25.658 1.00 22.14 O ATOM 1057 CB ILE B 74 44.776 1.112 27.992 1.00 22.44 C ATOM 1058 CG1 ILE B 74 44.615 2.473 28.664 1.00 22.39 C ATOM 1059 CG2 ILE B 74 45.333 0.077 28.983 1.00 24.26 C ATOM 1060 CD1 ILE B 74 43.608 2.486 29.808 1.00 27.08 C ATOM 1061 N VAL B 75 47.110 -0.661 26.212 1.00 17.96 N ATOM 1062 CA VAL B 75 47.408 -1.982 25.669 1.00 19.93 C ATOM 1063 C VAL B 75 47.694 -2.993 26.786 1.00 22.30 C ATOM 1064 O VAL B 75 48.641 -2.809 27.537 1.00 22.27 O ATOM 1065 CB VAL B 75 48.609 -1.923 24.710 1.00 17.70 C ATOM 1066 CG1 VAL B 75 49.023 -3.323 24.274 1.00 21.26 C ATOM 1067 CG2 VAL B 75 48.263 -1.062 23.481 1.00 19.95 C ATOM 1068 N TYR B 76 46.874 -4.041 26.888 1.00 22.76 N ATOM 1069 CA TYR B 76 47.101 -5.126 27.856 1.00 26.80 C ATOM 1070 C TYR B 76 47.963 -6.194 27.240 1.00 26.34 C ATOM 1071 O TYR B 76 47.638 -6.705 26.165 1.00 29.54 O ATOM 1072 CB TYR B 76 45.793 -5.769 28.318 1.00 27.13 C ATOM 1073 CG TYR B 76 44.801 -4.795 28.869 1.00 31.56 C ATOM 1074 CD1 TYR B 76 45.029 -4.151 30.076 1.00 33.42 C ATOM 1075 CD2 TYR B 76 43.626 -4.523 28.186 1.00 35.30 C ATOM 1076 CE1 TYR B 76 44.116 -3.253 30.578 1.00 36.41 C ATOM 1077 CE2 TYR B 76 42.709 -3.632 28.683 1.00 35.54 C ATOM 1078 CZ TYR B 76 42.961 -2.994 29.874 1.00 33.59 C ATOM 1079 OH TYR B 76 42.031 -2.105 30.357 1.00 39.76 O ATOM 1080 N CYS B 77 49.055 -6.543 27.911 1.00 24.96 N ATOM 1081 CA CYS B 77 49.998 -7.490 27.334 1.00 26.39 C ATOM 1082 C CYS B 77 50.653 -8.407 28.370 1.00 26.15 C ATOM 1083 O CYS B 77 51.642 -9.072 28.068 1.00 25.84 O ATOM 1084 CB CYS B 77 51.071 -6.727 26.544 1.00 25.05 C ATOM 1085 SG CYS B 77 51.816 -5.339 27.441 1.00 25.68 S ATOM 1086 N SER B 78 50.088 -8.476 29.574 1.00 25.17 N ATOM 1087 CA SER B 78 50.725 -9.231 30.662 1.00 24.03 C ATOM 1088 C SER B 78 50.854 -10.723 30.357 1.00 26.93 C ATOM 1089 O SER B 78 51.776 -11.378 30.839 1.00 30.56 O ATOM 1090 CB SER B 78 49.954 -9.048 31.971 1.00 25.36 C ATOM 1091 OG SER B 78 48.718 -9.734 31.923 1.00 29.56 O ATOM 1092 N ASN B 79 49.929 -11.259 29.568 1.00 24.05 N ATOM 1093 CA ASN B 79 49.994 -12.661 29.181 1.00 28.29 C ATOM 1094 C ASN B 79 50.474 -12.809 27.744 1.00 28.26 C ATOM 1095 O ASN B 79 50.209 -13.815 27.092 1.00 28.20 O ATOM 1096 CB ASN B 79 48.628 -13.333 29.351 1.00 28.02 C ATOM 1097 CG ASN B 79 48.118 -13.266 30.785 1.00 38.32 C ATOM 1098 OD1 ASN B 79 48.604 -13.981 31.662 1.00 35.99 O ATOM 1099 ND2 ASN B 79 47.133 -12.406 31.027 1.00 39.72 N ATOM 1100 N ASP B 80 51.186 -11.802 27.254 1.00 26.12 N ATOM 1101 CA ASP B 80 51.588 -11.789 25.857 1.00 25.83 C ATOM 1102 C ASP B 80 53.100 -11.654 25.698 1.00 25.90 C ATOM 1103 O ASP B 80 53.779 -11.092 26.560 1.00 25.44 O ATOM 1104 CB ASP B 80 50.879 -10.648 25.124 1.00 26.26 C ATOM 1105 CG ASP B 80 50.899 -10.825 23.617 1.00 25.33 C ATOM 1106 OD1 ASP B 80 49.981 -11.476 23.084 1.00 27.54 O ATOM 1107 OD2 ASP B 80 51.842 -10.327 22.978 1.00 24.50 O1- ATOM 1108 N LEU B 81 53.616 -12.180 24.591 1.00 26.91 N ATOM 1109 CA LEU B 81 55.004 -11.957 24.188 1.00 24.79 C ATOM 1110 C LEU B 81 55.394 -10.470 24.277 1.00 24.81 C ATOM 1111 O LEU B 81 56.494 -10.131 24.713 1.00 24.18 O ATOM 1112 CB LEU B 81 55.226 -12.481 22.761 1.00 27.18 C ATOM 1113 CG LEU B 81 56.507 -12.048 22.044 1.00 28.67 C ATOM 1114 CD1 LEU B 81 57.724 -12.729 22.652 1.00 29.66 C ATOM 1115 CD2 LEU B 81 56.426 -12.318 20.535 1.00 30.71 C ATOM 1116 N LEU B 82 54.488 -9.583 23.875 1.00 23.45 N ATOM 1117 CA LEU B 82 54.756 -8.147 23.967 1.00 24.12 C ATOM 1118 C LEU B 82 55.028 -7.696 25.416 1.00 21.00 C ATOM 1119 O LEU B 82 55.915 -6.879 25.672 1.00 22.84 O ATOM 1120 CB LEU B 82 53.588 -7.353 23.377 1.00 22.42 C ATOM 1121 CG LEU B 82 53.721 -5.825 23.350 1.00 21.37 C ATOM 1122 CD1 LEU B 82 55.022 -5.378 22.680 1.00 21.65 C ATOM 1123 CD2 LEU B 82 52.514 -5.188 22.664 1.00 18.08 C ATOM 1124 N GLY B 83 54.274 -8.235 26.361 1.00 22.52 N ATOM 1125 CA GLY B 83 54.491 -7.890 27.765 1.00 22.81 C ATOM 1126 C GLY B 83 55.854 -8.341 28.258 1.00 23.47 C ATOM 1127 O GLY B 83 56.503 -7.656 29.049 1.00 23.93 O ATOM 1128 N ASP B 84 56.291 -9.500 27.779 1.00 25.52 N ATOM 1129 CA ASP B 84 57.598 -10.036 28.135 1.00 25.30 C ATOM 1130 C ASP B 84 58.728 -9.134 27.666 1.00 25.49 C ATOM 1131 O ASP B 84 59.648 -8.844 28.424 1.00 25.54 O ATOM 1132 CB ASP B 84 57.789 -11.431 27.543 1.00 29.62 C ATOM 1133 CG ASP B 84 56.834 -12.449 28.130 1.00 33.30 C ATOM 1134 OD1 ASP B 84 56.429 -12.278 29.300 1.00 33.92 O ATOM 1135 OD2 ASP B 84 56.487 -13.416 27.418 1.00 34.86 O1- ATOM 1136 N LEU B 85 58.666 -8.685 26.416 1.00 24.11 N ATOM 1137 CA LEU B 85 59.789 -7.943 25.872 1.00 24.02 C ATOM 1138 C LEU B 85 59.773 -6.510 26.370 1.00 22.07 C ATOM 1139 O LEU B 85 60.831 -5.913 26.546 1.00 27.12 O ATOM 1140 CB LEU B 85 59.807 -8.002 24.334 1.00 28.60 C ATOM 1141 CG LEU B 85 58.813 -7.260 23.442 1.00 25.94 C ATOM 1142 CD1 LEU B 85 59.422 -5.988 22.896 1.00 28.19 C ATOM 1143 CD2 LEU B 85 58.397 -8.163 22.299 1.00 29.38 C ATOM 1144 N PHE B 86 58.586 -5.956 26.611 1.00 22.39 N ATOM 1145 CA PHE B 86 58.499 -4.619 27.206 1.00 23.24 C ATOM 1146 C PHE B 86 58.695 -4.681 28.724 1.00 21.64 C ATOM 1147 O PHE B 86 59.019 -3.677 29.344 1.00 22.04 O ATOM 1148 CB PHE B 86 57.151 -3.943 26.903 1.00 21.78 C ATOM 1149 CG PHE B 86 57.088 -3.261 25.561 1.00 22.60 C ATOM 1150 CD1 PHE B 86 58.149 -3.332 24.671 1.00 20.68 C ATOM 1151 CD2 PHE B 86 55.957 -2.550 25.189 1.00 22.09 C ATOM 1152 CE1 PHE B 86 58.085 -2.711 23.440 1.00 25.17 C ATOM 1153 CE2 PHE B 86 55.893 -1.918 23.956 1.00 25.88 C ATOM 1154 CZ PHE B 86 56.951 -2.007 23.082 1.00 23.92 C ATOM 1155 N GLY B 87 58.476 -5.854 29.313 1.00 23.46 N ATOM 1156 CA GLY B 87 58.588 -6.009 30.757 1.00 22.74 C ATOM 1157 C GLY B 87 57.542 -5.228 31.539 1.00 22.14 C ATOM 1158 O GLY B 87 57.853 -4.641 32.571 1.00 24.43 O ATOM 1159 N VAL B 88 56.305 -5.208 31.045 1.00 23.29 N ATOM 1160 CA VAL B 88 55.208 -4.512 31.726 1.00 20.90 C ATOM 1161 C VAL B 88 53.922 -5.315 31.600 1.00 21.38 C ATOM 1162 O VAL B 88 53.781 -6.125 30.677 1.00 21.41 O ATOM 1163 CB VAL B 88 54.966 -3.085 31.154 1.00 24.03 C ATOM 1164 CG1 VAL B 88 56.195 -2.187 31.333 1.00 25.01 C ATOM 1165 CG2 VAL B 88 54.525 -3.151 29.676 1.00 21.45 C ATOM 1166 N PRO B 89 52.971 -5.101 32.523 1.00 22.32 N ATOM 1167 CA PRO B 89 51.664 -5.752 32.390 1.00 22.16 C ATOM 1168 C PRO B 89 50.764 -5.041 31.378 1.00 22.83 C ATOM 1169 O PRO B 89 49.906 -5.673 30.769 1.00 21.90 O ATOM 1170 CB PRO B 89 51.057 -5.651 33.807 1.00 19.53 C ATOM 1171 CG PRO B 89 52.196 -5.184 34.708 1.00 24.29 C ATOM 1172 CD PRO B 89 53.114 -4.410 33.819 1.00 23.39 C ATOM 1173 N SER B 90 50.938 -3.732 31.247 1.00 23.06 N ATOM 1174 CA SER B 90 50.210 -2.941 30.253 1.00 23.11 C ATOM 1175 C SER B 90 50.942 -1.625 30.065 1.00 24.93 C ATOM 1176 O SER B 90 51.790 -1.273 30.879 1.00 23.81 O ATOM 1177 CB SER B 90 48.755 -2.700 30.680 1.00 24.25 C ATOM 1178 OG SER B 90 48.673 -1.823 31.797 1.00 25.26 O ATOM 1179 N PHE B 91 50.634 -0.914 28.984 1.00 21.83 N ATOM 1180 CA PHE B 91 51.189 0.406 28.759 1.00 20.03 C ATOM 1181 C PHE B 91 50.179 1.266 28.019 1.00 20.10 C ATOM 1182 O PHE B 91 49.203 0.750 27.469 1.00 21.06 O ATOM 1183 CB PHE B 91 52.505 0.337 27.977 1.00 20.67 C ATOM 1184 CG PHE B 91 52.371 -0.259 26.585 1.00 20.99 C ATOM 1185 CD1 PHE B 91 52.541 -1.616 26.378 1.00 19.30 C ATOM 1186 CD2 PHE B 91 52.092 0.549 25.491 1.00 23.60 C ATOM 1187 CE1 PHE B 91 52.429 -2.163 25.102 1.00 23.02 C ATOM 1188 CE2 PHE B 91 51.993 0.017 24.208 1.00 21.53 C ATOM 1189 CZ PHE B 91 52.158 -1.345 24.020 1.00 21.81 C ATOM 1190 N SER B 92 50.418 2.573 28.018 1.00 20.59 N ATOM 1191 CA SER B 92 49.589 3.507 27.270 1.00 23.35 C ATOM 1192 C SER B 92 50.334 4.047 26.062 1.00 20.62 C ATOM 1193 O SER B 92 51.469 4.490 26.171 1.00 21.07 O ATOM 1194 CB SER B 92 49.141 4.681 28.148 1.00 24.68 C ATOM 1195 OG SER B 92 48.619 5.721 27.329 1.00 21.63 O ATOM 1196 N VAL B 93 49.664 4.032 24.915 1.00 22.08 N ATOM 1197 CA VAL B 93 50.226 4.561 23.680 1.00 23.37 C ATOM 1198 C VAL B 93 50.419 6.073 23.776 1.00 24.23 C ATOM 1199 O VAL B 93 51.185 6.656 23.006 1.00 25.60 O ATOM 1200 CB VAL B 93 49.318 4.205 22.477 1.00 21.47 C ATOM 1201 CG1 VAL B 93 49.858 4.766 21.158 1.00 20.76 C ATOM 1202 CG2 VAL B 93 49.152 2.688 22.390 1.00 23.05 C ATOM 1203 N LYS B 94 49.740 6.714 24.726 1.00 20.66 N ATOM 1204 CA LYS B 94 49.898 8.160 24.900 1.00 23.86 C ATOM 1205 C LYS B 94 51.266 8.528 25.463 1.00 26.95 C ATOM 1206 O LYS B 94 51.691 9.680 25.377 1.00 28.54 O ATOM 1207 CB LYS B 94 48.821 8.727 25.823 1.00 24.48 C ATOM 1208 CG LYS B 94 47.464 8.987 25.188 1.00 26.32 C ATOM 1209 CD LYS B 94 46.534 9.568 26.252 1.00 29.09 C ATOM 1210 CE LYS B 94 45.185 9.930 25.686 1.00 33.72 C ATOM 1211 NZ LYS B 94 44.297 10.430 26.772 1.00 42.97 N1+ ATOM 1212 N GLU B 95 51.943 7.564 26.079 1.00 27.91 N ATOM 1213 CA GLU B 95 53.240 7.846 26.695 1.00 29.39 C ATOM 1214 C GLU B 95 54.341 7.540 25.687 1.00 28.96 C ATOM 1215 O GLU B 95 54.955 6.473 25.715 1.00 26.30 O ATOM 1216 CB GLU B 95 53.409 7.042 27.995 1.00 28.47 C ATOM 1217 CG GLU B 95 52.321 7.368 29.020 1.00 32.57 C ATOM 1218 CD GLU B 95 52.405 6.543 30.300 1.00 42.74 C ATOM 1219 OE1 GLU B 95 53.441 5.888 30.535 1.00 47.04 O ATOM 1220 OE2 GLU B 95 51.428 6.562 31.080 1.00 48.62 O1- ATOM 1221 N HIS B 96 54.570 8.498 24.792 1.00 25.35 N ATOM 1222 CA HIS B 96 55.415 8.293 23.624 1.00 31.87 C ATOM 1223 C HIS B 96 56.849 7.949 23.992 1.00 26.19 C ATOM 1224 O HIS B 96 57.411 6.986 23.470 1.00 28.67 O ATOM 1225 CB HIS B 96 55.379 9.535 22.725 1.00 28.39 C ATOM 1226 CG HIS B 96 54.059 9.750 22.053 1.00 34.94 C ATOM 1227 ND1 HIS B 96 53.836 10.765 21.147 1.00 38.67 N ATOM 1228 CD2 HIS B 96 52.891 9.068 22.147 1.00 33.44 C ATOM 1229 CE1 HIS B 96 52.590 10.700 20.712 1.00 33.60 C ATOM 1230 NE2 HIS B 96 51.996 9.677 21.301 1.00 34.51 N ATOM 1231 N ARG B 97 57.443 8.723 24.890 1.00 30.01 N ATOM 1232 CA ARG B 97 58.846 8.495 25.229 1.00 32.46 C ATOM 1233 C ARG B 97 59.041 7.149 25.924 1.00 29.24 C ATOM 1234 O ARG B 97 60.053 6.478 25.711 1.00 29.58 O ATOM 1235 CB ARG B 97 59.385 9.642 26.086 1.00 33.50 C ATOM 1236 CG ARG B 97 59.513 10.941 25.293 1.00 34.82 C ATOM 1237 CD ARG B 97 60.255 12.026 26.062 1.00 38.80 C ATOM 1238 NE ARG B 97 59.643 12.334 27.353 1.00 45.95 N ATOM 1239 CZ ARG B 97 58.758 13.307 27.552 1.00 47.81 C ATOM 1240 NH1 ARG B 97 58.363 14.067 26.540 1.00 48.29 N ATOM 1241 NH2 ARG B 97 58.260 13.514 28.765 1.00 46.11 N ATOM 1242 N LYS B 98 58.064 6.742 26.731 1.00 27.01 N ATOM 1243 CA LYS B 98 58.107 5.423 27.354 1.00 24.81 C ATOM 1244 C LYS B 98 58.091 4.311 26.304 1.00 27.64 C ATOM 1245 O LYS B 98 58.874 3.362 26.387 1.00 26.44 O ATOM 1246 CB LYS B 98 56.936 5.239 28.313 1.00 30.74 C ATOM 1247 CG LYS B 98 56.912 3.868 28.974 1.00 32.79 C ATOM 1248 CD LYS B 98 55.836 3.800 30.057 1.00 44.09 C ATOM 1249 CE LYS B 98 55.649 2.387 30.589 1.00 43.86 C ATOM 1250 NZ LYS B 98 54.472 2.313 31.500 1.00 43.42 N ATOM 1251 N ILE B 99 57.199 4.443 25.321 1.00 24.61 N ATOM 1252 CA ILE B 99 57.105 3.494 24.208 1.00 22.73 C ATOM 1253 C ILE B 99 58.415 3.377 23.450 1.00 22.24 C ATOM 1254 O ILE B 99 58.914 2.277 23.201 1.00 23.89 O ATOM 1255 CB ILE B 99 56.019 3.896 23.183 1.00 24.96 C ATOM 1256 CG1 ILE B 99 54.646 3.973 23.835 1.00 29.12 C ATOM 1257 CG2 ILE B 99 55.984 2.901 22.025 1.00 29.92 C ATOM 1258 CD1 ILE B 99 54.338 2.795 24.658 1.00 31.11 C ATOM 1259 N TYR B 100 58.958 4.519 23.047 1.00 23.07 N ATOM 1260 CA TYR B 100 60.201 4.502 22.299 1.00 24.05 C ATOM 1261 C TYR B 100 61.325 3.905 23.140 1.00 22.86 C ATOM 1262 O TYR B 100 62.153 3.164 22.632 1.00 22.75 O ATOM 1263 CB TYR B 100 60.548 5.904 21.810 1.00 24.35 C ATOM 1264 CG TYR B 100 59.858 6.224 20.506 1.00 25.34 C ATOM 1265 CD1 TYR B 100 58.668 6.946 20.478 1.00 30.04 C ATOM 1266 CD2 TYR B 100 60.375 5.770 19.304 1.00 31.28 C ATOM 1267 CE1 TYR B 100 58.027 7.222 19.273 1.00 27.97 C ATOM 1268 CE2 TYR B 100 59.747 6.043 18.103 1.00 32.22 C ATOM 1269 CZ TYR B 100 58.574 6.766 18.093 1.00 32.04 C ATOM 1270 OH TYR B 100 57.956 7.032 16.890 1.00 32.37 O ATOM 1271 N THR B 101 61.329 4.197 24.434 1.00 24.20 N ATOM 1272 CA THR B 101 62.348 3.636 25.312 1.00 26.16 C ATOM 1273 C THR B 101 62.246 2.113 25.359 1.00 24.98 C ATOM 1274 O THR B 101 63.253 1.405 25.256 1.00 26.71 O ATOM 1275 CB THR B 101 62.236 4.215 26.730 1.00 25.79 C ATOM 1276 OG1 THR B 101 62.621 5.593 26.696 1.00 30.23 O ATOM 1277 CG2 THR B 101 63.145 3.460 27.706 1.00 29.08 C ATOM 1278 N MET B 102 61.027 1.608 25.490 1.00 22.92 N ATOM 1279 CA MET B 102 60.840 0.164 25.562 1.00 23.18 C ATOM 1280 C MET B 102 61.241 -0.504 24.245 1.00 24.55 C ATOM 1281 O MET B 102 61.870 -1.561 24.245 1.00 25.62 O ATOM 1282 CB MET B 102 59.395 -0.167 25.935 1.00 23.62 C ATOM 1283 CG MET B 102 59.069 0.175 27.398 1.00 24.02 C ATOM 1284 SD MET B 102 57.414 -0.341 27.871 1.00 27.99 S ATOM 1285 CE MET B 102 56.422 0.742 26.852 1.00 25.54 C ATOM 1286 N ILE B 103 60.907 0.129 23.128 1.00 22.31 N ATOM 1287 CA ILE B 103 61.291 -0.403 21.824 1.00 21.92 C ATOM 1288 C ILE B 103 62.810 -0.391 21.668 1.00 24.71 C ATOM 1289 O ILE B 103 63.396 -1.372 21.210 1.00 27.38 O ATOM 1290 CB ILE B 103 60.630 0.393 20.668 1.00 23.30 C ATOM 1291 CG1 ILE B 103 59.112 0.186 20.696 1.00 23.24 C ATOM 1292 CG2 ILE B 103 61.215 -0.016 19.311 1.00 23.27 C ATOM 1293 CD1 ILE B 103 58.339 1.026 19.684 1.00 23.08 C ATOM 1294 N TYR B 104 63.445 0.708 22.070 1.00 23.33 N ATOM 1295 CA TYR B 104 64.894 0.870 21.890 1.00 27.24 C ATOM 1296 C TYR B 104 65.700 -0.149 22.679 1.00 30.79 C ATOM 1297 O TYR B 104 66.772 -0.580 22.245 1.00 28.24 O ATOM 1298 CB TYR B 104 65.332 2.275 22.296 1.00 26.92 C ATOM 1299 CG TYR B 104 64.913 3.352 21.329 1.00 26.79 C ATOM 1300 CD1 TYR B 104 64.649 3.054 19.997 1.00 31.30 C ATOM 1301 CD2 TYR B 104 64.778 4.671 21.747 1.00 32.42 C ATOM 1302 CE1 TYR B 104 64.265 4.044 19.106 1.00 31.29 C ATOM 1303 CE2 TYR B 104 64.392 5.667 20.863 1.00 33.26 C ATOM 1304 CZ TYR B 104 64.140 5.348 19.549 1.00 32.86 C ATOM 1305 OH TYR B 104 63.761 6.342 18.676 1.00 34.94 O ATOM 1306 N ARG B 105 65.176 -0.533 23.839 1.00 25.65 N ATOM 1307 CA ARG B 105 65.821 -1.548 24.663 1.00 27.93 C ATOM 1308 C ARG B 105 65.776 -2.912 23.986 1.00 28.36 C ATOM 1309 O ARG B 105 66.448 -3.846 24.418 1.00 27.46 O ATOM 1310 CB ARG B 105 65.155 -1.638 26.035 1.00 26.81 C ATOM 1311 CG ARG B 105 65.384 -0.438 26.934 1.00 31.48 C ATOM 1312 CD ARG B 105 64.829 -0.727 28.314 1.00 35.16 C ATOM 1313 NE ARG B 105 65.095 0.343 29.266 1.00 43.93 N ATOM 1314 CZ ARG B 105 64.171 0.873 30.059 1.00 43.98 C ATOM 1315 NH1 ARG B 105 64.495 1.843 30.904 1.00 47.79 N1+ ATOM 1316 NH2 ARG B 105 62.920 0.433 30.001 1.00 43.23 N ATOM 1317 N ASN B 106 64.971 -3.029 22.935 1.00 23.51 N ATOM 1318 CA ASN B 106 64.798 -4.314 22.260 1.00 25.49 C ATOM 1319 C ASN B 106 65.397 -4.363 20.863 1.00 25.15 C ATOM 1320 O ASN B 106 65.019 -5.198 20.036 1.00 25.41 O ATOM 1321 CB ASN B 106 63.319 -4.671 22.200 1.00 25.21 C ATOM 1322 CG ASN B 106 62.829 -5.281 23.497 1.00 30.34 C ATOM 1323 OD1 ASN B 106 62.884 -6.498 23.679 1.00 28.85 O ATOM 1324 ND2 ASN B 106 62.368 -4.436 24.414 1.00 24.90 N ATOM 1325 N LEU B 107 66.339 -3.472 20.602 1.00 25.10 N ATOM 1326 CA LEU B 107 67.015 -3.464 19.312 1.00 27.98 C ATOM 1327 C LEU B 107 68.394 -2.849 19.452 1.00 29.52 C ATOM 1328 O LEU B 107 68.730 -2.280 20.491 1.00 27.37 O ATOM 1329 CB LEU B 107 66.188 -2.705 18.272 1.00 25.92 C ATOM 1330 CG LEU B 107 65.699 -1.295 18.635 1.00 27.94 C ATOM 1331 CD1 LEU B 107 66.772 -0.226 18.431 1.00 28.56 C ATOM 1332 CD2 LEU B 107 64.448 -0.948 17.843 1.00 25.20 C ATOM 1333 N VAL B 108 69.188 -2.966 18.396 1.00 30.85 N ATOM 1334 CA VAL B 108 70.478 -2.305 18.328 1.00 30.11 C ATOM 1335 C VAL B 108 70.534 -1.542 17.011 1.00 30.54 C ATOM 1336 O VAL B 108 70.185 -2.088 15.972 1.00 28.77 O ATOM 1337 CB VAL B 108 71.645 -3.313 18.416 1.00 33.11 C ATOM 1338 CG1 VAL B 108 72.975 -2.609 18.224 1.00 35.00 C ATOM 1339 CG2 VAL B 108 71.607 -4.055 19.749 1.00 32.38 C ATOM 1340 N VAL B 109 70.946 -0.281 17.056 1.00 30.77 N ATOM 1341 CA VAL B 109 71.055 0.509 15.837 1.00 30.95 C ATOM 1342 C VAL B 109 72.261 0.047 15.025 1.00 35.00 C ATOM 1343 O VAL B 109 73.331 -0.200 15.580 1.00 32.79 O ATOM 1344 CB VAL B 109 71.170 2.013 16.143 1.00 31.27 C ATOM 1345 CG1 VAL B 109 71.530 2.801 14.890 1.00 33.92 C ATOM 1346 CG2 VAL B 109 69.867 2.527 16.743 1.00 32.43 C ATOM 1347 N VAL B 110 72.060 -0.093 13.717 1.00 34.69 N ATOM 1348 CA VAL B 110 73.121 -0.450 12.782 1.00 36.72 C ATOM 1349 C VAL B 110 73.843 0.794 12.273 1.00 40.73 C ATOM 1350 O VAL B 110 75.042 0.961 12.494 1.00 49.33 O ATOM 1351 CB VAL B 110 72.568 -1.225 11.579 1.00 38.39 C ATOM 1352 CG1 VAL B 110 73.670 -1.490 10.564 1.00 42.70 C ATOM 1353 CG2 VAL B 110 71.932 -2.521 12.034 1.00 35.64 C TER 1354 VAL B 110 ATOM 1355 N SER C 2 56.204 35.778 -1.345 1.00 50.96 N ATOM 1356 CA SER C 2 55.556 34.583 -0.812 1.00 45.98 C ATOM 1357 C SER C 2 56.307 34.029 0.398 1.00 42.44 C ATOM 1358 O SER C 2 57.464 34.371 0.644 1.00 47.01 O ATOM 1359 CB SER C 2 55.442 33.506 -1.895 1.00 40.42 C ATOM 1360 N LEU C 3 55.633 33.177 1.157 1.00 42.25 N ATOM 1361 CA LEU C 3 56.233 32.531 2.314 1.00 35.45 C ATOM 1362 C LEU C 3 56.617 31.110 1.932 1.00 36.65 C ATOM 1363 O LEU C 3 56.022 30.532 1.025 1.00 34.68 O ATOM 1364 CB LEU C 3 55.263 32.535 3.490 1.00 34.68 C ATOM 1365 CG LEU C 3 54.723 33.917 3.860 1.00 38.19 C ATOM 1366 CD1 LEU C 3 53.390 33.798 4.571 1.00 40.61 C ATOM 1367 CD2 LEU C 3 55.725 34.657 4.727 1.00 37.84 C ATOM 1368 N THR C 4 57.624 30.560 2.603 1.00 33.40 N ATOM 1369 CA THR C 4 58.060 29.196 2.333 1.00 33.93 C ATOM 1370 C THR C 4 58.360 28.469 3.624 1.00 32.36 C ATOM 1371 O THR C 4 58.051 28.956 4.716 1.00 33.60 O ATOM 1372 CB THR C 4 59.332 29.138 1.449 1.00 35.18 C ATOM 1373 OG1 THR C 4 60.450 29.655 2.183 1.00 37.12 O ATOM 1374 CG2 THR C 4 59.148 29.932 0.177 1.00 32.31 C ATOM 1375 N GLU C 5 58.982 27.303 3.487 1.00 32.43 N ATOM 1376 CA GLU C 5 59.420 26.518 4.632 1.00 36.19 C ATOM 1377 C GLU C 5 60.364 27.328 5.521 1.00 34.21 C ATOM 1378 O GLU C 5 60.450 27.080 6.718 1.00 35.60 O ATOM 1379 CB GLU C 5 60.098 25.227 4.163 1.00 37.75 C ATOM 1380 CG GLU C 5 60.709 24.378 5.280 1.00 38.46 C ATOM 1381 CD GLU C 5 59.686 23.901 6.300 1.00 44.97 C ATOM 1382 OE1 GLU C 5 58.506 23.722 5.926 1.00 40.74 O ATOM 1383 OE2 GLU C 5 60.064 23.700 7.478 1.00 41.40 O1- ATOM 1384 N ASP C 6 61.061 28.299 4.928 1.00 36.42 N ATOM 1385 CA ASP C 6 61.928 29.201 5.684 1.00 35.91 C ATOM 1386 C ASP C 6 61.158 29.893 6.809 1.00 36.23 C ATOM 1387 O ASP C 6 61.709 30.160 7.875 1.00 38.40 O ATOM 1388 CB ASP C 6 62.552 30.259 4.768 1.00 36.84 C ATOM 1389 CG ASP C 6 63.495 29.667 3.730 1.00 39.02 C ATOM 1390 OD1 ASP C 6 63.905 28.496 3.880 1.00 38.69 O ATOM 1391 OD2 ASP C 6 63.843 30.391 2.772 1.00 37.32 O1- ATOM 1392 N ASN C 7 59.881 30.169 6.565 1.00 33.96 N ATOM 1393 CA ASN C 7 59.057 30.915 7.508 1.00 31.78 C ATOM 1394 C ASN C 7 58.317 30.028 8.503 1.00 34.26 C ATOM 1395 O ASN C 7 57.459 30.506 9.243 1.00 36.91 O ATOM 1396 CB ASN C 7 58.051 31.779 6.746 1.00 33.60 C ATOM 1397 CG ASN C 7 58.712 32.654 5.696 1.00 36.07 C ATOM 1398 OD1 ASN C 7 58.766 32.300 4.517 1.00 32.35 O ATOM 1399 ND2 ASN C 7 59.230 33.801 6.123 1.00 33.52 N ATOM 1400 N ASN C 8 58.645 28.739 8.523 1.00 35.37 N ATOM 1401 CA ASN C 8 58.008 27.810 9.453 1.00 35.25 C ATOM 1402 C ASN C 8 58.267 28.223 10.898 1.00 36.62 C ATOM 1403 O ASN C 8 59.378 28.628 11.239 1.00 37.14 O ATOM 1404 CB ASN C 8 58.507 26.385 9.213 1.00 34.80 C ATOM 1405 CG ASN C 8 57.629 25.326 9.871 1.00 35.09 C ATOM 1406 OD1 ASN C 8 56.621 25.628 10.514 1.00 35.47 O ATOM 1407 ND2 ASN C 8 58.005 24.067 9.687 1.00 40.16 N ATOM 1408 N ASN C 9 57.227 28.130 11.721 1.00 35.58 N ATOM 1409 CA ASN C 9 57.285 28.459 13.146 1.00 39.97 C ATOM 1410 C ASN C 9 57.662 29.917 13.418 1.00 44.56 C ATOM 1411 O ASN C 9 58.413 30.207 14.351 1.00 48.10 O ATOM 1412 CB ASN C 9 58.268 27.535 13.873 1.00 38.36 C ATOM 1413 CG ASN C 9 58.068 26.073 13.521 1.00 42.97 C ATOM 1414 OD1 ASN C 9 59.000 25.391 13.078 1.00 39.60 O ATOM 1415 ND2 ASN C 9 56.848 25.584 13.712 1.00 40.01 N ATOM 1416 N THR C 10 57.139 30.829 12.604 1.00 39.07 N ATOM 1417 CA THR C 10 57.364 32.254 12.812 1.00 39.66 C ATOM 1418 C THR C 10 56.038 32.984 12.952 1.00 43.21 C ATOM 1419 O THR C 10 54.971 32.372 12.875 1.00 42.65 O ATOM 1420 CB THR C 10 58.161 32.892 11.657 1.00 38.92 C ATOM 1421 OG1 THR C 10 57.381 32.865 10.458 1.00 39.60 O ATOM 1422 CG2 THR C 10 59.465 32.155 11.425 1.00 38.46 C ATOM 1423 N THR C 11 56.111 34.295 13.154 1.00 42.20 N ATOM 1424 CA THR C 11 54.919 35.130 13.246 1.00 42.42 C ATOM 1425 C THR C 11 54.992 36.268 12.234 1.00 42.69 C ATOM 1426 O THR C 11 56.030 36.910 12.089 1.00 45.96 O ATOM 1427 CB THR C 11 54.745 35.723 14.664 1.00 44.39 C ATOM 1428 OG1 THR C 11 54.741 34.668 15.631 1.00 43.28 O ATOM 1429 CG2 THR C 11 53.441 36.497 14.767 1.00 42.68 C ATOM 1430 N ILE C 12 53.893 36.506 11.527 1.00 41.91 N ATOM 1431 CA ILE C 12 53.801 37.643 10.620 1.00 46.08 C ATOM 1432 C ILE C 12 52.618 38.521 11.002 1.00 47.02 C ATOM 1433 O ILE C 12 51.787 38.133 11.822 1.00 45.69 O ATOM 1434 CB ILE C 12 53.651 37.206 9.148 1.00 43.17 C ATOM 1435 CG1 ILE C 12 52.315 36.491 8.931 1.00 42.69 C ATOM 1436 CG2 ILE C 12 54.821 36.327 8.731 1.00 42.47 C ATOM 1437 CD1 ILE C 12 52.052 36.118 7.488 1.00 42.42 C ATOM 1438 N THR C 13 52.546 39.704 10.403 1.00 47.91 N ATOM 1439 CA THR C 13 51.461 40.633 10.680 1.00 49.72 C ATOM 1440 C THR C 13 50.907 41.203 9.386 1.00 52.47 C ATOM 1441 O THR C 13 51.596 41.928 8.672 1.00 56.83 O ATOM 1442 CB THR C 13 51.916 41.791 11.592 1.00 47.58 C ATOM 1443 N ILE C 14 49.657 40.866 9.087 1.00 52.81 N ATOM 1444 CA ILE C 14 48.986 41.386 7.905 1.00 55.38 C ATOM 1445 C ILE C 14 47.765 42.207 8.294 1.00 57.39 C ATOM 1446 O ILE C 14 47.307 42.152 9.435 1.00 55.82 O ATOM 1447 CB ILE C 14 48.541 40.258 6.963 1.00 56.21 C ATOM 1448 CG1 ILE C 14 47.473 39.395 7.641 1.00 53.75 C ATOM 1449 CG2 ILE C 14 49.734 39.419 6.532 1.00 55.31 C ATOM 1450 CD1 ILE C 14 46.876 38.346 6.736 1.00 53.08 C ATOM 1451 N ALA C 15 47.239 42.965 7.338 1.00 59.85 N ATOM 1452 CA ALA C 15 46.023 43.736 7.557 1.00 59.92 C ATOM 1453 C ALA C 15 44.800 42.888 7.229 1.00 60.32 C ATOM 1454 O ALA C 15 44.884 41.942 6.440 1.00 55.92 O ATOM 1455 CB ALA C 15 46.035 45.007 6.718 1.00 60.02 C ATOM 1456 N LYS C 16 43.669 43.220 7.844 1.00 60.18 N ATOM 1457 CA LYS C 16 42.420 42.524 7.564 1.00 58.22 C ATOM 1458 C LYS C 16 42.038 42.724 6.107 1.00 60.00 C ATOM 1459 O LYS C 16 41.899 43.857 5.641 1.00 57.74 O ATOM 1460 CB LYS C 16 41.300 43.013 8.483 1.00 59.61 C ATOM 1461 N GLY C 17 41.886 41.617 5.388 1.00 58.69 N ATOM 1462 CA GLY C 17 41.554 41.661 3.978 1.00 56.49 C ATOM 1463 C GLY C 17 42.778 41.492 3.102 1.00 57.50 C ATOM 1464 O GLY C 17 42.661 41.284 1.893 1.00 56.88 O ATOM 1465 N GLU C 18 43.958 41.586 3.707 1.00 57.60 N ATOM 1466 CA GLU C 18 45.199 41.395 2.963 1.00 57.52 C ATOM 1467 C GLU C 18 45.452 39.912 2.708 1.00 56.59 C ATOM 1468 O GLU C 18 45.076 39.056 3.513 1.00 53.88 O ATOM 1469 CB GLU C 18 46.387 42.007 3.706 1.00 56.02 C ATOM 1470 CG GLU C 18 47.576 42.306 2.814 1.00 59.08 C ATOM 1471 CD GLU C 18 48.878 42.380 3.582 1.00 58.49 C ATOM 1472 OE1 GLU C 18 48.846 42.713 4.785 1.00 59.66 O ATOM 1473 OE2 GLU C 18 49.935 42.103 2.980 1.00 63.78 O ATOM 1474 N ASN C 19 46.094 39.620 1.583 1.00 53.32 N ATOM 1475 CA ASN C 19 46.372 38.247 1.192 1.00 52.32 C ATOM 1476 C ASN C 19 47.855 37.920 1.293 1.00 50.46 C ATOM 1477 O ASN C 19 48.706 38.795 1.143 1.00 54.16 O ATOM 1478 CB ASN C 19 45.882 37.992 -0.236 1.00 54.08 C ATOM 1479 CG ASN C 19 44.457 38.462 -0.453 1.00 58.09 C ATOM 1480 OD1 ASN C 19 43.500 37.752 -0.142 1.00 59.07 O ATOM 1481 ND2 ASN C 19 44.308 39.670 -0.985 1.00 60.56 N ATOM 1482 N LYS C 20 48.156 36.654 1.554 1.00 45.86 N ATOM 1483 CA LYS C 20 49.527 36.167 1.518 1.00 44.59 C ATOM 1484 C LYS C 20 49.564 34.761 0.929 1.00 41.98 C ATOM 1485 O LYS C 20 48.588 34.017 1.005 1.00 42.74 O ATOM 1486 CB LYS C 20 50.153 36.179 2.915 1.00 43.18 C ATOM 1487 CG LYS C 20 50.710 37.535 3.333 1.00 46.34 C ATOM 1488 N GLU C 21 50.694 34.401 0.336 1.00 39.41 N ATOM 1489 CA GLU C 21 50.835 33.082 -0.250 1.00 37.10 C ATOM 1490 C GLU C 21 51.935 32.279 0.430 1.00 37.62 C ATOM 1491 O GLU C 21 53.046 32.767 0.639 1.00 39.92 O ATOM 1492 CB GLU C 21 51.117 33.191 -1.745 1.00 37.04 C ATOM 1493 CG GLU C 21 51.129 31.854 -2.460 1.00 36.55 C ATOM 1494 CD GLU C 21 51.359 32.000 -3.949 1.00 43.19 C ATOM 1495 OE1 GLU C 21 50.961 31.089 -4.703 1.00 41.90 O ATOM 1496 OE2 GLU C 21 51.943 33.025 -4.363 1.00 48.28 O1- ATOM 1497 N ILE C 22 51.611 31.042 0.775 1.00 35.30 N ATOM 1498 CA ILE C 22 52.594 30.107 1.293 1.00 32.02 C ATOM 1499 C ILE C 22 52.875 29.078 0.208 1.00 34.34 C ATOM 1500 O ILE C 22 51.950 28.569 -0.425 1.00 32.96 O ATOM 1501 CB ILE C 22 52.098 29.414 2.570 1.00 32.05 C ATOM 1502 CG1 ILE C 22 51.703 30.459 3.618 1.00 35.92 C ATOM 1503 CG2 ILE C 22 53.152 28.430 3.098 1.00 32.05 C ATOM 1504 CD1 ILE C 22 50.985 29.887 4.829 1.00 32.33 C ATOM 1505 N ILE C 23 54.146 28.785 -0.022 1.00 28.33 N ATOM 1506 CA ILE C 23 54.508 27.802 -1.027 1.00 30.72 C ATOM 1507 C ILE C 23 55.351 26.715 -0.389 1.00 29.09 C ATOM 1508 O ILE C 23 56.385 26.991 0.224 1.00 32.61 O ATOM 1509 CB ILE C 23 55.266 28.440 -2.209 1.00 31.32 C ATOM 1510 CG1 ILE C 23 54.418 29.544 -2.847 1.00 37.18 C ATOM 1511 CG2 ILE C 23 55.626 27.387 -3.244 1.00 30.90 C ATOM 1512 CD1 ILE C 23 55.104 30.253 -4.001 1.00 40.09 C ATOM 1513 N LEU C 24 54.887 25.477 -0.518 1.00 28.06 N ATOM 1514 CA LEU C 24 55.543 24.330 0.093 1.00 25.79 C ATOM 1515 C LEU C 24 55.690 23.211 -0.921 1.00 29.75 C ATOM 1516 O LEU C 24 54.755 22.928 -1.666 1.00 26.10 O ATOM 1517 CB LEU C 24 54.741 23.837 1.295 1.00 26.66 C ATOM 1518 CG LEU C 24 54.581 24.823 2.449 1.00 30.53 C ATOM 1519 CD1 LEU C 24 53.553 24.310 3.443 1.00 27.40 C ATOM 1520 CD2 LEU C 24 55.933 25.045 3.129 1.00 31.07 C ATOM 1521 N HIS C 25 56.852 22.565 -0.939 1.00 28.63 N ATOM 1522 CA HIS C 25 57.073 21.448 -1.845 1.00 31.86 C ATOM 1523 C HIS C 25 56.369 20.186 -1.356 1.00 31.54 C ATOM 1524 O HIS C 25 56.353 19.894 -0.166 1.00 25.65 O ATOM 1525 CB HIS C 25 58.566 21.169 -2.011 1.00 34.22 C ATOM 1526 CG HIS C 25 58.870 20.156 -3.071 1.00 34.33 C ATOM 1527 ND1 HIS C 25 59.038 18.817 -2.793 1.00 36.84 N ATOM 1528 CD2 HIS C 25 59.022 20.286 -4.411 1.00 33.45 C ATOM 1529 CE1 HIS C 25 59.289 18.164 -3.915 1.00 37.71 C ATOM 1530 NE2 HIS C 25 59.283 19.032 -4.912 1.00 35.30 N ATOM 1531 N GLY C 26 55.792 19.437 -2.288 1.00 26.33 N ATOM 1532 CA GLY C 26 55.178 18.165 -1.963 1.00 27.07 C ATOM 1533 C GLY C 26 55.204 17.277 -3.188 1.00 27.07 C ATOM 1534 O GLY C 26 55.515 17.744 -4.288 1.00 27.80 O ATOM 1535 N ASN C 27 54.897 15.996 -3.011 1.00 25.99 N ATOM 1536 CA ASN C 27 54.894 15.069 -4.144 1.00 27.40 C ATOM 1537 C ASN C 27 53.723 14.110 -4.032 1.00 24.85 C ATOM 1538 O ASN C 27 53.856 13.030 -3.461 1.00 23.12 O ATOM 1539 CB ASN C 27 56.211 14.300 -4.225 1.00 28.60 C ATOM 1540 CG ASN C 27 56.320 13.468 -5.492 1.00 29.10 C ATOM 1541 OD1 ASN C 27 55.458 13.535 -6.365 1.00 30.22 O ATOM 1542 ND2 ASN C 27 57.389 12.691 -5.604 1.00 30.73 N ATOM 1543 N PRO C 28 52.560 14.520 -4.556 1.00 25.83 N ATOM 1544 CA PRO C 28 51.312 13.759 -4.409 1.00 23.99 C ATOM 1545 C PRO C 28 51.323 12.393 -5.101 1.00 22.10 C ATOM 1546 O PRO C 28 50.390 11.618 -4.894 1.00 24.13 O ATOM 1547 CB PRO C 28 50.256 14.682 -5.041 1.00 25.82 C ATOM 1548 CG PRO C 28 51.020 15.637 -5.895 1.00 26.94 C ATOM 1549 CD PRO C 28 52.343 15.820 -5.210 1.00 26.28 C ATOM 1550 N THR C 29 52.348 12.091 -5.893 1.00 23.57 N ATOM 1551 CA THR C 29 52.435 10.757 -6.481 1.00 23.55 C ATOM 1552 C THR C 29 52.743 9.722 -5.392 1.00 26.96 C ATOM 1553 O THR C 29 52.597 8.520 -5.615 1.00 26.76 O ATOM 1554 CB THR C 29 53.501 10.660 -7.580 1.00 24.75 C ATOM 1555 OG1 THR C 29 54.799 10.889 -7.017 1.00 25.96 O ATOM 1556 CG2 THR C 29 53.225 11.662 -8.718 1.00 21.56 C ATOM 1557 N THR C 30 53.181 10.193 -4.222 1.00 23.08 N ATOM 1558 CA THR C 30 53.432 9.311 -3.083 1.00 25.32 C ATOM 1559 C THR C 30 52.152 9.013 -2.305 1.00 24.65 C ATOM 1560 O THR C 30 52.135 8.150 -1.431 1.00 27.37 O ATOM 1561 CB THR C 30 54.443 9.928 -2.080 1.00 26.03 C ATOM 1562 OG1 THR C 30 53.918 11.165 -1.590 1.00 22.35 O ATOM 1563 CG2 THR C 30 55.790 10.176 -2.729 1.00 23.84 C ATOM 1564 N GLY C 31 51.088 9.747 -2.597 1.00 23.60 N ATOM 1565 CA GLY C 31 49.894 9.660 -1.780 1.00 24.77 C ATOM 1566 C GLY C 31 49.828 10.720 -0.686 1.00 24.95 C ATOM 1567 O GLY C 31 48.769 10.968 -0.130 1.00 25.08 O ATOM 1568 N TYR C 32 50.955 11.355 -0.378 1.00 23.98 N ATOM 1569 CA TYR C 32 50.959 12.459 0.584 1.00 26.04 C ATOM 1570 C TYR C 32 50.543 13.767 -0.074 1.00 26.66 C ATOM 1571 O TYR C 32 50.727 13.951 -1.273 1.00 27.14 O ATOM 1572 CB TYR C 32 52.341 12.632 1.209 1.00 24.74 C ATOM 1573 CG TYR C 32 52.731 11.566 2.207 1.00 27.74 C ATOM 1574 CD1 TYR C 32 52.716 11.830 3.577 1.00 27.19 C ATOM 1575 CD2 TYR C 32 53.131 10.303 1.785 1.00 25.78 C ATOM 1576 CE1 TYR C 32 53.078 10.855 4.502 1.00 27.16 C ATOM 1577 CE2 TYR C 32 53.496 9.324 2.702 1.00 29.46 C ATOM 1578 CZ TYR C 32 53.471 9.610 4.058 1.00 31.07 C ATOM 1579 OH TYR C 32 53.832 8.636 4.967 1.00 29.95 O ATOM 1580 N SER C 33 49.985 14.674 0.718 1.00 22.68 N ATOM 1581 CA SER C 33 49.716 16.030 0.266 1.00 24.92 C ATOM 1582 C SER C 33 49.717 16.979 1.463 1.00 26.83 C ATOM 1583 O SER C 33 49.567 16.535 2.600 1.00 25.12 O ATOM 1584 CB SER C 33 48.379 16.101 -0.462 1.00 27.72 C ATOM 1585 OG SER C 33 47.309 15.931 0.446 1.00 29.77 O ATOM 1586 N TRP C 34 49.907 18.274 1.208 1.00 25.88 N ATOM 1587 CA TRP C 34 49.739 19.293 2.243 1.00 27.66 C ATOM 1588 C TRP C 34 48.264 19.626 2.412 1.00 27.30 C ATOM 1589 O TRP C 34 47.589 19.995 1.449 1.00 25.89 O ATOM 1590 CB TRP C 34 50.512 20.572 1.903 1.00 24.98 C ATOM 1591 CG TRP C 34 51.990 20.484 2.113 1.00 22.62 C ATOM 1592 CD1 TRP C 34 52.938 20.327 1.155 1.00 25.00 C ATOM 1593 CD2 TRP C 34 52.695 20.561 3.366 1.00 27.26 C ATOM 1594 NE1 TRP C 34 54.189 20.295 1.720 1.00 25.00 N ATOM 1595 CE2 TRP C 34 54.068 20.442 3.077 1.00 21.23 C ATOM 1596 CE3 TRP C 34 52.293 20.714 4.699 1.00 27.57 C ATOM 1597 CZ2 TRP C 34 55.051 20.470 4.072 1.00 27.95 C ATOM 1598 CZ3 TRP C 34 53.271 20.752 5.687 1.00 27.48 C ATOM 1599 CH2 TRP C 34 54.634 20.624 5.367 1.00 25.75 C ATOM 1600 N VAL C 35 47.764 19.496 3.634 1.00 25.39 N ATOM 1601 CA VAL C 35 46.375 19.830 3.918 1.00 30.01 C ATOM 1602 C VAL C 35 46.306 20.789 5.099 1.00 31.84 C ATOM 1603 O VAL C 35 47.208 20.810 5.934 1.00 31.17 O ATOM 1604 CB VAL C 35 45.542 18.568 4.218 1.00 32.99 C ATOM 1605 CG1 VAL C 35 45.508 17.650 2.989 1.00 32.79 C ATOM 1606 CG2 VAL C 35 46.114 17.838 5.414 1.00 30.47 C ATOM 1607 N VAL C 36 45.246 21.588 5.162 1.00 32.48 N ATOM 1608 CA VAL C 36 45.081 22.538 6.258 1.00 36.82 C ATOM 1609 C VAL C 36 44.529 21.845 7.494 1.00 37.67 C ATOM 1610 O VAL C 36 43.424 21.310 7.465 1.00 38.56 O ATOM 1611 CB VAL C 36 44.139 23.693 5.877 1.00 37.93 C ATOM 1612 CG1 VAL C 36 43.948 24.628 7.063 1.00 39.02 C ATOM 1613 CG2 VAL C 36 44.680 24.448 4.672 1.00 36.98 C ATOM 1614 N ASP C 37 45.298 21.855 8.578 1.00 38.61 N ATOM 1615 CA ASP C 37 44.868 21.224 9.822 1.00 41.69 C ATOM 1616 C ASP C 37 43.961 22.148 10.646 1.00 41.90 C ATOM 1617 O ASP C 37 42.996 21.693 11.255 1.00 44.73 O ATOM 1618 CB ASP C 37 46.086 20.792 10.636 1.00 41.37 C ATOM 1619 CG ASP C 37 45.732 19.838 11.751 1.00 50.33 C ATOM 1620 OD1 ASP C 37 44.901 20.201 12.607 1.00 54.26 O ATOM 1621 OD2 ASP C 37 46.278 18.715 11.767 1.00 57.54 O1- ATOM 1622 N SER C 38 44.278 23.440 10.669 1.00 45.12 N ATOM 1623 CA SER C 38 43.429 24.440 11.325 1.00 44.68 C ATOM 1624 C SER C 38 43.777 25.824 10.791 1.00 45.06 C ATOM 1625 O SER C 38 44.875 26.021 10.264 1.00 43.78 O ATOM 1626 CB SER C 38 43.585 24.390 12.849 1.00 43.37 C ATOM 1627 OG SER C 38 44.933 24.576 13.243 1.00 47.16 O ATOM 1628 N SER C 39 42.852 26.775 10.922 1.00 45.49 N ATOM 1629 CA SER C 39 43.000 28.080 10.271 1.00 47.15 C ATOM 1630 C SER C 39 42.203 29.204 10.942 1.00 53.25 C ATOM 1631 O SER C 39 41.274 29.759 10.342 1.00 53.70 O ATOM 1632 CB SER C 39 42.584 27.973 8.805 1.00 47.24 C ATOM 1633 OG SER C 39 42.657 29.226 8.143 1.00 53.24 O ATOM 1634 N GLU C 40 42.584 29.555 12.169 1.00 46.30 N ATOM 1635 CA GLU C 40 41.892 30.600 12.925 1.00 47.50 C ATOM 1636 C GLU C 40 42.245 32.012 12.453 1.00 48.84 C ATOM 1637 O GLU C 40 43.418 32.361 12.323 1.00 46.00 O ATOM 1638 CB GLU C 40 42.206 30.468 14.417 1.00 45.59 C ATOM 1639 N GLY C 41 41.218 32.818 12.202 1.00 45.53 N ATOM 1640 CA GLY C 41 41.396 34.207 11.821 1.00 46.09 C ATOM 1641 C GLY C 41 41.658 34.397 10.342 1.00 46.78 C ATOM 1642 O GLY C 41 41.767 35.527 9.857 1.00 46.16 O ATOM 1643 N LEU C 42 41.749 33.286 9.619 1.00 47.93 N ATOM 1644 CA LEU C 42 42.137 33.309 8.214 1.00 45.17 C ATOM 1645 C LEU C 42 41.222 32.454 7.353 1.00 46.42 C ATOM 1646 O LEU C 42 40.731 31.420 7.795 1.00 48.75 O ATOM 1647 CB LEU C 42 43.574 32.807 8.055 1.00 46.11 C ATOM 1648 CG LEU C 42 44.653 33.383 8.969 1.00 42.46 C ATOM 1649 CD1 LEU C 42 45.811 32.409 9.084 1.00 43.55 C ATOM 1650 CD2 LEU C 42 45.131 34.725 8.436 1.00 44.76 C ATOM 1651 N SER C 43 41.003 32.887 6.118 1.00 46.17 N ATOM 1652 CA SER C 43 40.436 32.013 5.105 1.00 45.86 C ATOM 1653 C SER C 43 41.592 31.514 4.250 1.00 45.17 C ATOM 1654 O SER C 43 42.648 32.145 4.214 1.00 42.25 O ATOM 1655 CB SER C 43 39.401 32.743 4.251 1.00 47.69 C ATOM 1656 OG SER C 43 40.008 33.780 3.498 1.00 47.31 O ATOM 1657 N ASN C 44 41.408 30.389 3.566 1.00 41.43 N ATOM 1658 CA ASN C 44 42.479 29.859 2.733 1.00 41.48 C ATOM 1659 C ASN C 44 42.013 29.082 1.507 1.00 41.74 C ATOM 1660 O ASN C 44 40.874 28.622 1.440 1.00 42.50 O ATOM 1661 CB ASN C 44 43.385 28.957 3.565 1.00 39.40 C ATOM 1662 CG ASN C 44 42.722 27.649 3.923 1.00 41.71 C ATOM 1663 OD1 ASN C 44 42.717 26.708 3.129 1.00 41.30 O ATOM 1664 ND2 ASN C 44 42.151 27.581 5.121 1.00 41.36 N ATOM 1665 N THR C 45 42.913 28.945 0.538 1.00 37.10 N ATOM 1666 CA THR C 45 42.736 28.016 -0.574 1.00 36.95 C ATOM 1667 C THR C 45 44.036 27.239 -0.778 1.00 39.25 C ATOM 1668 O THR C 45 45.128 27.775 -0.565 1.00 39.49 O ATOM 1669 CB THR C 45 42.358 28.731 -1.896 1.00 41.37 C ATOM 1670 OG1 THR C 45 43.514 29.373 -2.448 1.00 41.00 O ATOM 1671 CG2 THR C 45 41.257 29.764 -1.672 1.00 41.06 C ATOM 1672 N VAL C 46 43.920 25.978 -1.181 1.00 35.46 N ATOM 1673 CA VAL C 46 45.084 25.144 -1.449 1.00 33.63 C ATOM 1674 C VAL C 46 45.053 24.622 -2.879 1.00 35.59 C ATOM 1675 O VAL C 46 44.050 24.055 -3.318 1.00 37.58 O ATOM 1676 CB VAL C 46 45.168 23.944 -0.489 1.00 36.40 C ATOM 1677 CG1 VAL C 46 46.422 23.132 -0.770 1.00 28.45 C ATOM 1678 CG2 VAL C 46 45.150 24.409 0.947 1.00 34.02 C ATOM 1679 N GLU C 47 46.150 24.822 -3.601 1.00 33.44 N ATOM 1680 CA GLU C 47 46.263 24.343 -4.973 1.00 33.30 C ATOM 1681 C GLU C 47 47.632 23.716 -5.219 1.00 32.41 C ATOM 1682 O GLU C 47 48.662 24.280 -4.851 1.00 31.92 O ATOM 1683 CB GLU C 47 46.019 25.488 -5.962 1.00 33.91 C ATOM 1684 N TYR C 48 47.638 22.540 -5.835 1.00 27.63 N ATOM 1685 CA TYR C 48 48.882 21.910 -6.249 1.00 26.53 C ATOM 1686 C TYR C 48 49.270 22.275 -7.687 1.00 31.14 C ATOM 1687 O TYR C 48 48.446 22.194 -8.604 1.00 26.04 O ATOM 1688 CB TYR C 48 48.780 20.394 -6.120 1.00 25.71 C ATOM 1689 CG TYR C 48 50.039 19.694 -6.550 1.00 25.97 C ATOM 1690 CD1 TYR C 48 50.093 18.988 -7.745 1.00 25.51 C ATOM 1691 CD2 TYR C 48 51.190 19.764 -5.773 1.00 27.95 C ATOM 1692 CE1 TYR C 48 51.251 18.364 -8.144 1.00 25.00 C ATOM 1693 CE2 TYR C 48 52.350 19.139 -6.163 1.00 26.98 C ATOM 1694 CZ TYR C 48 52.374 18.443 -7.352 1.00 25.34 C ATOM 1695 OH TYR C 48 53.525 17.812 -7.741 1.00 28.29 O ATOM 1696 N VAL C 49 50.530 22.665 -7.875 1.00 27.57 N ATOM 1697 CA VAL C 49 51.079 22.935 -9.208 1.00 28.50 C ATOM 1698 C VAL C 49 52.334 22.095 -9.430 1.00 30.26 C ATOM 1699 O VAL C 49 53.339 22.274 -8.743 1.00 30.22 O ATOM 1700 CB VAL C 49 51.423 24.429 -9.394 1.00 31.86 C ATOM 1701 CG1 VAL C 49 52.080 24.665 -10.749 1.00 34.18 C ATOM 1702 CG2 VAL C 49 50.181 25.287 -9.247 1.00 29.98 C ATOM 1703 N ALA C 50 52.274 21.158 -10.368 1.00 26.33 N ATOM 1704 CA ALA C 50 53.415 20.281 -10.627 1.00 30.77 C ATOM 1705 C ALA C 50 54.590 21.062 -11.224 1.00 33.43 C ATOM 1706 O ALA C 50 54.387 21.995 -12.001 1.00 29.40 O ATOM 1707 CB ALA C 50 53.002 19.137 -11.560 1.00 31.90 C ATOM 1708 N AASP C 51 55.806 20.670 -10.859 0.42 34.38 N ATOM 1709 N BASP C 51 55.813 20.694 -10.842 0.58 34.40 N ATOM 1710 CA AASP C 51 57.005 21.300 -11.398 0.42 34.74 C ATOM 1711 CA BASP C 51 57.012 21.340 -11.380 0.58 34.73 C ATOM 1712 C AASP C 51 57.137 20.977 -12.879 0.42 36.04 C ATOM 1713 C BASP C 51 57.166 20.997 -12.861 0.58 36.04 C ATOM 1714 O AASP C 51 57.432 19.842 -13.251 0.42 37.11 O ATOM 1715 O BASP C 51 57.501 19.868 -13.215 0.58 37.12 O ATOM 1716 CB AASP C 51 58.250 20.837 -10.639 0.42 34.87 C ATOM 1717 CB BASP C 51 58.272 20.917 -10.609 0.58 34.85 C ATOM 1718 CG AASP C 51 59.503 21.579 -11.065 0.42 36.90 C ATOM 1719 CG BASP C 51 58.486 21.716 -9.319 0.58 35.73 C ATOM 1720 OD1AASP C 51 60.277 21.994 -10.180 0.42 38.27 O ATOM 1721 OD1BASP C 51 57.976 22.851 -9.209 0.58 33.76 O ATOM 1722 OD2AASP C 51 59.718 21.744 -12.283 0.42 39.15 O1- ATOM 1723 OD2BASP C 51 59.187 21.208 -8.416 0.58 36.03 O1- ATOM 1724 N GLN C 52 56.918 21.979 -13.721 1.00 35.25 N ATOM 1725 CA GLN C 52 56.953 21.772 -15.166 1.00 40.98 C ATOM 1726 C GLN C 52 58.374 21.683 -15.720 1.00 42.75 C ATOM 1727 O GLN C 52 58.573 21.302 -16.874 1.00 44.15 O ATOM 1728 CB GLN C 52 56.187 22.891 -15.867 1.00 36.93 C ATOM 1729 CG GLN C 52 54.712 22.933 -15.503 1.00 37.68 C ATOM 1730 CD GLN C 52 53.903 21.863 -16.215 1.00 35.28 C ATOM 1731 OE1 GLN C 52 54.323 21.333 -17.242 1.00 35.32 O ATOM 1732 NE2 GLN C 52 52.733 21.546 -15.674 1.00 37.55 N ATOM 1733 N HIS C 53 59.358 22.031 -14.896 1.00 44.23 N ATOM 1734 CA HIS C 53 60.754 21.996 -15.317 1.00 49.61 C ATOM 1735 C HIS C 53 61.629 21.278 -14.294 1.00 50.15 C ATOM 1736 O HIS C 53 61.884 20.078 -14.415 1.00 58.92 O ATOM 1737 CB HIS C 53 61.274 23.418 -15.552 1.00 52.55 C ATOM 1738 CG HIS C 53 60.453 24.205 -16.527 1.00 52.39 C ATOM 1739 ND1 HIS C 53 60.456 23.949 -17.883 1.00 53.17 N ATOM 1740 CD2 HIS C 53 59.598 25.239 -16.342 1.00 50.43 C ATOM 1741 CE1 HIS C 53 59.639 24.792 -18.490 1.00 49.56 C ATOM 1742 NE2 HIS C 53 59.106 25.585 -17.578 1.00 48.97 N ATOM 1743 N SER C 60 59.716 14.243 -9.148 1.00 44.54 N ATOM 1744 CA SER C 60 60.007 15.675 -9.172 1.00 45.13 C ATOM 1745 C SER C 60 59.119 16.446 -8.200 1.00 44.51 C ATOM 1746 O SER C 60 59.565 17.401 -7.565 1.00 48.27 O ATOM 1747 CB SER C 60 59.836 16.234 -10.584 1.00 44.22 C ATOM 1748 N GLY C 61 57.861 16.031 -8.090 1.00 37.98 N ATOM 1749 CA GLY C 61 56.919 16.686 -7.201 1.00 31.93 C ATOM 1750 C GLY C 61 56.502 18.046 -7.725 1.00 35.67 C ATOM 1751 O GLY C 61 56.529 18.306 -8.933 1.00 33.22 O ATOM 1752 N GLY C 62 56.117 18.927 -6.812 1.00 30.64 N ATOM 1753 CA GLY C 62 55.665 20.248 -7.194 1.00 30.74 C ATOM 1754 C GLY C 62 55.481 21.159 -6.000 1.00 32.32 C ATOM 1755 O GLY C 62 56.054 20.932 -4.935 1.00 31.35 O ATOM 1756 N LYS C 63 54.677 22.197 -6.178 1.00 30.73 N ATOM 1757 CA LYS C 63 54.472 23.176 -5.125 1.00 29.22 C ATOM 1758 C LYS C 63 53.008 23.263 -4.735 1.00 29.31 C ATOM 1759 O LYS C 63 52.128 23.339 -5.589 1.00 31.67 O ATOM 1760 CB LYS C 63 54.979 24.555 -5.564 1.00 31.63 C ATOM 1761 CG LYS C 63 56.437 24.577 -6.010 1.00 33.60 C ATOM 1762 N TYR C 64 52.746 23.232 -3.437 1.00 26.41 N ATOM 1763 CA TYR C 64 51.420 23.546 -2.947 1.00 25.77 C ATOM 1764 C TYR C 64 51.348 25.037 -2.691 1.00 30.80 C ATOM 1765 O TYR C 64 52.192 25.609 -1.996 1.00 31.13 O ATOM 1766 CB TYR C 64 51.085 22.742 -1.681 1.00 26.97 C ATOM 1767 CG TYR C 64 50.804 21.286 -1.987 1.00 26.36 C ATOM 1768 CD1 TYR C 64 49.497 20.818 -2.084 1.00 23.51 C ATOM 1769 CD2 TYR C 64 51.842 20.393 -2.213 1.00 24.68 C ATOM 1770 CE1 TYR C 64 49.233 19.503 -2.386 1.00 23.84 C ATOM 1771 CE2 TYR C 64 51.589 19.068 -2.514 1.00 24.75 C ATOM 1772 CZ TYR C 64 50.281 18.631 -2.600 1.00 26.92 C ATOM 1773 OH TYR C 64 50.022 17.316 -2.899 1.00 26.84 O ATOM 1774 N HIS C 65 50.353 25.675 -3.287 1.00 30.08 N ATOM 1775 CA HIS C 65 50.126 27.088 -3.049 1.00 33.33 C ATOM 1776 C HIS C 65 48.980 27.243 -2.077 1.00 33.62 C ATOM 1777 O HIS C 65 47.836 26.908 -2.393 1.00 33.07 O ATOM 1778 CB HIS C 65 49.834 27.824 -4.356 1.00 31.87 C ATOM 1779 CG HIS C 65 50.986 27.829 -5.308 1.00 34.18 C ATOM 1780 ND1 HIS C 65 51.828 28.910 -5.449 1.00 35.97 N ATOM 1781 CD2 HIS C 65 51.441 26.883 -6.163 1.00 33.93 C ATOM 1782 CE1 HIS C 65 52.748 28.634 -6.355 1.00 37.01 C ATOM 1783 NE2 HIS C 65 52.537 27.409 -6.803 1.00 36.40 N ATOM 1784 N ILE C 66 49.307 27.719 -0.879 1.00 34.43 N ATOM 1785 CA ILE C 66 48.312 27.981 0.143 1.00 31.59 C ATOM 1786 C ILE C 66 48.132 29.488 0.267 1.00 34.22 C ATOM 1787 O ILE C 66 48.974 30.177 0.844 1.00 37.72 O ATOM 1788 CB ILE C 66 48.711 27.383 1.522 1.00 33.98 C ATOM 1789 CG1 ILE C 66 48.952 25.872 1.428 1.00 32.37 C ATOM 1790 CG2 ILE C 66 47.632 27.671 2.555 1.00 32.69 C ATOM 1791 CD1 ILE C 66 50.406 25.470 1.252 1.00 28.26 C ATOM 1792 N LYS C 67 47.048 30.002 -0.298 1.00 37.06 N ATOM 1793 CA LYS C 67 46.753 31.424 -0.209 1.00 35.87 C ATOM 1794 C LYS C 67 45.895 31.680 1.016 1.00 39.19 C ATOM 1795 O LYS C 67 44.867 31.040 1.202 1.00 39.80 O ATOM 1796 CB LYS C 67 46.048 31.919 -1.479 1.00 35.49 C ATOM 1797 N ILE C 68 46.329 32.599 1.869 1.00 41.64 N ATOM 1798 CA ILE C 68 45.545 32.947 3.044 1.00 41.97 C ATOM 1799 C ILE C 68 45.152 34.416 2.997 1.00 45.35 C ATOM 1800 O ILE C 68 45.823 35.229 2.359 1.00 43.94 O ATOM 1801 CB ILE C 68 46.307 32.652 4.358 1.00 39.71 C ATOM 1802 CG1 ILE C 68 47.606 33.456 4.433 1.00 38.50 C ATOM 1803 CG2 ILE C 68 46.608 31.169 4.475 1.00 37.35 C ATOM 1804 CD1 ILE C 68 48.349 33.288 5.758 1.00 37.99 C ATOM 1805 N THR C 69 44.049 34.741 3.663 1.00 47.49 N ATOM 1806 CA THR C 69 43.558 36.110 3.746 1.00 48.64 C ATOM 1807 C THR C 69 43.103 36.408 5.169 1.00 47.26 C ATOM 1808 O THR C 69 42.364 35.627 5.761 1.00 47.39 O ATOM 1809 CB THR C 69 42.387 36.358 2.769 1.00 51.16 C ATOM 1810 OG1 THR C 69 42.812 36.098 1.425 1.00 53.72 O ATOM 1811 CG2 THR C 69 41.898 37.796 2.872 1.00 54.06 C ATOM 1812 N GLY C 70 43.559 37.527 5.723 1.00 50.64 N ATOM 1813 CA GLY C 70 43.151 37.926 7.060 1.00 50.03 C ATOM 1814 C GLY C 70 41.671 38.256 7.091 1.00 52.98 C ATOM 1815 O GLY C 70 41.233 39.229 6.473 1.00 54.16 O ATOM 1816 N THR C 71 40.895 37.445 7.804 1.00 49.48 N ATOM 1817 CA THR C 71 39.443 37.591 7.809 1.00 49.24 C ATOM 1818 C THR C 71 38.909 38.091 9.144 1.00 52.05 C ATOM 1819 O THR C 71 37.741 38.465 9.253 1.00 52.92 O ATOM 1820 CB THR C 71 38.747 36.262 7.475 1.00 45.94 C ATOM 1821 OG1 THR C 71 39.161 35.260 8.410 1.00 48.40 O ATOM 1822 CG2 THR C 71 39.102 35.816 6.066 1.00 48.24 C ATOM 1823 N GLN C 72 39.765 38.093 10.157 1.00 50.22 N ATOM 1824 CA GLN C 72 39.370 38.555 11.478 1.00 51.19 C ATOM 1825 C GLN C 72 40.546 39.189 12.214 1.00 52.27 C ATOM 1826 O GLN C 72 41.585 38.554 12.396 1.00 53.15 O ATOM 1827 CB GLN C 72 38.798 37.396 12.293 1.00 49.98 C ATOM 1828 N THR C 73 40.376 40.442 12.630 1.00 51.59 N ATOM 1829 CA THR C 73 41.400 41.152 13.391 1.00 53.94 C ATOM 1830 C THR C 73 41.740 40.388 14.666 1.00 54.51 C ATOM 1831 O THR C 73 40.847 39.987 15.412 1.00 55.14 O ATOM 1832 CB THR C 73 40.951 42.584 13.762 1.00 55.66 C ATOM 1833 OG1 THR C 73 40.727 43.349 12.570 1.00 55.01 O ATOM 1834 CG2 THR C 73 42.009 43.275 14.607 1.00 53.82 C ATOM 1835 N GLY C 74 43.030 40.179 14.906 1.00 51.82 N ATOM 1836 CA GLY C 74 43.472 39.468 16.091 1.00 51.85 C ATOM 1837 C GLY C 74 44.584 38.478 15.805 1.00 52.04 C ATOM 1838 O GLY C 74 45.126 38.434 14.696 1.00 49.19 O ATOM 1839 N GLU C 75 44.921 37.679 16.813 1.00 49.22 N ATOM 1840 CA GLU C 75 45.989 36.695 16.692 1.00 46.64 C ATOM 1841 C GLU C 75 45.501 35.454 15.949 1.00 49.56 C ATOM 1842 O GLU C 75 44.842 34.586 16.526 1.00 49.01 O ATOM 1843 CB GLU C 75 46.525 36.314 18.075 1.00 47.01 C ATOM 1844 N GLY C 76 45.829 35.381 14.663 1.00 44.36 N ATOM 1845 CA GLY C 76 45.416 34.270 13.826 1.00 45.80 C ATOM 1846 C GLY C 76 46.511 33.234 13.672 1.00 46.39 C ATOM 1847 O GLY C 76 47.645 33.442 14.109 1.00 41.49 O ATOM 1848 N LYS C 77 46.175 32.114 13.039 1.00 43.47 N ATOM 1849 CA LYS C 77 47.128 31.028 12.863 1.00 41.23 C ATOM 1850 C LYS C 77 46.642 30.015 11.835 1.00 42.34 C ATOM 1851 O LYS C 77 45.451 29.729 11.745 1.00 42.12 O ATOM 1852 CB LYS C 77 47.388 30.321 14.195 1.00 39.81 C ATOM 1853 CG LYS C 77 48.599 29.410 14.175 1.00 42.52 C ATOM 1854 CD LYS C 77 48.843 28.759 15.526 1.00 47.41 C ATOM 1855 CE LYS C 77 47.830 27.663 15.804 1.00 49.64 C ATOM 1856 NZ LYS C 77 48.156 26.914 17.050 1.00 52.38 N ATOM 1857 N ILE C 78 47.570 29.471 11.060 1.00 42.02 N ATOM 1858 CA ILE C 78 47.245 28.343 10.205 1.00 39.46 C ATOM 1859 C ILE C 78 48.265 27.238 10.448 1.00 39.40 C ATOM 1860 O ILE C 78 49.455 27.498 10.640 1.00 37.56 O ATOM 1861 CB ILE C 78 47.197 28.744 8.707 1.00 40.92 C ATOM 1862 CG1 ILE C 78 46.715 27.572 7.843 1.00 33.88 C ATOM 1863 CG2 ILE C 78 48.548 29.278 8.224 1.00 36.19 C ATOM 1864 CD1 ILE C 78 46.428 27.964 6.414 1.00 36.56 C ATOM 1865 N VAL C 79 47.781 26.003 10.497 1.00 37.72 N ATOM 1866 CA VAL C 79 48.657 24.853 10.614 1.00 34.43 C ATOM 1867 C VAL C 79 48.414 23.922 9.435 1.00 34.93 C ATOM 1868 O VAL C 79 47.274 23.547 9.147 1.00 31.78 O ATOM 1869 CB VAL C 79 48.444 24.095 11.936 1.00 40.06 C ATOM 1870 CG1 VAL C 79 49.288 22.838 11.963 1.00 34.42 C ATOM 1871 CG2 VAL C 79 48.789 24.989 13.120 1.00 38.83 C ATOM 1872 N LEU C 80 49.489 23.571 8.741 1.00 32.36 N ATOM 1873 CA LEU C 80 49.397 22.690 7.588 1.00 30.46 C ATOM 1874 C LEU C 80 50.133 21.407 7.904 1.00 29.95 C ATOM 1875 O LEU C 80 51.157 21.424 8.579 1.00 29.64 O ATOM 1876 CB LEU C 80 49.991 23.348 6.347 1.00 29.77 C ATOM 1877 CG LEU C 80 49.559 24.797 6.108 1.00 34.28 C ATOM 1878 CD1 LEU C 80 50.360 25.415 4.984 1.00 29.95 C ATOM 1879 CD2 LEU C 80 48.086 24.847 5.806 1.00 33.95 C ATOM 1880 N VAL C 81 49.616 20.290 7.412 1.00 27.56 N ATOM 1881 CA VAL C 81 50.256 19.010 7.662 1.00 25.29 C ATOM 1882 C VAL C 81 50.464 18.263 6.337 1.00 26.45 C ATOM 1883 O VAL C 81 49.585 18.249 5.478 1.00 28.80 O ATOM 1884 CB VAL C 81 49.422 18.166 8.652 1.00 30.35 C ATOM 1885 CG1 VAL C 81 50.085 16.850 8.909 1.00 33.55 C ATOM 1886 CG2 VAL C 81 49.257 18.911 9.984 1.00 33.83 C ATOM 1887 N TYR C 82 51.643 17.680 6.162 1.00 26.02 N ATOM 1888 CA TYR C 82 51.928 16.858 4.987 1.00 27.88 C ATOM 1889 C TYR C 82 51.606 15.417 5.347 1.00 30.53 C ATOM 1890 O TYR C 82 52.394 14.741 6.024 1.00 31.20 O ATOM 1891 CB TYR C 82 53.388 17.009 4.560 1.00 28.00 C ATOM 1892 CG TYR C 82 53.743 16.405 3.219 1.00 26.63 C ATOM 1893 CD1 TYR C 82 53.228 16.931 2.038 1.00 23.79 C ATOM 1894 CD2 TYR C 82 54.627 15.336 3.129 1.00 27.64 C ATOM 1895 CE1 TYR C 82 53.563 16.392 0.814 1.00 23.48 C ATOM 1896 CE2 TYR C 82 54.972 14.792 1.904 1.00 27.17 C ATOM 1897 CZ TYR C 82 54.433 15.326 0.748 1.00 24.92 C ATOM 1898 OH TYR C 82 54.763 14.791 -0.478 1.00 24.93 O ATOM 1899 N ARG C 83 50.433 14.952 4.933 1.00 27.04 N ATOM 1900 CA ARG C 83 49.971 13.652 5.394 1.00 30.44 C ATOM 1901 C ARG C 83 49.329 12.805 4.296 1.00 28.72 C ATOM 1902 O ARG C 83 48.955 13.304 3.231 1.00 24.96 O ATOM 1903 CB ARG C 83 48.979 13.827 6.545 1.00 30.26 C ATOM 1904 CG ARG C 83 47.650 14.453 6.141 1.00 33.94 C ATOM 1905 CD ARG C 83 46.664 14.472 7.322 1.00 34.34 C ATOM 1906 N ARG C 84 49.206 11.518 4.598 1.00 27.86 N ATOM 1907 CA ARG C 84 48.550 10.543 3.740 1.00 26.71 C ATOM 1908 C ARG C 84 47.471 9.850 4.543 1.00 27.11 C ATOM 1909 O ARG C 84 47.764 9.243 5.575 1.00 27.73 O ATOM 1910 CB ARG C 84 49.556 9.527 3.215 1.00 26.59 C ATOM 1911 CG ARG C 84 48.955 8.486 2.287 1.00 25.10 C ATOM 1912 CD ARG C 84 50.059 7.686 1.644 1.00 27.47 C ATOM 1913 NE ARG C 84 50.726 6.803 2.599 1.00 30.02 N ATOM 1914 CZ ARG C 84 51.872 6.186 2.337 1.00 29.66 C ATOM 1915 NH1 ARG C 84 52.467 6.369 1.160 1.00 31.91 N1+ ATOM 1916 NH2 ARG C 84 52.420 5.389 3.237 1.00 28.67 N ATOM 1917 N THR C 85 46.222 9.971 4.104 1.00 24.53 N ATOM 1918 CA THR C 85 45.119 9.335 4.818 1.00 30.20 C ATOM 1919 C THR C 85 45.331 7.825 4.890 1.00 25.69 C ATOM 1920 O THR C 85 45.594 7.181 3.878 1.00 23.77 O ATOM 1921 CB THR C 85 43.773 9.632 4.155 1.00 28.50 C ATOM 1922 OG1 THR C 85 43.617 11.047 4.022 1.00 30.21 O ATOM 1923 CG2 THR C 85 42.628 9.072 4.995 1.00 25.88 C ATOM 1924 N SER C 86 45.231 7.277 6.098 1.00 23.17 N ATOM 1925 CA SER C 86 45.466 5.852 6.333 1.00 25.14 C ATOM 1926 C SER C 86 44.225 5.009 6.039 1.00 20.58 C ATOM 1927 O SER C 86 43.103 5.519 6.042 1.00 20.86 O ATOM 1928 CB SER C 86 45.894 5.624 7.788 1.00 24.43 C ATOM 1929 OG SER C 86 44.776 5.822 8.628 1.00 21.48 O ATOM 1930 N PHE C 87 44.426 3.714 5.810 1.00 25.14 N ATOM 1931 CA PHE C 87 43.295 2.810 5.630 1.00 23.54 C ATOM 1932 C PHE C 87 42.316 2.897 6.807 1.00 22.91 C ATOM 1933 O PHE C 87 41.098 2.987 6.611 1.00 21.70 O ATOM 1934 CB PHE C 87 43.751 1.363 5.467 1.00 22.98 C ATOM 1935 CG PHE C 87 42.613 0.393 5.516 1.00 23.05 C ATOM 1936 CD1 PHE C 87 41.837 0.178 4.399 1.00 21.31 C ATOM 1937 CD2 PHE C 87 42.271 -0.248 6.704 1.00 24.11 C ATOM 1938 CE1 PHE C 87 40.757 -0.683 4.436 1.00 23.94 C ATOM 1939 CE2 PHE C 87 41.190 -1.108 6.753 1.00 23.49 C ATOM 1940 CZ PHE C 87 40.431 -1.323 5.618 1.00 21.72 C ATOM 1941 N ALA C 88 42.856 2.863 8.027 1.00 24.07 N ATOM 1942 CA ALA C 88 42.027 2.920 9.234 1.00 24.42 C ATOM 1943 C ALA C 88 41.124 4.139 9.228 1.00 24.37 C ATOM 1944 O ALA C 88 39.960 4.061 9.632 1.00 26.55 O ATOM 1945 CB ALA C 88 42.905 2.921 10.504 1.00 20.65 C ATOM 1946 N GLU C 89 41.654 5.267 8.761 1.00 22.34 N ATOM 1947 CA GLU C 89 40.868 6.496 8.720 1.00 21.19 C ATOM 1948 C GLU C 89 39.738 6.385 7.703 1.00 25.06 C ATOM 1949 O GLU C 89 38.604 6.777 7.981 1.00 22.05 O ATOM 1950 CB GLU C 89 41.764 7.702 8.422 1.00 24.58 C ATOM 1951 CG GLU C 89 42.675 8.059 9.607 1.00 28.50 C ATOM 1952 CD GLU C 89 43.695 9.149 9.295 1.00 33.99 C ATOM 1953 OE1 GLU C 89 44.330 9.099 8.222 1.00 31.01 O ATOM 1954 OE2 GLU C 89 43.874 10.050 10.143 1.00 39.56 O ATOM 1955 N TYR C 90 40.040 5.836 6.528 1.00 23.98 N ATOM 1956 CA TYR C 90 38.997 5.579 5.536 1.00 23.36 C ATOM 1957 C TYR C 90 37.931 4.614 6.057 1.00 23.66 C ATOM 1958 O TYR C 90 36.729 4.864 5.947 1.00 25.68 O ATOM 1959 CB TYR C 90 39.614 5.013 4.260 1.00 20.86 C ATOM 1960 CG TYR C 90 40.272 6.055 3.386 1.00 22.90 C ATOM 1961 CD1 TYR C 90 39.533 7.101 2.849 1.00 24.55 C ATOM 1962 CD2 TYR C 90 41.620 5.982 3.079 1.00 21.86 C ATOM 1963 CE1 TYR C 90 40.124 8.056 2.037 1.00 25.12 C ATOM 1964 CE2 TYR C 90 42.221 6.931 2.246 1.00 23.74 C ATOM 1965 CZ TYR C 90 41.465 7.965 1.739 1.00 21.81 C ATOM 1966 OH TYR C 90 42.044 8.915 0.918 1.00 30.86 O ATOM 1967 N TRP C 91 38.384 3.502 6.619 1.00 21.17 N ATOM 1968 CA TRP C 91 37.475 2.446 7.039 1.00 24.93 C ATOM 1969 C TRP C 91 36.540 2.902 8.157 1.00 26.99 C ATOM 1970 O TRP C 91 35.365 2.534 8.187 1.00 25.92 O ATOM 1971 CB TRP C 91 38.260 1.217 7.484 1.00 20.87 C ATOM 1972 CG TRP C 91 37.384 0.019 7.683 1.00 24.12 C ATOM 1973 CD1 TRP C 91 36.924 -0.482 8.871 1.00 24.18 C ATOM 1974 CD2 TRP C 91 36.847 -0.822 6.655 1.00 23.03 C ATOM 1975 NE1 TRP C 91 36.138 -1.591 8.642 1.00 25.68 N ATOM 1976 CE2 TRP C 91 36.075 -1.817 7.289 1.00 25.72 C ATOM 1977 CE3 TRP C 91 36.950 -0.831 5.256 1.00 26.92 C ATOM 1978 CZ2 TRP C 91 35.406 -2.808 6.574 1.00 25.99 C ATOM 1979 CZ3 TRP C 91 36.285 -1.822 4.545 1.00 25.34 C ATOM 1980 CH2 TRP C 91 35.520 -2.795 5.208 1.00 26.34 C ATOM 1981 N ASN C 92 37.071 3.709 9.066 1.00 28.08 N ATOM 1982 CA ASN C 92 36.300 4.243 10.181 1.00 29.74 C ATOM 1983 C ASN C 92 35.049 5.000 9.711 1.00 30.65 C ATOM 1984 O ASN C 92 34.023 5.005 10.386 1.00 31.48 O ATOM 1985 CB ASN C 92 37.200 5.152 11.027 1.00 29.30 C ATOM 1986 CG ASN C 92 36.796 5.191 12.486 1.00 40.53 C ATOM 1987 OD1 ASN C 92 35.622 5.043 12.821 1.00 44.85 O ATOM 1988 ND2 ASN C 92 37.774 5.399 13.367 1.00 46.79 N ATOM 1989 N LEU C 93 35.127 5.619 8.535 1.00 30.23 N ATOM 1990 CA LEU C 93 34.016 6.432 8.041 1.00 31.96 C ATOM 1991 C LEU C 93 32.801 5.612 7.579 1.00 34.19 C ATOM 1992 O LEU C 93 31.729 6.171 7.345 1.00 34.54 O ATOM 1993 CB LEU C 93 34.494 7.337 6.904 1.00 29.16 C ATOM 1994 CG LEU C 93 35.533 8.396 7.296 1.00 37.04 C ATOM 1995 CD1 LEU C 93 36.022 9.147 6.072 1.00 33.80 C ATOM 1996 CD2 LEU C 93 34.968 9.369 8.339 1.00 31.71 C ATOM 1997 N LEU C 94 32.963 4.294 7.459 1.00 32.54 N ATOM 1998 CA LEU C 94 31.849 3.406 7.115 1.00 31.93 C ATOM 1999 C LEU C 94 30.908 3.244 8.299 1.00 35.41 C ATOM 2000 O LEU C 94 29.786 2.765 8.154 1.00 33.76 O ATOM 2001 CB LEU C 94 32.362 2.035 6.675 1.00 27.30 C ATOM 2002 CG LEU C 94 33.103 1.967 5.341 1.00 30.51 C ATOM 2003 CD1 LEU C 94 33.763 0.612 5.199 1.00 31.54 C ATOM 2004 CD2 LEU C 94 32.140 2.197 4.184 1.00 29.81 C ATOM 2005 N SER C 95 31.398 3.613 9.478 1.00 36.26 N ATOM 2006 CA SER C 95 30.602 3.602 10.699 1.00 35.33 C ATOM 2007 C SER C 95 30.587 5.008 11.261 1.00 37.36 C ATOM 2008 O SER C 95 31.315 5.308 12.201 1.00 33.45 O ATOM 2009 CB SER C 95 31.174 2.631 11.725 1.00 36.12 C ATOM 2010 OG SER C 95 31.413 1.363 11.152 1.00 35.52 O ATOM 2011 N PRO C 96 29.766 5.881 10.665 1.00 37.17 N ATOM 2012 CA PRO C 96 29.813 7.304 10.995 1.00 36.31 C ATOM 2013 C PRO C 96 29.427 7.564 12.445 1.00 34.88 C ATOM 2014 O PRO C 96 28.519 6.928 12.977 1.00 34.47 O ATOM 2015 CB PRO C 96 28.796 7.924 10.027 1.00 39.44 C ATOM 2016 CG PRO C 96 27.857 6.805 9.703 1.00 42.24 C ATOM 2017 CD PRO C 96 28.702 5.567 9.692 1.00 39.03 C ATOM 2018 N ASP C 97 30.147 8.479 13.077 1.00 31.18 N ATOM 2019 CA ASP C 97 29.820 8.905 14.428 1.00 30.99 C ATOM 2020 C ASP C 97 28.612 9.836 14.423 1.00 33.67 C ATOM 2021 O ASP C 97 28.417 10.602 13.472 1.00 27.40 O ATOM 2022 CB ASP C 97 31.022 9.595 15.063 1.00 33.75 C ATOM 2023 CG ASP C 97 32.202 8.657 15.244 1.00 29.01 C ATOM 2024 OD1 ASP C 97 33.344 9.070 14.951 1.00 34.40 O ATOM 2025 OD2 ASP C 97 31.977 7.509 15.682 1.00 34.71 O1- ATOM 2026 N ARG C 98 27.801 9.760 15.477 1.00 28.10 N ATOM 2027 CA ARG C 98 26.712 10.711 15.664 1.00 28.20 C ATOM 2028 C ARG C 98 27.288 12.121 15.681 1.00 29.59 C ATOM 2029 O ARG C 98 28.354 12.351 16.249 1.00 31.30 O ATOM 2030 CB ARG C 98 25.943 10.420 16.954 1.00 29.17 C ATOM 2031 N THR C 99 26.610 13.053 15.019 1.00 30.34 N ATOM 2032 CA THR C 99 27.076 14.432 14.967 1.00 28.18 C ATOM 2033 C THR C 99 25.976 15.406 15.368 1.00 31.09 C ATOM 2034 O THR C 99 24.789 15.116 15.228 1.00 33.15 O ATOM 2035 CB THR C 99 27.574 14.829 13.559 1.00 33.14 C ATOM 2036 OG1 THR C 99 26.472 14.797 12.644 1.00 33.31 O ATOM 2037 CG2 THR C 99 28.661 13.884 13.077 1.00 31.86 C ATOM 2038 N PHE C 100 26.383 16.567 15.865 1.00 28.81 N ATOM 2039 CA PHE C 100 25.441 17.632 16.175 1.00 30.45 C ATOM 2040 C PHE C 100 25.864 18.888 15.445 1.00 31.47 C ATOM 2041 O PHE C 100 27.009 19.329 15.568 1.00 28.83 O ATOM 2042 CB PHE C 100 25.366 17.900 17.683 1.00 28.42 C ATOM 2043 CG PHE C 100 24.364 18.955 18.052 1.00 28.41 C ATOM 2044 CD1 PHE C 100 23.034 18.620 18.269 1.00 30.52 C ATOM 2045 CD2 PHE C 100 24.741 20.282 18.149 1.00 26.39 C ATOM 2046 CE1 PHE C 100 22.104 19.592 18.597 1.00 32.91 C ATOM 2047 CE2 PHE C 100 23.813 21.261 18.477 1.00 29.21 C ATOM 2048 CZ PHE C 100 22.497 20.912 18.704 1.00 27.10 C ATOM 2049 N THR C 101 24.934 19.470 14.696 1.00 31.46 N ATOM 2050 CA THR C 101 25.248 20.617 13.864 1.00 30.89 C ATOM 2051 C THR C 101 24.316 21.803 14.100 1.00 31.84 C ATOM 2052 O THR C 101 23.090 21.662 14.113 1.00 32.45 O ATOM 2053 CB THR C 101 25.187 20.247 12.374 1.00 31.70 C ATOM 2054 OG1 THR C 101 26.030 19.115 12.133 1.00 32.35 O ATOM 2055 CG2 THR C 101 25.647 21.415 11.523 1.00 34.29 C ATOM 2056 N LEU C 102 24.910 22.977 14.253 1.00 32.26 N ATOM 2057 CA LEU C 102 24.147 24.182 14.519 1.00 33.25 C ATOM 2058 C LEU C 102 24.712 25.341 13.707 1.00 36.34 C ATOM 2059 O LEU C 102 25.860 25.739 13.906 1.00 39.32 O ATOM 2060 CB LEU C 102 24.179 24.503 16.016 1.00 32.87 C ATOM 2061 CG LEU C 102 23.149 25.472 16.592 1.00 38.02 C ATOM 2062 CD1 LEU C 102 21.774 24.835 16.566 1.00 35.52 C ATOM 2063 CD2 LEU C 102 23.531 25.886 18.014 1.00 34.64 C ATOM 2064 N LYS C 103 23.921 25.869 12.776 1.00 37.83 N ATOM 2065 CA LYS C 103 24.291 27.111 12.102 1.00 33.80 C ATOM 2066 C LYS C 103 24.007 28.275 13.042 1.00 33.09 C ATOM 2067 O LYS C 103 22.990 28.297 13.735 1.00 33.26 O ATOM 2068 CB LYS C 103 23.536 27.274 10.782 1.00 36.72 C ATOM 2069 CG LYS C 103 24.101 26.428 9.652 1.00 36.58 C ATOM 2070 N VAL C 104 24.921 29.230 13.096 1.00 32.34 N ATOM 2071 CA VAL C 104 24.797 30.306 14.065 1.00 32.01 C ATOM 2072 C VAL C 104 25.072 31.657 13.438 1.00 34.49 C ATOM 2073 O VAL C 104 26.212 31.968 13.093 1.00 34.79 O ATOM 2074 CB VAL C 104 25.764 30.118 15.245 1.00 32.78 C ATOM 2075 CG1 VAL C 104 25.594 31.249 16.236 1.00 34.21 C ATOM 2076 CG2 VAL C 104 25.534 28.773 15.918 1.00 33.46 C ATOM 2077 N ASN C 105 24.027 32.461 13.288 1.00 31.37 N ATOM 2078 CA ASN C 105 24.193 33.797 12.744 1.00 33.76 C ATOM 2079 C ASN C 105 24.541 34.748 13.863 1.00 33.82 C ATOM 2080 O ASN C 105 23.712 35.048 14.717 1.00 34.42 O ATOM 2081 CB ASN C 105 22.934 34.258 12.007 1.00 33.50 C ATOM 2082 CG ASN C 105 22.702 33.485 10.726 1.00 37.71 C ATOM 2083 OD1 ASN C 105 23.648 33.180 9.994 1.00 35.58 O ATOM 2084 ND2 ASN C 105 21.449 33.141 10.457 1.00 33.70 N ATOM 2085 N VAL C 106 25.788 35.198 13.860 1.00 33.00 N ATOM 2086 CA VAL C 106 26.281 36.112 14.868 1.00 33.81 C ATOM 2087 C VAL C 106 26.073 37.547 14.412 1.00 36.92 C ATOM 2088 O VAL C 106 26.510 37.928 13.326 1.00 36.73 O ATOM 2089 CB VAL C 106 27.771 35.868 15.156 1.00 32.03 C ATOM 2090 CG1 VAL C 106 28.279 36.834 16.214 1.00 32.91 C ATOM 2091 CG2 VAL C 106 27.997 34.420 15.582 1.00 32.70 C ATOM 2092 N GLN C 107 25.390 38.335 15.236 1.00 36.94 N ATOM 2093 CA GLN C 107 25.179 39.747 14.939 1.00 36.22 C ATOM 2094 C GLN C 107 26.021 40.619 15.861 1.00 39.55 C ATOM 2095 O GLN C 107 25.827 40.635 17.080 1.00 36.18 O ATOM 2096 CB GLN C 107 23.698 40.111 15.071 1.00 36.46 C ATOM 2097 CG GLN C 107 22.788 39.305 14.168 1.00 36.61 C ATOM 2098 CD GLN C 107 22.993 39.627 12.704 1.00 40.23 C ATOM 2099 OE1 GLN C 107 23.487 40.702 12.356 1.00 38.58 O ATOM 2100 NE2 GLN C 107 22.606 38.697 11.833 1.00 42.53 N ATOM 2101 OXT GLN C 107 26.919 41.329 15.403 1.00 42.92 O1- TER 2102 GLN C 107 ATOM 2103 N MET D 1 15.888 28.464 25.889 1.00 55.71 N ATOM 2104 CA MET D 1 17.055 28.839 26.681 1.00 52.92 C ATOM 2105 C MET D 1 18.302 28.084 26.221 1.00 51.33 C ATOM 2106 O MET D 1 19.263 28.687 25.745 1.00 52.92 O ATOM 2107 CB MET D 1 16.798 28.581 28.167 1.00 52.24 C ATOM 2108 CG MET D 1 15.993 29.676 28.850 1.00 57.13 C ATOM 2109 SD MET D 1 15.402 29.197 30.485 1.00 62.81 S ATOM 2110 CE MET D 1 14.206 30.496 30.801 1.00 47.61 C ATOM 2111 N SER D 2 18.281 26.763 26.363 1.00 48.52 N ATOM 2112 CA SER D 2 19.406 25.938 25.938 1.00 45.01 C ATOM 2113 C SER D 2 18.992 25.014 24.802 1.00 41.87 C ATOM 2114 O SER D 2 17.843 24.583 24.732 1.00 41.68 O ATOM 2115 CB SER D 2 19.953 25.124 27.112 1.00 42.09 C ATOM 2116 OG SER D 2 18.952 24.274 27.644 1.00 47.53 O ATOM 2117 N LEU D 3 19.932 24.719 23.909 1.00 38.94 N ATOM 2118 CA LEU D 3 19.657 23.827 22.791 1.00 36.59 C ATOM 2119 C LEU D 3 19.957 22.392 23.189 1.00 35.49 C ATOM 2120 O LEU D 3 20.819 22.142 24.029 1.00 33.15 O ATOM 2121 CB LEU D 3 20.479 24.209 21.559 1.00 35.64 C ATOM 2122 CG LEU D 3 20.288 25.591 20.927 1.00 39.29 C ATOM 2123 CD1 LEU D 3 18.841 26.057 21.015 1.00 38.62 C ATOM 2124 CD2 LEU D 3 21.201 26.595 21.580 1.00 36.19 C ATOM 2125 N THR D 4 19.230 21.453 22.595 1.00 30.07 N ATOM 2126 CA THR D 4 19.443 20.039 22.863 1.00 33.26 C ATOM 2127 C THR D 4 19.448 19.283 21.546 1.00 35.20 C ATOM 2128 O THR D 4 19.491 19.898 20.481 1.00 32.55 O ATOM 2129 CB THR D 4 18.363 19.457 23.794 1.00 36.00 C ATOM 2130 OG1 THR D 4 17.078 19.598 23.184 1.00 41.50 O ATOM 2131 CG2 THR D 4 18.365 20.178 25.135 1.00 36.02 C ATOM 2132 N GLU D 5 19.396 17.956 21.622 1.00 35.64 N ATOM 2133 CA GLU D 5 19.441 17.109 20.429 1.00 37.35 C ATOM 2134 C GLU D 5 18.389 17.503 19.388 1.00 37.75 C ATOM 2135 O GLU D 5 18.610 17.367 18.185 1.00 35.17 O ATOM 2136 CB GLU D 5 19.262 15.639 20.819 1.00 36.65 C ATOM 2137 CG GLU D 5 20.466 15.021 21.540 1.00 39.38 C ATOM 2138 CD GLU D 5 20.467 15.241 23.053 1.00 39.37 C ATOM 2139 OE1 GLU D 5 19.679 16.073 23.560 1.00 39.68 O ATOM 2140 OE2 GLU D 5 21.263 14.564 23.740 1.00 35.35 O ATOM 2141 N ASP D 6 17.253 18.011 19.852 1.00 37.93 N ATOM 2142 CA ASP D 6 16.162 18.372 18.954 1.00 41.41 C ATOM 2143 C ASP D 6 16.475 19.588 18.091 1.00 41.33 C ATOM 2144 O ASP D 6 15.797 19.835 17.094 1.00 42.73 O ATOM 2145 CB ASP D 6 14.882 18.621 19.750 1.00 41.52 C ATOM 2146 CG ASP D 6 14.258 17.336 20.255 1.00 51.23 C ATOM 2147 OD1 ASP D 6 14.689 16.247 19.811 1.00 51.83 O ATOM 2148 OD2 ASP D 6 13.330 17.413 21.087 1.00 55.00 O ATOM 2149 N ASN D 7 17.505 20.340 18.459 1.00 37.50 N ATOM 2150 CA ASN D 7 17.893 21.502 17.669 1.00 37.82 C ATOM 2151 C ASN D 7 18.949 21.163 16.629 1.00 34.49 C ATOM 2152 O ASN D 7 19.504 22.054 15.985 1.00 36.11 O ATOM 2153 CB ASN D 7 18.403 22.618 18.576 1.00 36.80 C ATOM 2154 CG ASN D 7 17.371 23.047 19.598 1.00 40.92 C ATOM 2155 OD1 ASN D 7 17.343 22.544 20.722 1.00 34.76 O ATOM 2156 ND2 ASN D 7 16.510 23.981 19.209 1.00 39.33 N ATOM 2157 N ASN D 8 19.234 19.874 16.475 1.00 36.60 N ATOM 2158 CA ASN D 8 20.213 19.422 15.489 1.00 36.18 C ATOM 2159 C ASN D 8 19.817 19.895 14.089 1.00 36.29 C ATOM 2160 O ASN D 8 18.653 19.792 13.705 1.00 37.13 O ATOM 2161 CB ASN D 8 20.342 17.898 15.539 1.00 33.65 C ATOM 2162 CG ASN D 8 21.466 17.358 14.663 1.00 35.74 C ATOM 2163 OD1 ASN D 8 22.386 18.078 14.262 1.00 33.18 O ATOM 2164 ND2 ASN D 8 21.393 16.069 14.367 1.00 40.77 N ATOM 2165 N ASN D 9 20.790 20.442 13.365 1.00 32.46 N ATOM 2166 CA ASN D 9 20.611 20.957 12.005 1.00 37.48 C ATOM 2167 C ASN D 9 19.612 22.103 11.919 1.00 38.87 C ATOM 2168 O ASN D 9 18.806 22.152 10.999 1.00 37.20 O ATOM 2169 CB ASN D 9 20.177 19.844 11.045 1.00 36.51 C ATOM 2170 CG ASN D 9 21.241 18.778 10.865 1.00 40.31 C ATOM 2171 OD1 ASN D 9 22.316 19.044 10.325 1.00 40.84 O ATOM 2172 ND2 ASN D 9 20.936 17.558 11.295 1.00 40.20 N ATOM 2173 N THR D 10 19.661 23.017 12.884 1.00 38.61 N ATOM 2174 CA THR D 10 18.873 24.236 12.802 1.00 36.43 C ATOM 2175 C THR D 10 19.784 25.454 12.766 1.00 36.12 C ATOM 2176 O THR D 10 21.006 25.329 12.817 1.00 35.33 O ATOM 2177 CB THR D 10 17.896 24.375 13.974 1.00 34.30 C ATOM 2178 OG1 THR D 10 18.629 24.573 15.188 1.00 35.80 O ATOM 2179 CG2 THR D 10 17.024 23.135 14.096 1.00 36.05 C ATOM 2180 N THR D 11 19.172 26.628 12.661 1.00 32.44 N ATOM 2181 CA THR D 11 19.890 27.890 12.642 1.00 33.17 C ATOM 2182 C THR D 11 19.420 28.746 13.809 1.00 36.78 C ATOM 2183 O THR D 11 18.221 28.851 14.059 1.00 36.60 O ATOM 2184 CB THR D 11 19.665 28.652 11.319 1.00 34.95 C ATOM 2185 OG1 THR D 11 20.115 27.850 10.219 1.00 37.79 O ATOM 2186 CG2 THR D 11 20.422 29.968 11.319 1.00 34.38 C ATOM 2187 N ILE D 12 20.357 29.339 14.541 1.00 33.07 N ATOM 2188 CA ILE D 12 19.994 30.265 15.604 1.00 32.28 C ATOM 2189 C ILE D 12 20.686 31.594 15.389 1.00 31.18 C ATOM 2190 O ILE D 12 21.639 31.697 14.614 1.00 32.60 O ATOM 2191 CB ILE D 12 20.377 29.745 17.009 1.00 33.58 C ATOM 2192 CG1 ILE D 12 21.903 29.642 17.129 1.00 31.84 C ATOM 2193 CG2 ILE D 12 19.674 28.429 17.308 1.00 32.75 C ATOM 2194 CD1 ILE D 12 22.412 29.464 18.554 1.00 34.01 C ATOM 2195 N THR D 13 20.205 32.608 16.095 1.00 28.60 N ATOM 2196 CA THR D 13 20.816 33.922 16.063 1.00 29.02 C ATOM 2197 C THR D 13 21.347 34.261 17.441 1.00 31.36 C ATOM 2198 O THR D 13 20.660 34.045 18.436 1.00 33.41 O ATOM 2199 CB THR D 13 19.815 35.014 15.632 1.00 32.59 C ATOM 2200 OG1 THR D 13 19.277 34.697 14.340 1.00 36.84 O ATOM 2201 CG2 THR D 13 20.509 36.361 15.568 1.00 30.31 C ATOM 2202 N ILE D 14 22.564 34.790 17.497 1.00 29.73 N ATOM 2203 CA ILE D 14 23.114 35.307 18.742 1.00 30.49 C ATOM 2204 C ILE D 14 23.878 36.600 18.508 1.00 32.66 C ATOM 2205 O ILE D 14 24.326 36.881 17.396 1.00 31.69 O ATOM 2206 CB ILE D 14 24.068 34.305 19.431 1.00 33.42 C ATOM 2207 CG1 ILE D 14 25.288 34.030 18.546 1.00 29.73 C ATOM 2208 CG2 ILE D 14 23.339 33.019 19.798 1.00 35.68 C ATOM 2209 CD1 ILE D 14 26.321 33.138 19.210 1.00 35.96 C ATOM 2210 N ALA D 15 24.035 37.380 19.569 1.00 29.66 N ATOM 2211 CA ALA D 15 24.817 38.599 19.492 1.00 29.75 C ATOM 2212 C ALA D 15 26.299 38.271 19.619 1.00 35.44 C ATOM 2213 O ALA D 15 26.674 37.323 20.309 1.00 34.09 O ATOM 2214 CB ALA D 15 24.392 39.568 20.571 1.00 29.85 C ATOM 2215 N LYS D 16 27.139 39.042 18.940 1.00 30.70 N ATOM 2216 CA LYS D 16 28.573 38.939 19.148 1.00 33.39 C ATOM 2217 C LYS D 16 28.886 39.170 20.623 1.00 32.42 C ATOM 2218 O LYS D 16 28.552 40.216 21.176 1.00 33.18 O ATOM 2219 CB LYS D 16 29.319 39.944 18.272 1.00 33.52 C ATOM 2220 CG LYS D 16 30.818 39.951 18.493 1.00 37.03 C ATOM 2221 CD LYS D 16 31.533 40.832 17.486 1.00 36.78 C ATOM 2222 CE LYS D 16 33.032 40.833 17.746 1.00 44.10 C ATOM 2223 NZ LYS D 16 33.787 41.606 16.718 1.00 44.86 N1+ ATOM 2224 N GLY D 17 29.506 38.184 21.265 1.00 34.67 N ATOM 2225 CA GLY D 17 29.808 38.280 22.683 1.00 30.20 C ATOM 2226 C GLY D 17 28.765 37.629 23.579 1.00 36.34 C ATOM 2227 O GLY D 17 28.987 37.469 24.783 1.00 35.96 O ATOM 2228 N GLU D 18 27.623 37.259 23.005 1.00 33.92 N ATOM 2229 CA GLU D 18 26.601 36.520 23.755 1.00 32.68 C ATOM 2230 C GLU D 18 26.964 35.038 23.879 1.00 34.78 C ATOM 2231 O GLU D 18 27.495 34.435 22.938 1.00 30.46 O ATOM 2232 CB GLU D 18 25.229 36.661 23.087 1.00 34.10 C ATOM 2233 CG GLU D 18 24.107 35.885 23.785 1.00 34.11 C ATOM 2234 CD GLU D 18 22.810 35.856 22.983 1.00 40.02 C ATOM 2235 OE1 GLU D 18 22.786 36.391 21.852 1.00 34.56 O ATOM 2236 OE2 GLU D 18 21.810 35.293 23.482 1.00 43.92 O1- ATOM 2237 N ASN D 19 26.679 34.459 25.043 1.00 32.30 N ATOM 2238 CA ASN D 19 26.864 33.032 25.261 1.00 33.21 C ATOM 2239 C ASN D 19 25.565 32.275 25.087 1.00 32.56 C ATOM 2240 O ASN D 19 24.497 32.784 25.397 1.00 35.45 O ATOM 2241 CB ASN D 19 27.409 32.749 26.667 1.00 34.72 C ATOM 2242 CG ASN D 19 28.664 33.524 26.973 1.00 38.28 C ATOM 2243 OD1 ASN D 19 29.544 33.674 26.123 1.00 39.73 O ATOM 2244 ND2 ASN D 19 28.756 34.028 28.197 1.00 39.51 N ATOM 2245 N ALYS D 20 25.678 31.038 24.616 0.42 33.64 N ATOM 2246 N BLYS D 20 25.657 31.060 24.568 0.58 33.64 N ATOM 2247 CA ALYS D 20 24.532 30.155 24.443 0.42 33.59 C ATOM 2248 CA BLYS D 20 24.513 30.162 24.520 0.58 33.57 C ATOM 2249 C ALYS D 20 24.964 28.716 24.716 0.42 33.26 C ATOM 2250 C BLYS D 20 24.998 28.776 24.881 0.58 33.22 C ATOM 2251 O ALYS D 20 26.084 28.326 24.383 0.42 32.21 O ATOM 2252 O BLYS D 20 26.186 28.479 24.764 0.58 32.12 O ATOM 2253 CB ALYS D 20 23.954 30.300 23.034 0.42 35.46 C ATOM 2254 CB BLYS D 20 23.849 30.167 23.140 0.58 35.42 C ATOM 2255 CG ALYS D 20 22.745 29.436 22.756 0.42 35.39 C ATOM 2256 CG BLYS D 20 22.956 31.373 22.879 0.58 35.48 C ATOM 2257 CD ALYS D 20 21.549 29.828 23.606 0.42 38.47 C ATOM 2258 CD BLYS D 20 21.564 31.190 23.466 0.58 38.99 C ATOM 2259 CE ALYS D 20 20.872 31.087 23.079 0.42 39.55 C ATOM 2260 CE BLYS D 20 20.801 30.084 22.747 0.58 40.28 C ATOM 2261 NZ ALYS D 20 19.612 31.385 23.819 0.42 41.42 N ATOM 2262 NZ BLYS D 20 19.417 29.904 23.275 0.58 43.42 N ATOM 2263 N GLU D 21 24.079 27.928 25.319 1.00 30.14 N ATOM 2264 CA GLU D 21 24.446 26.606 25.789 1.00 30.34 C ATOM 2265 C GLU D 21 23.775 25.473 25.032 1.00 33.09 C ATOM 2266 O GLU D 21 22.558 25.462 24.847 1.00 33.93 O ATOM 2267 CB GLU D 21 24.124 26.491 27.281 1.00 35.50 C ATOM 2268 CG GLU D 21 24.607 25.209 27.923 1.00 34.53 C ATOM 2269 CD GLU D 21 24.568 25.280 29.438 1.00 40.29 C ATOM 2270 OE1 GLU D 21 23.490 25.585 29.989 1.00 43.14 O ATOM 2271 OE2 GLU D 21 25.618 25.049 30.073 1.00 44.06 O1- ATOM 2272 N ILE D 22 24.595 24.522 24.592 1.00 27.93 N ATOM 2273 CA ILE D 22 24.116 23.276 24.011 1.00 28.49 C ATOM 2274 C ILE D 22 24.303 22.171 25.042 1.00 27.58 C ATOM 2275 O ILE D 22 25.363 22.073 25.656 1.00 27.02 O ATOM 2276 CB ILE D 22 24.880 22.918 22.724 1.00 28.86 C ATOM 2277 CG1 ILE D 22 24.884 24.097 21.745 1.00 28.69 C ATOM 2278 CG2 ILE D 22 24.303 21.666 22.084 1.00 29.09 C ATOM 2279 CD1 ILE D 22 25.860 23.899 20.591 1.00 27.56 C ATOM 2280 N ILE D 23 23.276 21.358 25.257 1.00 24.52 N ATOM 2281 CA ILE D 23 23.385 20.270 26.208 1.00 26.67 C ATOM 2282 C ILE D 23 23.023 18.958 25.529 1.00 28.11 C ATOM 2283 O ILE D 23 21.938 18.817 24.969 1.00 28.48 O ATOM 2284 CB ILE D 23 22.482 20.490 27.439 1.00 27.28 C ATOM 2285 CG1 ILE D 23 22.759 21.857 28.071 1.00 29.71 C ATOM 2286 CG2 ILE D 23 22.694 19.375 28.449 1.00 27.52 C ATOM 2287 CD1 ILE D 23 21.870 22.192 29.261 1.00 34.41 C ATOM 2288 N LEU D 24 23.942 17.998 25.575 1.00 26.67 N ATOM 2289 CA LEU D 24 23.730 16.718 24.909 1.00 28.11 C ATOM 2290 C LEU D 24 24.046 15.579 25.851 1.00 27.14 C ATOM 2291 O LEU D 24 25.050 15.623 26.561 1.00 27.28 O ATOM 2292 CB LEU D 24 24.600 16.614 23.655 1.00 27.14 C ATOM 2293 CG LEU D 24 24.470 17.741 22.629 1.00 29.33 C ATOM 2294 CD1 LEU D 24 25.620 17.673 21.651 1.00 27.19 C ATOM 2295 CD2 LEU D 24 23.150 17.635 21.896 1.00 28.30 C ATOM 2296 N AHIS D 25 23.186 14.564 25.845 0.49 28.65 N ATOM 2297 N BHIS D 25 23.196 14.559 25.885 0.51 28.85 N ATOM 2298 CA AHIS D 25 23.415 13.334 26.590 0.49 30.69 C ATOM 2299 CA BHIS D 25 23.477 13.426 26.753 0.51 30.60 C ATOM 2300 C AHIS D 25 24.708 12.671 26.131 0.49 30.74 C ATOM 2301 C BHIS D 25 24.628 12.619 26.172 0.51 30.76 C ATOM 2302 O AHIS D 25 25.041 12.714 24.948 0.49 27.62 O ATOM 2303 O BHIS D 25 24.780 12.511 24.957 0.51 27.69 O ATOM 2304 CB AHIS D 25 22.241 12.363 26.404 0.49 32.20 C ATOM 2305 CB BHIS D 25 22.249 12.533 26.949 0.51 32.58 C ATOM 2306 CG AHIS D 25 20.960 12.825 27.028 0.49 33.51 C ATOM 2307 CG BHIS D 25 22.439 11.477 27.997 0.51 32.23 C ATOM 2308 ND1AHIS D 25 19.780 12.922 26.323 0.49 35.08 N ATOM 2309 ND1BHIS D 25 22.153 11.689 29.329 0.51 34.12 N ATOM 2310 CD2AHIS D 25 20.672 13.206 28.296 0.49 35.09 C ATOM 2311 CD2BHIS D 25 22.907 10.208 27.912 0.51 32.28 C ATOM 2312 CE1AHIS D 25 18.823 13.349 27.126 0.49 32.68 C ATOM 2313 CE1BHIS D 25 22.427 10.595 30.017 0.51 34.89 C ATOM 2314 NE2AHIS D 25 19.338 13.529 28.329 0.49 35.11 N ATOM 2315 NE2BHIS D 25 22.886 9.681 29.180 0.51 31.58 N ATOM 2316 N GLY D 26 25.437 12.064 27.065 1.00 30.23 N ATOM 2317 CA GLY D 26 26.613 11.299 26.707 1.00 28.68 C ATOM 2318 C GLY D 26 26.937 10.338 27.836 1.00 32.19 C ATOM 2319 O GLY D 26 26.494 10.528 28.978 1.00 30.15 O ATOM 2320 N ASN D 27 27.684 9.289 27.511 1.00 29.67 N ATOM 2321 CA ASN D 27 28.133 8.334 28.512 1.00 30.88 C ATOM 2322 C ASN D 27 29.605 7.989 28.339 1.00 26.84 C ATOM 2323 O ASN D 27 29.943 6.995 27.692 1.00 28.50 O ATOM 2324 CB ASN D 27 27.307 7.055 28.459 1.00 31.62 C ATOM 2325 CG ASN D 27 27.499 6.208 29.698 1.00 35.62 C ATOM 2326 OD1 ASN D 27 28.371 6.496 30.528 1.00 33.76 O ATOM 2327 ND2 ASN D 27 26.692 5.167 29.838 1.00 38.70 N ATOM 2328 N PRO D 28 30.485 8.811 28.917 1.00 23.61 N ATOM 2329 CA PRO D 28 31.932 8.657 28.741 1.00 25.51 C ATOM 2330 C PRO D 28 32.533 7.387 29.362 1.00 27.17 C ATOM 2331 O PRO D 28 33.716 7.133 29.131 1.00 23.77 O ATOM 2332 CB PRO D 28 32.497 9.911 29.416 1.00 27.75 C ATOM 2333 CG PRO D 28 31.436 10.346 30.368 1.00 28.13 C ATOM 2334 CD PRO D 28 30.149 10.019 29.686 1.00 27.52 C ATOM 2335 N THR D 29 31.761 6.606 30.114 1.00 24.47 N ATOM 2336 CA THR D 29 32.280 5.340 30.622 1.00 25.11 C ATOM 2337 C THR D 29 32.488 4.341 29.483 1.00 28.94 C ATOM 2338 O THR D 29 33.166 3.335 29.664 1.00 25.08 O ATOM 2339 CB THR D 29 31.359 4.704 31.677 1.00 27.50 C ATOM 2340 OG1 THR D 29 30.062 4.485 31.115 1.00 25.77 O ATOM 2341 CG2 THR D 29 31.238 5.608 32.891 1.00 24.99 C ATOM 2342 N THR D 30 31.900 4.623 28.317 1.00 25.45 N ATOM 2343 CA THR D 30 32.085 3.792 27.130 1.00 23.99 C ATOM 2344 C THR D 30 33.350 4.188 26.390 1.00 25.61 C ATOM 2345 O THR D 30 33.811 3.477 25.496 1.00 28.42 O ATOM 2346 CB THR D 30 30.902 3.913 26.143 1.00 28.81 C ATOM 2347 OG1 THR D 30 30.807 5.268 25.687 1.00 20.24 O ATOM 2348 CG2 THR D 30 29.600 3.510 26.811 1.00 27.51 C ATOM 2349 N GLY D 31 33.898 5.339 26.753 1.00 21.11 N ATOM 2350 CA GLY D 31 35.035 5.893 26.046 1.00 22.19 C ATOM 2351 C GLY D 31 34.659 6.943 25.011 1.00 23.99 C ATOM 2352 O GLY D 31 35.525 7.675 24.527 1.00 26.21 O ATOM 2353 N TYR D 32 33.375 7.021 24.663 1.00 22.17 N ATOM 2354 CA TYR D 32 32.901 8.085 23.765 1.00 24.34 C ATOM 2355 C TYR D 32 32.744 9.401 24.511 1.00 26.16 C ATOM 2356 O TYR D 32 32.474 9.412 25.711 1.00 26.03 O ATOM 2357 CB TYR D 32 31.565 7.701 23.115 1.00 23.67 C ATOM 2358 CG TYR D 32 31.690 6.692 22.000 1.00 25.20 C ATOM 2359 CD1 TYR D 32 31.783 5.332 22.273 1.00 25.76 C ATOM 2360 CD2 TYR D 32 31.710 7.099 20.665 1.00 29.20 C ATOM 2361 CE1 TYR D 32 31.899 4.399 21.245 1.00 25.10 C ATOM 2362 CE2 TYR D 32 31.822 6.168 19.627 1.00 24.07 C ATOM 2363 CZ TYR D 32 31.915 4.823 19.933 1.00 27.64 C ATOM 2364 OH TYR D 32 32.026 3.888 18.932 1.00 30.81 O ATOM 2365 N SER D 33 32.917 10.510 23.801 1.00 23.81 N ATOM 2366 CA SER D 33 32.610 11.821 24.347 1.00 25.53 C ATOM 2367 C SER D 33 32.196 12.775 23.225 1.00 27.60 C ATOM 2368 O SER D 33 32.504 12.538 22.057 1.00 25.24 O ATOM 2369 CB SER D 33 33.812 12.388 25.107 1.00 27.58 C ATOM 2370 OG SER D 33 34.898 12.615 24.228 1.00 28.06 O ATOM 2371 N TRP D 34 31.493 13.846 23.581 1.00 26.09 N ATOM 2372 CA TRP D 34 31.188 14.900 22.623 1.00 25.36 C ATOM 2373 C TRP D 34 32.381 15.836 22.491 1.00 28.70 C ATOM 2374 O TRP D 34 32.892 16.347 23.487 1.00 30.48 O ATOM 2375 CB TRP D 34 29.939 15.679 23.048 1.00 25.36 C ATOM 2376 CG TRP D 34 28.661 14.954 22.759 1.00 24.43 C ATOM 2377 CD1 TRP D 34 27.866 14.305 23.651 1.00 26.09 C ATOM 2378 CD2 TRP D 34 28.035 14.809 21.477 1.00 26.11 C ATOM 2379 NE1 TRP D 34 26.778 13.758 23.002 1.00 28.09 N ATOM 2380 CE2 TRP D 34 26.861 14.055 21.667 1.00 25.18 C ATOM 2381 CE3 TRP D 34 28.359 15.240 20.185 1.00 24.47 C ATOM 2382 CZ2 TRP D 34 26.001 13.726 20.614 1.00 27.69 C ATOM 2383 CZ3 TRP D 34 27.506 14.911 19.137 1.00 29.26 C ATOM 2384 CH2 TRP D 34 26.342 14.157 19.359 1.00 26.07 C ATOM 2385 N VAL D 35 32.824 16.054 21.258 1.00 26.51 N ATOM 2386 CA VAL D 35 33.976 16.904 20.993 1.00 28.31 C ATOM 2387 C VAL D 35 33.653 17.828 19.825 1.00 29.79 C ATOM 2388 O VAL D 35 32.826 17.490 18.979 1.00 31.28 O ATOM 2389 CB VAL D 35 35.244 16.057 20.695 1.00 31.91 C ATOM 2390 CG1 VAL D 35 35.086 15.280 19.409 1.00 33.65 C ATOM 2391 CG2 VAL D 35 36.480 16.924 20.627 1.00 34.75 C ATOM 2392 N VAL D 36 34.277 19.004 19.795 1.00 31.15 N ATOM 2393 CA VAL D 36 34.062 19.950 18.708 1.00 32.38 C ATOM 2394 C VAL D 36 34.834 19.516 17.474 1.00 35.14 C ATOM 2395 O VAL D 36 36.064 19.517 17.475 1.00 36.16 O ATOM 2396 CB VAL D 36 34.496 21.375 19.088 1.00 32.07 C ATOM 2397 CG1 VAL D 36 34.290 22.314 17.911 1.00 33.06 C ATOM 2398 CG2 VAL D 36 33.722 21.868 20.315 1.00 32.98 C ATOM 2399 N ASP D 37 34.117 19.137 16.426 1.00 33.38 N ATOM 2400 CA ASP D 37 34.770 18.695 15.195 1.00 36.67 C ATOM 2401 C ASP D 37 35.230 19.894 14.377 1.00 38.73 C ATOM 2402 O ASP D 37 36.344 19.910 13.859 1.00 42.63 O ATOM 2403 CB ASP D 37 33.836 17.810 14.376 1.00 34.19 C ATOM 2404 CG ASP D 37 34.503 17.262 13.129 1.00 42.56 C ATOM 2405 OD1 ASP D 37 34.060 17.612 12.019 1.00 38.35 O ATOM 2406 OD2 ASP D 37 35.480 16.495 13.261 1.00 43.79 O1- ATOM 2407 N SER D 38 34.370 20.901 14.264 1.00 36.69 N ATOM 2408 CA SER D 38 34.756 22.158 13.636 1.00 39.68 C ATOM 2409 C SER D 38 33.861 23.288 14.110 1.00 39.29 C ATOM 2410 O SER D 38 32.781 23.057 14.653 1.00 35.56 O ATOM 2411 CB SER D 38 34.704 22.052 12.104 1.00 36.36 C ATOM 2412 OG SER D 38 33.383 21.818 11.643 1.00 35.82 O ATOM 2413 N SER D 39 34.324 24.515 13.915 1.00 38.74 N ATOM 2414 CA SER D 39 33.490 25.674 14.165 1.00 39.35 C ATOM 2415 C SER D 39 33.953 26.858 13.325 1.00 42.58 C ATOM 2416 O SER D 39 35.039 26.839 12.745 1.00 40.62 O ATOM 2417 CB SER D 39 33.507 26.047 15.641 1.00 37.15 C ATOM 2418 OG SER D 39 34.686 26.759 15.958 1.00 43.37 O ATOM 2419 N GLU D 40 33.113 27.884 13.266 1.00 40.54 N ATOM 2420 CA GLU D 40 33.470 29.147 12.640 1.00 40.93 C ATOM 2421 C GLU D 40 32.665 30.263 13.291 1.00 37.55 C ATOM 2422 O GLU D 40 31.473 30.104 13.546 1.00 36.59 O ATOM 2423 CB GLU D 40 33.213 29.104 11.132 1.00 38.80 C ATOM 2424 N GLY D 41 33.318 31.381 13.578 1.00 35.34 N ATOM 2425 CA GLY D 41 32.626 32.537 14.118 1.00 32.61 C ATOM 2426 C GLY D 41 32.304 32.416 15.597 1.00 36.83 C ATOM 2427 O GLY D 41 31.594 33.256 16.152 1.00 37.04 O ATOM 2428 N LEU D 42 32.839 31.384 16.242 1.00 33.96 N ATOM 2429 CA LEU D 42 32.509 31.101 17.638 1.00 34.99 C ATOM 2430 C LEU D 42 33.716 30.672 18.463 1.00 34.80 C ATOM 2431 O LEU D 42 34.665 30.102 17.933 1.00 37.20 O ATOM 2432 CB LEU D 42 31.453 29.997 17.715 1.00 36.26 C ATOM 2433 CG LEU D 42 30.158 30.130 16.916 1.00 35.81 C ATOM 2434 CD1 LEU D 42 29.424 28.800 16.912 1.00 33.02 C ATOM 2435 CD2 LEU D 42 29.279 31.231 17.491 1.00 34.92 C ATOM 2436 N SER D 43 33.676 30.943 19.764 1.00 35.02 N ATOM 2437 CA SER D 43 34.560 30.255 20.697 1.00 35.56 C ATOM 2438 C SER D 43 33.702 29.299 21.518 1.00 35.96 C ATOM 2439 O SER D 43 32.475 29.411 21.532 1.00 33.64 O ATOM 2440 CB SER D 43 35.311 31.237 21.596 1.00 34.30 C ATOM 2441 OG SER D 43 34.436 31.883 22.502 1.00 39.21 O ATOM 2442 N ASN D 44 34.325 28.344 22.190 1.00 32.89 N ATOM 2443 CA ASN D 44 33.536 27.379 22.933 1.00 33.20 C ATOM 2444 C ASN D 44 34.273 26.769 24.109 1.00 34.30 C ATOM 2445 O ASN D 44 35.497 26.831 24.192 1.00 32.87 O ATOM 2446 CB ASN D 44 33.065 26.258 22.007 1.00 30.23 C ATOM 2447 CG ASN D 44 34.167 25.272 21.690 1.00 35.98 C ATOM 2448 OD1 ASN D 44 34.397 24.322 22.438 1.00 36.77 O ATOM 2449 ND2 ASN D 44 34.864 25.499 20.588 1.00 34.39 N ATOM 2450 N THR D 45 33.500 26.188 25.019 1.00 32.25 N ATOM 2451 CA THR D 45 34.029 25.309 26.051 1.00 34.18 C ATOM 2452 C THR D 45 33.138 24.082 26.126 1.00 33.02 C ATOM 2453 O THR D 45 31.924 24.172 25.906 1.00 32.43 O ATOM 2454 CB THR D 45 34.080 25.978 27.431 1.00 32.81 C ATOM 2455 OG1 THR D 45 32.762 26.403 27.789 1.00 36.09 O ATOM 2456 CG2 THR D 45 35.025 27.176 27.430 1.00 35.25 C ATOM 2457 N VAL D 46 33.742 22.937 26.418 1.00 28.68 N ATOM 2458 CA VAL D 46 32.996 21.703 26.600 1.00 25.56 C ATOM 2459 C VAL D 46 33.250 21.156 28.004 1.00 29.83 C ATOM 2460 O VAL D 46 34.394 21.065 28.439 1.00 31.35 O ATOM 2461 CB VAL D 46 33.377 20.652 25.554 1.00 27.12 C ATOM 2462 CG1 VAL D 46 32.576 19.393 25.770 1.00 27.98 C ATOM 2463 CG2 VAL D 46 33.132 21.195 24.146 1.00 28.02 C ATOM 2464 N GLU D 47 32.177 20.811 28.707 1.00 28.19 N ATOM 2465 CA GLU D 47 32.268 20.268 30.056 1.00 29.98 C ATOM 2466 C GLU D 47 31.339 19.072 30.193 1.00 31.77 C ATOM 2467 O GLU D 47 30.218 19.084 29.677 1.00 32.25 O ATOM 2468 CB GLU D 47 31.912 21.335 31.099 1.00 30.24 C ATOM 2469 N TYR D 48 31.815 18.031 30.867 1.00 27.03 N ATOM 2470 CA TYR D 48 30.964 16.910 31.213 1.00 26.83 C ATOM 2471 C TYR D 48 30.395 17.128 32.599 1.00 28.35 C ATOM 2472 O TYR D 48 31.127 17.470 33.525 1.00 27.12 O ATOM 2473 CB TYR D 48 31.731 15.594 31.170 1.00 26.42 C ATOM 2474 CG TYR D 48 30.944 14.421 31.723 1.00 27.25 C ATOM 2475 CD1 TYR D 48 31.222 13.901 32.983 1.00 29.17 C ATOM 2476 CD2 TYR D 48 29.915 13.848 30.992 1.00 26.45 C ATOM 2477 CE1 TYR D 48 30.500 12.827 33.488 1.00 30.76 C ATOM 2478 CE2 TYR D 48 29.191 12.784 31.484 1.00 26.55 C ATOM 2479 CZ TYR D 48 29.486 12.272 32.723 1.00 28.49 C ATOM 2480 OH TYR D 48 28.759 11.207 33.208 1.00 29.87 O ATOM 2481 N VAL D 49 29.087 16.942 32.733 1.00 28.48 N ATOM 2482 CA VAL D 49 28.430 17.055 34.028 1.00 29.06 C ATOM 2483 C VAL D 49 27.666 15.774 34.284 1.00 30.39 C ATOM 2484 O VAL D 49 26.728 15.442 33.558 1.00 28.43 O ATOM 2485 CB VAL D 49 27.476 18.262 34.096 1.00 31.33 C ATOM 2486 CG1 VAL D 49 26.955 18.447 35.510 1.00 31.00 C ATOM 2487 CG2 VAL D 49 28.183 19.522 33.628 1.00 33.73 C ATOM 2488 N ALA D 50 28.091 15.037 35.302 1.00 29.36 N ATOM 2489 CA ALA D 50 27.459 13.771 35.629 1.00 28.36 C ATOM 2490 C ALA D 50 26.007 13.989 36.046 1.00 27.39 C ATOM 2491 O ALA D 50 25.692 14.986 36.694 1.00 27.74 O ATOM 2492 CB ALA D 50 28.236 13.069 36.737 1.00 25.43 C ATOM 2493 N ASP D 51 25.122 13.076 35.654 1.00 28.38 N ATOM 2494 CA ASP D 51 23.768 13.068 36.205 1.00 31.41 C ATOM 2495 C ASP D 51 23.841 12.688 37.684 1.00 34.17 C ATOM 2496 O ASP D 51 24.295 11.595 38.030 1.00 32.51 O ATOM 2497 CB ASP D 51 22.857 12.097 35.448 1.00 30.60 C ATOM 2498 CG ASP D 51 22.428 12.631 34.091 1.00 36.04 C ATOM 2499 OD1 ASP D 51 22.638 13.832 33.813 1.00 36.11 O ATOM 2500 OD2 ASP D 51 21.866 11.847 33.303 1.00 37.90 O1- ATOM 2501 N GLN D 52 23.394 13.589 38.551 1.00 33.61 N ATOM 2502 CA GLN D 52 23.586 13.425 39.992 1.00 36.65 C ATOM 2503 C GLN D 52 22.533 12.559 40.693 1.00 36.23 C ATOM 2504 O GLN D 52 22.686 12.231 41.869 1.00 35.27 O ATOM 2505 CB GLN D 52 23.640 14.802 40.654 1.00 34.67 C ATOM 2506 CG GLN D 52 24.865 15.629 40.277 1.00 36.10 C ATOM 2507 CD GLN D 52 26.151 15.117 40.918 1.00 37.28 C ATOM 2508 OE1 GLN D 52 26.118 14.386 41.908 1.00 34.63 O ATOM 2509 NE2 GLN D 52 27.290 15.504 40.352 1.00 37.64 N ATOM 2510 N HIS D 53 21.475 12.173 39.987 1.00 38.20 N ATOM 2511 CA HIS D 53 20.412 11.383 40.618 1.00 40.47 C ATOM 2512 C HIS D 53 20.215 10.026 39.952 1.00 39.09 C ATOM 2513 O HIS D 53 19.843 9.953 38.781 1.00 52.38 O ATOM 2514 CB HIS D 53 19.099 12.168 40.603 1.00 40.43 C ATOM 2515 CG HIS D 53 19.269 13.617 40.934 1.00 40.44 C ATOM 2516 ND1 HIS D 53 19.605 14.057 42.196 1.00 41.70 N ATOM 2517 CD2 HIS D 53 19.170 14.727 40.162 1.00 42.50 C ATOM 2518 CE1 HIS D 53 19.696 15.375 42.192 1.00 41.41 C ATOM 2519 NE2 HIS D 53 19.437 15.807 40.970 1.00 42.63 N ATOM 2520 N SER D 60 22.173 6.275 33.544 1.00 49.29 N ATOM 2521 CA SER D 60 23.617 6.218 33.342 1.00 46.96 C ATOM 2522 C SER D 60 24.143 7.461 32.625 1.00 47.41 C ATOM 2523 O SER D 60 23.418 8.122 31.878 1.00 45.13 O ATOM 2524 CB SER D 60 23.998 4.967 32.543 1.00 45.53 C ATOM 2525 N GLY D 61 25.412 7.773 32.858 1.00 40.60 N ATOM 2526 CA GLY D 61 26.069 8.840 32.135 1.00 34.00 C ATOM 2527 C GLY D 61 25.740 10.228 32.644 1.00 36.55 C ATOM 2528 O GLY D 61 25.500 10.447 33.831 1.00 33.05 O ATOM 2529 N GLY D 62 25.744 11.186 31.732 1.00 32.49 N ATOM 2530 CA GLY D 62 25.533 12.562 32.111 1.00 33.61 C ATOM 2531 C GLY D 62 25.322 13.409 30.883 1.00 30.01 C ATOM 2532 O GLY D 62 24.852 12.925 29.859 1.00 31.12 O ATOM 2533 N LYS D 63 25.666 14.683 30.990 1.00 28.43 N ATOM 2534 CA LYS D 63 25.415 15.612 29.909 1.00 30.55 C ATOM 2535 C LYS D 63 26.640 16.445 29.602 1.00 27.95 C ATOM 2536 O LYS D 63 27.346 16.891 30.498 1.00 27.46 O ATOM 2537 CB LYS D 63 24.223 16.514 30.253 1.00 29.44 C ATOM 2538 CG LYS D 63 22.946 15.722 30.457 1.00 35.76 C ATOM 2539 CD LYS D 63 21.705 16.581 30.492 1.00 42.10 C ATOM 2540 CE LYS D 63 20.481 15.698 30.686 1.00 40.43 C ATOM 2541 NZ LYS D 63 20.703 14.721 31.796 1.00 40.80 N ATOM 2542 N TYR D 64 26.891 16.641 28.317 1.00 24.02 N ATOM 2543 CA TYR D 64 27.939 17.545 27.889 1.00 23.99 C ATOM 2544 C TYR D 64 27.335 18.918 27.697 1.00 22.84 C ATOM 2545 O TYR D 64 26.306 19.071 27.039 1.00 28.34 O ATOM 2546 CB TYR D 64 28.608 17.036 26.604 1.00 25.13 C ATOM 2547 CG TYR D 64 29.540 15.887 26.891 1.00 25.46 C ATOM 2548 CD1 TYR D 64 30.901 16.099 27.078 1.00 25.37 C ATOM 2549 CD2 TYR D 64 29.052 14.595 27.018 1.00 23.58 C ATOM 2550 CE1 TYR D 64 31.754 15.046 27.362 1.00 25.73 C ATOM 2551 CE2 TYR D 64 29.889 13.543 27.305 1.00 28.41 C ATOM 2552 CZ TYR D 64 31.240 13.770 27.473 1.00 27.62 C ATOM 2553 OH TYR D 64 32.069 12.710 27.753 1.00 29.28 O ATOM 2554 N HIS D 65 27.960 19.904 28.320 1.00 26.36 N ATOM 2555 CA HIS D 65 27.564 21.287 28.179 1.00 26.27 C ATOM 2556 C HIS D 65 28.549 21.959 27.251 1.00 27.56 C ATOM 2557 O HIS D 65 29.725 22.113 27.584 1.00 29.14 O ATOM 2558 CB HIS D 65 27.531 21.997 29.536 1.00 26.17 C ATOM 2559 CG HIS D 65 26.446 21.515 30.450 1.00 29.53 C ATOM 2560 ND1 HIS D 65 25.545 22.370 31.051 1.00 29.85 N ATOM 2561 CD2 HIS D 65 26.129 20.271 30.881 1.00 30.85 C ATOM 2562 CE1 HIS D 65 24.719 21.671 31.810 1.00 34.55 C ATOM 2563 NE2 HIS D 65 25.049 20.395 31.723 1.00 30.57 N ATOM 2564 N ILE D 66 28.083 22.333 26.068 1.00 27.17 N ATOM 2565 CA ILE D 66 28.938 23.049 25.144 1.00 28.97 C ATOM 2566 C ILE D 66 28.487 24.500 25.093 1.00 28.85 C ATOM 2567 O ILE D 66 27.451 24.829 24.527 1.00 30.12 O ATOM 2568 CB ILE D 66 28.929 22.432 23.739 1.00 29.41 C ATOM 2569 CG1 ILE D 66 29.315 20.946 23.801 1.00 27.51 C ATOM 2570 CG2 ILE D 66 29.906 23.179 22.836 1.00 30.85 C ATOM 2571 CD1 ILE D 66 28.144 19.986 23.900 1.00 27.04 C ATOM 2572 N LYS D 67 29.277 25.362 25.715 1.00 27.53 N ATOM 2573 CA LYS D 67 28.967 26.776 25.784 1.00 28.64 C ATOM 2574 C LYS D 67 29.608 27.485 24.604 1.00 31.60 C ATOM 2575 O LYS D 67 30.825 27.463 24.460 1.00 31.11 O ATOM 2576 CB LYS D 67 29.463 27.362 27.114 1.00 29.59 C ATOM 2577 CG LYS D 67 29.251 28.860 27.264 1.00 33.17 C ATOM 2578 N ILE D 68 28.798 28.095 23.745 1.00 30.20 N ATOM 2579 CA ILE D 68 29.350 28.824 22.614 1.00 31.45 C ATOM 2580 C ILE D 68 29.200 30.322 22.828 1.00 33.35 C ATOM 2581 O ILE D 68 28.274 30.775 23.497 1.00 32.47 O ATOM 2582 CB ILE D 68 28.681 28.429 21.279 1.00 31.78 C ATOM 2583 CG1 ILE D 68 27.179 28.734 21.315 1.00 32.87 C ATOM 2584 CG2 ILE D 68 28.942 26.958 20.955 1.00 31.40 C ATOM 2585 CD1 ILE D 68 26.489 28.589 19.961 1.00 32.84 C ATOM 2586 N THR D 69 30.135 31.080 22.267 1.00 32.38 N ATOM 2587 CA THR D 69 30.097 32.534 22.312 1.00 31.36 C ATOM 2588 C THR D 69 30.348 33.081 20.913 1.00 34.42 C ATOM 2589 O THR D 69 31.322 32.695 20.265 1.00 35.81 O ATOM 2590 CB THR D 69 31.152 33.107 23.276 1.00 34.75 C ATOM 2591 OG1 THR D 69 30.945 32.568 24.585 1.00 34.23 O ATOM 2592 CG2 THR D 69 31.051 34.626 23.337 1.00 34.07 C ATOM 2593 N GLY D 70 29.463 33.955 20.442 1.00 30.06 N ATOM 2594 CA GLY D 70 29.650 34.595 19.149 1.00 30.25 C ATOM 2595 C GLY D 70 30.865 35.500 19.202 1.00 33.96 C ATOM 2596 O GLY D 70 30.941 36.393 20.048 1.00 32.74 O ATOM 2597 N THR D 71 31.825 35.264 18.312 1.00 32.52 N ATOM 2598 CA THR D 71 33.091 35.992 18.357 1.00 35.44 C ATOM 2599 C THR D 71 33.355 36.787 17.078 1.00 39.09 C ATOM 2600 O THR D 71 34.083 37.776 17.101 1.00 40.54 O ATOM 2601 CB THR D 71 34.271 35.041 18.610 1.00 34.30 C ATOM 2602 OG1 THR D 71 34.258 33.993 17.631 1.00 34.29 O ATOM 2603 CG2 THR D 71 34.161 34.431 20.003 1.00 35.29 C ATOM 2604 N GLN D 72 32.767 36.365 15.965 1.00 37.98 N ATOM 2605 CA GLN D 72 32.795 37.191 14.758 1.00 38.81 C ATOM 2606 C GLN D 72 31.423 37.252 14.101 1.00 38.36 C ATOM 2607 O GLN D 72 30.758 36.230 13.918 1.00 35.34 O ATOM 2608 CB GLN D 72 33.829 36.687 13.743 1.00 40.70 C ATOM 2609 CG GLN D 72 33.996 37.654 12.565 1.00 42.90 C ATOM 2610 CD GLN D 72 35.049 37.228 11.549 1.00 49.80 C ATOM 2611 OE1 GLN D 72 35.173 36.049 11.205 1.00 45.63 O ATOM 2612 NE2 GLN D 72 35.810 38.198 11.058 1.00 49.54 N ATOM 2613 N THR D 73 31.013 38.469 13.752 1.00 38.27 N ATOM 2614 CA THR D 73 29.761 38.712 13.054 1.00 34.89 C ATOM 2615 C THR D 73 29.766 37.988 11.712 1.00 37.44 C ATOM 2616 O THR D 73 30.779 37.976 11.016 1.00 36.78 O ATOM 2617 CB THR D 73 29.535 40.227 12.847 1.00 38.35 C ATOM 2618 OG1 THR D 73 29.433 40.870 14.125 1.00 41.56 O ATOM 2619 CG2 THR D 73 28.270 40.491 12.055 1.00 42.15 C ATOM 2620 N GLY D 74 28.644 37.368 11.364 1.00 33.09 N ATOM 2621 CA GLY D 74 28.553 36.616 10.127 1.00 33.70 C ATOM 2622 C GLY D 74 27.915 35.262 10.343 1.00 34.76 C ATOM 2623 O GLY D 74 27.484 34.942 11.453 1.00 35.87 O ATOM 2624 N GLU D 75 27.844 34.465 9.282 1.00 33.23 N ATOM 2625 CA GLU D 75 27.240 33.145 9.374 1.00 36.75 C ATOM 2626 C GLU D 75 28.254 32.154 9.923 1.00 37.08 C ATOM 2627 O GLU D 75 29.138 31.692 9.207 1.00 36.74 O ATOM 2628 CB GLU D 75 26.715 32.676 8.012 1.00 33.80 C ATOM 2629 N GLY D 76 28.118 31.839 11.206 1.00 37.40 N ATOM 2630 CA GLY D 76 28.990 30.881 11.854 1.00 35.89 C ATOM 2631 C GLY D 76 28.377 29.497 11.908 1.00 36.92 C ATOM 2632 O GLY D 76 27.272 29.269 11.417 1.00 33.89 O ATOM 2633 N LYS D 77 29.093 28.566 12.526 1.00 33.11 N ATOM 2634 CA LYS D 77 28.662 27.180 12.533 1.00 32.23 C ATOM 2635 C LYS D 77 29.431 26.410 13.590 1.00 32.27 C ATOM 2636 O LYS D 77 30.578 26.738 13.882 1.00 32.13 O ATOM 2637 CB LYS D 77 28.873 26.555 11.150 1.00 35.22 C ATOM 2638 CG LYS D 77 28.380 25.126 11.002 1.00 35.39 C ATOM 2639 CD LYS D 77 28.635 24.604 9.587 1.00 40.32 C ATOM 2640 N ILE D 78 28.798 25.407 14.184 1.00 33.92 N ATOM 2641 CA ILE D 78 29.534 24.483 15.031 1.00 31.12 C ATOM 2642 C ILE D 78 29.088 23.057 14.739 1.00 31.72 C ATOM 2643 O ILE D 78 27.895 22.774 14.556 1.00 29.46 O ATOM 2644 CB ILE D 78 29.385 24.824 16.542 1.00 34.75 C ATOM 2645 CG1 ILE D 78 30.347 23.972 17.376 1.00 31.96 C ATOM 2646 CG2 ILE D 78 27.949 24.667 17.014 1.00 34.33 C ATOM 2647 CD1 ILE D 78 30.535 24.467 18.795 1.00 33.42 C ATOM 2648 N VAL D 79 30.070 22.168 14.623 1.00 31.70 N ATOM 2649 CA VAL D 79 29.799 20.758 14.406 1.00 28.20 C ATOM 2650 C VAL D 79 30.439 19.976 15.537 1.00 32.86 C ATOM 2651 O VAL D 79 31.641 20.091 15.776 1.00 31.55 O ATOM 2652 CB VAL D 79 30.345 20.249 13.053 1.00 33.84 C ATOM 2653 CG1 VAL D 79 30.013 18.776 12.876 1.00 31.12 C ATOM 2654 CG2 VAL D 79 29.780 21.074 11.898 1.00 31.70 C ATOM 2655 N LEU D 80 29.621 19.201 16.235 1.00 28.50 N ATOM 2656 CA LEU D 80 30.084 18.364 17.328 1.00 29.01 C ATOM 2657 C LEU D 80 29.945 16.914 16.917 1.00 28.77 C ATOM 2658 O LEU D 80 29.008 16.549 16.208 1.00 27.54 O ATOM 2659 CB LEU D 80 29.278 18.626 18.602 1.00 27.05 C ATOM 2660 CG LEU D 80 29.104 20.081 19.041 1.00 28.36 C ATOM 2661 CD1 LEU D 80 28.189 20.157 20.256 1.00 29.46 C ATOM 2662 CD2 LEU D 80 30.451 20.699 19.352 1.00 30.10 C ATOM 2663 N VAL D 81 30.873 16.082 17.367 1.00 26.44 N ATOM 2664 CA VAL D 81 30.812 14.673 17.047 1.00 25.33 C ATOM 2665 C VAL D 81 30.979 13.823 18.313 1.00 27.86 C ATOM 2666 O VAL D 81 31.785 14.139 19.188 1.00 27.79 O ATOM 2667 CB VAL D 81 31.878 14.316 15.981 1.00 29.64 C ATOM 2668 CG1 VAL D 81 33.261 14.713 16.445 1.00 26.09 C ATOM 2669 CG2 VAL D 81 31.824 12.853 15.639 1.00 28.18 C ATOM 2670 N TYR D 82 30.173 12.771 18.418 1.00 26.55 N ATOM 2671 CA TYR D 82 30.242 11.844 19.540 1.00 27.76 C ATOM 2672 C TYR D 82 31.154 10.695 19.133 1.00 28.33 C ATOM 2673 O TYR D 82 30.717 9.766 18.447 1.00 28.51 O ATOM 2674 CB TYR D 82 28.841 11.342 19.907 1.00 24.30 C ATOM 2675 CG TYR D 82 28.732 10.563 21.203 1.00 25.69 C ATOM 2676 CD1 TYR D 82 28.938 11.185 22.432 1.00 25.14 C ATOM 2677 CD2 TYR D 82 28.377 9.220 21.197 1.00 23.41 C ATOM 2678 CE1 TYR D 82 28.820 10.481 23.620 1.00 25.63 C ATOM 2679 CE2 TYR D 82 28.253 8.505 22.376 1.00 26.05 C ATOM 2680 CZ TYR D 82 28.474 9.142 23.585 1.00 27.45 C ATOM 2681 OH TYR D 82 28.343 8.430 24.757 1.00 28.24 O ATOM 2682 N ARG D 83 32.421 10.767 19.531 1.00 23.04 N ATOM 2683 CA ARG D 83 33.406 9.818 19.025 1.00 27.11 C ATOM 2684 C ARG D 83 34.301 9.231 20.115 1.00 29.37 C ATOM 2685 O ARG D 83 34.337 9.718 21.247 1.00 23.32 O ATOM 2686 CB ARG D 83 34.279 10.481 17.955 1.00 28.12 C ATOM 2687 CG ARG D 83 35.217 11.545 18.492 1.00 29.51 C ATOM 2688 CD ARG D 83 36.278 11.918 17.460 1.00 38.13 C ATOM 2689 N ARG D 84 35.009 8.169 19.747 1.00 26.79 N ATOM 2690 CA ARG D 84 35.984 7.517 20.617 1.00 26.05 C ATOM 2691 C ARG D 84 37.258 7.316 19.821 1.00 26.58 C ATOM 2692 O ARG D 84 37.239 6.657 18.777 1.00 25.29 O ATOM 2693 CB ARG D 84 35.452 6.178 21.131 1.00 25.33 C ATOM 2694 CG ARG D 84 36.451 5.371 21.955 1.00 23.79 C ATOM 2695 CD ARG D 84 35.762 4.164 22.573 1.00 24.98 C ATOM 2696 NE ARG D 84 35.509 3.114 21.594 1.00 28.31 N ATOM 2697 CZ ARG D 84 34.682 2.094 21.794 1.00 28.21 C ATOM 2698 NH1 ARG D 84 34.015 1.992 22.939 1.00 28.25 N1+ ATOM 2699 NH2 ARG D 84 34.523 1.177 20.852 1.00 26.47 N ATOM 2700 N THR D 85 38.358 7.898 20.287 1.00 22.42 N ATOM 2701 CA THR D 85 39.611 7.787 19.551 1.00 25.88 C ATOM 2702 C THR D 85 39.997 6.313 19.421 1.00 25.49 C ATOM 2703 O THR D 85 39.914 5.559 20.388 1.00 23.04 O ATOM 2704 CB THR D 85 40.722 8.598 20.233 1.00 22.60 C ATOM 2705 OG1 THR D 85 40.290 9.955 20.356 1.00 27.18 O ATOM 2706 CG2 THR D 85 41.983 8.575 19.419 1.00 22.60 C ATOM 2707 N SER D 86 40.375 5.893 18.216 1.00 18.74 N ATOM 2708 CA SER D 86 40.673 4.481 17.963 1.00 19.45 C ATOM 2709 C SER D 86 42.129 4.160 18.269 1.00 19.99 C ATOM 2710 O SER D 86 42.966 5.059 18.297 1.00 17.68 O ATOM 2711 CB SER D 86 40.384 4.128 16.507 1.00 19.77 C ATOM 2712 OG SER D 86 41.319 4.792 15.680 1.00 19.39 O ATOM 2713 N PHE D 87 42.437 2.882 18.475 1.00 18.92 N ATOM 2714 CA PHE D 87 43.828 2.485 18.625 1.00 19.43 C ATOM 2715 C PHE D 87 44.677 2.994 17.454 1.00 18.01 C ATOM 2716 O PHE D 87 45.772 3.509 17.657 1.00 19.00 O ATOM 2717 CB PHE D 87 43.989 0.965 18.721 1.00 19.04 C ATOM 2718 CG PHE D 87 45.423 0.533 18.645 1.00 21.40 C ATOM 2719 CD1 PHE D 87 46.262 0.718 19.737 1.00 17.92 C ATOM 2720 CD2 PHE D 87 45.952 -0.005 17.468 1.00 21.20 C ATOM 2721 CE1 PHE D 87 47.600 0.377 19.673 1.00 20.83 C ATOM 2722 CE2 PHE D 87 47.292 -0.365 17.397 1.00 23.14 C ATOM 2723 CZ PHE D 87 48.120 -0.172 18.503 1.00 19.44 C ATOM 2724 N ALA D 88 44.167 2.829 16.231 1.00 19.92 N ATOM 2725 CA ALA D 88 44.909 3.256 15.046 1.00 21.14 C ATOM 2726 C ALA D 88 45.279 4.736 15.132 1.00 20.64 C ATOM 2727 O ALA D 88 46.408 5.115 14.817 1.00 22.97 O ATOM 2728 CB ALA D 88 44.100 2.966 13.772 1.00 20.38 C ATOM 2729 N GLU D 89 44.346 5.562 15.604 1.00 21.19 N ATOM 2730 CA GLU D 89 44.601 6.995 15.735 1.00 23.09 C ATOM 2731 C GLU D 89 45.699 7.304 16.766 1.00 23.63 C ATOM 2732 O GLU D 89 46.603 8.106 16.494 1.00 22.53 O ATOM 2733 CB GLU D 89 43.300 7.731 16.078 1.00 24.26 C ATOM 2734 CG GLU D 89 42.365 7.831 14.874 1.00 28.76 C ATOM 2735 CD GLU D 89 40.958 8.344 15.196 1.00 34.33 C ATOM 2736 OE1 GLU D 89 40.433 8.089 16.297 1.00 27.66 O ATOM 2737 OE2 GLU D 89 40.360 8.993 14.313 1.00 41.77 O1- ATOM 2738 N TYR D 90 45.636 6.662 17.934 1.00 23.45 N ATOM 2739 CA TYR D 90 46.692 6.808 18.930 1.00 20.75 C ATOM 2740 C TYR D 90 48.034 6.316 18.406 1.00 21.37 C ATOM 2741 O TYR D 90 49.056 6.972 18.591 1.00 22.54 O ATOM 2742 CB TYR D 90 46.355 6.036 20.208 1.00 22.48 C ATOM 2743 CG TYR D 90 45.262 6.639 21.047 1.00 19.27 C ATOM 2744 CD1 TYR D 90 45.413 7.893 21.617 1.00 23.82 C ATOM 2745 CD2 TYR D 90 44.089 5.941 21.293 1.00 18.88 C ATOM 2746 CE1 TYR D 90 44.418 8.446 22.420 1.00 24.63 C ATOM 2747 CE2 TYR D 90 43.086 6.481 22.094 1.00 20.98 C ATOM 2748 CZ TYR D 90 43.259 7.735 22.648 1.00 22.51 C ATOM 2749 OH TYR D 90 42.271 8.279 23.433 1.00 28.24 O ATOM 2750 N TRP D 91 48.031 5.153 17.760 1.00 21.30 N ATOM 2751 CA TRP D 91 49.281 4.568 17.301 1.00 22.40 C ATOM 2752 C TRP D 91 49.920 5.432 16.208 1.00 24.61 C ATOM 2753 O TRP D 91 51.143 5.594 16.171 1.00 24.52 O ATOM 2754 CB TRP D 91 49.071 3.136 16.797 1.00 19.69 C ATOM 2755 CG TRP D 91 50.379 2.437 16.627 1.00 21.98 C ATOM 2756 CD1 TRP D 91 51.067 2.251 15.461 1.00 24.69 C ATOM 2757 CD2 TRP D 91 51.193 1.885 17.664 1.00 23.82 C ATOM 2758 NE1 TRP D 91 52.248 1.596 15.706 1.00 23.38 N ATOM 2759 CE2 TRP D 91 52.349 1.358 17.052 1.00 22.68 C ATOM 2760 CE3 TRP D 91 51.047 1.765 19.056 1.00 22.15 C ATOM 2761 CZ2 TRP D 91 53.353 0.725 17.779 1.00 22.24 C ATOM 2762 CZ3 TRP D 91 52.046 1.144 19.772 1.00 18.67 C ATOM 2763 CH2 TRP D 91 53.187 0.634 19.136 1.00 20.35 C ATOM 2764 N ASN D 92 49.096 5.995 15.329 1.00 23.13 N ATOM 2765 CA ASN D 92 49.606 6.870 14.268 1.00 25.45 C ATOM 2766 C ASN D 92 50.383 8.056 14.840 1.00 27.25 C ATOM 2767 O ASN D 92 51.362 8.513 14.245 1.00 27.58 O ATOM 2768 CB ASN D 92 48.457 7.377 13.382 1.00 23.28 C ATOM 2769 CG ASN D 92 48.915 8.418 12.365 1.00 33.47 C ATOM 2770 OD1 ASN D 92 49.526 8.078 11.354 1.00 35.30 O ATOM 2771 ND2 ASN D 92 48.621 9.693 12.633 1.00 36.01 N ATOM 2772 N LEU D 93 49.960 8.529 16.009 1.00 26.25 N ATOM 2773 CA LEU D 93 50.550 9.720 16.618 1.00 26.64 C ATOM 2774 C LEU D 93 51.962 9.479 17.162 1.00 28.90 C ATOM 2775 O LEU D 93 52.648 10.425 17.546 1.00 29.67 O ATOM 2776 CB LEU D 93 49.653 10.248 17.742 1.00 30.74 C ATOM 2777 CG LEU D 93 48.310 10.886 17.377 1.00 29.94 C ATOM 2778 CD1 LEU D 93 47.500 11.170 18.636 1.00 29.76 C ATOM 2779 CD2 LEU D 93 48.517 12.164 16.565 1.00 30.11 C ATOM 2780 N LEU D 94 52.396 8.222 17.204 1.00 26.81 N ATOM 2781 CA LEU D 94 53.783 7.922 17.567 1.00 28.86 C ATOM 2782 C LEU D 94 54.738 8.370 16.469 1.00 29.17 C ATOM 2783 O LEU D 94 55.922 8.598 16.718 1.00 30.39 O ATOM 2784 CB LEU D 94 53.980 6.430 17.834 1.00 25.33 C ATOM 2785 CG LEU D 94 53.439 5.870 19.150 1.00 29.58 C ATOM 2786 CD1 LEU D 94 53.626 4.363 19.177 1.00 28.42 C ATOM 2787 CD2 LEU D 94 54.141 6.513 20.339 1.00 26.51 C ATOM 2788 N SER D 95 54.215 8.481 15.253 1.00 28.09 N ATOM 2789 CA SER D 95 54.994 8.933 14.099 1.00 30.87 C ATOM 2790 C SER D 95 54.415 10.231 13.553 1.00 33.20 C ATOM 2791 O SER D 95 53.512 10.204 12.720 1.00 33.01 O ATOM 2792 CB SER D 95 54.992 7.882 12.990 1.00 29.26 C ATOM 2793 OG SER D 95 54.959 6.573 13.513 1.00 30.09 O ATOM 2794 N PRO D 96 54.949 11.372 13.997 1.00 36.79 N ATOM 2795 CA PRO D 96 54.329 12.658 13.661 1.00 40.52 C ATOM 2796 C PRO D 96 54.526 13.043 12.197 1.00 34.99 C ATOM 2797 O PRO D 96 55.564 12.739 11.621 1.00 31.91 O ATOM 2798 CB PRO D 96 55.051 13.651 14.587 1.00 40.23 C ATOM 2799 CG PRO D 96 56.114 12.840 15.337 1.00 43.48 C ATOM 2800 CD PRO D 96 56.274 11.548 14.608 1.00 38.08 C ATOM 2801 N ASP D 97 53.536 13.700 11.607 1.00 39.01 N ATOM 2802 CA ASP D 97 53.644 14.158 10.224 1.00 37.10 C ATOM 2803 C ASP D 97 54.401 15.477 10.140 1.00 37.97 C ATOM 2804 O ASP D 97 54.413 16.242 11.099 1.00 37.70 O ATOM 2805 CB ASP D 97 52.261 14.330 9.602 1.00 37.21 C ATOM 2806 CG ASP D 97 51.504 13.022 9.460 1.00 39.31 C ATOM 2807 OD1 ASP D 97 52.135 11.987 9.146 1.00 39.01 O ATOM 2808 OD2 ASP D 97 50.268 13.044 9.646 1.00 41.20 O1- ATOM 2809 N ARG D 98 55.021 15.749 8.992 1.00 36.30 N ATOM 2810 CA ARG D 98 55.669 17.041 8.776 1.00 33.26 C ATOM 2811 C ARG D 98 54.630 18.142 8.936 1.00 34.23 C ATOM 2812 O ARG D 98 53.513 18.032 8.437 1.00 31.76 O ATOM 2813 CB ARG D 98 56.324 17.118 7.397 1.00 38.52 C ATOM 2814 CG ARG D 98 57.022 18.452 7.129 1.00 40.13 C ATOM 2815 CD ARG D 98 57.705 18.484 5.769 1.00 43.44 C ATOM 2816 NE ARG D 98 58.981 19.197 5.816 1.00 51.20 N ATOM 2817 CZ ARG D 98 59.199 20.403 5.299 1.00 50.47 C ATOM 2818 NH1 ARG D 98 60.402 20.952 5.401 1.00 56.49 N ATOM 2819 NH2 ARG D 98 58.228 21.060 4.678 1.00 47.98 N ATOM 2820 N THR D 99 54.996 19.198 9.649 1.00 35.16 N ATOM 2821 CA THR D 99 54.045 20.242 9.995 1.00 29.18 C ATOM 2822 C THR D 99 54.584 21.625 9.625 1.00 33.80 C ATOM 2823 O THR D 99 55.771 21.908 9.797 1.00 32.63 O ATOM 2824 CB THR D 99 53.709 20.172 11.507 1.00 36.23 C ATOM 2825 OG1 THR D 99 53.061 18.923 11.778 1.00 35.61 O ATOM 2826 CG2 THR D 99 52.795 21.296 11.931 1.00 32.55 C ATOM 2827 N PHE D 100 53.710 22.468 9.084 1.00 28.59 N ATOM 2828 CA PHE D 100 54.027 23.875 8.865 1.00 30.55 C ATOM 2829 C PHE D 100 53.087 24.737 9.699 1.00 32.74 C ATOM 2830 O PHE D 100 51.867 24.651 9.560 1.00 32.95 O ATOM 2831 CB PHE D 100 53.918 24.243 7.380 1.00 28.52 C ATOM 2832 CG PHE D 100 54.261 25.679 7.082 1.00 29.40 C ATOM 2833 CD1 PHE D 100 55.562 26.045 6.779 1.00 32.41 C ATOM 2834 CD2 PHE D 100 53.282 26.660 7.106 1.00 28.25 C ATOM 2835 CE1 PHE D 100 55.877 27.364 6.498 1.00 31.04 C ATOM 2836 CE2 PHE D 100 53.591 27.980 6.836 1.00 28.22 C ATOM 2837 CZ PHE D 100 54.888 28.331 6.530 1.00 30.30 C ATOM 2838 N THR D 101 53.658 25.570 10.563 1.00 33.39 N ATOM 2839 CA THR D 101 52.864 26.427 11.436 1.00 35.01 C ATOM 2840 C THR D 101 53.199 27.899 11.239 1.00 36.50 C ATOM 2841 O THR D 101 54.363 28.282 11.267 1.00 37.60 O ATOM 2842 CB THR D 101 53.079 26.070 12.912 1.00 38.26 C ATOM 2843 OG1 THR D 101 52.789 24.682 13.115 1.00 32.23 O ATOM 2844 CG2 THR D 101 52.183 26.919 13.803 1.00 37.13 C ATOM 2845 N LEU D 102 52.173 28.719 11.045 1.00 37.75 N ATOM 2846 CA LEU D 102 52.368 30.145 10.849 1.00 35.54 C ATOM 2847 C LEU D 102 51.390 30.946 11.693 1.00 38.40 C ATOM 2848 O LEU D 102 50.176 30.858 11.499 1.00 38.35 O ATOM 2849 CB LEU D 102 52.205 30.518 9.370 1.00 35.44 C ATOM 2850 CG LEU D 102 52.601 31.948 8.993 1.00 38.46 C ATOM 2851 CD1 LEU D 102 54.113 32.113 9.055 1.00 39.02 C ATOM 2852 CD2 LEU D 102 52.071 32.338 7.620 1.00 36.77 C ATOM 2853 N LYS D 103 51.917 31.723 12.635 1.00 42.02 N ATOM 2854 CA LYS D 103 51.090 32.649 13.402 1.00 40.53 C ATOM 2855 C LYS D 103 50.905 33.930 12.598 1.00 40.61 C ATOM 2856 O LYS D 103 51.852 34.433 11.991 1.00 41.33 O ATOM 2857 CB LYS D 103 51.717 32.949 14.765 1.00 40.70 C ATOM 2858 CG LYS D 103 51.801 31.749 15.689 1.00 41.51 C ATOM 2859 N VAL D 104 49.681 34.446 12.573 1.00 39.63 N ATOM 2860 CA VAL D 104 49.380 35.620 11.764 1.00 42.52 C ATOM 2861 C VAL D 104 48.619 36.671 12.567 1.00 46.74 C ATOM 2862 O VAL D 104 47.459 36.475 12.923 1.00 43.59 O ATOM 2863 CB VAL D 104 48.551 35.253 10.513 1.00 43.44 C ATOM 2864 CG1 VAL D 104 48.334 36.480 9.648 1.00 45.86 C ATOM 2865 CG2 VAL D 104 49.234 34.144 9.711 1.00 41.35 C ATOM 2866 N ASN D 105 49.280 37.786 12.857 1.00 47.20 N ATOM 2867 CA ASN D 105 48.613 38.902 13.514 1.00 49.01 C ATOM 2868 C ASN D 105 47.823 39.711 12.497 1.00 50.22 C ATOM 2869 O ASN D 105 48.401 40.339 11.607 1.00 52.09 O ATOM 2870 CB ASN D 105 49.626 39.792 14.231 1.00 49.37 C ATOM 2871 CG ASN D 105 50.283 39.096 15.405 1.00 50.23 C ATOM 2872 OD1 ASN D 105 49.626 38.391 16.173 1.00 50.96 O ATOM 2873 ND2 ASN D 105 51.591 39.283 15.546 1.00 53.67 N ATOM 2874 N VAL D 106 46.502 39.682 12.617 1.00 49.41 N ATOM 2875 CA VAL D 106 45.644 40.419 11.699 1.00 53.20 C ATOM 2876 C VAL D 106 45.306 41.796 12.268 1.00 56.06 C ATOM 2877 O VAL D 106 44.666 41.910 13.316 1.00 55.31 O ATOM 2878 CB VAL D 106 44.349 39.652 11.401 1.00 53.31 C ATOM 2879 CG1 VAL D 106 43.567 40.347 10.298 1.00 55.50 C ATOM 2880 CG2 VAL D 106 44.662 38.214 11.009 1.00 51.02 C ATOM 2881 N GLN D 107 45.745 42.838 11.567 1.00 57.58 N ATOM 2882 CA GLN D 107 45.561 44.210 12.023 1.00 59.73 C ATOM 2883 C GLN D 107 44.577 44.963 11.132 1.00 62.34 C ATOM 2884 O GLN D 107 43.451 45.250 11.540 1.00 65.86 O ATOM 2885 CB GLN D 107 46.906 44.942 12.063 1.00 61.38 C TER 2886 GLN D 107 HETATM 2887 CL CL A 201 25.645 -16.241 17.862 1.00 59.89 CL HETATM 2888 CL CL A 202 42.959 9.270 -4.013 1.00 54.56 CL HETATM 2889 S ASO4 B 201 56.145 9.888 28.158 0.46 33.76 S HETATM 2890 S BSO4 B 201 55.240 11.989 26.199 0.54 39.77 S HETATM 2891 O1 ASO4 B 201 56.165 10.540 26.847 0.46 34.25 O HETATM 2892 O1 BSO4 B 201 55.292 11.398 27.533 0.54 37.31 O HETATM 2893 O2 ASO4 B 201 56.351 8.458 28.012 0.46 28.98 O HETATM 2894 O2 BSO4 B 201 53.951 11.688 25.575 0.54 35.16 O HETATM 2895 O3 ASO4 B 201 57.220 10.432 28.988 0.46 41.61 O HETATM 2896 O3 BSO4 B 201 56.310 11.426 25.385 0.54 36.94 O HETATM 2897 O4 ASO4 B 201 54.863 10.125 28.819 0.46 37.68 O HETATM 2898 O4 BSO4 B 201 55.410 13.435 26.308 0.54 41.45 O HETATM 2899 CL CL B 202 68.003 -8.328 6.708 1.00 61.79 CL HETATM 2900 CL CL B 203 45.896 -0.666 12.745 1.00 55.49 CL HETATM 2901 CL CL B 204 56.131 6.715 31.686 1.00 65.99 CL HETATM 2902 CL CL B 205 41.498 8.525 28.431 1.00 52.28 CL HETATM 2903 S SO4 C 201 37.391 31.742 12.992 1.00 72.95 S HETATM 2904 O1 SO4 C 201 38.561 31.731 12.117 1.00 61.26 O HETATM 2905 O2 SO4 C 201 36.172 31.787 12.190 1.00 70.11 O HETATM 2906 O3 SO4 C 201 37.388 30.525 13.802 1.00 68.64 O HETATM 2907 O4 SO4 C 201 37.439 32.920 13.857 1.00 68.93 O HETATM 2908 CL CL D 201 16.256 26.151 10.991 1.00 62.77 CL HETATM 2909 C1 GOL D 202 33.790 41.298 12.948 1.00 49.89 C HETATM 2910 O1 GOL D 202 33.028 40.726 13.992 1.00 47.30 O HETATM 2911 C2 GOL D 202 35.278 41.114 13.236 1.00 54.43 C HETATM 2912 O2 GOL D 202 35.619 41.736 14.455 1.00 57.10 O HETATM 2913 C3 GOL D 202 36.106 41.723 12.111 1.00 57.12 C HETATM 2914 O3 GOL D 202 37.449 41.850 12.529 1.00 55.78 O HETATM 2915 O HOH A 301 37.553 -16.745 15.623 1.00 41.56 O HETATM 2916 O HOH A 302 49.638 -7.863 9.088 1.00 30.46 O HETATM 2917 O HOH A 303 26.291 -16.747 10.639 1.00 37.83 O HETATM 2918 O HOH A 304 47.350 -1.825 8.589 1.00 22.04 O HETATM 2919 O HOH A 305 29.029 -11.147 -3.454 1.00 35.29 O HETATM 2920 O HOH A 306 50.911 1.800 -3.784 1.00 37.57 O HETATM 2921 O HOH A 307 45.745 -12.181 0.153 1.00 31.13 O HETATM 2922 O HOH A 308 47.928 2.393 7.187 1.00 23.60 O HETATM 2923 O HOH A 309 48.262 3.736 -5.785 1.00 27.52 O HETATM 2924 O HOH A 310 38.988 -0.328 -7.131 1.00 31.51 O HETATM 2925 O HOH A 311 35.061 -2.563 -7.468 1.00 29.25 O HETATM 2926 O HOH A 312 32.592 -1.017 12.968 1.00 32.68 O HETATM 2927 O HOH A 313 49.288 -7.919 1.299 1.00 31.71 O HETATM 2928 O HOH A 314 28.845 -8.646 -4.394 1.00 40.51 O HETATM 2929 O HOH A 315 46.614 9.073 -0.820 1.00 33.34 O HETATM 2930 O HOH A 316 27.174 -19.165 7.617 1.00 34.13 O HETATM 2931 O HOH A 317 38.829 -2.961 12.213 1.00 21.66 O HETATM 2932 O HOH A 318 27.726 -13.496 -2.896 1.00 38.86 O HETATM 2933 O HOH A 319 44.472 -7.622 -6.351 1.00 33.91 O HETATM 2934 O HOH A 320 30.366 -9.011 -8.756 1.00 37.64 O HETATM 2935 O HOH A 321 18.544 -11.185 4.352 1.00 43.93 O HETATM 2936 O HOH A 322 50.893 -1.266 -1.934 1.00 34.31 O HETATM 2937 O HOH A 323 29.026 3.720 -3.105 1.00 38.73 O HETATM 2938 O HOH A 324 44.844 -9.845 -3.489 1.00 30.83 O HETATM 2939 O HOH A 325 25.530 -11.123 19.232 1.00 50.06 O HETATM 2940 O HOH A 326 25.096 -1.547 13.178 1.00 40.07 O HETATM 2941 O HOH A 327 28.383 6.293 -1.258 1.00 41.31 O HETATM 2942 O HOH A 328 44.056 -6.053 -8.371 1.00 32.46 O HETATM 2943 O HOH A 329 42.232 -16.320 5.260 1.00 44.46 O HETATM 2944 O HOH A 330 46.193 -10.893 -1.657 1.00 34.59 O HETATM 2945 O HOH A 331 39.334 2.036 -7.270 1.00 41.88 O HETATM 2946 O HOH A 332 50.403 3.058 8.572 1.00 43.02 O HETATM 2947 O HOH B 301 53.380 0.366 31.978 1.00 33.24 O HETATM 2948 O HOH B 302 57.887 -12.122 31.189 1.00 32.56 O HETATM 2949 O HOH B 303 59.514 -9.552 30.814 1.00 30.66 O HETATM 2950 O HOH B 304 41.831 -2.782 15.542 1.00 22.15 O HETATM 2951 O HOH B 305 55.409 3.204 10.897 1.00 25.13 O HETATM 2952 O HOH B 306 38.891 0.910 29.979 1.00 25.79 O HETATM 2953 O HOH B 307 60.158 -3.828 33.595 1.00 28.00 O HETATM 2954 O HOH B 308 39.867 0.169 17.130 1.00 22.66 O HETATM 2955 O HOH B 309 67.429 -8.893 14.033 1.00 34.69 O HETATM 2956 O HOH B 310 63.722 -8.380 21.896 1.00 31.72 O HETATM 2957 O HOH B 311 50.479 -0.665 11.966 1.00 25.99 O HETATM 2958 O HOH B 312 52.583 3.392 29.700 1.00 32.98 O HETATM 2959 O HOH B 313 67.584 -10.955 16.975 1.00 36.15 O HETATM 2960 O HOH B 314 52.061 -13.932 23.060 1.00 29.74 O HETATM 2961 O HOH B 315 41.677 -9.167 14.933 1.00 29.46 O HETATM 2962 O HOH B 316 46.973 -7.959 30.623 1.00 29.26 O HETATM 2963 O HOH B 317 53.813 -13.207 30.124 1.00 35.63 O HETATM 2964 O HOH B 318 71.149 0.862 19.690 1.00 31.89 O HETATM 2965 O HOH B 319 38.579 -4.380 25.851 1.00 33.78 O HETATM 2966 O HOH B 320 43.896 -0.905 32.316 1.00 36.82 O HETATM 2967 O HOH B 321 48.924 1.183 31.420 1.00 30.26 O HETATM 2968 O HOH B 322 47.715 -10.283 27.662 1.00 29.50 O HETATM 2969 O HOH B 323 62.656 -4.350 28.501 1.00 43.26 O HETATM 2970 O HOH B 324 62.795 5.055 10.026 1.00 34.13 O HETATM 2971 O HOH B 325 51.681 -14.621 18.786 1.00 41.99 O HETATM 2972 O HOH B 326 59.492 -7.244 5.772 1.00 44.08 O HETATM 2973 O HOH B 327 48.559 10.868 21.936 1.00 34.23 O HETATM 2974 O HOH B 328 46.461 -6.357 32.645 1.00 31.69 O HETATM 2975 O HOH B 329 45.667 -0.314 9.778 1.00 31.32 O HETATM 2976 O HOH B 330 47.657 3.109 31.904 1.00 38.26 O HETATM 2977 O HOH C 301 55.008 6.751 4.643 1.00 40.61 O HETATM 2978 O HOH C 302 33.741 6.259 13.340 1.00 40.34 O HETATM 2979 O HOH C 303 28.390 43.097 16.119 1.00 38.73 O HETATM 2980 O HOH C 304 45.574 28.474 -3.467 1.00 37.82 O HETATM 2981 O HOH C 305 24.586 16.974 12.546 1.00 35.37 O HETATM 2982 O HOH C 306 41.868 24.273 2.663 1.00 43.42 O HETATM 2983 O HOH C 307 42.425 12.073 1.910 1.00 43.82 O HETATM 2984 O HOH C 308 54.735 13.903 6.917 1.00 32.73 O HETATM 2985 O HOH C 309 47.613 16.985 -3.964 1.00 27.95 O HETATM 2986 O HOH C 310 38.238 8.387 10.068 1.00 33.39 O HETATM 2987 O HOH C 311 25.363 42.601 18.829 1.00 33.63 O HETATM 2988 O HOH C 312 35.921 8.463 14.558 1.00 30.98 O HETATM 2989 O HOH C 313 57.548 21.797 7.524 1.00 39.86 O HETATM 2990 O HOH C 314 45.860 7.242 1.209 1.00 22.84 O HETATM 2991 O HOH C 315 33.857 1.052 10.086 1.00 33.78 O HETATM 2992 O HOH C 316 60.495 32.454 2.466 1.00 32.76 O HETATM 2993 O HOH C 317 54.144 26.449 -8.749 1.00 39.89 O HETATM 2994 O HOH C 318 58.301 34.906 8.941 1.00 39.05 O HETATM 2995 O HOH C 319 41.204 11.327 -0.025 1.00 46.94 O HETATM 2996 O HOH C 320 55.299 24.094 -9.498 1.00 30.68 O HETATM 2997 O HOH C 321 35.626 5.893 3.595 1.00 27.63 O HETATM 2998 O HOH C 322 44.033 8.248 -0.930 1.00 36.71 O HETATM 2999 O HOH C 323 45.086 8.604 12.244 1.00 28.17 O HETATM 3000 O HOH C 324 34.417 7.320 17.091 1.00 27.40 O HETATM 3001 O HOH C 325 43.142 21.701 3.247 1.00 39.57 O HETATM 3002 O HOH C 326 50.206 10.859 7.217 1.00 32.16 O HETATM 3003 O HOH C 327 59.240 25.782 1.055 1.00 37.56 O HETATM 3004 O HOH C 328 45.441 11.087 1.497 1.00 35.17 O HETATM 3005 O HOH C 329 35.642 7.849 11.928 1.00 39.61 O HETATM 3006 O HOH C 330 58.886 23.285 1.065 1.00 31.30 O HETATM 3007 O HOH C 331 45.683 2.188 8.727 1.00 24.97 O HETATM 3008 O HOH C 332 24.239 11.974 13.520 1.00 37.48 O HETATM 3009 O HOH C 333 49.539 20.758 -11.648 1.00 35.90 O HETATM 3010 O HOH C 334 58.767 35.369 14.228 1.00 43.31 O HETATM 3011 O HOH C 335 47.857 12.316 -3.305 1.00 32.71 O HETATM 3012 O HOH C 336 34.869 -0.888 11.440 1.00 25.75 O HETATM 3013 O HOH C 337 44.348 6.002 11.844 1.00 34.60 O HETATM 3014 O HOH C 338 39.277 1.389 11.461 1.00 36.26 O HETATM 3015 O HOH C 339 46.545 3.922 10.940 1.00 27.52 O HETATM 3016 O HOH C 340 37.080 36.675 14.711 1.00 48.31 O HETATM 3017 O HOH C 341 46.568 10.068 -3.251 1.00 37.76 O HETATM 3018 O HOH C 342 46.677 14.291 -3.354 1.00 37.29 O HETATM 3019 O HOH C 343 60.898 22.230 0.571 1.00 43.52 O HETATM 3020 O HOH C 344 38.093 -0.426 12.680 1.00 34.25 O HETATM 3021 O HOH D 301 54.099 11.644 8.014 1.00 38.28 O HETATM 3022 O HOH D 302 34.679 33.806 11.192 1.00 45.15 O HETATM 3023 O HOH D 303 40.010 7.950 12.266 1.00 36.49 O HETATM 3024 O HOH D 304 53.141 5.230 14.169 1.00 27.22 O HETATM 3025 O HOH D 305 34.767 29.188 15.720 1.00 42.39 O HETATM 3026 O HOH D 306 34.337 13.345 28.400 1.00 30.83 O HETATM 3027 O HOH D 307 34.351 27.445 18.338 1.00 40.73 O HETATM 3028 O HOH D 308 36.185 11.259 21.983 1.00 38.89 O HETATM 3029 O HOH D 309 41.027 7.079 25.306 1.00 35.77 O HETATM 3030 O HOH D 310 22.676 10.141 43.355 1.00 38.47 O HETATM 3031 O HOH D 311 36.445 10.068 24.233 1.00 37.77 O HETATM 3032 O HOH D 312 34.876 16.446 25.184 1.00 31.65 O HETATM 3033 O HOH D 313 36.464 14.578 25.066 1.00 37.38 O HETATM 3034 O HOH D 314 29.978 34.146 12.479 1.00 35.28 O HETATM 3035 O HOH D 315 55.182 23.575 12.741 1.00 37.76 O HETATM 3036 O HOH D 316 37.447 7.128 16.155 1.00 33.18 O HETATM 3037 O HOH D 317 39.751 5.425 23.056 1.00 21.76 O HETATM 3038 O HOH D 318 21.739 29.081 26.689 1.00 42.70 O HETATM 3039 O HOH D 319 46.395 9.878 14.492 1.00 30.12 O HETATM 3040 O HOH D 320 49.542 8.395 20.857 1.00 29.94 O HETATM 3041 O HOH D 321 24.075 16.106 34.247 1.00 29.44 O HETATM 3042 O HOH D 322 30.867 24.308 28.739 1.00 34.53 O HETATM 3043 O HOH D 323 28.666 8.144 17.603 1.00 29.18 O HETATM 3044 O HOH D 324 20.259 16.900 26.156 1.00 37.72 O HETATM 3045 O HOH D 325 35.746 34.584 15.338 1.00 44.24 O HETATM 3046 O HOH D 326 37.971 10.464 14.399 1.00 42.31 O HETATM 3047 O HOH D 327 36.712 3.893 18.824 1.00 31.14 O HETATM 3048 O HOH D 328 35.478 8.860 27.689 1.00 30.93 O HETATM 3049 O HOH D 329 23.065 12.649 22.598 1.00 38.09 O HETATM 3050 O HOH D 330 23.563 18.596 33.408 1.00 34.47 O HETATM 3051 O HOH D 331 36.155 19.787 21.851 1.00 33.76 O HETATM 3052 O HOH D 332 17.836 32.139 17.717 1.00 29.66 O HETATM 3053 O HOH D 333 35.918 1.703 18.343 1.00 38.37 O HETATM 3054 O HOH D 334 37.941 11.706 20.354 1.00 37.59 O HETATM 3055 O HOH D 335 57.616 19.088 10.970 1.00 37.22 O HETATM 3056 O HOH D 336 36.697 23.063 26.564 1.00 38.39 O HETATM 3057 O HOH D 337 48.073 3.446 12.983 1.00 30.73 O HETATM 3058 O HOH D 338 38.389 6.979 25.038 1.00 32.82 O HETATM 3059 O HOH D 339 37.225 28.112 21.381 1.00 37.34 O HETATM 3060 O HOH D 340 41.729 1.113 15.416 1.00 21.66 O HETATM 3061 O HOH D 341 38.334 9.042 23.177 1.00 29.91 O HETATM 3062 O HOH D 342 53.164 2.761 12.692 1.00 22.57 O HETATM 3063 O HOH D 343 41.674 5.811 12.462 1.00 35.53 O HETATM 3064 O HOH D 344 41.838 11.727 23.195 1.00 44.92 O HETATM 3065 O HOH D 345 40.426 2.151 13.299 1.00 30.33 O HETATM 3066 O HOH D 346 24.498 9.647 22.397 1.00 45.29 O HETATM 3067 O HOH D 347 37.569 7.910 27.788 1.00 34.45 O HETATM 3068 O HOH D 348 57.907 17.202 2.477 1.00 43.95 O HETATM 3069 O HOH D 349 43.366 -0.876 14.742 1.00 28.86 O HETATM 3070 O HOH D 350 44.945 11.849 14.944 1.00 42.65 O HETATM 3071 O HOH D 351 51.066 2.002 11.435 1.00 31.60 O CONECT 2889 2891 2893 2895 2897 CONECT 2890 2892 2894 2896 2898 CONECT 2891 2889 CONECT 2892 2890 CONECT 2893 2889 CONECT 2894 2890 CONECT 2895 2889 CONECT 2896 2890 CONECT 2897 2889 CONECT 2898 2890 CONECT 2903 2904 2905 2906 2907 CONECT 2904 2903 CONECT 2905 2903 CONECT 2906 2903 CONECT 2907 2903 CONECT 2909 2910 2911 CONECT 2910 2909 CONECT 2911 2909 2912 2913 CONECT 2912 2911 CONECT 2913 2911 2914 CONECT 2914 2913 MASTER 495 0 10 14 23 0 12 6 3024 4 21 42 END
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Related entries of code: 5swk
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3eqs
RCSB PDB
PDBbind
12aa, >3EQS_2|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5swk
Complex Type
Protein-Protein
PDBbind Subset
general set
Protein Name
EhICP1-p53 chimeras
Ligand Name
human MDM2
EC.Number
E.C.-.-.-.-
Resolution
1.92(Å)
Affinity (Kd/Ki/IC50)
Kd=2.57uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) Proteins Vol. 86: pp. 802-812
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q00987
Entrez Gene ID
NCBI Entrez Gene ID:
4193
ASD
Information of known allosteric effects of PDB entries
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