USER MOD reduce.3.24.130724 H: found=0, std=0, add=2446, rem=0, adj=65 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER TRANSCRIPTION 25-JUN-06 2HFP TITLE CRYSTAL STRUCTURE OF PPAR GAMMA WITH N-SULFONYL-2-INDOLE TITLE 2 CARBOXAMIDE LIGANDS COMPND MOL_ID: 1; COMPND 2 MOLECULE: PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR GAMMA; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: LIGAND BINDING DOMAIN (RESIDUES 234-505); COMPND 5 SYNONYM: PPAR-GAMMA; COMPND 6 ENGINEERED: YES; COMPND 7 MOL_ID: 2; COMPND 8 MOLECULE: SRC PEPTIDE FRAGMENT; COMPND 9 CHAIN: B; COMPND 0 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: PPARG, NR1C3; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 0 EXPRESSION_SYSTEM_PLASMID: PDEST 17; SOURCE 1 MOL_ID: 2; SOURCE 2 SYNTHETIC: YES; SOURCE 3 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. KEYWDS PPAR PPARGAMMA LBD, TRANSCRIPTION EXPDTA X-RAY DIFFRACTION AUTHOR M.E.POKROSS,A.G.EVDOKIMOV,R.L.WALTER,M.J.MEKEL,C.R.HOPKINS REVDAT 3 24-FEB-09 2HFP 1 VERSN REVDAT 2 17-OCT-06 2HFP 1 JRNL REVDAT 1 19-SEP-06 2HFP 0 JRNL AUTH C.R.HOPKINS,S.V.O'NEIL,M.C.LAUFERSWEILER,Y.WANG, JRNL AUTH 2 M.POKROSS,M.MEKEL,A.EVDOKIMOV,R.WALTER, JRNL AUTH 3 M.KONTOYIANNI,M.E.PETREY,G.SABATAKOS,J.T.ROESGEN, JRNL AUTH 4 E.RICHARDSON,T.P.DEMUTH JR. JRNL TITL DESIGN AND SYNTHESIS OF NOVEL N-SULFONYL-2-INDOLE JRNL TITL 2 CARBOXAMIDES AS POTENT PPAR-GAMMA BINDING AGENTS JRNL TITL 3 WITH POTENTIAL APPLICATION TO THE TREATMENT OF JRNL TITL 4 OSTEOPOROSIS. JRNL REF BIOORG.MED.CHEM.LETT. V. 16 5659 2006 JRNL REFN ISSN 0960-894X JRNL PMID 16919947 JRNL DOI 10.1016/J.BMCL.2006.08.003 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 2.00 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.2.0019 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.00 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 39.80 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 93.5 REMARK 3 NUMBER OF REFLECTIONS : 19404 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING + TEST SET) : 0.209 REMARK 3 R VALUE (WORKING SET) : 0.205 REMARK 3 FREE R VALUE : 0.285 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.200 REMARK 3 FREE R VALUE TEST SET COUNT : 1005 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.00 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.05 REMARK 3 REFLECTION IN BIN (WORKING SET) : 951 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 65.59 REMARK 3 BIN R VALUE (WORKING SET) : 0.2110 REMARK 3 BIN FREE R VALUE SET COUNT : 42 REMARK 3 BIN FREE R VALUE : 0.3570 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2326 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 80 REMARK 3 SOLVENT ATOMS : 122 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 25.70 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 32.00 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 1.61000 REMARK 3 B22 (A**2) : -0.52000 REMARK 3 B33 (A**2) : -1.09000 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.235 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.220 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.150 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 5.270 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.944 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.891 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2455 ; 0.017 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 3319 ; 1.808 ; 2.030 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 287 ;13.646 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 105 ;35.379 ;25.143 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 463 ;18.238 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 10 ;16.531 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 372 ; 0.438 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 1787 ; 0.007 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 1176 ; 0.280 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): 1736 ; 0.327 ; 0.200 REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 123 ; 0.344 ; 0.200 REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): 51 ; 0.425 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 13 ; 0.147 ; 0.200 REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 1480 ; 2.638 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 2343 ; 3.741 ; 2.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 1083 ; 5.873 ; 3.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 976 ; 8.618 ; 4.500 REMARK 3 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 NCS RESTRAINTS STATISTICS REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.40 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE REMARK 3 RIDING POSITIONS REMARK 4 REMARK 4 2HFP COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 28-JUN-06. REMARK 100 THE RCSB ID CODE IS RCSB038294. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 01-JAN-05 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : NULL REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 22-ID REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.0 REMARK 200 MONOCHROMATOR : SI REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARRESEARCH REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 19433 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.000 REMARK 200 RESOLUTION RANGE LOW (A) : 39.821 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 93.4 REMARK 200 DATA REDUNDANCY : 0.930 REMARK 200 R MERGE (I) : 0.04270 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 16.8300 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.00 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.10 REMARK 200 COMPLETENESS FOR SHELL (%) : 72.8 REMARK 200 DATA REDUNDANCY IN SHELL : 0.73 REMARK 200 R MERGE FOR SHELL (I) : 0.33420 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 3.480 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: AMORE REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 41.67 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.11 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: TWO MICROLITERS OF PROTEIN SOLUTION REMARK 280 (10 MG/ML, 1 PEPTIDE FRAGMENT) WAS ADDED TO TWO MICROLITERS OF REMARK 280 WELL (2% PEG400, 1.6 MOLAR AMMONIUM SULFATE, 100 MM MES 6.5) REMARK 280 AND HUNG OVER 1000 MICROLITERS WELL IN A 2 + 2 HANGING DROP REMARK 280 CRYSTALLIZATION SETUP , TEMPERATURE 298.0K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X+1/2,-Y,Z+1/2 REMARK 290 3555 -X,Y+1/2,-Z+1/2 REMARK 290 4555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 23.24350 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 41.03750 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 38.58900 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 41.03750 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 23.24350 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 38.58900 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 3690 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 13870 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -5.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B 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 MET A 196 REMARK 465 SER A 197 REMARK 465 TYR A 198 REMARK 465 TYR A 199 REMARK 465 HIS A 200 REMARK 465 HIS A 201 REMARK 465 HIS A 202 REMARK 465 HIS A 203 REMARK 465 HIS A 204 REMARK 465 HIS A 205 REMARK 465 HIS B 597 REMARK 465 SER B 598 REMARK 465 SER B 599 REMARK 465 LEU B 600 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 NZ LYS A 275 O HOH A 39 1.82 REMARK 500 ND2 ASN A 402 O HOH A 111 1.95 REMARK 500 NE2 GLN A 273 O HOH A 70 2.06 REMARK 500 O HOH A 104 O HOH A 107 2.14 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. REMARK 500 REMARK 500 DISTANCE CUTOFF: REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE REMARK 500 CE1 TYR A 477 O HOH A 21 4555 1.80 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 ARG A 234 NE - CZ - NH1 ANGL. DEV. = 3.2 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 GLU A 207 110.44 154.57 REMARK 500 LYS A 240 -117.51 119.19 REMARK 500 THR A 241 -115.57 -44.99 REMARK 500 THR A 242 -74.98 -118.66 REMARK 500 ASP A 243 84.09 20.49 REMARK 500 SER A 245 115.09 108.04 REMARK 500 GLU A 272 42.20 37.19 REMARK 500 GLN A 273 -38.52 -25.96 REMARK 500 ASN A 335 -169.32 -120.13 REMARK 500 LYS A 358 -78.01 70.33 REMARK 500 GLU A 460 69.08 -105.23 REMARK 500 ASP A 462 -31.82 90.00 REMARK 500 ASP A 475 42.79 -107.01 REMARK 500 GLU B 602 -142.63 68.97 REMARK 500 ARG B 603 -42.07 100.85 REMARK 500 SER B 615 120.01 133.80 REMARK 500 PRO B 616 150.15 -46.61 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: NON-CIS, NON-TRANS REMARK 500 REMARK 500 THE FOLLOWING PEPTIDE BONDS DEVIATE SIGNIFICANTLY FROM BOTH REMARK 500 CIS AND TRANS CONFORMATION. CIS BONDS, IF ANY, ARE LISTED REMARK 500 ON CISPEP RECORDS. TRANS IS DEFINED AS 180 +/- 30 AND REMARK 500 CIS IS DEFINED AS 0 +/- 30 DEGREES. REMARK 500 MODEL OMEGA REMARK 500 PRO A 206 GLU A 207 -67.05 REMARK 500 LYS A 240 THR A 241 -93.37 REMARK 500 THR A 242 ASP A 243 109.49 REMARK 500 ASP A 243 LYS A 244 -139.88 REMARK 500 LYS A 244 SER A 245 129.68 REMARK 500 ARG A 357 LYS A 358 126.11 REMARK 500 GLU B 613 GLY B 614 -148.26 REMARK 500 GLY B 614 SER B 615 -134.94 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 NSI A 478 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NSI A 479 DBREF 2HFP A 206 477 UNP Q86U60 PPARG_HUMAN 234 505 DBREF 2HFP B 597 617 UNP Q2T9G5 Q2T9G5_HUMAN 680 700 SEQADV 2HFP MET A 196 UNP Q86U60 CLONING ARTIFACT SEQADV 2HFP SER A 197 UNP Q86U60 CLONING ARTIFACT SEQADV 2HFP TYR A 198 UNP Q86U60 CLONING ARTIFACT SEQADV 2HFP TYR A 199 UNP Q86U60 CLONING ARTIFACT SEQADV 2HFP HIS A 200 UNP Q86U60 CLONING ARTIFACT SEQADV 2HFP HIS A 201 UNP Q86U60 CLONING ARTIFACT SEQADV 2HFP HIS A 202 UNP Q86U60 CLONING ARTIFACT SEQADV 2HFP HIS A 203 UNP Q86U60 CLONING ARTIFACT SEQADV 2HFP HIS A 204 UNP Q86U60 CLONING ARTIFACT SEQADV 2HFP HIS A 205 UNP Q86U60 CLONING ARTIFACT SEQRES 1 A 282 MET SER TYR TYR HIS HIS HIS HIS HIS HIS PRO GLU SER SEQRES 2 A 282 ALA ASP LEU ARG ALA LEU ALA LYS HIS LEU TYR ASP SER SEQRES 3 A 282 TYR ILE LYS SER PHE PRO LEU THR LYS ALA LYS ALA ARG SEQRES 4 A 282 ALA ILE LEU THR GLY LYS THR THR ASP LYS SER PRO PHE SEQRES 5 A 282 VAL ILE TYR ASP MET ASN SER LEU MET MET GLY GLU ASP SEQRES 6 A 282 LYS ILE LYS PHE LYS HIS ILE THR PRO LEU GLN GLU GLN SEQRES 7 A 282 SER LYS GLU VAL ALA ILE ARG ILE PHE GLN GLY CYS GLN SEQRES 8 A 282 PHE ARG SER VAL GLU ALA VAL GLN GLU ILE THR GLU TYR SEQRES 9 A 282 ALA LYS SER ILE PRO GLY PHE VAL ASN LEU ASP LEU ASN SEQRES 10 A 282 ASP GLN VAL THR LEU LEU LYS TYR GLY VAL HIS GLU ILE SEQRES 11 A 282 ILE TYR THR MET LEU ALA SER LEU MET ASN LYS ASP GLY SEQRES 12 A 282 VAL LEU ILE SER GLU GLY GLN GLY PHE MET THR ARG GLU SEQRES 13 A 282 PHE LEU LYS SER LEU ARG LYS PRO PHE GLY ASP PHE MET SEQRES 14 A 282 GLU PRO LYS PHE GLU PHE ALA VAL LYS PHE ASN ALA LEU SEQRES 15 A 282 GLU LEU ASP ASP SER ASP LEU ALA ILE PHE ILE ALA VAL SEQRES 16 A 282 ILE ILE LEU SER GLY ASP ARG PRO GLY LEU LEU ASN VAL SEQRES 17 A 282 LYS PRO ILE GLU ASP ILE GLN ASP ASN LEU LEU GLN ALA SEQRES 18 A 282 LEU GLU LEU GLN LEU LYS LEU ASN HIS PRO GLU SER SER SEQRES 19 A 282 GLN LEU PHE ALA LYS LEU LEU GLN LYS MET THR ASP LEU SEQRES 20 A 282 ARG GLN ILE VAL THR GLU HIS VAL GLN LEU LEU GLN VAL SEQRES 21 A 282 ILE LYS LYS THR GLU THR ASP MET SER LEU HIS PRO LEU SEQRES 22 A 282 LEU GLN GLU ILE TYR LYS ASP LEU TYR SEQRES 1 B 21 HIS SER SER LEU THR GLU ARG HIS LYS ILE LEU HIS ARG SEQRES 2 B 21 LEU LEU GLN GLU GLY SER PRO SER HET NSI A 478 40 HET NSI A 479 40 HETNAM NSI 3-(4-METHOXYPHENYL)-N-(PHENYLSULFONYL)-1-[3- HETNAM 2 NSI (TRIFLUOROMETHYL)BENZYL]-1H-INDOLE-2-CARBOXAMIDE FORMUL 3 NSI 2(C30 H23 F3 N2 O4 S) FORMUL 5 HOH *122(H2 O) HELIX 1 1 GLU A 207 PHE A 226 1 20 HELIX 2 2 THR A 229 GLY A 239 1 11 HELIX 3 3 ASP A 251 LYS A 263 1 13 HELIX 4 4 PHE A 264 HIS A 266 5 3 HELIX 5 5 ILE A 267 GLU A 272 5 6 HELIX 6 6 GLU A 276 SER A 302 1 27 HELIX 7 7 GLY A 305 LEU A 309 5 5 HELIX 8 8 ASP A 310 LEU A 333 1 24 HELIX 9 9 ARG A 350 SER A 355 1 6 HELIX 10 10 PRO A 359 PHE A 363 5 5 HELIX 11 11 MET A 364 ALA A 376 1 13 HELIX 12 12 ASP A 380 LEU A 393 1 14 HELIX 13 13 ASN A 402 HIS A 425 1 24 HELIX 14 14 GLN A 430 GLU A 460 1 31 HELIX 15 15 HIS A 466 LYS A 474 1 9 HELIX 16 16 HIS B 604 GLN B 612 1 9 SHEET 1 A 4 PHE A 247 ILE A 249 0 SHEET 2 A 4 GLY A 346 THR A 349 1 O PHE A 347 N ILE A 249 SHEET 3 A 4 GLY A 338 ILE A 341 -1 N VAL A 339 O MET A 348 SHEET 4 A 4 MET A 334 ASN A 335 -1 N ASN A 335 O GLY A 338 CISPEP 1 GLU B 602 ARG B 603 0 -14.32 SITE *** AC1 15 HOH A 56 HOH A 128 GLU A 259 LYS A 265 SITE *** AC1 15 HIS A 266 ILE A 281 GLY A 284 CYS A 285 SITE *** AC1 15 ARG A 288 ALA A 292 ILE A 326 LEU A 330 SITE *** AC1 15 ILE A 341 SER A 342 NSI A 479 SITE *** AC2 14 ALA A 278 CYS A 285 GLN A 286 HIS A 323 SITE *** AC2 14 TYR A 327 PHE A 360 PHE A 363 LYS A 367 SITE *** AC2 14 HIS A 449 LEU A 452 LEU A 453 LEU A 469 SITE *** AC2 14 TYR A 473 NSI A 478 CRYST1 46.487 77.178 82.075 90.00 90.00 90.00 P 21 21 21 4 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 0.021511 0.000000 0.000000 0.00000 SCALE2 0.000000 0.012957 0.000000 0.00000 SCALE3 0.000000 0.000000 0.012184 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 608 HIS : no HD1:sc= -3.92! C(o=-19!,f=-21!) USER MOD Set 1.2: B 612 GLN : amide:sc= -15.2! C(o=-19!,f=-15!) USER MOD Set 2.1: A 319 LYS NZ :NH3+ 148:sc= 1.73 (180deg=-0.767) USER MOD Set 2.2: B 604 HIS : no HE2:sc= 0.779 K(o=2.5,f=-7.8!) USER MOD Set 3.1: A 323 HIS : no HD1:sc= 1.51 K(o=5.1,f=-4.1!) USER MOD Set 3.2: A 449 HIS : no HE2:sc= 1.83 K(o=5.1,f=-7.8!) USER MOD Set 3.3: A 473 TYR OH : rot -33:sc= 1.8 USER MOD Set 4.1: A 429 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 430 GLN : amide:sc= -0.236 X(o=-0.24,f=-0.24) USER MOD Set 5.1: A 342 SER OG : rot -51:sc= 0.529 USER MOD Set 5.2: A 345 GLN : amide:sc= -0.939 K(o=-0.41,f=0.54) USER MOD Set 6.1: A 221 SER OG : rot 73:sc= 0.141 USER MOD Set 6.2: A 302 SER OG : rot -44:sc= 1.38 USER MOD Single : A 208 SER OG : rot 180:sc= 0 USER MOD Single : A 216 LYS NZ :NH3+ 168:sc= 1.26 (180deg=0.879) USER MOD Single : A 217 HIS : no HD1:sc= 0.997 K(o=1,f=-3.3!) USER MOD Single : A 219 TYR OH : rot 180:sc= 0.427 USER MOD Single : A 222 TYR OH : rot 140:sc= 2.18 USER MOD Single : A 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 225 SER OG : rot 80:sc= 1.14 USER MOD Single : A 229 THR OG1 : rot 180:sc= -1.93! USER MOD Single : A 230 LYS NZ :NH3+ 154:sc= 2.45 (180deg=1.7) USER MOD Single : A 232 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 238 THR OG1 : rot 180:sc= 0 USER MOD Single : A 240 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 241 THR OG1 : rot -76:sc= -2.16! USER MOD Single : A 242 THR OG1 : rot 180:sc= 0 USER MOD Single : A 244 LYS NZ :NH3+ 160:sc= -0.0224 (180deg=-0.504) USER MOD Single : A 245 SER OG : rot 180:sc= 0 USER MOD Single : A 250 TYR OH : rot 30:sc= 0.981 USER MOD Single : A 252 MET CE :methyl -110:sc= -4.3! (180deg=-8.57!) USER MOD Single : A 253 ASN : amide:sc= 0.0782 X(o=0.078,f=0.32) USER MOD Single : A 254 SER OG : rot -76:sc= 1.97 USER MOD Single : A 256 MET CE :methyl -127:sc= -0.0606 (180deg=-0.334) USER MOD Single : A 257 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 261 LYS NZ :NH3+ 151:sc= 1.33 (180deg=0.435) USER MOD Single : A 263 LYS NZ :NH3+ -177:sc= 0.538 (180deg=0.498) USER MOD Single : A 265 LYS NZ :NH3+ -138:sc= 0.684 (180deg=-1.32) USER MOD Single : A 266 HIS : no HD1:sc= -0.0151 X(o=-0.015,f=-0.18) USER MOD Single : A 268 THR OG1 : rot 117:sc= 0.00738 USER MOD Single : A 271 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 273 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 274 SER OG : rot 180:sc= 0.0043 USER MOD Single : A 275 LYS NZ :NH3+ -170:sc= 0.0588 (180deg=0.0508) USER MOD Single : A 283 GLN : amide:sc= -2.6! K(o=-2.6!,f=0.00077) USER MOD Single : A 285 CYS SG : rot 72:sc= -0.493 USER MOD Single : A 286 GLN : amide:sc= -0.25! C(o=-0.25!,f=-9.3!) USER MOD Single : A 289 SER OG : rot 77:sc= 0.0998 USER MOD Single : A 294 GLN : amide:sc= 0.961 K(o=0.96,f=0.16) USER MOD Single : A 297 THR OG1 : rot 79:sc= 0.988 USER MOD Single : A 299 TYR OH : rot 163:sc= 1.37 USER MOD Single : A 301 LYS NZ :NH3+ -166:sc= 0.232 (180deg=0.172) USER MOD Single : A 308 ASN : amide:sc=-0.000865 X(o=-0.00086,f=0) USER MOD Single : A 312 ASN : amide:sc= -1.14 K(o=-1.1,f=-0.022) USER MOD Single : A 314 GLN : amide:sc= 0.155 X(o=0.15,f=-0.18) USER MOD Single : A 316 THR OG1 : rot 147:sc= 1.26 USER MOD Single : A 320 TYR OH : rot 47:sc= 0.0755 USER MOD Single : A 327 TYR OH : rot 150:sc= -0.0115 USER MOD Single : A 328 THR OG1 : rot -43:sc= 1.14 USER MOD Single : A 329 MET CE :methyl -170:sc= -1.43 (180deg=-1.72) USER MOD Single : A 332 SER OG : rot -14:sc= 2.45 USER MOD Single : A 334 MET CE :methyl 150:sc= -26.1! (180deg=-31.9!) USER MOD Single : A 335 ASN : amide:sc= -0.56 K(o=-0.56,f=-5.3!) USER MOD Single : A 336 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 348 MET CE :methyl -168:sc=-0.00446 (180deg=-0.148) USER MOD Single : A 349 THR OG1 : rot 180:sc= 0.00202 USER MOD Single : A 354 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 355 SER OG : rot -39:sc= 1.03 USER MOD Single : A 358 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 364 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 367 LYS NZ :NH3+ -140:sc= -3.57! (180deg=-4.89!) USER MOD Single : A 373 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 375 ASN : amide:sc= 1.39 K(o=1.4,f=-1.6!) USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 394 SER OG : rot 75:sc= 2.09 USER MOD Single : A 402 ASN : amide:sc= 0.702 X(o=0.7,f=0.32) USER MOD Single : A 404 LYS NZ :NH3+ -150:sc= -0.763 (180deg=-1.75!) USER MOD Single : A 410 GLN : amide:sc= 0.629 X(o=0.63,f=0.37) USER MOD Single : A 412 ASN : amide:sc= -1.48! K(o=-1.5!,f=-0.022) USER MOD Single : A 415 GLN : amide:sc= -2.62! C(o=-2.6!,f=-4.6!) USER MOD Single : A 420 GLN : amide:sc= 0.429 K(o=0.43,f=-6!) USER MOD Single : A 422 LYS NZ :NH3+ 143:sc= 1.59 (180deg=1.33) USER MOD Single : A 424 ASN : amide:sc= 1.02 K(o=1,f=-0.4) USER MOD Single : A 425 HIS : no HD1:sc= 2.22 K(o=2.5,f=-9!) USER MOD Single : A 428 SER OG : rot -71:sc= 0.678 USER MOD Single : A 434 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 437 GLN : amide:sc= 0.47 K(o=0.47,f=-0.9) USER MOD Single : A 438 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 439 MET CE :methyl 177:sc= -1.28 (180deg=-1.33) USER MOD Single : A 440 THR OG1 : rot 180:sc= 0 USER MOD Single : A 444 GLN : amide:sc= -0.983 K(o=-0.98,f=-0.29) USER MOD Single : A 447 THR OG1 : rot 86:sc= 0.147 USER MOD Single : A 451 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 454 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 457 LYS NZ :NH3+ 153:sc= 0.293 (180deg=-0.519) USER MOD Single : A 458 LYS NZ :NH3+ 164:sc= -0.0168 (180deg=-0.626) USER MOD Single : A 459 THR OG1 : rot 180:sc= 0 USER MOD Single : A 461 THR OG1 : rot 180:sc= 0 USER MOD Single : A 463 MET CE :methyl 180:sc= -10.9! (180deg=-10.9!) USER MOD Single : A 464 SER OG : rot 180:sc= 0 USER MOD Single : A 466 HIS : no HD1:sc= 0.111 K(o=0.11,f=-8.7!) USER MOD Single : A 470 GLN : amide:sc= -1.44! K(o=-1.4!,f=1.1) USER MOD Single : A 474 LYS NZ :NH3+ -168:sc= -2.37! (180deg=-2.99!) USER MOD Single : A 477 TYR OH : rot 180:sc= 0 USER MOD Single : B 601 THR OG1 : rot 180:sc= 0 USER MOD Single : B 605 LYS NZ :NH3+ -110:sc= 0.0388 (180deg=0) USER MOD Single : B 615 SER OG : rot 88:sc= 0.251 USER MOD Single : B 617 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 206 1.575 18.395 22.186 1.00 62.03 N ATOM 2 CA PRO A 206 0.681 17.523 22.924 1.00 61.35 C ATOM 3 C PRO A 206 1.347 17.210 24.257 1.00 60.41 C ATOM 4 O PRO A 206 2.037 18.082 24.805 1.00 63.67 O ATOM 5 CB PRO A 206 0.619 16.271 22.027 1.00 60.19 C ATOM 6 CG PRO A 206 1.789 16.392 21.063 1.00 60.20 C ATOM 7 CD PRO A 206 2.563 17.608 21.434 1.00 61.71 C ATOM 0 HA PRO A 206 -0.199 17.885 23.111 1.00 61.35 H new ATOM 0 HB2 PRO A 206 0.686 15.461 22.556 1.00 60.19 H new ATOM 0 HB3 PRO A 206 -0.223 16.228 21.548 1.00 60.19 H new ATOM 0 HG2 PRO A 206 2.352 15.603 21.111 1.00 60.20 H new ATOM 0 HG3 PRO A 206 1.471 16.458 20.149 1.00 60.20 H new ATOM 0 HD2 PRO A 206 3.339 17.392 21.974 1.00 61.71 H new ATOM 0 HD3 PRO A 206 2.885 18.084 20.652 1.00 61.71 H new ATOM 8 N GLU A 207 1.167 15.999 24.790 1.00 57.82 N ATOM 9 CA GLU A 207 -0.115 15.481 25.297 1.00 54.01 C ATOM 10 C GLU A 207 -0.199 13.945 25.269 1.00 51.00 C ATOM 11 O GLU A 207 -0.277 13.328 24.189 1.00 47.69 O ATOM 12 CB GLU A 207 -1.323 16.157 24.640 1.00 55.18 C ATOM 13 CG GLU A 207 -1.717 15.590 23.311 1.00 54.51 C ATOM 14 CD GLU A 207 -3.084 14.983 23.358 1.00 63.53 C ATOM 15 OE1 GLU A 207 -3.458 14.438 24.429 1.00 62.55 O ATOM 16 OE2 GLU A 207 -3.787 15.054 22.324 1.00 65.82 O ATOM 0 H GLU A 207 1.810 15.434 24.871 1.00 57.82 H new ATOM 0 HA GLU A 207 -0.148 15.725 26.235 1.00 54.01 H new ATOM 0 HB2 GLU A 207 -2.081 16.092 25.242 1.00 55.18 H new ATOM 0 HB3 GLU A 207 -1.129 17.101 24.530 1.00 55.18 H new ATOM 0 HG2 GLU A 207 -1.695 16.290 22.640 1.00 54.51 H new ATOM 0 HG3 GLU A 207 -1.072 14.918 23.041 1.00 54.51 H new ATOM 17 N SER A 208 -0.189 13.346 26.467 1.00 45.93 N ATOM 18 CA SER A 208 0.161 11.933 26.647 1.00 43.40 C ATOM 19 C SER A 208 -0.555 10.882 25.778 1.00 41.42 C ATOM 20 O SER A 208 0.103 9.959 25.256 1.00 39.28 O ATOM 21 CB SER A 208 0.053 11.532 28.102 1.00 43.12 C ATOM 22 OG SER A 208 0.888 10.423 28.371 1.00 46.77 O ATOM 0 H SER A 208 -0.386 13.751 27.199 1.00 45.93 H new ATOM 0 HA SER A 208 1.075 11.914 26.323 1.00 43.40 H new ATOM 0 HB2 SER A 208 0.304 12.278 28.669 1.00 43.12 H new ATOM 0 HB3 SER A 208 -0.867 11.311 28.315 1.00 43.12 H new ATOM 0 HG SER A 208 0.820 10.211 29.181 1.00 46.77 H new ATOM 23 N ALA A 209 -1.883 10.982 25.651 1.00 38.85 N ATOM 24 CA ALA A 209 -2.661 9.874 25.047 1.00 36.38 C ATOM 25 C ALA A 209 -2.415 9.821 23.551 1.00 35.77 C ATOM 26 O ALA A 209 -2.468 8.756 22.934 1.00 35.53 O ATOM 27 CB ALA A 209 -4.118 10.021 25.328 1.00 36.72 C ATOM 0 H ALA A 209 -2.348 11.661 25.899 1.00 38.85 H new ATOM 0 HA ALA A 209 -2.363 9.042 25.447 1.00 36.38 H new ATOM 0 HB1 ALA A 209 -4.602 9.285 24.922 1.00 36.72 H new ATOM 0 HB2 ALA A 209 -4.265 10.015 26.287 1.00 36.72 H new ATOM 0 HB3 ALA A 209 -4.436 10.859 24.958 1.00 36.72 H new ATOM 28 N ASP A 210 -2.173 10.995 22.971 1.00 35.04 N ATOM 29 CA ASP A 210 -1.855 11.111 21.562 1.00 33.36 C ATOM 30 C ASP A 210 -0.437 10.713 21.205 1.00 29.56 C ATOM 31 O ASP A 210 -0.225 10.070 20.210 1.00 30.17 O ATOM 32 CB ASP A 210 -2.138 12.516 21.056 1.00 33.64 C ATOM 33 CG ASP A 210 -3.639 12.765 20.868 1.00 45.85 C ATOM 34 OD1 ASP A 210 -4.453 11.906 21.300 1.00 52.78 O ATOM 35 OD2 ASP A 210 -4.002 13.814 20.293 1.00 57.35 O ATOM 0 H ASP A 210 -2.190 11.746 23.390 1.00 35.04 H new ATOM 0 HA ASP A 210 -2.436 10.473 21.119 1.00 33.36 H new ATOM 0 HB2 ASP A 210 -1.779 13.163 21.683 1.00 33.64 H new ATOM 0 HB3 ASP A 210 -1.680 12.654 20.212 1.00 33.64 H new ATOM 36 N LEU A 211 0.536 11.100 22.008 1.00 27.98 N ATOM 37 CA LEU A 211 1.898 10.594 21.845 1.00 25.97 C ATOM 38 C LEU A 211 2.016 9.104 22.076 1.00 23.38 C ATOM 39 O LEU A 211 2.887 8.427 21.511 1.00 23.74 O ATOM 40 CB LEU A 211 2.812 11.289 22.841 1.00 26.47 C ATOM 41 CG LEU A 211 2.964 12.780 22.655 1.00 25.30 C ATOM 42 CD1 LEU A 211 3.974 13.288 23.704 1.00 21.35 C ATOM 43 CD2 LEU A 211 3.333 13.130 21.220 1.00 26.98 C ATOM 0 H LEU A 211 0.435 11.656 22.657 1.00 27.98 H new ATOM 0 HA LEU A 211 2.150 10.776 20.926 1.00 25.97 H new ATOM 0 HB2 LEU A 211 2.475 11.123 23.735 1.00 26.47 H new ATOM 0 HB3 LEU A 211 3.691 10.881 22.789 1.00 26.47 H new ATOM 0 HG LEU A 211 2.119 13.234 22.803 1.00 25.30 H new ATOM 0 HD11 LEU A 211 4.089 14.246 23.605 1.00 21.35 H new ATOM 0 HD12 LEU A 211 3.642 13.093 24.594 1.00 21.35 H new ATOM 0 HD13 LEU A 211 4.827 12.845 23.573 1.00 21.35 H new ATOM 0 HD21 LEU A 211 3.423 14.092 21.134 1.00 26.98 H new ATOM 0 HD22 LEU A 211 4.174 12.705 20.989 1.00 26.98 H new ATOM 0 HD23 LEU A 211 2.638 12.816 20.621 1.00 26.98 H new ATOM 44 N ARG A 212 1.173 8.576 22.935 1.00 23.31 N ATOM 45 CA ARG A 212 1.127 7.148 23.160 1.00 24.88 C ATOM 46 C ARG A 212 0.417 6.423 22.010 1.00 26.08 C ATOM 47 O ARG A 212 0.786 5.343 21.652 1.00 23.07 O ATOM 48 CB ARG A 212 0.383 6.850 24.473 1.00 29.59 C ATOM 49 CG ARG A 212 1.188 7.208 25.713 1.00 30.63 C ATOM 50 CD ARG A 212 2.045 6.022 26.094 1.00 41.17 C ATOM 51 NE ARG A 212 3.323 6.197 25.423 1.00 50.32 N ATOM 52 CZ ARG A 212 4.211 5.240 25.155 1.00 47.57 C ATOM 53 NH1 ARG A 212 3.986 3.965 25.498 1.00 45.70 N ATOM 54 NH2 ARG A 212 5.341 5.589 24.551 1.00 24.41 N ATOM 0 H ARG A 212 0.613 9.030 23.403 1.00 23.31 H new ATOM 0 HA ARG A 212 2.041 6.827 23.212 1.00 24.88 H new ATOM 0 HB2 ARG A 212 -0.452 7.343 24.484 1.00 29.59 H new ATOM 0 HB3 ARG A 212 0.156 5.907 24.503 1.00 29.59 H new ATOM 0 HG2 ARG A 212 1.745 7.983 25.540 1.00 30.63 H new ATOM 0 HG3 ARG A 212 0.594 7.442 26.443 1.00 30.63 H new ATOM 0 HD2 ARG A 212 2.164 5.978 27.056 1.00 41.17 H new ATOM 0 HD3 ARG A 212 1.624 5.191 25.822 1.00 41.17 H new ATOM 0 HE ARG A 212 3.525 6.995 25.175 1.00 50.32 H new ATOM 0 HH11 ARG A 212 3.257 3.750 25.900 1.00 45.70 H new ATOM 0 HH12 ARG A 212 4.571 3.361 25.317 1.00 45.70 H new ATOM 0 HH21 ARG A 212 5.482 6.412 24.345 1.00 24.41 H new ATOM 0 HH22 ARG A 212 5.932 4.992 24.366 1.00 24.41 H new ATOM 55 N ALA A 213 -0.653 7.011 21.491 1.00 27.68 N ATOM 56 CA ALA A 213 -1.315 6.482 20.307 1.00 24.77 C ATOM 57 C ALA A 213 -0.424 6.594 19.074 1.00 22.71 C ATOM 58 O ALA A 213 -0.451 5.730 18.245 1.00 26.32 O ATOM 59 CB ALA A 213 -2.662 7.200 20.056 1.00 24.19 C ATOM 0 H ALA A 213 -1.014 7.723 21.812 1.00 27.68 H new ATOM 0 HA ALA A 213 -1.490 5.542 20.471 1.00 24.77 H new ATOM 0 HB1 ALA A 213 -3.083 6.831 19.264 1.00 24.19 H new ATOM 0 HB2 ALA A 213 -3.245 7.072 20.821 1.00 24.19 H new ATOM 0 HB3 ALA A 213 -2.504 8.148 19.926 1.00 24.19 H new ATOM 60 N LEU A 214 0.378 7.643 18.951 1.00 25.08 N ATOM 61 CA LEU A 214 1.405 7.667 17.885 1.00 24.77 C ATOM 62 C LEU A 214 2.381 6.504 18.019 1.00 23.45 C ATOM 63 O LEU A 214 2.752 5.861 17.026 1.00 26.81 O ATOM 64 CB LEU A 214 2.242 8.947 17.972 1.00 23.79 C ATOM 65 CG LEU A 214 2.745 9.618 16.689 1.00 29.69 C ATOM 66 CD1 LEU A 214 3.953 10.496 16.833 1.00 31.66 C ATOM 67 CD2 LEU A 214 2.727 8.817 15.412 1.00 25.04 C ATOM 0 H LEU A 214 0.356 8.340 19.454 1.00 25.08 H new ATOM 0 HA LEU A 214 0.925 7.612 17.044 1.00 24.77 H new ATOM 0 HB2 LEU A 214 1.716 9.604 18.455 1.00 23.79 H new ATOM 0 HB3 LEU A 214 3.019 8.748 18.518 1.00 23.79 H new ATOM 0 HG LEU A 214 2.004 10.229 16.552 1.00 29.69 H new ATOM 0 HD11 LEU A 214 4.187 10.869 15.969 1.00 31.66 H new ATOM 0 HD12 LEU A 214 3.758 11.216 17.453 1.00 31.66 H new ATOM 0 HD13 LEU A 214 4.696 9.972 17.170 1.00 31.66 H new ATOM 0 HD21 LEU A 214 3.069 9.360 14.685 1.00 25.04 H new ATOM 0 HD22 LEU A 214 3.283 8.029 15.516 1.00 25.04 H new ATOM 0 HD23 LEU A 214 1.817 8.546 15.212 1.00 25.04 H new ATOM 68 N ALA A 215 2.872 6.274 19.228 1.00 20.03 N ATOM 69 CA ALA A 215 3.942 5.291 19.415 1.00 17.22 C ATOM 70 C ALA A 215 3.404 3.917 19.043 1.00 20.29 C ATOM 71 O ALA A 215 4.087 3.063 18.455 1.00 21.15 O ATOM 72 CB ALA A 215 4.381 5.321 20.835 1.00 20.20 C ATOM 0 H ALA A 215 2.608 6.667 19.946 1.00 20.03 H new ATOM 0 HA ALA A 215 4.704 5.496 18.851 1.00 17.22 H new ATOM 0 HB1 ALA A 215 5.090 4.673 20.968 1.00 20.20 H new ATOM 0 HB2 ALA A 215 4.708 6.207 21.054 1.00 20.20 H new ATOM 0 HB3 ALA A 215 3.631 5.103 21.410 1.00 20.20 H new ATOM 73 N LYS A 216 2.153 3.737 19.391 1.00 21.02 N ATOM 74 CA LYS A 216 1.441 2.515 19.132 1.00 24.16 C ATOM 75 C LYS A 216 1.103 2.267 17.682 1.00 23.23 C ATOM 76 O LYS A 216 1.172 1.119 17.203 1.00 25.42 O ATOM 77 CB LYS A 216 0.131 2.552 19.880 1.00 20.07 C ATOM 78 CG LYS A 216 -0.299 1.158 20.363 1.00 34.26 C ATOM 79 CD LYS A 216 -1.353 0.569 19.528 1.00 38.55 C ATOM 80 CE LYS A 216 -1.397 -0.959 19.780 1.00 53.06 C ATOM 81 NZ LYS A 216 -2.187 -1.725 18.734 1.00 55.28 N ATOM 0 H LYS A 216 1.683 4.335 19.793 1.00 21.02 H new ATOM 0 HA LYS A 216 2.038 1.805 19.417 1.00 24.16 H new ATOM 0 HB2 LYS A 216 0.212 3.146 20.642 1.00 20.07 H new ATOM 0 HB3 LYS A 216 -0.558 2.920 19.305 1.00 20.07 H new ATOM 0 HG2 LYS A 216 0.472 0.569 20.367 1.00 34.26 H new ATOM 0 HG3 LYS A 216 -0.614 1.220 21.278 1.00 34.26 H new ATOM 0 HD2 LYS A 216 -2.211 0.969 19.739 1.00 38.55 H new ATOM 0 HD3 LYS A 216 -1.179 0.750 18.591 1.00 38.55 H new ATOM 0 HE2 LYS A 216 -0.490 -1.301 19.804 1.00 53.06 H new ATOM 0 HE3 LYS A 216 -1.786 -1.124 20.653 1.00 53.06 H new ATOM 0 HZ1 LYS A 216 -2.036 -2.597 18.827 1.00 55.28 H new ATOM 0 HZ2 LYS A 216 -3.056 -1.562 18.840 1.00 55.28 H new ATOM 0 HZ3 LYS A 216 -1.934 -1.465 17.921 1.00 55.28 H new ATOM 82 N HIS A 217 0.676 3.320 17.006 1.00 22.87 N ATOM 83 CA HIS A 217 0.471 3.257 15.566 1.00 27.01 C ATOM 84 C HIS A 217 1.752 2.827 14.860 1.00 25.26 C ATOM 85 O HIS A 217 1.727 1.925 14.025 1.00 25.73 O ATOM 86 CB HIS A 217 -0.011 4.601 15.014 1.00 26.58 C ATOM 87 CG HIS A 217 -0.050 4.643 13.517 1.00 35.31 C ATOM 88 ND1 HIS A 217 -1.120 4.168 12.785 1.00 34.18 N ATOM 89 CD2 HIS A 217 0.864 5.069 12.612 1.00 38.47 C ATOM 90 CE1 HIS A 217 -0.865 4.308 11.497 1.00 37.17 C ATOM 91 NE2 HIS A 217 0.333 4.849 11.365 1.00 35.50 N ATOM 0 H HIS A 217 0.498 4.083 17.361 1.00 22.87 H new ATOM 0 HA HIS A 217 -0.218 2.596 15.395 1.00 27.01 H new ATOM 0 HB2 HIS A 217 -0.898 4.787 15.360 1.00 26.58 H new ATOM 0 HB3 HIS A 217 0.573 5.305 15.337 1.00 26.58 H new ATOM 0 HD2 HIS A 217 1.695 5.441 12.800 1.00 38.47 H new ATOM 0 HE1 HIS A 217 -1.432 4.067 10.801 1.00 37.17 H new ATOM 0 HE2 HIS A 217 0.718 5.034 10.619 1.00 35.50 H new ATOM 92 N LEU A 218 2.857 3.487 15.211 1.00 21.02 N ATOM 93 CA LEU A 218 4.146 3.245 14.625 1.00 22.59 C ATOM 94 C LEU A 218 4.658 1.826 14.878 1.00 24.06 C ATOM 95 O LEU A 218 5.213 1.195 13.990 1.00 27.65 O ATOM 96 CB LEU A 218 5.126 4.268 15.172 1.00 21.64 C ATOM 97 CG LEU A 218 4.929 5.718 14.696 1.00 28.10 C ATOM 98 CD1 LEU A 218 5.948 6.661 15.462 1.00 20.03 C ATOM 99 CD2 LEU A 218 5.167 5.802 13.186 1.00 24.56 C ATOM 0 H LEU A 218 2.864 4.101 15.813 1.00 21.02 H new ATOM 0 HA LEU A 218 4.061 3.333 13.663 1.00 22.59 H new ATOM 0 HB2 LEU A 218 5.072 4.255 16.140 1.00 21.64 H new ATOM 0 HB3 LEU A 218 6.024 3.988 14.934 1.00 21.64 H new ATOM 0 HG LEU A 218 4.022 6.005 14.886 1.00 28.10 H new ATOM 0 HD11 LEU A 218 5.828 7.577 15.165 1.00 20.03 H new ATOM 0 HD12 LEU A 218 5.784 6.607 16.417 1.00 20.03 H new ATOM 0 HD13 LEU A 218 6.856 6.377 15.273 1.00 20.03 H new ATOM 0 HD21 LEU A 218 5.042 6.717 12.889 1.00 24.56 H new ATOM 0 HD22 LEU A 218 6.072 5.518 12.985 1.00 24.56 H new ATOM 0 HD23 LEU A 218 4.538 5.225 12.726 1.00 24.56 H new ATOM 100 N TYR A 219 4.501 1.323 16.093 1.00 21.80 N ATOM 101 CA TYR A 219 4.935 -0.054 16.417 1.00 23.35 C ATOM 102 C TYR A 219 4.131 -1.089 15.599 1.00 25.35 C ATOM 103 O TYR A 219 4.686 -2.002 14.995 1.00 23.10 O ATOM 104 CB TYR A 219 4.794 -0.320 17.931 1.00 25.19 C ATOM 105 CG TYR A 219 4.929 -1.771 18.316 1.00 25.63 C ATOM 106 CD1 TYR A 219 6.183 -2.358 18.430 1.00 26.83 C ATOM 107 CD2 TYR A 219 3.794 -2.585 18.470 1.00 30.93 C ATOM 108 CE1 TYR A 219 6.324 -3.700 18.731 1.00 28.26 C ATOM 109 CE2 TYR A 219 3.911 -3.947 18.770 1.00 30.57 C ATOM 110 CZ TYR A 219 5.187 -4.490 18.918 1.00 35.88 C ATOM 111 OH TYR A 219 5.350 -5.831 19.228 1.00 32.58 O ATOM 0 H TYR A 219 4.148 1.751 16.750 1.00 21.80 H new ATOM 0 HA TYR A 219 5.870 -0.145 16.177 1.00 23.35 H new ATOM 0 HB2 TYR A 219 5.467 0.194 18.404 1.00 25.19 H new ATOM 0 HB3 TYR A 219 3.929 0.004 18.227 1.00 25.19 H new ATOM 0 HD1 TYR A 219 6.943 -1.838 18.301 1.00 26.83 H new ATOM 0 HD2 TYR A 219 2.948 -2.211 18.371 1.00 30.93 H new ATOM 0 HE1 TYR A 219 7.172 -4.075 18.809 1.00 28.26 H new ATOM 0 HE2 TYR A 219 3.154 -4.478 18.869 1.00 30.57 H new ATOM 0 HH TYR A 219 4.597 -6.192 19.315 1.00 32.58 H new ATOM 112 N ASP A 220 2.817 -0.942 15.599 1.00 24.93 N ATOM 113 CA ASP A 220 1.951 -1.777 14.765 1.00 29.01 C ATOM 114 C ASP A 220 2.318 -1.789 13.284 1.00 26.78 C ATOM 115 O ASP A 220 2.200 -2.827 12.635 1.00 27.46 O ATOM 116 CB ASP A 220 0.515 -1.306 14.870 1.00 24.26 C ATOM 117 CG ASP A 220 -0.192 -1.808 16.116 1.00 36.14 C ATOM 118 OD1 ASP A 220 0.417 -2.457 17.030 1.00 31.66 O ATOM 119 OD2 ASP A 220 -1.416 -1.537 16.156 1.00 42.07 O ATOM 0 H ASP A 220 2.399 -0.362 16.076 1.00 24.93 H new ATOM 0 HA ASP A 220 2.070 -2.677 15.107 1.00 29.01 H new ATOM 0 HB2 ASP A 220 0.498 -0.336 14.865 1.00 24.26 H new ATOM 0 HB3 ASP A 220 0.026 -1.602 14.087 1.00 24.26 H new ATOM 120 N SER A 221 2.666 -0.622 12.724 1.00 28.62 N ATOM 121 CA SER A 221 3.198 -0.531 11.340 1.00 24.93 C ATOM 122 C SER A 221 4.556 -1.133 11.163 1.00 26.24 C ATOM 123 O SER A 221 4.860 -1.704 10.113 1.00 23.39 O ATOM 124 CB SER A 221 3.325 0.915 10.888 1.00 24.09 C ATOM 125 OG SER A 221 2.090 1.551 10.977 1.00 33.18 O ATOM 0 H SER A 221 2.604 0.136 13.126 1.00 28.62 H new ATOM 0 HA SER A 221 2.552 -1.028 10.814 1.00 24.93 H new ATOM 0 HB2 SER A 221 3.976 1.378 11.438 1.00 24.09 H new ATOM 0 HB3 SER A 221 3.650 0.949 9.975 1.00 24.09 H new ATOM 0 HG SER A 221 1.906 1.694 11.784 1.00 33.18 H new ATOM 126 N TYR A 222 5.421 -0.932 12.162 1.00 23.35 N ATOM 127 CA TYR A 222 6.753 -1.488 12.132 1.00 19.61 C ATOM 128 C TYR A 222 6.680 -3.000 12.094 1.00 23.01 C ATOM 129 O TYR A 222 7.411 -3.653 11.354 1.00 24.60 O ATOM 130 CB TYR A 222 7.497 -1.015 13.364 1.00 18.68 C ATOM 131 CG TYR A 222 8.796 -1.678 13.717 1.00 24.32 C ATOM 132 CD1 TYR A 222 10.009 -1.036 13.441 1.00 29.81 C ATOM 133 CD2 TYR A 222 8.832 -2.885 14.429 1.00 22.79 C ATOM 134 CE1 TYR A 222 11.224 -1.590 13.850 1.00 26.98 C ATOM 135 CE2 TYR A 222 10.021 -3.445 14.813 1.00 23.81 C ATOM 136 CZ TYR A 222 11.225 -2.780 14.562 1.00 26.26 C ATOM 137 OH TYR A 222 12.455 -3.347 14.949 1.00 30.44 O ATOM 0 H TYR A 222 5.243 -0.471 12.866 1.00 23.35 H new ATOM 0 HA TYR A 222 7.224 -1.192 11.337 1.00 19.61 H new ATOM 0 HB2 TYR A 222 7.670 -0.066 13.258 1.00 18.68 H new ATOM 0 HB3 TYR A 222 6.901 -1.112 14.123 1.00 18.68 H new ATOM 0 HD1 TYR A 222 10.006 -0.229 12.979 1.00 29.81 H new ATOM 0 HD2 TYR A 222 8.035 -3.313 14.644 1.00 22.79 H new ATOM 0 HE1 TYR A 222 12.026 -1.165 13.647 1.00 26.98 H new ATOM 0 HE2 TYR A 222 10.028 -4.270 15.242 1.00 23.81 H new ATOM 0 HH TYR A 222 12.390 -3.652 15.729 1.00 30.44 H new ATOM 138 N ILE A 223 5.815 -3.585 12.899 1.00 24.36 N ATOM 139 CA ILE A 223 5.684 -5.019 12.832 1.00 27.89 C ATOM 140 C ILE A 223 5.118 -5.538 11.488 1.00 26.45 C ATOM 141 O ILE A 223 5.536 -6.596 11.045 1.00 26.52 O ATOM 142 CB ILE A 223 5.057 -5.680 14.097 1.00 28.19 C ATOM 143 CG1 ILE A 223 3.588 -5.338 14.239 1.00 36.21 C ATOM 144 CG2 ILE A 223 5.862 -5.365 15.386 1.00 27.70 C ATOM 145 CD1 ILE A 223 2.949 -5.881 15.539 1.00 37.34 C ATOM 0 H ILE A 223 5.312 -3.186 13.471 1.00 24.36 H new ATOM 0 HA ILE A 223 6.600 -5.338 12.846 1.00 27.89 H new ATOM 0 HB ILE A 223 5.112 -6.640 13.970 1.00 28.19 H new ATOM 0 HG12 ILE A 223 3.484 -4.374 14.215 1.00 36.21 H new ATOM 0 HG13 ILE A 223 3.105 -5.695 13.477 1.00 36.21 H new ATOM 0 HG21 ILE A 223 5.438 -5.794 16.146 1.00 27.70 H new ATOM 0 HG22 ILE A 223 6.768 -5.698 15.291 1.00 27.70 H new ATOM 0 HG23 ILE A 223 5.884 -4.406 15.528 1.00 27.70 H new ATOM 0 HD11 ILE A 223 2.013 -5.629 15.569 1.00 37.34 H new ATOM 0 HD12 ILE A 223 3.024 -6.848 15.557 1.00 37.34 H new ATOM 0 HD13 ILE A 223 3.409 -5.507 16.307 1.00 37.34 H new ATOM 146 N LYS A 224 4.228 -4.777 10.838 1.00 26.57 N ATOM 147 CA LYS A 224 3.695 -5.131 9.506 1.00 28.80 C ATOM 148 C LYS A 224 4.735 -4.973 8.396 1.00 29.70 C ATOM 149 O LYS A 224 4.666 -5.679 7.390 1.00 28.66 O ATOM 150 CB LYS A 224 2.485 -4.257 9.131 1.00 28.43 C ATOM 151 CG LYS A 224 1.281 -4.420 10.046 1.00 38.19 C ATOM 152 CD LYS A 224 -0.014 -4.117 9.329 1.00 48.26 C ATOM 153 CE LYS A 224 -0.497 -5.318 8.508 1.00 54.43 C ATOM 154 NZ LYS A 224 -1.917 -5.173 7.977 1.00 58.31 N ATOM 0 H LYS A 224 3.915 -4.041 11.154 1.00 26.57 H new ATOM 0 HA LYS A 224 3.435 -6.063 9.576 1.00 28.80 H new ATOM 0 HB2 LYS A 224 2.758 -3.326 9.138 1.00 28.43 H new ATOM 0 HB3 LYS A 224 2.217 -4.468 8.223 1.00 28.43 H new ATOM 0 HG2 LYS A 224 1.256 -5.327 10.389 1.00 38.19 H new ATOM 0 HG3 LYS A 224 1.373 -3.830 10.810 1.00 38.19 H new ATOM 0 HD2 LYS A 224 -0.694 -3.872 9.976 1.00 48.26 H new ATOM 0 HD3 LYS A 224 0.110 -3.353 8.744 1.00 48.26 H new ATOM 0 HE2 LYS A 224 0.106 -5.451 7.760 1.00 54.43 H new ATOM 0 HE3 LYS A 224 -0.447 -6.115 9.058 1.00 54.43 H new ATOM 0 HZ1 LYS A 224 -2.136 -5.899 7.512 1.00 58.31 H new ATOM 0 HZ2 LYS A 224 -2.481 -5.077 8.659 1.00 58.31 H new ATOM 0 HZ3 LYS A 224 -1.965 -4.458 7.450 1.00 58.31 H new ATOM 155 N SER A 225 5.653 -4.016 8.575 1.00 27.16 N ATOM 156 CA SER A 225 6.652 -3.623 7.572 1.00 22.83 C ATOM 157 C SER A 225 7.912 -4.436 7.605 1.00 23.20 C ATOM 158 O SER A 225 8.473 -4.677 6.563 1.00 25.08 O ATOM 159 CB SER A 225 7.002 -2.165 7.728 1.00 23.00 C ATOM 160 OG SER A 225 5.840 -1.400 7.615 1.00 21.68 O ATOM 0 H SER A 225 5.713 -3.565 9.305 1.00 27.16 H new ATOM 0 HA SER A 225 6.235 -3.791 6.712 1.00 22.83 H new ATOM 0 HB2 SER A 225 7.421 -2.012 8.590 1.00 23.00 H new ATOM 0 HB3 SER A 225 7.643 -1.901 7.050 1.00 23.00 H new ATOM 0 HG SER A 225 5.418 -1.422 8.341 1.00 21.68 H new ATOM 161 N PHE A 226 8.392 -4.835 8.798 1.00 26.11 N ATOM 162 CA PHE A 226 9.681 -5.485 8.937 1.00 26.67 C ATOM 163 C PHE A 226 9.506 -6.906 9.427 1.00 32.54 C ATOM 164 O PHE A 226 9.045 -7.123 10.555 1.00 33.68 O ATOM 165 CB PHE A 226 10.596 -4.719 9.897 1.00 25.97 C ATOM 166 CG PHE A 226 10.806 -3.300 9.477 1.00 31.96 C ATOM 167 CD1 PHE A 226 11.475 -3.029 8.318 1.00 25.57 C ATOM 168 CD2 PHE A 226 10.228 -2.242 10.184 1.00 30.56 C ATOM 169 CE1 PHE A 226 11.650 -1.742 7.906 1.00 22.61 C ATOM 170 CE2 PHE A 226 10.396 -0.951 9.762 1.00 30.00 C ATOM 171 CZ PHE A 226 11.096 -0.701 8.608 1.00 23.88 C ATOM 0 H PHE A 226 7.970 -4.730 9.540 1.00 26.11 H new ATOM 0 HA PHE A 226 10.098 -5.495 8.061 1.00 26.67 H new ATOM 0 HB2 PHE A 226 10.212 -4.736 10.788 1.00 25.97 H new ATOM 0 HB3 PHE A 226 11.454 -5.168 9.949 1.00 25.97 H new ATOM 0 HD1 PHE A 226 11.814 -3.728 7.806 1.00 25.57 H new ATOM 0 HD2 PHE A 226 9.726 -2.417 10.947 1.00 30.56 H new ATOM 0 HE1 PHE A 226 12.150 -1.567 7.141 1.00 22.61 H new ATOM 0 HE2 PHE A 226 10.038 -0.248 10.254 1.00 30.00 H new ATOM 0 HZ PHE A 226 11.195 0.172 8.303 1.00 23.88 H new ATOM 172 N PRO A 227 9.940 -7.878 8.612 1.00 34.62 N ATOM 173 CA PRO A 227 9.542 -9.273 8.834 1.00 36.52 C ATOM 174 C PRO A 227 10.128 -9.868 10.143 1.00 33.67 C ATOM 175 O PRO A 227 9.387 -10.466 10.947 1.00 36.63 O ATOM 176 CB PRO A 227 10.040 -10.004 7.581 1.00 38.71 C ATOM 177 CG PRO A 227 11.054 -9.073 6.898 1.00 36.93 C ATOM 178 CD PRO A 227 10.923 -7.698 7.517 1.00 35.98 C ATOM 0 HA PRO A 227 8.584 -9.362 8.957 1.00 36.52 H new ATOM 0 HB2 PRO A 227 10.454 -10.849 7.817 1.00 38.71 H new ATOM 0 HB3 PRO A 227 9.302 -10.206 6.984 1.00 38.71 H new ATOM 0 HG2 PRO A 227 11.956 -9.412 7.013 1.00 36.93 H new ATOM 0 HG3 PRO A 227 10.886 -9.032 5.943 1.00 36.93 H new ATOM 0 HD2 PRO A 227 11.775 -7.380 7.855 1.00 35.98 H new ATOM 0 HD3 PRO A 227 10.614 -7.046 6.868 1.00 35.98 H new ATOM 179 N LEU A 228 11.406 -9.618 10.393 1.00 28.93 N ATOM 180 CA LEU A 228 12.082 -10.144 11.587 1.00 26.07 C ATOM 181 C LEU A 228 12.281 -8.996 12.590 1.00 25.65 C ATOM 182 O LEU A 228 13.106 -8.122 12.361 1.00 25.27 O ATOM 183 CB LEU A 228 13.453 -10.686 11.164 1.00 25.19 C ATOM 184 CG LEU A 228 14.255 -11.259 12.341 1.00 24.18 C ATOM 185 CD1 LEU A 228 13.580 -12.463 12.954 1.00 38.26 C ATOM 186 CD2 LEU A 228 15.636 -11.567 11.949 1.00 30.30 C ATOM 0 H LEU A 228 11.909 -9.142 9.883 1.00 28.93 H new ATOM 0 HA LEU A 228 11.554 -10.848 11.995 1.00 26.07 H new ATOM 0 HB2 LEU A 228 13.330 -11.377 10.495 1.00 25.19 H new ATOM 0 HB3 LEU A 228 13.963 -9.974 10.747 1.00 25.19 H new ATOM 0 HG LEU A 228 14.286 -10.570 13.023 1.00 24.18 H new ATOM 0 HD11 LEU A 228 14.116 -12.794 13.691 1.00 38.26 H new ATOM 0 HD12 LEU A 228 12.702 -12.211 13.281 1.00 38.26 H new ATOM 0 HD13 LEU A 228 13.488 -13.158 12.284 1.00 38.26 H new ATOM 0 HD21 LEU A 228 16.116 -11.926 12.711 1.00 30.30 H new ATOM 0 HD22 LEU A 228 15.631 -12.221 11.233 1.00 30.30 H new ATOM 0 HD23 LEU A 228 16.074 -10.757 11.644 1.00 30.30 H new ATOM 187 N THR A 229 11.502 -8.974 13.678 1.00 24.46 N ATOM 188 CA THR A 229 11.656 -7.971 14.713 1.00 24.86 C ATOM 189 C THR A 229 12.953 -8.180 15.485 1.00 23.39 C ATOM 190 O THR A 229 13.495 -9.311 15.543 1.00 20.94 O ATOM 191 CB THR A 229 10.501 -8.034 15.746 1.00 23.98 C ATOM 192 OG1 THR A 229 10.477 -9.325 16.339 1.00 27.96 O ATOM 193 CG2 THR A 229 9.159 -7.801 15.069 1.00 24.39 C ATOM 0 H THR A 229 10.874 -9.542 13.828 1.00 24.46 H new ATOM 0 HA THR A 229 11.656 -7.113 14.261 1.00 24.86 H new ATOM 0 HB THR A 229 10.650 -7.346 16.414 1.00 23.98 H new ATOM 0 HG1 THR A 229 9.854 -9.364 16.901 1.00 27.96 H new ATOM 0 HG21 THR A 229 8.451 -7.844 15.730 1.00 24.39 H new ATOM 0 HG22 THR A 229 9.156 -6.927 14.649 1.00 24.39 H new ATOM 0 HG23 THR A 229 9.013 -8.483 14.395 1.00 24.39 H new ATOM 194 N LYS A 230 13.410 -7.125 16.160 1.00 19.44 N ATOM 195 CA LYS A 230 14.481 -7.340 17.098 1.00 18.08 C ATOM 196 C LYS A 230 14.207 -8.339 18.223 1.00 20.46 C ATOM 197 O LYS A 230 15.114 -9.041 18.673 1.00 19.02 O ATOM 198 CB LYS A 230 14.989 -6.025 17.688 1.00 17.64 C ATOM 199 CG LYS A 230 16.190 -6.239 18.644 1.00 24.19 C ATOM 200 CD LYS A 230 16.644 -4.883 19.214 1.00 21.50 C ATOM 201 CE LYS A 230 17.943 -4.982 20.081 1.00 24.20 C ATOM 202 NZ LYS A 230 18.183 -3.652 20.738 1.00 23.92 N ATOM 0 H LYS A 230 13.123 -6.317 16.089 1.00 19.44 H new ATOM 0 HA LYS A 230 15.167 -7.754 16.552 1.00 18.08 H new ATOM 0 HB2 LYS A 230 15.252 -5.430 16.969 1.00 17.64 H new ATOM 0 HB3 LYS A 230 14.269 -5.588 18.169 1.00 17.64 H new ATOM 0 HG2 LYS A 230 15.938 -6.836 19.366 1.00 24.19 H new ATOM 0 HG3 LYS A 230 16.922 -6.662 18.169 1.00 24.19 H new ATOM 0 HD2 LYS A 230 16.797 -4.266 18.481 1.00 21.50 H new ATOM 0 HD3 LYS A 230 15.930 -4.510 19.754 1.00 21.50 H new ATOM 0 HE2 LYS A 230 17.848 -5.677 20.751 1.00 24.20 H new ATOM 0 HE3 LYS A 230 18.701 -5.225 19.526 1.00 24.20 H new ATOM 0 HZ1 LYS A 230 18.649 -3.770 21.487 1.00 23.92 H new ATOM 0 HZ2 LYS A 230 18.640 -3.125 20.185 1.00 23.92 H new ATOM 0 HZ3 LYS A 230 17.402 -3.271 20.932 1.00 23.92 H new ATOM 203 N ALA A 231 12.985 -8.381 18.748 1.00 22.47 N ATOM 204 CA ALA A 231 12.657 -9.393 19.751 1.00 21.44 C ATOM 205 C ALA A 231 12.917 -10.832 19.283 1.00 21.54 C ATOM 206 O ALA A 231 13.412 -11.674 20.029 1.00 24.49 O ATOM 207 CB ALA A 231 11.170 -9.248 20.181 1.00 21.14 C ATOM 0 H ALA A 231 12.344 -7.846 18.544 1.00 22.47 H new ATOM 0 HA ALA A 231 13.249 -9.233 20.502 1.00 21.44 H new ATOM 0 HB1 ALA A 231 10.958 -9.922 20.846 1.00 21.14 H new ATOM 0 HB2 ALA A 231 11.026 -8.366 20.558 1.00 21.14 H new ATOM 0 HB3 ALA A 231 10.596 -9.366 19.408 1.00 21.14 H new ATOM 208 N LYS A 232 12.483 -11.126 18.073 1.00 25.25 N ATOM 209 CA LYS A 232 12.637 -12.455 17.512 1.00 24.63 C ATOM 210 C LYS A 232 14.073 -12.715 17.133 1.00 25.35 C ATOM 211 O LYS A 232 14.568 -13.791 17.383 1.00 28.91 O ATOM 212 CB LYS A 232 11.745 -12.567 16.315 1.00 24.68 C ATOM 213 CG LYS A 232 10.298 -12.613 16.742 1.00 33.72 C ATOM 214 CD LYS A 232 9.362 -11.989 15.714 1.00 50.23 C ATOM 215 CE LYS A 232 7.965 -11.857 16.290 1.00 53.54 C ATOM 216 NZ LYS A 232 6.963 -12.277 15.267 1.00 62.76 N ATOM 0 H LYS A 232 12.091 -10.564 17.553 1.00 25.25 H new ATOM 0 HA LYS A 232 12.388 -13.120 18.173 1.00 24.63 H new ATOM 0 HB2 LYS A 232 11.890 -11.812 15.724 1.00 24.68 H new ATOM 0 HB3 LYS A 232 11.966 -13.367 15.813 1.00 24.68 H new ATOM 0 HG2 LYS A 232 10.038 -13.535 16.893 1.00 33.72 H new ATOM 0 HG3 LYS A 232 10.199 -12.149 17.588 1.00 33.72 H new ATOM 0 HD2 LYS A 232 9.695 -11.116 15.451 1.00 50.23 H new ATOM 0 HD3 LYS A 232 9.339 -12.536 14.914 1.00 50.23 H new ATOM 0 HE2 LYS A 232 7.879 -12.406 17.085 1.00 53.54 H new ATOM 0 HE3 LYS A 232 7.801 -10.940 16.560 1.00 53.54 H new ATOM 0 HZ1 LYS A 232 6.143 -12.200 15.605 1.00 62.76 H new ATOM 0 HZ2 LYS A 232 7.037 -11.758 14.548 1.00 62.76 H new ATOM 0 HZ3 LYS A 232 7.110 -13.124 15.037 1.00 62.76 H new ATOM 217 N ALA A 233 14.761 -11.732 16.549 1.00 24.27 N ATOM 218 CA ALA A 233 16.208 -11.863 16.357 1.00 21.93 C ATOM 219 C ALA A 233 16.974 -12.111 17.640 1.00 20.63 C ATOM 220 O ALA A 233 17.919 -12.888 17.673 1.00 26.70 O ATOM 221 CB ALA A 233 16.781 -10.638 15.606 1.00 21.65 C ATOM 0 H ALA A 233 14.419 -10.997 16.262 1.00 24.27 H new ATOM 0 HA ALA A 233 16.331 -12.656 15.812 1.00 21.93 H new ATOM 0 HB1 ALA A 233 17.738 -10.747 15.491 1.00 21.65 H new ATOM 0 HB2 ALA A 233 16.358 -10.564 14.736 1.00 21.65 H new ATOM 0 HB3 ALA A 233 16.607 -9.833 16.119 1.00 21.65 H new ATOM 222 N ARG A 234 16.626 -11.435 18.715 1.00 23.86 N ATOM 223 CA ARG A 234 17.382 -11.628 19.945 1.00 24.03 C ATOM 224 C ARG A 234 17.127 -13.039 20.541 1.00 26.68 C ATOM 225 O ARG A 234 18.025 -13.676 21.069 1.00 31.64 O ATOM 226 CB ARG A 234 16.992 -10.517 20.942 1.00 29.11 C ATOM 227 CG ARG A 234 17.611 -9.158 20.643 1.00 29.23 C ATOM 228 CD ARG A 234 19.142 -9.285 20.781 1.00 37.81 C ATOM 229 NE ARG A 234 19.773 -8.852 19.553 1.00 36.43 N ATOM 230 CZ ARG A 234 21.084 -8.716 19.338 1.00 38.64 C ATOM 231 NH1 ARG A 234 22.012 -8.977 20.258 1.00 32.84 N ATOM 232 NH2 ARG A 234 21.470 -8.319 18.154 1.00 30.62 N ATOM 0 H ARG A 234 15.976 -10.874 18.761 1.00 23.86 H new ATOM 0 HA ARG A 234 18.332 -11.571 19.757 1.00 24.03 H new ATOM 0 HB2 ARG A 234 16.026 -10.426 20.947 1.00 29.11 H new ATOM 0 HB3 ARG A 234 17.256 -10.791 21.834 1.00 29.11 H new ATOM 0 HG2 ARG A 234 17.375 -8.868 19.748 1.00 29.23 H new ATOM 0 HG3 ARG A 234 17.270 -8.489 21.257 1.00 29.23 H new ATOM 0 HD2 ARG A 234 19.455 -8.747 21.525 1.00 37.81 H new ATOM 0 HD3 ARG A 234 19.384 -10.204 20.974 1.00 37.81 H new ATOM 0 HE ARG A 234 19.252 -8.663 18.896 1.00 36.43 H new ATOM 0 HH11 ARG A 234 21.778 -9.249 21.040 1.00 32.84 H new ATOM 0 HH12 ARG A 234 22.845 -8.874 20.070 1.00 32.84 H new ATOM 0 HH21 ARG A 234 20.886 -8.155 17.544 1.00 30.62 H new ATOM 0 HH22 ARG A 234 22.308 -8.222 17.985 1.00 30.62 H new ATOM 233 N ALA A 235 15.876 -13.482 20.496 1.00 28.66 N ATOM 234 CA ALA A 235 15.473 -14.836 20.831 1.00 30.79 C ATOM 235 C ALA A 235 16.316 -15.869 20.081 1.00 33.42 C ATOM 236 O ALA A 235 16.871 -16.793 20.693 1.00 36.45 O ATOM 237 CB ALA A 235 13.983 -15.027 20.483 1.00 30.77 C ATOM 0 H ALA A 235 15.217 -12.982 20.261 1.00 28.66 H new ATOM 0 HA ALA A 235 15.611 -14.970 21.782 1.00 30.79 H new ATOM 0 HB1 ALA A 235 13.712 -15.931 20.706 1.00 30.77 H new ATOM 0 HB2 ALA A 235 13.449 -14.395 20.989 1.00 30.77 H new ATOM 0 HB3 ALA A 235 13.850 -14.875 19.534 1.00 30.77 H new ATOM 238 N ILE A 236 16.413 -15.719 18.769 1.00 32.01 N ATOM 239 CA ILE A 236 17.332 -16.561 17.969 1.00 30.96 C ATOM 240 C ILE A 236 18.782 -16.516 18.398 1.00 32.67 C ATOM 241 O ILE A 236 19.420 -17.565 18.558 1.00 37.02 O ATOM 242 CB ILE A 236 17.225 -16.249 16.467 1.00 29.53 C ATOM 243 CG1 ILE A 236 15.779 -16.412 16.034 1.00 23.76 C ATOM 244 CG2 ILE A 236 18.129 -17.205 15.628 1.00 30.41 C ATOM 245 CD1 ILE A 236 15.414 -15.639 14.785 1.00 20.80 C ATOM 0 H ILE A 236 15.965 -15.144 18.313 1.00 32.01 H new ATOM 0 HA ILE A 236 17.029 -17.466 18.142 1.00 30.96 H new ATOM 0 HB ILE A 236 17.524 -15.339 16.315 1.00 29.53 H new ATOM 0 HG12 ILE A 236 15.601 -17.354 15.883 1.00 23.76 H new ATOM 0 HG13 ILE A 236 15.201 -16.127 16.759 1.00 23.76 H new ATOM 0 HG21 ILE A 236 18.044 -16.988 14.686 1.00 30.41 H new ATOM 0 HG22 ILE A 236 19.054 -17.099 15.901 1.00 30.41 H new ATOM 0 HG23 ILE A 236 17.852 -18.123 15.774 1.00 30.41 H new ATOM 0 HD11 ILE A 236 14.480 -15.791 14.571 1.00 20.80 H new ATOM 0 HD12 ILE A 236 15.560 -14.692 14.936 1.00 20.80 H new ATOM 0 HD13 ILE A 236 15.967 -15.938 14.046 1.00 20.80 H new ATOM 246 N LEU A 237 19.336 -15.321 18.552 1.00 33.42 N ATOM 247 CA LEU A 237 20.798 -15.172 18.617 1.00 35.59 C ATOM 248 C LEU A 237 21.245 -15.756 19.947 1.00 40.20 C ATOM 249 O LEU A 237 22.408 -16.128 20.165 1.00 40.39 O ATOM 250 CB LEU A 237 21.178 -13.703 18.558 1.00 32.43 C ATOM 251 CG LEU A 237 21.325 -13.100 17.176 1.00 29.98 C ATOM 252 CD1 LEU A 237 21.271 -11.604 17.249 1.00 24.47 C ATOM 253 CD2 LEU A 237 22.641 -13.512 16.534 1.00 22.58 C ATOM 0 H LEU A 237 18.895 -14.586 18.621 1.00 33.42 H new ATOM 0 HA LEU A 237 21.221 -15.626 17.871 1.00 35.59 H new ATOM 0 HB2 LEU A 237 20.507 -13.196 19.041 1.00 32.43 H new ATOM 0 HB3 LEU A 237 22.017 -13.587 19.031 1.00 32.43 H new ATOM 0 HG LEU A 237 20.591 -13.430 16.635 1.00 29.98 H new ATOM 0 HD11 LEU A 237 21.366 -11.233 16.358 1.00 24.47 H new ATOM 0 HD12 LEU A 237 20.420 -11.329 17.624 1.00 24.47 H new ATOM 0 HD13 LEU A 237 21.992 -11.281 17.812 1.00 24.47 H new ATOM 0 HD21 LEU A 237 22.710 -13.114 15.652 1.00 22.58 H new ATOM 0 HD22 LEU A 237 23.379 -13.207 17.085 1.00 22.58 H new ATOM 0 HD23 LEU A 237 22.674 -14.478 16.455 1.00 22.58 H new ATOM 254 N THR A 238 20.272 -15.835 20.841 1.00 43.51 N ATOM 255 CA THR A 238 20.515 -15.966 22.256 1.00 46.87 C ATOM 256 C THR A 238 20.298 -17.424 22.681 1.00 48.68 C ATOM 257 O THR A 238 20.895 -17.898 23.655 1.00 50.34 O ATOM 258 CB THR A 238 19.622 -14.949 23.011 1.00 47.02 C ATOM 259 OG1 THR A 238 20.319 -14.433 24.143 1.00 51.71 O ATOM 260 CG2 THR A 238 18.276 -15.515 23.401 1.00 44.10 C ATOM 0 H THR A 238 19.438 -15.813 20.633 1.00 43.51 H new ATOM 0 HA THR A 238 21.435 -15.755 22.481 1.00 46.87 H new ATOM 0 HB THR A 238 19.432 -14.222 22.397 1.00 47.02 H new ATOM 0 HG1 THR A 238 19.830 -13.882 24.546 1.00 51.71 H new ATOM 0 HG21 THR A 238 17.763 -14.837 23.868 1.00 44.10 H new ATOM 0 HG22 THR A 238 17.797 -15.790 22.604 1.00 44.10 H new ATOM 0 HG23 THR A 238 18.403 -16.281 23.982 1.00 44.10 H new ATOM 261 N GLY A 239 19.486 -18.139 21.906 1.00 48.37 N ATOM 262 CA GLY A 239 18.953 -19.424 22.314 1.00 52.63 C ATOM 263 C GLY A 239 17.623 -19.222 23.012 1.00 55.82 C ATOM 264 O GLY A 239 17.309 -18.117 23.497 1.00 53.69 O ATOM 0 H GLY A 239 19.230 -17.886 21.125 1.00 48.37 H new ATOM 0 HA2 GLY A 239 18.839 -19.998 21.540 1.00 52.63 H new ATOM 0 HA3 GLY A 239 19.577 -19.870 22.908 1.00 52.63 H new ATOM 265 N LYS A 240 16.832 -20.286 23.077 1.00 57.81 N ATOM 266 CA LYS A 240 15.371 -20.126 23.132 1.00 62.13 C ATOM 267 C LYS A 240 14.845 -20.833 21.892 1.00 63.93 C ATOM 268 O LYS A 240 15.000 -22.049 21.776 1.00 64.09 O ATOM 269 CB LYS A 240 14.967 -18.633 23.175 1.00 60.46 C ATOM 270 CG LYS A 240 15.090 -18.004 24.582 1.00 62.10 C ATOM 271 CD LYS A 240 15.614 -16.551 24.603 1.00 62.46 C ATOM 272 CE LYS A 240 14.479 -15.518 24.466 1.00 60.52 C ATOM 273 NZ LYS A 240 14.956 -14.092 24.491 1.00 59.13 N ATOM 0 H LYS A 240 17.109 -21.100 23.091 1.00 57.81 H new ATOM 0 HA LYS A 240 14.993 -20.509 23.939 1.00 62.13 H new ATOM 0 HB2 LYS A 240 15.524 -18.136 22.556 1.00 60.46 H new ATOM 0 HB3 LYS A 240 14.052 -18.544 22.867 1.00 60.46 H new ATOM 0 HG2 LYS A 240 14.219 -18.026 25.009 1.00 62.10 H new ATOM 0 HG3 LYS A 240 15.682 -18.555 25.117 1.00 62.10 H new ATOM 0 HD2 LYS A 240 16.093 -16.394 25.432 1.00 62.46 H new ATOM 0 HD3 LYS A 240 16.249 -16.428 23.880 1.00 62.46 H new ATOM 0 HE2 LYS A 240 14.005 -15.678 23.635 1.00 60.52 H new ATOM 0 HE3 LYS A 240 13.842 -15.651 25.186 1.00 60.52 H new ATOM 0 HZ1 LYS A 240 14.259 -13.544 24.408 1.00 59.13 H new ATOM 0 HZ2 LYS A 240 15.370 -13.931 25.262 1.00 59.13 H new ATOM 0 HZ3 LYS A 240 15.521 -13.956 23.817 1.00 59.13 H new ATOM 274 N THR A 241 14.199 -20.106 20.986 1.00 66.78 N ATOM 275 CA THR A 241 12.755 -19.976 21.010 1.00 69.16 C ATOM 276 C THR A 241 12.194 -21.396 21.250 1.00 70.34 C ATOM 277 O THR A 241 12.430 -22.004 22.300 1.00 70.92 O ATOM 278 CB THR A 241 12.238 -19.413 19.658 1.00 68.70 C ATOM 279 OG1 THR A 241 12.296 -20.437 18.658 1.00 72.48 O ATOM 280 CG2 THR A 241 13.095 -18.238 19.187 1.00 68.82 C ATOM 0 H THR A 241 14.585 -19.679 20.347 1.00 66.78 H new ATOM 0 HA THR A 241 12.470 -19.362 21.705 1.00 69.16 H new ATOM 0 HB THR A 241 11.326 -19.111 19.791 1.00 68.70 H new ATOM 0 HG1 THR A 241 13.091 -20.540 18.408 1.00 72.48 H new ATOM 0 HG21 THR A 241 12.752 -17.905 18.343 1.00 68.82 H new ATOM 0 HG22 THR A 241 13.065 -17.530 19.849 1.00 68.82 H new ATOM 0 HG23 THR A 241 14.012 -18.532 19.070 1.00 68.82 H new ATOM 281 N THR A 242 11.466 -21.937 20.280 1.00 71.51 N ATOM 282 CA THR A 242 11.286 -23.381 20.235 1.00 71.21 C ATOM 283 C THR A 242 11.820 -24.082 18.991 1.00 71.31 C ATOM 284 O THR A 242 12.874 -24.717 19.071 1.00 71.34 O ATOM 285 CB THR A 242 9.852 -23.857 20.583 1.00 70.53 C ATOM 286 OG1 THR A 242 8.940 -22.754 20.548 1.00 69.65 O ATOM 287 CG2 THR A 242 9.833 -24.486 21.964 1.00 71.06 C ATOM 0 H THR A 242 11.076 -21.497 19.652 1.00 71.51 H new ATOM 0 HA THR A 242 11.866 -23.671 20.956 1.00 71.21 H new ATOM 0 HB THR A 242 9.578 -24.516 19.926 1.00 70.53 H new ATOM 0 HG1 THR A 242 8.167 -23.023 20.736 1.00 69.65 H new ATOM 0 HG21 THR A 242 8.933 -24.781 22.173 1.00 71.06 H new ATOM 0 HG22 THR A 242 10.434 -25.247 21.981 1.00 71.06 H new ATOM 0 HG23 THR A 242 10.120 -23.833 22.621 1.00 71.06 H new ATOM 288 N ASP A 243 11.124 -23.960 17.851 1.00 70.91 N ATOM 289 CA ASP A 243 11.580 -23.174 16.687 1.00 70.38 C ATOM 290 C ASP A 243 13.077 -22.933 16.693 1.00 67.78 C ATOM 291 O ASP A 243 13.533 -21.886 17.140 1.00 68.98 O ATOM 292 CB ASP A 243 10.810 -21.866 16.471 1.00 71.48 C ATOM 293 CG ASP A 243 10.705 -21.490 14.980 1.00 76.35 C ATOM 294 OD1 ASP A 243 11.732 -21.573 14.259 1.00 78.56 O ATOM 295 OD2 ASP A 243 9.592 -21.123 14.523 1.00 80.87 O ATOM 0 H ASP A 243 10.361 -24.337 17.729 1.00 70.91 H new ATOM 0 HA ASP A 243 11.374 -23.736 15.924 1.00 70.38 H new ATOM 0 HB2 ASP A 243 9.919 -21.952 16.844 1.00 71.48 H new ATOM 0 HB3 ASP A 243 11.252 -21.149 16.953 1.00 71.48 H new ATOM 296 N LYS A 244 13.828 -23.911 16.185 1.00 63.71 N ATOM 297 CA LYS A 244 15.094 -24.296 16.806 1.00 60.15 C ATOM 298 C LYS A 244 16.292 -24.351 15.835 1.00 56.44 C ATOM 299 O LYS A 244 16.641 -25.424 15.330 1.00 53.73 O ATOM 300 CB LYS A 244 14.947 -25.618 17.579 1.00 61.92 C ATOM 301 CG LYS A 244 14.613 -26.850 16.712 1.00 64.55 C ATOM 302 CD LYS A 244 13.426 -27.671 17.255 1.00 60.53 C ATOM 303 CE LYS A 244 12.725 -28.445 16.126 1.00 63.05 C ATOM 304 NZ LYS A 244 13.663 -28.869 15.031 1.00 60.83 N ATOM 0 H LYS A 244 13.622 -24.363 15.483 1.00 63.71 H new ATOM 0 HA LYS A 244 15.303 -23.583 17.429 1.00 60.15 H new ATOM 0 HB2 LYS A 244 15.773 -25.791 18.057 1.00 61.92 H new ATOM 0 HB3 LYS A 244 14.251 -25.511 18.246 1.00 61.92 H new ATOM 0 HG2 LYS A 244 14.411 -26.558 15.809 1.00 64.55 H new ATOM 0 HG3 LYS A 244 15.395 -27.421 16.657 1.00 64.55 H new ATOM 0 HD2 LYS A 244 13.741 -28.292 17.930 1.00 60.53 H new ATOM 0 HD3 LYS A 244 12.791 -27.079 17.688 1.00 60.53 H new ATOM 0 HE2 LYS A 244 12.295 -29.231 16.498 1.00 63.05 H new ATOM 0 HE3 LYS A 244 12.024 -27.891 15.748 1.00 63.05 H new ATOM 0 HZ1 LYS A 244 13.298 -29.536 14.568 1.00 60.83 H new ATOM 0 HZ2 LYS A 244 13.816 -28.181 14.488 1.00 60.83 H new ATOM 0 HZ3 LYS A 244 14.432 -29.142 15.387 1.00 60.83 H new ATOM 305 N SER A 245 16.892 -23.180 15.589 1.00 47.65 N ATOM 306 CA SER A 245 18.343 -23.017 15.701 1.00 44.02 C ATOM 307 C SER A 245 18.975 -22.878 14.311 1.00 38.24 C ATOM 308 O SER A 245 18.888 -23.816 13.519 1.00 36.04 O ATOM 309 CB SER A 245 18.956 -24.192 16.468 1.00 43.01 C ATOM 310 OG SER A 245 20.191 -23.829 17.075 1.00 49.84 O ATOM 0 H SER A 245 16.472 -22.467 15.355 1.00 47.65 H new ATOM 0 HA SER A 245 18.527 -22.205 16.198 1.00 44.02 H new ATOM 0 HB2 SER A 245 18.335 -24.494 17.149 1.00 43.01 H new ATOM 0 HB3 SER A 245 19.098 -24.937 15.863 1.00 43.01 H new ATOM 0 HG SER A 245 20.504 -24.489 17.489 1.00 49.84 H new ATOM 311 N PRO A 246 19.570 -21.687 14.015 1.00 32.43 N ATOM 312 CA PRO A 246 19.958 -21.251 12.671 1.00 28.44 C ATOM 313 C PRO A 246 21.090 -22.121 12.178 1.00 26.39 C ATOM 314 O PRO A 246 21.907 -22.554 12.995 1.00 24.49 O ATOM 315 CB PRO A 246 20.471 -19.814 12.901 1.00 26.84 C ATOM 316 CG PRO A 246 20.931 -19.826 14.317 1.00 33.45 C ATOM 317 CD PRO A 246 19.895 -20.659 15.022 1.00 29.88 C ATOM 0 HA PRO A 246 19.240 -21.302 12.021 1.00 28.44 H new ATOM 0 HB2 PRO A 246 21.194 -19.592 12.293 1.00 26.84 H new ATOM 0 HB3 PRO A 246 19.770 -19.158 12.760 1.00 26.84 H new ATOM 0 HG2 PRO A 246 21.817 -20.213 14.401 1.00 33.45 H new ATOM 0 HG3 PRO A 246 20.977 -18.929 14.684 1.00 33.45 H new ATOM 0 HD2 PRO A 246 20.242 -21.051 15.839 1.00 29.88 H new ATOM 0 HD3 PRO A 246 19.116 -20.135 15.267 1.00 29.88 H new ATOM 318 N PHE A 247 21.104 -22.411 10.875 1.00 23.34 N ATOM 319 CA PHE A 247 22.310 -22.903 10.209 1.00 22.12 C ATOM 320 C PHE A 247 23.459 -21.894 10.220 1.00 22.89 C ATOM 321 O PHE A 247 23.278 -20.688 10.028 1.00 21.71 O ATOM 322 CB PHE A 247 22.022 -23.442 8.774 1.00 23.73 C ATOM 323 CG PHE A 247 21.636 -22.378 7.748 1.00 25.84 C ATOM 324 CD1 PHE A 247 20.298 -22.240 7.307 1.00 26.68 C ATOM 325 CD2 PHE A 247 22.600 -21.562 7.172 1.00 26.19 C ATOM 326 CE1 PHE A 247 19.959 -21.271 6.349 1.00 28.48 C ATOM 327 CE2 PHE A 247 22.246 -20.596 6.239 1.00 29.70 C ATOM 328 CZ PHE A 247 20.931 -20.470 5.820 1.00 24.83 C ATOM 0 H PHE A 247 20.422 -22.329 10.358 1.00 23.34 H new ATOM 0 HA PHE A 247 22.609 -23.658 10.740 1.00 22.12 H new ATOM 0 HB2 PHE A 247 22.810 -23.909 8.455 1.00 23.73 H new ATOM 0 HB3 PHE A 247 21.307 -24.095 8.826 1.00 23.73 H new ATOM 0 HD1 PHE A 247 19.638 -22.796 7.655 1.00 26.68 H new ATOM 0 HD2 PHE A 247 23.492 -21.663 7.413 1.00 26.19 H new ATOM 0 HE1 PHE A 247 19.075 -21.175 6.075 1.00 28.48 H new ATOM 0 HE2 PHE A 247 22.897 -20.029 5.893 1.00 29.70 H new ATOM 0 HZ PHE A 247 20.709 -19.837 5.176 1.00 24.83 H new ATOM 329 N VAL A 248 24.667 -22.395 10.441 1.00 17.71 N ATOM 330 CA VAL A 248 25.796 -21.536 10.630 1.00 15.60 C ATOM 331 C VAL A 248 26.715 -21.613 9.397 1.00 18.37 C ATOM 332 O VAL A 248 26.971 -22.714 8.853 1.00 18.46 O ATOM 333 CB VAL A 248 26.601 -21.951 11.931 1.00 19.60 C ATOM 334 CG1 VAL A 248 27.784 -21.002 12.164 1.00 20.44 C ATOM 335 CG2 VAL A 248 25.705 -21.887 13.203 1.00 22.42 C ATOM 0 H VAL A 248 24.843 -23.236 10.483 1.00 17.71 H new ATOM 0 HA VAL A 248 25.481 -20.626 10.742 1.00 15.60 H new ATOM 0 HB VAL A 248 26.909 -22.859 11.785 1.00 19.60 H new ATOM 0 HG11 VAL A 248 28.263 -21.272 12.963 1.00 20.44 H new ATOM 0 HG12 VAL A 248 28.382 -21.037 11.401 1.00 20.44 H new ATOM 0 HG13 VAL A 248 27.455 -20.096 12.275 1.00 20.44 H new ATOM 0 HG21 VAL A 248 26.226 -22.146 13.979 1.00 22.42 H new ATOM 0 HG22 VAL A 248 25.376 -20.982 13.322 1.00 22.42 H new ATOM 0 HG23 VAL A 248 24.954 -22.493 13.101 1.00 22.42 H new ATOM 336 N ILE A 249 27.185 -20.459 8.965 1.00 17.87 N ATOM 337 CA ILE A 249 28.140 -20.329 7.901 1.00 18.46 C ATOM 338 C ILE A 249 29.477 -19.882 8.497 1.00 21.61 C ATOM 339 O ILE A 249 29.558 -18.834 9.095 1.00 21.66 O ATOM 340 CB ILE A 249 27.678 -19.337 6.843 1.00 18.16 C ATOM 341 CG1 ILE A 249 26.516 -19.958 6.038 1.00 17.64 C ATOM 342 CG2 ILE A 249 28.865 -19.093 5.854 1.00 17.27 C ATOM 343 CD1 ILE A 249 25.820 -19.004 5.081 1.00 21.37 C ATOM 0 H ILE A 249 26.944 -19.704 9.300 1.00 17.87 H new ATOM 0 HA ILE A 249 28.236 -21.189 7.462 1.00 18.46 H new ATOM 0 HB ILE A 249 27.393 -18.511 7.265 1.00 18.16 H new ATOM 0 HG12 ILE A 249 26.857 -20.712 5.532 1.00 17.64 H new ATOM 0 HG13 ILE A 249 25.859 -20.308 6.660 1.00 17.64 H new ATOM 0 HG21 ILE A 249 28.592 -18.462 5.170 1.00 17.27 H new ATOM 0 HG22 ILE A 249 29.623 -18.733 6.341 1.00 17.27 H new ATOM 0 HG23 ILE A 249 29.117 -19.932 5.438 1.00 17.27 H new ATOM 0 HD11 ILE A 249 25.107 -19.472 4.618 1.00 21.37 H new ATOM 0 HD12 ILE A 249 25.447 -18.260 5.579 1.00 21.37 H new ATOM 0 HD13 ILE A 249 26.461 -18.670 4.433 1.00 21.37 H new ATOM 344 N TYR A 250 30.528 -20.693 8.367 1.00 19.72 N ATOM 345 CA TYR A 250 31.785 -20.340 9.008 1.00 20.70 C ATOM 346 C TYR A 250 32.938 -20.775 8.129 1.00 22.11 C ATOM 347 O TYR A 250 34.074 -20.615 8.531 1.00 21.08 O ATOM 348 CB TYR A 250 31.908 -21.035 10.340 1.00 21.39 C ATOM 349 CG TYR A 250 31.723 -22.523 10.208 1.00 18.01 C ATOM 350 CD1 TYR A 250 30.471 -23.107 10.429 1.00 15.15 C ATOM 351 CD2 TYR A 250 32.798 -23.345 9.910 1.00 20.28 C ATOM 352 CE1 TYR A 250 30.272 -24.461 10.273 1.00 19.15 C ATOM 353 CE2 TYR A 250 32.619 -24.726 9.754 1.00 19.67 C ATOM 354 CZ TYR A 250 31.386 -25.276 9.975 1.00 22.26 C ATOM 355 OH TYR A 250 31.219 -26.628 9.812 1.00 20.39 O ATOM 0 H TYR A 250 30.532 -21.430 7.925 1.00 19.72 H new ATOM 0 HA TYR A 250 31.805 -19.379 9.142 1.00 20.70 H new ATOM 0 HB2 TYR A 250 32.779 -20.849 10.723 1.00 21.39 H new ATOM 0 HB3 TYR A 250 31.246 -20.679 10.954 1.00 21.39 H new ATOM 0 HD1 TYR A 250 29.757 -22.569 10.687 1.00 15.15 H new ATOM 0 HD2 TYR A 250 33.646 -22.977 9.813 1.00 20.28 H new ATOM 0 HE1 TYR A 250 29.423 -24.830 10.362 1.00 19.15 H new ATOM 0 HE2 TYR A 250 33.334 -25.265 9.502 1.00 19.67 H new ATOM 0 HH TYR A 250 30.449 -26.781 9.513 1.00 20.39 H new ATOM 356 N ASP A 251 32.636 -21.357 6.949 1.00 18.86 N ATOM 357 CA ASP A 251 33.694 -21.762 5.978 1.00 17.83 C ATOM 358 C ASP A 251 33.102 -21.984 4.592 1.00 18.60 C ATOM 359 O ASP A 251 31.911 -21.788 4.419 1.00 20.56 O ATOM 360 CB ASP A 251 34.533 -22.966 6.511 1.00 18.87 C ATOM 361 CG ASP A 251 33.792 -24.307 6.517 1.00 23.32 C ATOM 362 OD1 ASP A 251 32.581 -24.431 6.161 1.00 17.49 O ATOM 363 OD2 ASP A 251 34.469 -25.309 6.874 1.00 21.82 O ATOM 0 H ASP A 251 31.834 -21.526 6.690 1.00 18.86 H new ATOM 0 HA ASP A 251 34.327 -21.033 5.885 1.00 17.83 H new ATOM 0 HB2 ASP A 251 35.332 -23.054 5.968 1.00 18.87 H new ATOM 0 HB3 ASP A 251 34.825 -22.767 7.414 1.00 18.87 H new ATOM 364 N MET A 252 33.907 -22.356 3.591 1.00 18.47 N ATOM 365 CA MET A 252 33.358 -22.542 2.268 1.00 17.78 C ATOM 366 C MET A 252 32.308 -23.651 2.250 1.00 17.93 C ATOM 367 O MET A 252 31.282 -23.527 1.624 1.00 19.68 O ATOM 368 CB MET A 252 34.473 -22.830 1.234 1.00 21.79 C ATOM 369 CG MET A 252 33.938 -23.162 -0.169 1.00 27.60 C ATOM 370 SD MET A 252 33.144 -21.718 -0.926 1.00 42.97 S ATOM 371 CE MET A 252 34.481 -20.543 -0.878 1.00 43.37 C ATOM 0 H MET A 252 34.752 -22.500 3.664 1.00 18.47 H new ATOM 0 HA MET A 252 32.921 -21.713 2.018 1.00 17.78 H new ATOM 0 HB2 MET A 252 35.057 -22.058 1.175 1.00 21.79 H new ATOM 0 HB3 MET A 252 35.014 -23.571 1.550 1.00 21.79 H new ATOM 0 HG2 MET A 252 34.667 -23.466 -0.732 1.00 27.60 H new ATOM 0 HG3 MET A 252 33.301 -23.891 -0.111 1.00 27.60 H new ATOM 0 HE1 MET A 252 34.281 -19.851 -0.228 1.00 43.37 H new ATOM 0 HE2 MET A 252 35.301 -20.996 -0.626 1.00 43.37 H new ATOM 0 HE3 MET A 252 34.591 -20.141 -1.754 1.00 43.37 H new ATOM 372 N ASN A 253 32.591 -24.756 2.908 1.00 17.24 N ATOM 373 CA ASN A 253 31.715 -25.913 2.816 1.00 17.75 C ATOM 374 C ASN A 253 30.420 -25.518 3.441 1.00 14.86 C ATOM 375 O ASN A 253 29.370 -25.773 2.897 1.00 16.27 O ATOM 376 CB ASN A 253 32.329 -27.103 3.588 1.00 19.20 C ATOM 377 CG ASN A 253 31.456 -28.364 3.533 1.00 21.68 C ATOM 378 OD1 ASN A 253 31.162 -28.889 2.453 1.00 15.43 O ATOM 379 ND2 ASN A 253 31.015 -28.834 4.714 1.00 21.67 N ATOM 0 H ASN A 253 33.280 -24.861 3.412 1.00 17.24 H new ATOM 0 HA ASN A 253 31.592 -26.186 1.893 1.00 17.75 H new ATOM 0 HB2 ASN A 253 33.204 -27.304 3.220 1.00 19.20 H new ATOM 0 HB3 ASN A 253 32.462 -26.848 4.514 1.00 19.20 H new ATOM 0 HD21 ASN A 253 30.507 -29.527 4.738 1.00 21.67 H new ATOM 0 HD22 ASN A 253 31.241 -28.441 5.445 1.00 21.67 H new ATOM 380 N SER A 254 30.463 -24.883 4.598 1.00 14.02 N ATOM 381 CA SER A 254 29.153 -24.519 5.220 1.00 15.88 C ATOM 382 C SER A 254 28.434 -23.405 4.441 1.00 16.21 C ATOM 383 O SER A 254 27.205 -23.328 4.455 1.00 15.66 O ATOM 384 CB SER A 254 29.333 -24.118 6.677 1.00 16.36 C ATOM 385 OG SER A 254 30.347 -23.120 6.778 1.00 16.81 O ATOM 0 H SER A 254 31.171 -24.658 5.030 1.00 14.02 H new ATOM 0 HA SER A 254 28.593 -25.310 5.183 1.00 15.88 H new ATOM 0 HB2 SER A 254 28.497 -23.780 7.034 1.00 16.36 H new ATOM 0 HB3 SER A 254 29.575 -24.893 7.208 1.00 16.36 H new ATOM 0 HG SER A 254 31.102 -23.478 6.691 1.00 16.81 H new ATOM 386 N LEU A 255 29.194 -22.535 3.747 1.00 15.10 N ATOM 387 CA LEU A 255 28.555 -21.492 2.900 1.00 14.76 C ATOM 388 C LEU A 255 27.758 -22.185 1.807 1.00 15.92 C ATOM 389 O LEU A 255 26.618 -21.829 1.511 1.00 15.59 O ATOM 390 CB LEU A 255 29.657 -20.562 2.302 1.00 16.16 C ATOM 391 CG LEU A 255 29.214 -19.503 1.269 1.00 19.42 C ATOM 392 CD1 LEU A 255 28.126 -18.637 1.862 1.00 23.23 C ATOM 393 CD2 LEU A 255 30.401 -18.671 0.751 1.00 19.20 C ATOM 0 H LEU A 255 30.054 -22.527 3.749 1.00 15.10 H new ATOM 0 HA LEU A 255 27.954 -20.940 3.424 1.00 14.76 H new ATOM 0 HB2 LEU A 255 30.090 -20.100 3.037 1.00 16.16 H new ATOM 0 HB3 LEU A 255 30.329 -21.124 1.885 1.00 16.16 H new ATOM 0 HG LEU A 255 28.852 -19.960 0.494 1.00 19.42 H new ATOM 0 HD11 LEU A 255 27.850 -17.973 1.211 1.00 23.23 H new ATOM 0 HD12 LEU A 255 27.366 -19.190 2.101 1.00 23.23 H new ATOM 0 HD13 LEU A 255 28.463 -18.191 2.655 1.00 23.23 H new ATOM 0 HD21 LEU A 255 30.083 -18.019 0.107 1.00 19.20 H new ATOM 0 HD22 LEU A 255 30.823 -18.211 1.494 1.00 19.20 H new ATOM 0 HD23 LEU A 255 31.046 -19.257 0.326 1.00 19.20 H new ATOM 394 N MET A 256 28.346 -23.206 1.184 1.00 19.36 N ATOM 395 CA MET A 256 27.677 -23.868 0.064 1.00 23.44 C ATOM 396 C MET A 256 26.491 -24.702 0.533 1.00 22.29 C ATOM 397 O MET A 256 25.468 -24.792 -0.150 1.00 23.77 O ATOM 398 CB MET A 256 28.683 -24.757 -0.629 1.00 20.69 C ATOM 399 CG MET A 256 29.956 -24.005 -0.916 1.00 30.95 C ATOM 400 SD MET A 256 30.884 -24.788 -2.232 1.00 44.59 S ATOM 401 CE MET A 256 29.891 -24.102 -3.582 1.00 41.61 C ATOM 0 H MET A 256 29.117 -23.526 1.389 1.00 19.36 H new ATOM 0 HA MET A 256 27.336 -23.193 -0.543 1.00 23.44 H new ATOM 0 HB2 MET A 256 28.877 -25.528 -0.073 1.00 20.69 H new ATOM 0 HB3 MET A 256 28.307 -25.092 -1.458 1.00 20.69 H new ATOM 0 HG2 MET A 256 29.746 -23.091 -1.164 1.00 30.95 H new ATOM 0 HG3 MET A 256 30.499 -23.964 -0.113 1.00 30.95 H new ATOM 0 HE1 MET A 256 29.586 -24.821 -4.157 1.00 41.61 H new ATOM 0 HE2 MET A 256 29.124 -23.635 -3.215 1.00 41.61 H new ATOM 0 HE3 MET A 256 30.430 -23.482 -4.098 1.00 41.61 H new ATOM 402 N MET A 257 26.623 -25.324 1.701 1.00 20.55 N ATOM 403 CA MET A 257 25.472 -26.000 2.340 1.00 20.82 C ATOM 404 C MET A 257 24.355 -24.986 2.589 1.00 23.28 C ATOM 405 O MET A 257 23.173 -25.243 2.321 1.00 25.05 O ATOM 406 CB MET A 257 25.879 -26.655 3.665 1.00 23.55 C ATOM 407 CG MET A 257 26.841 -27.831 3.500 1.00 23.29 C ATOM 408 SD MET A 257 26.080 -29.107 2.457 1.00 35.56 S ATOM 409 CE MET A 257 27.441 -30.243 2.451 1.00 30.06 C ATOM 0 H MET A 257 27.359 -25.372 2.144 1.00 20.55 H new ATOM 0 HA MET A 257 25.158 -26.696 1.742 1.00 20.82 H new ATOM 0 HB2 MET A 257 26.293 -25.987 4.233 1.00 23.55 H new ATOM 0 HB3 MET A 257 25.081 -26.962 4.123 1.00 23.55 H new ATOM 0 HG2 MET A 257 27.671 -27.527 3.100 1.00 23.29 H new ATOM 0 HG3 MET A 257 27.064 -28.202 4.368 1.00 23.29 H new ATOM 0 HE1 MET A 257 27.211 -31.022 1.920 1.00 30.06 H new ATOM 0 HE2 MET A 257 28.221 -29.811 2.069 1.00 30.06 H new ATOM 0 HE3 MET A 257 27.637 -30.518 3.360 1.00 30.06 H new ATOM 410 N GLY A 258 24.747 -23.816 3.062 1.00 17.98 N ATOM 411 CA GLY A 258 23.794 -22.740 3.340 1.00 21.25 C ATOM 412 C GLY A 258 23.139 -22.179 2.097 1.00 21.55 C ATOM 413 O GLY A 258 21.927 -21.925 2.082 1.00 23.01 O ATOM 0 H GLY A 258 25.566 -23.617 3.232 1.00 17.98 H new ATOM 0 HA2 GLY A 258 23.106 -23.073 3.937 1.00 21.25 H new ATOM 0 HA3 GLY A 258 24.253 -22.024 3.807 1.00 21.25 H new ATOM 414 N GLU A 259 23.926 -21.946 1.053 1.00 23.53 N ATOM 415 CA GLU A 259 23.371 -21.386 -0.165 1.00 25.17 C ATOM 416 C GLU A 259 22.286 -22.296 -0.745 1.00 25.79 C ATOM 417 O GLU A 259 21.329 -21.836 -1.327 1.00 25.97 O ATOM 418 CB GLU A 259 24.467 -21.130 -1.213 1.00 28.04 C ATOM 419 CG GLU A 259 25.248 -19.834 -1.029 1.00 29.46 C ATOM 420 CD GLU A 259 26.490 -19.717 -1.963 1.00 34.37 C ATOM 421 OE1 GLU A 259 27.244 -20.706 -2.170 1.00 40.59 O ATOM 422 OE2 GLU A 259 26.739 -18.608 -2.458 1.00 29.79 O ATOM 0 H GLU A 259 24.771 -22.103 1.031 1.00 23.53 H new ATOM 0 HA GLU A 259 22.967 -20.535 0.066 1.00 25.17 H new ATOM 0 HB2 GLU A 259 25.091 -21.872 -1.196 1.00 28.04 H new ATOM 0 HB3 GLU A 259 24.058 -21.123 -2.093 1.00 28.04 H new ATOM 0 HG2 GLU A 259 24.657 -19.083 -1.194 1.00 29.46 H new ATOM 0 HG3 GLU A 259 25.539 -19.769 -0.106 1.00 29.46 H new ATOM 423 N ASP A 260 22.439 -23.593 -0.596 1.00 23.28 N ATOM 424 CA ASP A 260 21.417 -24.505 -1.042 1.00 27.20 C ATOM 425 C ASP A 260 20.093 -24.444 -0.273 1.00 27.41 C ATOM 426 O ASP A 260 19.022 -24.772 -0.834 1.00 29.49 O ATOM 427 CB ASP A 260 21.946 -25.920 -1.056 1.00 29.40 C ATOM 428 CG ASP A 260 21.152 -26.806 -1.987 1.00 40.54 C ATOM 429 OD1 ASP A 260 20.278 -27.540 -1.477 1.00 47.36 O ATOM 430 OD2 ASP A 260 21.398 -26.745 -3.215 1.00 45.60 O ATOM 0 H ASP A 260 23.127 -23.965 -0.239 1.00 23.28 H new ATOM 0 HA ASP A 260 21.198 -24.210 -1.940 1.00 27.20 H new ATOM 0 HB2 ASP A 260 22.877 -25.915 -1.330 1.00 29.40 H new ATOM 0 HB3 ASP A 260 21.916 -26.285 -0.158 1.00 29.40 H new ATOM 431 N LYS A 261 20.127 -23.995 0.979 1.00 25.10 N ATOM 432 CA LYS A 261 18.865 -23.797 1.723 1.00 24.49 C ATOM 433 C LYS A 261 18.113 -22.530 1.290 1.00 26.09 C ATOM 434 O LYS A 261 16.887 -22.482 1.359 1.00 27.48 O ATOM 435 CB LYS A 261 19.112 -23.785 3.226 1.00 25.37 C ATOM 436 CG LYS A 261 19.681 -25.091 3.708 1.00 26.45 C ATOM 437 CD LYS A 261 19.933 -25.116 5.190 1.00 23.35 C ATOM 438 CE LYS A 261 20.459 -26.540 5.558 1.00 33.83 C ATOM 439 NZ LYS A 261 20.374 -26.835 7.014 1.00 36.88 N ATOM 0 H LYS A 261 20.844 -23.801 1.413 1.00 25.10 H new ATOM 0 HA LYS A 261 18.297 -24.552 1.505 1.00 24.49 H new ATOM 0 HB2 LYS A 261 19.722 -23.065 3.448 1.00 25.37 H new ATOM 0 HB3 LYS A 261 18.279 -23.604 3.689 1.00 25.37 H new ATOM 0 HG2 LYS A 261 19.070 -25.808 3.478 1.00 26.45 H new ATOM 0 HG3 LYS A 261 20.513 -25.267 3.241 1.00 26.45 H new ATOM 0 HD2 LYS A 261 20.583 -24.439 5.436 1.00 23.35 H new ATOM 0 HD3 LYS A 261 19.118 -24.918 5.677 1.00 23.35 H new ATOM 0 HE2 LYS A 261 19.949 -27.204 5.069 1.00 33.83 H new ATOM 0 HE3 LYS A 261 21.382 -26.623 5.270 1.00 33.83 H new ATOM 0 HZ1 LYS A 261 20.270 -27.711 7.134 1.00 36.88 H new ATOM 0 HZ2 LYS A 261 21.122 -26.568 7.415 1.00 36.88 H new ATOM 0 HZ3 LYS A 261 19.679 -26.403 7.365 1.00 36.88 H new ATOM 440 N ILE A 262 18.841 -21.514 0.831 1.00 25.83 N ATOM 441 CA ILE A 262 18.260 -20.198 0.572 1.00 29.09 C ATOM 442 C ILE A 262 18.083 -19.797 -0.915 1.00 31.91 C ATOM 443 O ILE A 262 17.512 -18.746 -1.226 1.00 29.52 O ATOM 444 CB ILE A 262 18.962 -19.067 1.389 1.00 31.51 C ATOM 445 CG1 ILE A 262 20.471 -18.998 1.121 1.00 34.34 C ATOM 446 CG2 ILE A 262 18.750 -19.329 2.923 1.00 31.57 C ATOM 447 CD1 ILE A 262 20.934 -18.002 0.049 1.00 35.92 C ATOM 0 H ILE A 262 19.682 -21.568 0.662 1.00 25.83 H new ATOM 0 HA ILE A 262 17.351 -20.300 0.893 1.00 29.09 H new ATOM 0 HB ILE A 262 18.565 -18.226 1.112 1.00 31.51 H new ATOM 0 HG12 ILE A 262 20.917 -18.776 1.953 1.00 34.34 H new ATOM 0 HG13 ILE A 262 20.774 -19.883 0.864 1.00 34.34 H new ATOM 0 HG21 ILE A 262 19.185 -18.629 3.434 1.00 31.57 H new ATOM 0 HG22 ILE A 262 17.801 -19.333 3.123 1.00 31.57 H new ATOM 0 HG23 ILE A 262 19.133 -20.188 3.161 1.00 31.57 H new ATOM 0 HD11 ILE A 262 21.899 -18.043 -0.036 1.00 35.92 H new ATOM 0 HD12 ILE A 262 20.525 -18.228 -0.801 1.00 35.92 H new ATOM 0 HD13 ILE A 262 20.670 -17.104 0.306 1.00 35.92 H new ATOM 448 N LYS A 263 18.569 -20.618 -1.828 1.00 30.02 N ATOM 449 CA LYS A 263 18.597 -20.197 -3.205 1.00 33.41 C ATOM 450 C LYS A 263 17.226 -20.054 -3.914 1.00 31.41 C ATOM 451 O LYS A 263 17.113 -19.369 -4.929 1.00 33.33 O ATOM 452 CB LYS A 263 19.570 -21.062 -3.988 1.00 31.76 C ATOM 453 CG LYS A 263 19.193 -22.494 -4.048 1.00 32.60 C ATOM 454 CD LYS A 263 20.104 -23.109 -5.108 1.00 32.43 C ATOM 455 CE LYS A 263 19.526 -24.356 -5.648 1.00 38.83 C ATOM 456 NZ LYS A 263 19.513 -25.319 -4.530 1.00 44.78 N ATOM 0 H LYS A 263 18.880 -21.405 -1.673 1.00 30.02 H new ATOM 0 HA LYS A 263 18.911 -19.279 -3.185 1.00 33.41 H new ATOM 0 HB2 LYS A 263 19.639 -20.717 -4.892 1.00 31.76 H new ATOM 0 HB3 LYS A 263 20.450 -20.986 -3.588 1.00 31.76 H new ATOM 0 HG2 LYS A 263 19.317 -22.925 -3.188 1.00 32.60 H new ATOM 0 HG3 LYS A 263 18.259 -22.600 -4.286 1.00 32.60 H new ATOM 0 HD2 LYS A 263 20.241 -22.474 -5.828 1.00 32.43 H new ATOM 0 HD3 LYS A 263 20.975 -23.293 -4.723 1.00 32.43 H new ATOM 0 HE2 LYS A 263 18.629 -24.205 -5.986 1.00 38.83 H new ATOM 0 HE3 LYS A 263 20.055 -24.691 -6.388 1.00 38.83 H new ATOM 0 HZ1 LYS A 263 19.211 -26.105 -4.818 1.00 44.78 H new ATOM 0 HZ2 LYS A 263 20.339 -25.417 -4.213 1.00 44.78 H new ATOM 0 HZ3 LYS A 263 18.981 -25.017 -3.884 1.00 44.78 H new ATOM 457 N PHE A 264 16.184 -20.674 -3.365 1.00 29.54 N ATOM 458 CA PHE A 264 14.894 -20.709 -4.030 1.00 25.70 C ATOM 459 C PHE A 264 14.308 -19.332 -3.908 1.00 24.21 C ATOM 460 O PHE A 264 13.255 -19.055 -4.439 1.00 26.50 O ATOM 461 CB PHE A 264 13.975 -21.692 -3.306 1.00 28.64 C ATOM 462 CG PHE A 264 13.629 -21.278 -1.932 1.00 25.20 C ATOM 463 CD1 PHE A 264 14.423 -21.635 -0.850 1.00 27.58 C ATOM 464 CD2 PHE A 264 12.497 -20.525 -1.714 1.00 31.19 C ATOM 465 CE1 PHE A 264 14.091 -21.223 0.439 1.00 23.83 C ATOM 466 CE2 PHE A 264 12.139 -20.145 -0.474 1.00 25.21 C ATOM 467 CZ PHE A 264 12.951 -20.492 0.640 1.00 31.67 C ATOM 0 H PHE A 264 16.208 -21.080 -2.607 1.00 29.54 H new ATOM 0 HA PHE A 264 14.988 -20.981 -4.956 1.00 25.70 H new ATOM 0 HB2 PHE A 264 13.158 -21.797 -3.819 1.00 28.64 H new ATOM 0 HB3 PHE A 264 14.404 -22.561 -3.275 1.00 28.64 H new ATOM 0 HD1 PHE A 264 15.183 -22.153 -0.987 1.00 27.58 H new ATOM 0 HD2 PHE A 264 11.970 -20.274 -2.438 1.00 31.19 H new ATOM 0 HE1 PHE A 264 14.639 -21.443 1.157 1.00 23.83 H new ATOM 0 HE2 PHE A 264 11.359 -19.655 -0.346 1.00 25.21 H new ATOM 0 HZ PHE A 264 12.710 -20.225 1.498 1.00 31.67 H new ATOM 468 N LYS A 265 14.995 -18.496 -3.164 1.00 21.35 N ATOM 469 CA LYS A 265 14.448 -17.251 -2.671 1.00 26.73 C ATOM 470 C LYS A 265 14.432 -16.209 -3.779 1.00 24.47 C ATOM 471 O LYS A 265 13.521 -15.347 -3.810 1.00 23.12 O ATOM 472 CB LYS A 265 15.305 -16.729 -1.528 1.00 25.27 C ATOM 473 CG LYS A 265 14.607 -16.545 -0.204 1.00 35.02 C ATOM 474 CD LYS A 265 15.632 -16.310 0.938 1.00 36.02 C ATOM 475 CE LYS A 265 16.640 -15.162 0.640 1.00 44.11 C ATOM 476 NZ LYS A 265 18.002 -15.267 1.355 1.00 41.76 N ATOM 0 H LYS A 265 15.809 -18.636 -2.925 1.00 21.35 H new ATOM 0 HA LYS A 265 13.543 -17.414 -2.362 1.00 26.73 H new ATOM 0 HB2 LYS A 265 16.047 -17.340 -1.399 1.00 25.27 H new ATOM 0 HB3 LYS A 265 15.683 -15.876 -1.795 1.00 25.27 H new ATOM 0 HG2 LYS A 265 13.999 -15.791 -0.257 1.00 35.02 H new ATOM 0 HG3 LYS A 265 14.071 -17.329 -0.006 1.00 35.02 H new ATOM 0 HD2 LYS A 265 15.153 -16.106 1.756 1.00 36.02 H new ATOM 0 HD3 LYS A 265 16.125 -17.131 1.095 1.00 36.02 H new ATOM 0 HE2 LYS A 265 16.797 -15.132 -0.317 1.00 44.11 H new ATOM 0 HE3 LYS A 265 16.228 -14.319 0.887 1.00 44.11 H new ATOM 0 HZ1 LYS A 265 18.243 -14.464 1.655 1.00 41.76 H new ATOM 0 HZ2 LYS A 265 17.935 -15.831 2.040 1.00 41.76 H new ATOM 0 HZ3 LYS A 265 18.615 -15.566 0.784 1.00 41.76 H new ATOM 477 N HIS A 266 15.459 -16.272 -4.642 1.00 19.57 N ATOM 478 CA HIS A 266 15.625 -15.321 -5.747 1.00 25.02 C ATOM 479 C HIS A 266 15.635 -16.041 -7.072 1.00 25.66 C ATOM 480 O HIS A 266 16.084 -17.196 -7.162 1.00 24.32 O ATOM 481 CB HIS A 266 16.903 -14.487 -5.553 1.00 24.66 C ATOM 482 CG HIS A 266 16.917 -13.760 -4.251 1.00 34.35 C ATOM 483 ND1 HIS A 266 16.114 -12.660 -4.008 1.00 34.68 N ATOM 484 CD2 HIS A 266 17.549 -14.034 -3.084 1.00 38.72 C ATOM 485 CE1 HIS A 266 16.279 -12.272 -2.753 1.00 40.06 C ATOM 486 NE2 HIS A 266 17.151 -13.081 -2.173 1.00 37.94 N ATOM 0 H HIS A 266 16.077 -16.869 -4.600 1.00 19.57 H new ATOM 0 HA HIS A 266 14.870 -14.712 -5.748 1.00 25.02 H new ATOM 0 HB2 HIS A 266 17.677 -15.070 -5.603 1.00 24.66 H new ATOM 0 HB3 HIS A 266 16.982 -13.848 -6.278 1.00 24.66 H new ATOM 0 HD2 HIS A 266 18.141 -14.734 -2.928 1.00 38.72 H new ATOM 0 HE1 HIS A 266 15.853 -11.552 -2.347 1.00 40.06 H new ATOM 0 HE2 HIS A 266 17.425 -13.021 -1.360 1.00 37.94 H new ATOM 487 N ILE A 267 15.135 -15.380 -8.113 1.00 23.39 N ATOM 488 CA ILE A 267 15.217 -15.977 -9.418 1.00 21.73 C ATOM 489 C ILE A 267 16.674 -16.303 -9.764 1.00 25.60 C ATOM 490 O ILE A 267 17.636 -15.686 -9.238 1.00 24.83 O ATOM 491 CB ILE A 267 14.649 -15.067 -10.498 1.00 25.29 C ATOM 492 CG1 ILE A 267 15.479 -13.763 -10.584 1.00 20.12 C ATOM 493 CG2 ILE A 267 13.149 -14.892 -10.254 1.00 19.34 C ATOM 494 CD1 ILE A 267 15.081 -12.760 -11.726 1.00 24.78 C ATOM 0 H ILE A 267 14.757 -14.608 -8.078 1.00 23.39 H new ATOM 0 HA ILE A 267 14.688 -16.790 -9.390 1.00 21.73 H new ATOM 0 HB ILE A 267 14.727 -15.457 -11.383 1.00 25.29 H new ATOM 0 HG12 ILE A 267 15.409 -13.301 -9.734 1.00 20.12 H new ATOM 0 HG13 ILE A 267 16.412 -14.003 -10.700 1.00 20.12 H new ATOM 0 HG21 ILE A 267 12.775 -14.313 -10.937 1.00 19.34 H new ATOM 0 HG22 ILE A 267 12.712 -15.757 -10.290 1.00 19.34 H new ATOM 0 HG23 ILE A 267 13.007 -14.494 -9.381 1.00 19.34 H new ATOM 0 HD11 ILE A 267 15.660 -11.982 -11.690 1.00 24.78 H new ATOM 0 HD12 ILE A 267 15.178 -13.195 -12.587 1.00 24.78 H new ATOM 0 HD13 ILE A 267 14.159 -12.482 -11.606 1.00 24.78 H new ATOM 495 N THR A 268 16.812 -17.253 -10.675 1.00 26.87 N ATOM 496 CA THR A 268 18.100 -17.857 -11.025 1.00 34.16 C ATOM 497 C THR A 268 19.296 -16.927 -11.259 1.00 34.20 C ATOM 498 O THR A 268 20.380 -17.158 -10.685 1.00 38.53 O ATOM 499 CB THR A 268 17.937 -18.817 -12.197 1.00 33.98 C ATOM 500 OG1 THR A 268 17.016 -19.853 -11.804 1.00 38.37 O ATOM 501 CG2 THR A 268 19.307 -19.450 -12.582 1.00 40.89 C ATOM 0 H THR A 268 16.150 -17.575 -11.119 1.00 26.87 H new ATOM 0 HA THR A 268 18.346 -18.321 -10.210 1.00 34.16 H new ATOM 0 HB THR A 268 17.600 -18.336 -12.969 1.00 33.98 H new ATOM 0 HG1 THR A 268 16.333 -19.821 -12.292 1.00 38.37 H new ATOM 0 HG21 THR A 268 19.185 -20.057 -13.328 1.00 40.89 H new ATOM 0 HG22 THR A 268 19.928 -18.749 -12.834 1.00 40.89 H new ATOM 0 HG23 THR A 268 19.663 -19.939 -11.823 1.00 40.89 H new ATOM 502 N PRO A 269 19.127 -15.883 -12.095 1.00 34.71 N ATOM 503 CA PRO A 269 20.259 -14.935 -12.225 1.00 34.85 C ATOM 504 C PRO A 269 20.755 -14.294 -10.927 1.00 35.65 C ATOM 505 O PRO A 269 21.938 -13.972 -10.818 1.00 40.72 O ATOM 506 CB PRO A 269 19.721 -13.845 -13.177 1.00 36.15 C ATOM 507 CG PRO A 269 18.527 -14.467 -13.897 1.00 35.25 C ATOM 508 CD PRO A 269 17.973 -15.534 -12.957 1.00 30.59 C ATOM 0 HA PRO A 269 21.040 -15.416 -12.541 1.00 34.85 H new ATOM 0 HB2 PRO A 269 19.455 -13.053 -12.683 1.00 36.15 H new ATOM 0 HB3 PRO A 269 20.403 -13.569 -13.810 1.00 36.15 H new ATOM 0 HG2 PRO A 269 17.854 -13.797 -14.095 1.00 35.25 H new ATOM 0 HG3 PRO A 269 18.797 -14.857 -14.743 1.00 35.25 H new ATOM 0 HD2 PRO A 269 17.229 -15.196 -12.435 1.00 30.59 H new ATOM 0 HD3 PRO A 269 17.649 -16.306 -13.447 1.00 30.59 H new ATOM 509 N LEU A 270 19.885 -14.057 -9.960 1.00 33.16 N ATOM 510 CA LEU A 270 20.322 -13.340 -8.782 1.00 33.77 C ATOM 511 C LEU A 270 21.156 -14.171 -7.811 1.00 36.38 C ATOM 512 O LEU A 270 21.590 -13.665 -6.775 1.00 38.76 O ATOM 513 CB LEU A 270 19.144 -12.748 -8.032 1.00 31.47 C ATOM 514 CG LEU A 270 18.221 -11.768 -8.750 1.00 38.12 C ATOM 515 CD1 LEU A 270 17.294 -11.207 -7.680 1.00 33.16 C ATOM 516 CD2 LEU A 270 19.015 -10.671 -9.436 1.00 36.91 C ATOM 0 H LEU A 270 19.059 -14.296 -9.965 1.00 33.16 H new ATOM 0 HA LEU A 270 20.897 -12.638 -9.124 1.00 33.77 H new ATOM 0 HB2 LEU A 270 18.598 -13.485 -7.717 1.00 31.47 H new ATOM 0 HB3 LEU A 270 19.494 -12.298 -7.247 1.00 31.47 H new ATOM 0 HG LEU A 270 17.715 -12.205 -9.453 1.00 38.12 H new ATOM 0 HD11 LEU A 270 16.680 -10.573 -8.083 1.00 33.16 H new ATOM 0 HD12 LEU A 270 16.791 -11.931 -7.276 1.00 33.16 H new ATOM 0 HD13 LEU A 270 17.820 -10.759 -6.999 1.00 33.16 H new ATOM 0 HD21 LEU A 270 18.407 -10.063 -9.884 1.00 36.91 H new ATOM 0 HD22 LEU A 270 19.531 -10.183 -8.775 1.00 36.91 H new ATOM 0 HD23 LEU A 270 19.616 -11.065 -10.088 1.00 36.91 H new ATOM 517 N GLN A 271 21.381 -15.437 -8.138 1.00 37.65 N ATOM 518 CA GLN A 271 22.266 -16.307 -7.352 1.00 39.41 C ATOM 519 C GLN A 271 23.765 -16.035 -7.600 1.00 39.97 C ATOM 520 O GLN A 271 24.610 -16.311 -6.765 1.00 39.53 O ATOM 521 CB GLN A 271 21.867 -17.755 -7.653 1.00 38.45 C ATOM 522 CG GLN A 271 20.340 -17.911 -7.481 1.00 39.73 C ATOM 523 CD GLN A 271 19.818 -19.259 -7.852 1.00 49.00 C ATOM 524 OE1 GLN A 271 20.581 -20.127 -8.285 1.00 51.64 O ATOM 525 NE2 GLN A 271 18.495 -19.472 -7.657 1.00 48.59 N ATOM 0 H GLN A 271 21.028 -15.822 -8.821 1.00 37.65 H new ATOM 0 HA GLN A 271 22.151 -16.120 -6.407 1.00 39.41 H new ATOM 0 HB2 GLN A 271 22.127 -17.992 -8.557 1.00 38.45 H new ATOM 0 HB3 GLN A 271 22.334 -18.361 -7.056 1.00 38.45 H new ATOM 0 HG2 GLN A 271 20.108 -17.728 -6.557 1.00 39.73 H new ATOM 0 HG3 GLN A 271 19.893 -17.242 -8.023 1.00 39.73 H new ATOM 0 HE21 GLN A 271 17.998 -18.839 -7.353 1.00 48.59 H new ATOM 0 HE22 GLN A 271 18.152 -20.240 -7.837 1.00 48.59 H new ATOM 526 N GLU A 272 24.070 -15.449 -8.750 1.00 41.66 N ATOM 527 CA GLU A 272 25.435 -15.156 -9.168 1.00 42.87 C ATOM 528 C GLU A 272 26.428 -16.224 -8.771 1.00 41.60 C ATOM 529 O GLU A 272 27.520 -15.909 -8.311 1.00 41.22 O ATOM 530 CB GLU A 272 25.883 -13.780 -8.684 1.00 44.97 C ATOM 531 CG GLU A 272 25.481 -12.656 -9.651 1.00 47.69 C ATOM 532 CD GLU A 272 24.453 -11.771 -9.024 1.00 50.37 C ATOM 533 OE1 GLU A 272 24.403 -11.797 -7.777 1.00 54.66 O ATOM 534 OE2 GLU A 272 23.706 -11.071 -9.746 1.00 46.16 O ATOM 0 H GLU A 272 23.476 -15.205 -9.322 1.00 41.66 H new ATOM 0 HA GLU A 272 25.419 -15.149 -10.138 1.00 42.87 H new ATOM 0 HB2 GLU A 272 25.496 -13.606 -7.812 1.00 44.97 H new ATOM 0 HB3 GLU A 272 26.847 -13.778 -8.573 1.00 44.97 H new ATOM 0 HG2 GLU A 272 26.262 -12.134 -9.892 1.00 47.69 H new ATOM 0 HG3 GLU A 272 25.131 -13.037 -10.471 1.00 47.69 H new ATOM 535 N GLN A 273 26.008 -17.477 -8.943 1.00 43.14 N ATOM 536 CA GLN A 273 26.868 -18.680 -9.026 1.00 47.15 C ATOM 537 C GLN A 273 28.300 -18.509 -9.504 1.00 45.14 C ATOM 538 O GLN A 273 29.184 -19.216 -9.034 1.00 46.25 O ATOM 539 CB GLN A 273 26.234 -19.715 -9.953 1.00 47.13 C ATOM 540 CG GLN A 273 25.272 -20.686 -9.272 1.00 57.47 C ATOM 541 CD GLN A 273 24.455 -21.514 -10.284 1.00 55.92 C ATOM 542 OE1 GLN A 273 23.462 -21.032 -10.852 1.00 63.40 O ATOM 543 NE2 GLN A 273 24.873 -22.761 -10.505 1.00 63.07 N ATOM 0 H GLN A 273 25.173 -17.667 -9.019 1.00 43.14 H new ATOM 0 HA GLN A 273 26.925 -18.946 -8.095 1.00 47.15 H new ATOM 0 HB2 GLN A 273 25.757 -19.249 -10.658 1.00 47.13 H new ATOM 0 HB3 GLN A 273 26.941 -20.225 -10.378 1.00 47.13 H new ATOM 0 HG2 GLN A 273 25.774 -21.286 -8.699 1.00 57.47 H new ATOM 0 HG3 GLN A 273 24.666 -20.189 -8.701 1.00 57.47 H new ATOM 0 HE21 GLN A 273 25.566 -23.062 -10.093 1.00 63.07 H new ATOM 0 HE22 GLN A 273 24.450 -23.264 -11.059 1.00 63.07 H new ATOM 544 N SER A 274 28.515 -17.639 -10.489 1.00 43.49 N ATOM 545 CA SER A 274 29.751 -17.665 -11.274 1.00 43.40 C ATOM 546 C SER A 274 30.818 -16.745 -10.653 1.00 40.98 C ATOM 547 O SER A 274 31.973 -16.685 -11.117 1.00 41.72 O ATOM 548 CB SER A 274 29.469 -17.283 -12.739 1.00 44.05 C ATOM 549 OG SER A 274 28.667 -16.110 -12.822 1.00 50.89 O ATOM 0 H SER A 274 27.959 -17.025 -10.720 1.00 43.49 H new ATOM 0 HA SER A 274 30.101 -18.570 -11.262 1.00 43.40 H new ATOM 0 HB2 SER A 274 30.307 -17.138 -13.205 1.00 44.05 H new ATOM 0 HB3 SER A 274 29.019 -18.017 -13.186 1.00 44.05 H new ATOM 0 HG SER A 274 28.528 -15.922 -13.629 1.00 50.89 H new ATOM 550 N LYS A 275 30.424 -16.048 -9.586 1.00 35.98 N ATOM 551 CA LYS A 275 31.262 -15.034 -8.988 1.00 31.33 C ATOM 552 C LYS A 275 31.979 -15.610 -7.776 1.00 29.29 C ATOM 553 O LYS A 275 31.499 -16.558 -7.140 1.00 30.87 O ATOM 554 CB LYS A 275 30.428 -13.817 -8.650 1.00 33.02 C ATOM 555 CG LYS A 275 30.199 -12.921 -9.865 1.00 41.76 C ATOM 556 CD LYS A 275 28.863 -12.193 -9.764 1.00 53.36 C ATOM 557 CE LYS A 275 28.577 -11.371 -11.025 1.00 62.62 C ATOM 558 NZ LYS A 275 29.355 -10.079 -11.045 1.00 64.42 N ATOM 0 H LYS A 275 29.665 -16.156 -9.196 1.00 35.98 H new ATOM 0 HA LYS A 275 31.945 -14.748 -9.615 1.00 31.33 H new ATOM 0 HB2 LYS A 275 29.572 -14.102 -8.294 1.00 33.02 H new ATOM 0 HB3 LYS A 275 30.870 -13.307 -7.953 1.00 33.02 H new ATOM 0 HG2 LYS A 275 30.919 -12.275 -9.934 1.00 41.76 H new ATOM 0 HG3 LYS A 275 30.219 -13.456 -10.674 1.00 41.76 H new ATOM 0 HD2 LYS A 275 28.151 -12.838 -9.628 1.00 53.36 H new ATOM 0 HD3 LYS A 275 28.869 -11.609 -8.990 1.00 53.36 H new ATOM 0 HE2 LYS A 275 28.802 -11.895 -11.810 1.00 62.62 H new ATOM 0 HE3 LYS A 275 27.628 -11.177 -11.075 1.00 62.62 H new ATOM 0 HZ1 LYS A 275 29.060 -9.565 -11.709 1.00 64.42 H new ATOM 0 HZ2 LYS A 275 29.246 -9.654 -10.271 1.00 64.42 H new ATOM 0 HZ3 LYS A 275 30.219 -10.254 -11.167 1.00 64.42 H new ATOM 559 N GLU A 276 33.158 -15.067 -7.481 1.00 25.34 N ATOM 560 CA GLU A 276 33.921 -15.498 -6.358 1.00 23.71 C ATOM 561 C GLU A 276 33.103 -15.165 -5.110 1.00 25.85 C ATOM 562 O GLU A 276 32.291 -14.232 -5.122 1.00 23.43 O ATOM 563 CB GLU A 276 35.231 -14.738 -6.352 1.00 25.97 C ATOM 564 CG GLU A 276 35.074 -13.371 -5.792 1.00 33.06 C ATOM 565 CD GLU A 276 36.372 -12.650 -5.675 1.00 37.50 C ATOM 566 OE1 GLU A 276 36.715 -11.942 -6.660 1.00 39.60 O ATOM 567 OE2 GLU A 276 37.036 -12.782 -4.614 1.00 39.56 O ATOM 0 H GLU A 276 33.524 -14.437 -7.938 1.00 25.34 H new ATOM 0 HA GLU A 276 34.112 -16.448 -6.388 1.00 23.71 H new ATOM 0 HB2 GLU A 276 35.886 -15.228 -5.831 1.00 25.97 H new ATOM 0 HB3 GLU A 276 35.575 -14.679 -7.257 1.00 25.97 H new ATOM 0 HG2 GLU A 276 34.474 -12.860 -6.357 1.00 33.06 H new ATOM 0 HG3 GLU A 276 34.659 -13.429 -4.917 1.00 33.06 H new ATOM 568 N VAL A 277 33.335 -15.881 -4.028 1.00 25.75 N ATOM 569 CA VAL A 277 32.455 -15.757 -2.900 1.00 25.11 C ATOM 570 C VAL A 277 32.408 -14.371 -2.253 1.00 22.12 C ATOM 571 O VAL A 277 31.348 -13.966 -1.867 1.00 24.03 O ATOM 572 CB VAL A 277 32.584 -16.890 -1.855 1.00 27.25 C ATOM 573 CG1 VAL A 277 33.007 -18.201 -2.460 1.00 29.10 C ATOM 574 CG2 VAL A 277 33.423 -16.474 -0.702 1.00 32.01 C ATOM 0 H VAL A 277 33.986 -16.434 -3.931 1.00 25.75 H new ATOM 0 HA VAL A 277 31.583 -15.871 -3.310 1.00 25.11 H new ATOM 0 HB VAL A 277 31.695 -17.055 -1.504 1.00 27.25 H new ATOM 0 HG11 VAL A 277 33.072 -18.873 -1.764 1.00 29.10 H new ATOM 0 HG12 VAL A 277 32.352 -18.480 -3.118 1.00 29.10 H new ATOM 0 HG13 VAL A 277 33.871 -18.096 -2.889 1.00 29.10 H new ATOM 0 HG21 VAL A 277 33.484 -17.204 -0.066 1.00 32.01 H new ATOM 0 HG22 VAL A 277 34.312 -16.243 -1.015 1.00 32.01 H new ATOM 0 HG23 VAL A 277 33.022 -15.703 -0.271 1.00 32.01 H new ATOM 575 N ALA A 278 33.532 -13.648 -2.139 1.00 20.74 N ATOM 576 CA ALA A 278 33.498 -12.311 -1.544 1.00 22.12 C ATOM 577 C ALA A 278 32.498 -11.445 -2.261 1.00 25.19 C ATOM 578 O ALA A 278 31.764 -10.699 -1.625 1.00 23.40 O ATOM 579 CB ALA A 278 34.863 -11.646 -1.524 1.00 25.26 C ATOM 0 H ALA A 278 34.309 -13.911 -2.396 1.00 20.74 H new ATOM 0 HA ALA A 278 33.224 -12.417 -0.620 1.00 22.12 H new ATOM 0 HB1 ALA A 278 34.789 -10.766 -1.122 1.00 25.26 H new ATOM 0 HB2 ALA A 278 35.479 -12.187 -1.006 1.00 25.26 H new ATOM 0 HB3 ALA A 278 35.194 -11.559 -2.432 1.00 25.26 H new ATOM 580 N ILE A 279 32.407 -11.614 -3.583 1.00 27.48 N ATOM 581 CA ILE A 279 31.484 -10.830 -4.405 1.00 27.31 C ATOM 582 C ILE A 279 30.069 -11.360 -4.315 1.00 25.68 C ATOM 583 O ILE A 279 29.127 -10.580 -4.318 1.00 27.51 O ATOM 584 CB ILE A 279 31.971 -10.744 -5.887 1.00 27.10 C ATOM 585 CG1 ILE A 279 33.333 -10.069 -5.948 1.00 34.01 C ATOM 586 CG2 ILE A 279 30.965 -10.020 -6.786 1.00 30.19 C ATOM 587 CD1 ILE A 279 33.278 -8.572 -5.846 1.00 28.11 C ATOM 0 H ILE A 279 32.876 -12.183 -4.025 1.00 27.48 H new ATOM 0 HA ILE A 279 31.476 -9.928 -4.049 1.00 27.31 H new ATOM 0 HB ILE A 279 32.048 -11.650 -6.225 1.00 27.10 H new ATOM 0 HG12 ILE A 279 33.886 -10.413 -5.229 1.00 34.01 H new ATOM 0 HG13 ILE A 279 33.767 -10.311 -6.781 1.00 34.01 H new ATOM 0 HG21 ILE A 279 31.306 -9.989 -7.694 1.00 30.19 H new ATOM 0 HG22 ILE A 279 30.120 -10.495 -6.774 1.00 30.19 H new ATOM 0 HG23 ILE A 279 30.832 -9.116 -6.460 1.00 30.19 H new ATOM 0 HD11 ILE A 279 34.177 -8.211 -5.892 1.00 28.11 H new ATOM 0 HD12 ILE A 279 32.750 -8.217 -6.578 1.00 28.11 H new ATOM 0 HD13 ILE A 279 32.871 -8.320 -5.002 1.00 28.11 H new ATOM 588 N ARG A 280 29.871 -12.666 -4.231 1.00 26.29 N ATOM 589 CA ARG A 280 28.480 -13.137 -4.064 1.00 26.14 C ATOM 590 C ARG A 280 27.904 -12.608 -2.731 1.00 26.39 C ATOM 591 O ARG A 280 26.720 -12.276 -2.668 1.00 25.33 O ATOM 592 CB ARG A 280 28.321 -14.649 -4.052 1.00 22.26 C ATOM 593 CG ARG A 280 28.974 -15.408 -5.171 1.00 23.76 C ATOM 594 CD ARG A 280 28.287 -16.706 -5.422 1.00 26.43 C ATOM 595 NE ARG A 280 28.537 -17.739 -4.404 1.00 31.58 N ATOM 596 CZ ARG A 280 29.611 -18.528 -4.372 1.00 35.74 C ATOM 597 NH1 ARG A 280 29.714 -19.470 -3.434 1.00 27.74 N ATOM 598 NH2 ARG A 280 30.582 -18.375 -5.285 1.00 31.84 N ATOM 0 H ARG A 280 30.479 -13.274 -4.264 1.00 26.29 H new ATOM 0 HA ARG A 280 28.006 -12.796 -4.838 1.00 26.14 H new ATOM 0 HB2 ARG A 280 28.675 -14.983 -3.213 1.00 22.26 H new ATOM 0 HB3 ARG A 280 27.373 -14.853 -4.061 1.00 22.26 H new ATOM 0 HG2 ARG A 280 28.960 -14.871 -5.979 1.00 23.76 H new ATOM 0 HG3 ARG A 280 29.905 -15.570 -4.954 1.00 23.76 H new ATOM 0 HD2 ARG A 280 27.332 -16.547 -5.477 1.00 26.43 H new ATOM 0 HD3 ARG A 280 28.568 -17.045 -6.286 1.00 26.43 H new ATOM 0 HE ARG A 280 27.948 -17.841 -3.786 1.00 31.58 H new ATOM 0 HH11 ARG A 280 29.089 -19.567 -2.852 1.00 27.74 H new ATOM 0 HH12 ARG A 280 30.406 -19.980 -3.411 1.00 27.74 H new ATOM 0 HH21 ARG A 280 30.511 -17.768 -5.890 1.00 31.84 H new ATOM 0 HH22 ARG A 280 31.275 -18.884 -5.265 1.00 31.84 H new ATOM 599 N ILE A 281 28.737 -12.569 -1.684 1.00 23.92 N ATOM 600 CA ILE A 281 28.277 -12.158 -0.347 1.00 23.89 C ATOM 601 C ILE A 281 27.904 -10.700 -0.392 1.00 23.73 C ATOM 602 O ILE A 281 26.848 -10.304 0.113 1.00 29.09 O ATOM 603 CB ILE A 281 29.317 -12.412 0.772 1.00 22.75 C ATOM 604 CG1 ILE A 281 29.340 -13.919 1.129 1.00 23.90 C ATOM 605 CG2 ILE A 281 28.903 -11.628 2.066 1.00 26.50 C ATOM 606 CD1 ILE A 281 30.749 -14.395 1.589 1.00 19.85 C ATOM 0 H ILE A 281 29.571 -12.776 -1.725 1.00 23.92 H new ATOM 0 HA ILE A 281 27.509 -12.706 -0.122 1.00 23.89 H new ATOM 0 HB ILE A 281 30.187 -12.120 0.457 1.00 22.75 H new ATOM 0 HG12 ILE A 281 28.696 -14.092 1.834 1.00 23.90 H new ATOM 0 HG13 ILE A 281 29.062 -14.437 0.357 1.00 23.90 H new ATOM 0 HG21 ILE A 281 29.556 -11.789 2.765 1.00 26.50 H new ATOM 0 HG22 ILE A 281 28.866 -10.678 1.871 1.00 26.50 H new ATOM 0 HG23 ILE A 281 28.031 -11.931 2.363 1.00 26.50 H new ATOM 0 HD11 ILE A 281 30.718 -15.341 1.802 1.00 19.85 H new ATOM 0 HD12 ILE A 281 31.390 -14.245 0.876 1.00 19.85 H new ATOM 0 HD13 ILE A 281 31.019 -13.896 2.376 1.00 19.85 H new ATOM 607 N PHE A 282 28.739 -9.903 -1.049 1.00 24.96 N ATOM 608 CA PHE A 282 28.465 -8.482 -1.230 1.00 25.30 C ATOM 609 C PHE A 282 27.209 -8.261 -2.090 1.00 24.01 C ATOM 610 O PHE A 282 26.336 -7.421 -1.782 1.00 27.20 O ATOM 611 CB PHE A 282 29.646 -7.787 -1.929 1.00 27.90 C ATOM 612 CG PHE A 282 29.305 -6.410 -2.359 1.00 28.18 C ATOM 613 CD1 PHE A 282 29.364 -5.364 -1.442 1.00 35.72 C ATOM 614 CD2 PHE A 282 28.829 -6.163 -3.639 1.00 32.60 C ATOM 615 CE1 PHE A 282 29.015 -4.074 -1.803 1.00 39.20 C ATOM 616 CE2 PHE A 282 28.469 -4.877 -4.006 1.00 38.30 C ATOM 617 CZ PHE A 282 28.561 -3.830 -3.084 1.00 32.07 C ATOM 0 H PHE A 282 29.477 -10.169 -1.401 1.00 24.96 H new ATOM 0 HA PHE A 282 28.327 -8.106 -0.347 1.00 25.30 H new ATOM 0 HB2 PHE A 282 30.406 -7.758 -1.326 1.00 27.90 H new ATOM 0 HB3 PHE A 282 29.916 -8.308 -2.701 1.00 27.90 H new ATOM 0 HD1 PHE A 282 29.643 -5.535 -0.571 1.00 35.72 H new ATOM 0 HD2 PHE A 282 28.752 -6.860 -4.250 1.00 32.60 H new ATOM 0 HE1 PHE A 282 29.086 -3.379 -1.189 1.00 39.20 H new ATOM 0 HE2 PHE A 282 28.165 -4.709 -4.869 1.00 38.30 H new ATOM 0 HZ PHE A 282 28.316 -2.968 -3.334 1.00 32.07 H new ATOM 618 N GLN A 283 27.085 -9.017 -3.169 1.00 22.04 N ATOM 619 CA GLN A 283 25.864 -8.944 -4.014 1.00 24.10 C ATOM 620 C GLN A 283 24.624 -9.332 -3.216 1.00 25.64 C ATOM 621 O GLN A 283 23.587 -8.715 -3.362 1.00 24.78 O ATOM 622 CB GLN A 283 25.954 -9.857 -5.255 1.00 25.62 C ATOM 623 CG GLN A 283 27.051 -9.459 -6.285 1.00 29.14 C ATOM 624 CD GLN A 283 26.937 -8.009 -6.796 1.00 43.79 C ATOM 625 OE1 GLN A 283 25.848 -7.532 -7.102 1.00 47.22 O ATOM 626 NE2 GLN A 283 28.073 -7.322 -6.905 1.00 44.15 N ATOM 0 H GLN A 283 27.679 -9.577 -3.440 1.00 22.04 H new ATOM 0 HA GLN A 283 25.796 -8.023 -4.310 1.00 24.10 H new ATOM 0 HB2 GLN A 283 26.121 -10.766 -4.960 1.00 25.62 H new ATOM 0 HB3 GLN A 283 25.094 -9.857 -5.703 1.00 25.62 H new ATOM 0 HG2 GLN A 283 27.923 -9.581 -5.878 1.00 29.14 H new ATOM 0 HG3 GLN A 283 27.005 -10.063 -7.042 1.00 29.14 H new ATOM 0 HE21 GLN A 283 28.819 -7.687 -6.682 1.00 44.15 H new ATOM 0 HE22 GLN A 283 28.060 -6.514 -7.199 1.00 44.15 H new ATOM 627 N GLY A 284 24.728 -10.395 -2.413 1.00 26.62 N ATOM 628 CA GLY A 284 23.656 -10.797 -1.512 1.00 25.98 C ATOM 629 C GLY A 284 23.272 -9.736 -0.479 1.00 26.06 C ATOM 630 O GLY A 284 22.081 -9.524 -0.240 1.00 28.29 O ATOM 0 H GLY A 284 25.423 -10.900 -2.379 1.00 26.62 H new ATOM 0 HA2 GLY A 284 22.872 -11.020 -2.038 1.00 25.98 H new ATOM 0 HA3 GLY A 284 23.925 -11.605 -1.046 1.00 25.98 H new ATOM 631 N CYS A 285 24.247 -9.075 0.156 1.00 25.17 N ATOM 632 CA CYS A 285 23.894 -7.970 1.064 1.00 24.14 C ATOM 633 C CYS A 285 23.212 -6.843 0.365 1.00 25.76 C ATOM 634 O CYS A 285 22.301 -6.250 0.897 1.00 22.38 O ATOM 635 CB CYS A 285 25.122 -7.352 1.703 1.00 24.56 C ATOM 636 SG CYS A 285 25.900 -8.471 2.757 1.00 30.33 S ATOM 0 H CYS A 285 25.088 -9.240 0.081 1.00 25.17 H new ATOM 0 HA CYS A 285 23.308 -8.379 1.720 1.00 24.14 H new ATOM 0 HB2 CYS A 285 25.742 -7.068 1.013 1.00 24.56 H new ATOM 0 HB3 CYS A 285 24.868 -6.558 2.199 1.00 24.56 H new ATOM 0 HG CYS A 285 26.432 -9.329 2.108 1.00 30.33 H new ATOM 637 N GLN A 286 23.722 -6.457 -0.806 1.00 25.18 N ATOM 638 CA GLN A 286 23.171 -5.294 -1.489 1.00 28.36 C ATOM 639 C GLN A 286 21.788 -5.635 -1.969 1.00 25.43 C ATOM 640 O GLN A 286 20.905 -4.800 -1.974 1.00 28.12 O ATOM 641 CB GLN A 286 24.045 -4.867 -2.671 1.00 30.54 C ATOM 642 CG GLN A 286 23.611 -5.505 -3.915 1.00 40.53 C ATOM 643 CD GLN A 286 23.889 -4.634 -5.070 1.00 49.27 C ATOM 644 OE1 GLN A 286 22.992 -3.991 -5.602 1.00 41.42 O ATOM 645 NE2 GLN A 286 25.163 -4.572 -5.464 1.00 57.39 N ATOM 0 H GLN A 286 24.372 -6.847 -1.212 1.00 25.18 H new ATOM 0 HA GLN A 286 23.142 -4.550 -0.868 1.00 28.36 H new ATOM 0 HB2 GLN A 286 24.009 -3.903 -2.770 1.00 30.54 H new ATOM 0 HB3 GLN A 286 24.970 -5.099 -2.492 1.00 30.54 H new ATOM 0 HG2 GLN A 286 24.068 -6.353 -4.026 1.00 40.53 H new ATOM 0 HG3 GLN A 286 22.662 -5.698 -3.871 1.00 40.53 H new ATOM 0 HE21 GLN A 286 25.761 -5.041 -5.062 1.00 57.39 H new ATOM 0 HE22 GLN A 286 25.386 -4.063 -6.120 1.00 57.39 H new ATOM 646 N PHE A 287 21.558 -6.874 -2.347 1.00 28.53 N ATOM 647 CA PHE A 287 20.181 -7.217 -2.676 1.00 25.15 C ATOM 648 C PHE A 287 19.238 -7.282 -1.444 1.00 25.73 C ATOM 649 O PHE A 287 18.071 -6.928 -1.518 1.00 26.19 O ATOM 650 CB PHE A 287 20.074 -8.476 -3.507 1.00 27.91 C ATOM 651 CG PHE A 287 18.743 -8.609 -4.135 1.00 33.05 C ATOM 652 CD1 PHE A 287 18.536 -8.201 -5.445 1.00 33.84 C ATOM 653 CD2 PHE A 287 17.655 -9.029 -3.390 1.00 35.82 C ATOM 654 CE1 PHE A 287 17.255 -8.263 -6.025 1.00 30.26 C ATOM 655 CE2 PHE A 287 16.379 -9.079 -3.969 1.00 36.13 C ATOM 656 CZ PHE A 287 16.195 -8.694 -5.290 1.00 30.66 C ATOM 0 H PHE A 287 22.141 -7.502 -2.419 1.00 28.53 H new ATOM 0 HA PHE A 287 19.871 -6.476 -3.221 1.00 25.15 H new ATOM 0 HB2 PHE A 287 20.757 -8.468 -4.196 1.00 27.91 H new ATOM 0 HB3 PHE A 287 20.246 -9.249 -2.947 1.00 27.91 H new ATOM 0 HD1 PHE A 287 19.252 -7.883 -5.946 1.00 33.84 H new ATOM 0 HD2 PHE A 287 17.771 -9.279 -2.502 1.00 35.82 H new ATOM 0 HE1 PHE A 287 17.133 -8.009 -6.911 1.00 30.26 H new ATOM 0 HE2 PHE A 287 15.653 -9.371 -3.466 1.00 36.13 H new ATOM 0 HZ PHE A 287 15.348 -8.731 -5.672 1.00 30.66 H new ATOM 657 N ARG A 288 19.741 -7.743 -0.306 1.00 21.98 N ATOM 658 CA ARG A 288 18.947 -7.687 0.903 1.00 19.37 C ATOM 659 C ARG A 288 18.708 -6.214 1.306 1.00 17.01 C ATOM 660 O ARG A 288 17.664 -5.872 1.846 1.00 20.41 O ATOM 661 CB ARG A 288 19.605 -8.527 2.055 1.00 18.17 C ATOM 662 CG ARG A 288 18.827 -8.357 3.394 1.00 17.33 C ATOM 663 CD ARG A 288 17.450 -9.031 3.277 1.00 15.61 C ATOM 664 NE ARG A 288 16.707 -9.020 4.536 1.00 32.88 N ATOM 665 CZ ARG A 288 16.032 -7.973 5.018 1.00 34.44 C ATOM 666 NH1 ARG A 288 16.010 -6.832 4.357 1.00 28.99 N ATOM 667 NH2 ARG A 288 15.378 -8.065 6.174 1.00 34.60 N ATOM 0 H ARG A 288 20.525 -8.085 -0.216 1.00 21.98 H new ATOM 0 HA ARG A 288 18.081 -8.091 0.734 1.00 19.37 H new ATOM 0 HB2 ARG A 288 19.623 -9.464 1.805 1.00 18.17 H new ATOM 0 HB3 ARG A 288 20.526 -8.248 2.176 1.00 18.17 H new ATOM 0 HG2 ARG A 288 19.330 -8.752 4.124 1.00 17.33 H new ATOM 0 HG3 ARG A 288 18.720 -7.415 3.600 1.00 17.33 H new ATOM 0 HD2 ARG A 288 16.930 -8.578 2.595 1.00 15.61 H new ATOM 0 HD3 ARG A 288 17.567 -9.948 2.983 1.00 15.61 H new ATOM 0 HE ARG A 288 16.704 -9.743 5.002 1.00 32.88 H new ATOM 0 HH11 ARG A 288 16.432 -6.759 3.611 1.00 28.99 H new ATOM 0 HH12 ARG A 288 15.574 -6.161 4.672 1.00 28.99 H new ATOM 0 HH21 ARG A 288 15.388 -8.802 6.616 1.00 34.60 H new ATOM 0 HH22 ARG A 288 14.945 -7.387 6.478 1.00 34.60 H new ATOM 668 N SER A 289 19.660 -5.331 1.040 1.00 18.87 N ATOM 669 CA SER A 289 19.485 -3.906 1.308 1.00 18.85 C ATOM 670 C SER A 289 18.407 -3.266 0.477 1.00 21.95 C ATOM 671 O SER A 289 17.777 -2.309 0.896 1.00 22.21 O ATOM 672 CB SER A 289 20.776 -3.163 1.091 1.00 17.55 C ATOM 673 OG SER A 289 21.670 -3.505 2.132 1.00 21.20 O ATOM 0 H SER A 289 20.423 -5.537 0.701 1.00 18.87 H new ATOM 0 HA SER A 289 19.210 -3.846 2.236 1.00 18.85 H new ATOM 0 HB2 SER A 289 21.157 -3.394 0.230 1.00 17.55 H new ATOM 0 HB3 SER A 289 20.617 -2.206 1.084 1.00 17.55 H new ATOM 0 HG SER A 289 21.994 -4.266 1.985 1.00 21.20 H new ATOM 674 N VAL A 290 18.244 -3.766 -0.735 1.00 21.63 N ATOM 675 CA VAL A 290 17.183 -3.306 -1.649 1.00 22.53 C ATOM 676 C VAL A 290 15.858 -3.751 -1.092 1.00 19.63 C ATOM 677 O VAL A 290 14.907 -3.005 -1.103 1.00 19.95 O ATOM 678 CB VAL A 290 17.405 -3.816 -3.137 1.00 18.77 C ATOM 679 CG1 VAL A 290 16.134 -3.630 -3.970 1.00 24.26 C ATOM 680 CG2 VAL A 290 18.541 -3.004 -3.768 1.00 30.62 C ATOM 0 H VAL A 290 18.742 -4.385 -1.063 1.00 21.63 H new ATOM 0 HA VAL A 290 17.205 -2.338 -1.705 1.00 22.53 H new ATOM 0 HB VAL A 290 17.627 -4.760 -3.118 1.00 18.77 H new ATOM 0 HG11 VAL A 290 16.290 -3.947 -4.874 1.00 24.26 H new ATOM 0 HG12 VAL A 290 15.409 -4.136 -3.571 1.00 24.26 H new ATOM 0 HG13 VAL A 290 15.897 -2.690 -3.994 1.00 24.26 H new ATOM 0 HG21 VAL A 290 18.688 -3.305 -4.678 1.00 30.62 H new ATOM 0 HG22 VAL A 290 18.303 -2.064 -3.774 1.00 30.62 H new ATOM 0 HG23 VAL A 290 19.353 -3.128 -3.252 1.00 30.62 H new ATOM 681 N GLU A 291 15.798 -4.966 -0.567 1.00 18.32 N ATOM 682 CA GLU A 291 14.573 -5.374 0.077 1.00 17.73 C ATOM 683 C GLU A 291 14.273 -4.548 1.307 1.00 17.54 C ATOM 684 O GLU A 291 13.136 -4.274 1.626 1.00 20.47 O ATOM 685 CB GLU A 291 14.608 -6.852 0.410 1.00 19.84 C ATOM 686 CG GLU A 291 14.848 -7.683 -0.838 1.00 24.16 C ATOM 687 CD GLU A 291 14.996 -9.142 -0.522 1.00 34.90 C ATOM 688 OE1 GLU A 291 15.833 -9.482 0.331 1.00 39.07 O ATOM 689 OE2 GLU A 291 14.294 -9.958 -1.143 1.00 40.35 O ATOM 0 H GLU A 291 16.432 -5.547 -0.573 1.00 18.32 H new ATOM 0 HA GLU A 291 13.851 -5.217 -0.552 1.00 17.73 H new ATOM 0 HB2 GLU A 291 15.309 -7.025 1.058 1.00 19.84 H new ATOM 0 HB3 GLU A 291 13.770 -7.115 0.822 1.00 19.84 H new ATOM 0 HG2 GLU A 291 14.109 -7.560 -1.455 1.00 24.16 H new ATOM 0 HG3 GLU A 291 15.648 -7.367 -1.287 1.00 24.16 H new ATOM 690 N ALA A 292 15.301 -4.210 2.045 1.00 18.92 N ATOM 691 CA ALA A 292 15.152 -3.215 3.101 1.00 18.66 C ATOM 692 C ALA A 292 14.573 -1.864 2.691 1.00 17.59 C ATOM 693 O ALA A 292 13.682 -1.371 3.358 1.00 20.35 O ATOM 694 CB ALA A 292 16.504 -3.073 3.923 1.00 16.95 C ATOM 0 H ALA A 292 16.092 -4.536 1.960 1.00 18.92 H new ATOM 0 HA ALA A 292 14.457 -3.570 3.677 1.00 18.66 H new ATOM 0 HB1 ALA A 292 16.390 -2.409 4.621 1.00 16.95 H new ATOM 0 HB2 ALA A 292 16.731 -3.927 4.324 1.00 16.95 H new ATOM 0 HB3 ALA A 292 17.218 -2.796 3.327 1.00 16.95 H new ATOM 695 N VAL A 293 15.086 -1.235 1.628 1.00 17.24 N ATOM 696 CA VAL A 293 14.506 0.031 1.148 1.00 19.09 C ATOM 697 C VAL A 293 13.033 -0.069 0.876 1.00 19.30 C ATOM 698 O VAL A 293 12.263 0.844 1.154 1.00 22.42 O ATOM 699 CB VAL A 293 15.172 0.511 -0.136 1.00 19.31 C ATOM 700 CG1 VAL A 293 14.411 1.741 -0.733 1.00 20.70 C ATOM 701 CG2 VAL A 293 16.636 0.792 0.135 1.00 18.82 C ATOM 0 H VAL A 293 15.760 -1.518 1.175 1.00 17.24 H new ATOM 0 HA VAL A 293 14.661 0.662 1.868 1.00 19.09 H new ATOM 0 HB VAL A 293 15.127 -0.183 -0.812 1.00 19.31 H new ATOM 0 HG11 VAL A 293 14.851 2.030 -1.548 1.00 20.70 H new ATOM 0 HG12 VAL A 293 13.495 1.490 -0.932 1.00 20.70 H new ATOM 0 HG13 VAL A 293 14.414 2.467 -0.090 1.00 20.70 H new ATOM 0 HG21 VAL A 293 17.063 1.098 -0.680 1.00 18.82 H new ATOM 0 HG22 VAL A 293 16.713 1.478 0.817 1.00 18.82 H new ATOM 0 HG23 VAL A 293 17.070 -0.019 0.442 1.00 18.82 H new ATOM 702 N GLN A 294 12.618 -1.175 0.277 1.00 18.10 N ATOM 703 CA GLN A 294 11.190 -1.368 0.048 1.00 17.61 C ATOM 704 C GLN A 294 10.344 -1.480 1.322 1.00 20.82 C ATOM 705 O GLN A 294 9.191 -1.066 1.332 1.00 20.30 O ATOM 706 CB GLN A 294 10.984 -2.635 -0.796 1.00 22.38 C ATOM 707 CG GLN A 294 11.654 -2.547 -2.191 1.00 21.36 C ATOM 708 CD GLN A 294 11.593 -3.879 -2.900 1.00 23.80 C ATOM 709 OE1 GLN A 294 12.618 -4.491 -3.210 1.00 29.29 O ATOM 710 NE2 GLN A 294 10.405 -4.361 -3.091 1.00 22.90 N ATOM 0 H GLN A 294 13.127 -1.811 0.001 1.00 18.10 H new ATOM 0 HA GLN A 294 10.884 -0.569 -0.409 1.00 17.61 H new ATOM 0 HB2 GLN A 294 11.343 -3.399 -0.318 1.00 22.38 H new ATOM 0 HB3 GLN A 294 10.033 -2.792 -0.908 1.00 22.38 H new ATOM 0 HG2 GLN A 294 11.210 -1.871 -2.726 1.00 21.36 H new ATOM 0 HG3 GLN A 294 12.578 -2.270 -2.094 1.00 21.36 H new ATOM 0 HE21 GLN A 294 9.714 -3.904 -2.861 1.00 22.90 H new ATOM 0 HE22 GLN A 294 10.308 -5.138 -3.447 1.00 22.90 H new ATOM 711 N GLU A 295 10.896 -2.079 2.379 1.00 20.33 N ATOM 712 CA GLU A 295 10.165 -2.248 3.675 1.00 23.15 C ATOM 713 C GLU A 295 10.110 -0.904 4.379 1.00 20.33 C ATOM 714 O GLU A 295 9.066 -0.484 4.964 1.00 17.97 O ATOM 715 CB GLU A 295 10.927 -3.262 4.570 1.00 23.52 C ATOM 716 CG GLU A 295 10.700 -4.741 4.194 1.00 27.24 C ATOM 717 CD GLU A 295 11.870 -5.724 4.597 1.00 36.16 C ATOM 718 OE1 GLU A 295 12.708 -5.415 5.502 1.00 38.71 O ATOM 719 OE2 GLU A 295 11.940 -6.827 3.978 1.00 44.37 O ATOM 0 H GLU A 295 11.694 -2.400 2.381 1.00 20.33 H new ATOM 0 HA GLU A 295 9.268 -2.576 3.509 1.00 23.15 H new ATOM 0 HB2 GLU A 295 11.876 -3.070 4.522 1.00 23.52 H new ATOM 0 HB3 GLU A 295 10.657 -3.129 5.492 1.00 23.52 H new ATOM 0 HG2 GLU A 295 9.881 -5.045 4.616 1.00 27.24 H new ATOM 0 HG3 GLU A 295 10.564 -4.799 3.235 1.00 27.24 H new ATOM 720 N ILE A 296 11.216 -0.189 4.285 1.00 18.19 N ATOM 721 CA ILE A 296 11.308 1.151 4.878 1.00 17.42 C ATOM 722 C ILE A 296 10.394 2.121 4.194 1.00 22.61 C ATOM 723 O ILE A 296 9.802 2.990 4.845 1.00 25.14 O ATOM 724 CB ILE A 296 12.758 1.670 4.841 1.00 18.80 C ATOM 725 CG1 ILE A 296 13.668 0.788 5.703 1.00 15.21 C ATOM 726 CG2 ILE A 296 12.897 3.114 5.350 1.00 20.30 C ATOM 727 CD1 ILE A 296 15.195 1.097 5.346 1.00 16.94 C ATOM 0 H ILE A 296 11.929 -0.453 3.884 1.00 18.19 H new ATOM 0 HA ILE A 296 11.027 1.076 5.803 1.00 17.42 H new ATOM 0 HB ILE A 296 13.020 1.643 3.907 1.00 18.80 H new ATOM 0 HG12 ILE A 296 13.504 0.958 6.644 1.00 15.21 H new ATOM 0 HG13 ILE A 296 13.471 -0.149 5.546 1.00 15.21 H new ATOM 0 HG21 ILE A 296 13.827 3.386 5.304 1.00 20.30 H new ATOM 0 HG22 ILE A 296 12.360 3.705 4.799 1.00 20.30 H new ATOM 0 HG23 ILE A 296 12.591 3.164 6.269 1.00 20.30 H new ATOM 0 HD11 ILE A 296 15.774 0.540 5.890 1.00 16.94 H new ATOM 0 HD12 ILE A 296 15.353 0.907 4.408 1.00 16.94 H new ATOM 0 HD13 ILE A 296 15.386 2.031 5.523 1.00 16.94 H new ATOM 728 N THR A 297 10.262 1.996 2.878 1.00 22.64 N ATOM 729 CA THR A 297 9.307 2.844 2.105 1.00 21.69 C ATOM 730 C THR A 297 7.844 2.627 2.551 1.00 22.99 C ATOM 731 O THR A 297 7.096 3.574 2.781 1.00 22.95 O ATOM 732 CB THR A 297 9.477 2.573 0.615 1.00 24.22 C ATOM 733 OG1 THR A 297 10.798 2.970 0.240 1.00 18.38 O ATOM 734 CG2 THR A 297 8.467 3.338 -0.230 1.00 26.36 C ATOM 0 H THR A 297 10.706 1.434 2.401 1.00 22.64 H new ATOM 0 HA THR A 297 9.513 3.775 2.285 1.00 21.69 H new ATOM 0 HB THR A 297 9.330 1.627 0.457 1.00 24.22 H new ATOM 0 HG1 THR A 297 11.345 2.373 0.465 1.00 18.38 H new ATOM 0 HG21 THR A 297 8.611 3.137 -1.168 1.00 26.36 H new ATOM 0 HG22 THR A 297 7.568 3.075 0.022 1.00 26.36 H new ATOM 0 HG23 THR A 297 8.578 4.290 -0.084 1.00 26.36 H new ATOM 735 N GLU A 298 7.462 1.371 2.711 1.00 21.93 N ATOM 736 CA GLU A 298 6.154 1.001 3.177 1.00 24.92 C ATOM 737 C GLU A 298 5.971 1.404 4.650 1.00 23.98 C ATOM 738 O GLU A 298 4.924 1.888 5.045 1.00 22.11 O ATOM 739 CB GLU A 298 6.019 -0.505 3.021 1.00 28.51 C ATOM 740 CG GLU A 298 4.712 -1.020 3.388 1.00 39.54 C ATOM 741 CD GLU A 298 3.808 -1.139 2.174 1.00 51.13 C ATOM 742 OE1 GLU A 298 4.163 -0.575 1.103 1.00 44.63 O ATOM 743 OE2 GLU A 298 2.747 -1.795 2.317 1.00 56.48 O ATOM 0 H GLU A 298 7.973 0.699 2.546 1.00 21.93 H new ATOM 0 HA GLU A 298 5.472 1.459 2.661 1.00 24.92 H new ATOM 0 HB2 GLU A 298 6.204 -0.744 2.099 1.00 28.51 H new ATOM 0 HB3 GLU A 298 6.693 -0.939 3.567 1.00 28.51 H new ATOM 0 HG2 GLU A 298 4.810 -1.889 3.808 1.00 39.54 H new ATOM 0 HG3 GLU A 298 4.303 -0.433 4.043 1.00 39.54 H new ATOM 744 N TYR A 299 6.990 1.210 5.471 1.00 21.86 N ATOM 745 CA TYR A 299 7.019 1.859 6.779 1.00 19.77 C ATOM 746 C TYR A 299 6.830 3.378 6.770 1.00 18.83 C ATOM 747 O TYR A 299 5.999 3.877 7.494 1.00 21.11 O ATOM 748 CB TYR A 299 8.260 1.486 7.612 1.00 18.09 C ATOM 749 CG TYR A 299 8.158 2.042 9.032 1.00 17.73 C ATOM 750 CD1 TYR A 299 7.086 1.673 9.867 1.00 22.01 C ATOM 751 CD2 TYR A 299 9.120 2.875 9.550 1.00 13.98 C ATOM 752 CE1 TYR A 299 7.002 2.146 11.178 1.00 19.88 C ATOM 753 CE2 TYR A 299 9.041 3.359 10.847 1.00 14.89 C ATOM 754 CZ TYR A 299 7.951 2.991 11.650 1.00 24.57 C ATOM 755 OH TYR A 299 7.806 3.459 12.950 1.00 23.73 O ATOM 0 H TYR A 299 7.670 0.713 5.297 1.00 21.86 H new ATOM 0 HA TYR A 299 6.230 1.494 7.209 1.00 19.77 H new ATOM 0 HB2 TYR A 299 8.353 0.521 7.645 1.00 18.09 H new ATOM 0 HB3 TYR A 299 9.058 1.833 7.182 1.00 18.09 H new ATOM 0 HD1 TYR A 299 6.425 1.106 9.541 1.00 22.01 H new ATOM 0 HD2 TYR A 299 9.842 3.120 9.018 1.00 13.98 H new ATOM 0 HE1 TYR A 299 6.298 1.882 11.725 1.00 19.88 H new ATOM 0 HE2 TYR A 299 9.703 3.921 11.181 1.00 14.89 H new ATOM 0 HH TYR A 299 8.538 3.771 13.219 1.00 23.73 H new ATOM 756 N ALA A 300 7.607 4.103 5.968 1.00 17.41 N ATOM 757 CA ALA A 300 7.496 5.525 5.869 1.00 18.36 C ATOM 758 C ALA A 300 6.096 6.008 5.485 1.00 20.73 C ATOM 759 O ALA A 300 5.538 6.942 6.084 1.00 20.69 O ATOM 760 CB ALA A 300 8.550 6.067 4.929 1.00 19.43 C ATOM 0 H ALA A 300 8.217 3.764 5.465 1.00 17.41 H new ATOM 0 HA ALA A 300 7.652 5.880 6.758 1.00 18.36 H new ATOM 0 HB1 ALA A 300 8.466 7.031 4.869 1.00 19.43 H new ATOM 0 HB2 ALA A 300 9.431 5.840 5.265 1.00 19.43 H new ATOM 0 HB3 ALA A 300 8.430 5.677 4.049 1.00 19.43 H new ATOM 761 N LYS A 301 5.490 5.364 4.516 1.00 21.86 N ATOM 762 CA LYS A 301 4.113 5.682 4.160 1.00 24.11 C ATOM 763 C LYS A 301 3.111 5.638 5.325 1.00 25.54 C ATOM 764 O LYS A 301 2.018 6.252 5.277 1.00 27.25 O ATOM 765 CB LYS A 301 3.673 4.791 2.995 1.00 26.23 C ATOM 766 CG LYS A 301 4.419 5.162 1.705 1.00 25.22 C ATOM 767 CD LYS A 301 3.833 4.520 0.398 1.00 31.25 C ATOM 768 CE LYS A 301 3.880 3.008 0.436 1.00 35.30 C ATOM 769 NZ LYS A 301 3.447 2.450 -0.878 1.00 36.73 N ATOM 0 H LYS A 301 5.850 4.739 4.047 1.00 21.86 H new ATOM 0 HA LYS A 301 4.107 6.613 3.889 1.00 24.11 H new ATOM 0 HB2 LYS A 301 3.841 3.861 3.214 1.00 26.23 H new ATOM 0 HB3 LYS A 301 2.717 4.882 2.857 1.00 26.23 H new ATOM 0 HG2 LYS A 301 4.411 6.127 1.608 1.00 25.22 H new ATOM 0 HG3 LYS A 301 5.347 4.894 1.794 1.00 25.22 H new ATOM 0 HD2 LYS A 301 2.915 4.811 0.280 1.00 31.25 H new ATOM 0 HD3 LYS A 301 4.333 4.839 -0.370 1.00 31.25 H new ATOM 0 HE2 LYS A 301 4.780 2.710 0.641 1.00 35.30 H new ATOM 0 HE3 LYS A 301 3.303 2.677 1.142 1.00 35.30 H new ATOM 0 HZ1 LYS A 301 3.282 1.580 -0.791 1.00 36.73 H new ATOM 0 HZ2 LYS A 301 2.708 2.866 -1.149 1.00 36.73 H new ATOM 0 HZ3 LYS A 301 4.092 2.570 -1.479 1.00 36.73 H new ATOM 770 N SER A 302 3.458 4.933 6.388 1.00 25.64 N ATOM 771 CA SER A 302 2.510 4.806 7.517 1.00 25.29 C ATOM 772 C SER A 302 2.737 5.888 8.602 1.00 20.12 C ATOM 773 O SER A 302 2.056 5.935 9.614 1.00 24.89 O ATOM 774 CB SER A 302 2.701 3.439 8.151 1.00 24.40 C ATOM 775 OG SER A 302 3.907 3.473 8.930 1.00 35.95 O ATOM 0 H SER A 302 4.209 4.527 6.488 1.00 25.64 H new ATOM 0 HA SER A 302 1.612 4.920 7.168 1.00 25.29 H new ATOM 0 HB2 SER A 302 1.942 3.217 8.712 1.00 24.40 H new ATOM 0 HB3 SER A 302 2.759 2.754 7.467 1.00 24.40 H new ATOM 0 HG SER A 302 4.514 3.853 8.491 1.00 35.95 H new ATOM 776 N ILE A 303 3.756 6.703 8.438 1.00 22.33 N ATOM 777 CA ILE A 303 4.060 7.711 9.409 1.00 23.07 C ATOM 778 C ILE A 303 3.077 8.892 9.247 1.00 25.23 C ATOM 779 O ILE A 303 3.095 9.566 8.211 1.00 22.15 O ATOM 780 CB ILE A 303 5.518 8.207 9.229 1.00 24.82 C ATOM 781 CG1 ILE A 303 6.528 7.083 9.550 1.00 20.22 C ATOM 782 CG2 ILE A 303 5.788 9.331 10.218 1.00 21.18 C ATOM 783 CD1 ILE A 303 7.978 7.456 9.142 1.00 21.32 C ATOM 0 H ILE A 303 4.287 6.684 7.762 1.00 22.33 H new ATOM 0 HA ILE A 303 3.969 7.335 10.298 1.00 23.07 H new ATOM 0 HB ILE A 303 5.621 8.498 8.310 1.00 24.82 H new ATOM 0 HG12 ILE A 303 6.502 6.890 10.500 1.00 20.22 H new ATOM 0 HG13 ILE A 303 6.263 6.272 9.088 1.00 20.22 H new ATOM 0 HG21 ILE A 303 6.699 9.645 10.110 1.00 21.18 H new ATOM 0 HG22 ILE A 303 5.172 10.062 10.053 1.00 21.18 H new ATOM 0 HG23 ILE A 303 5.665 9.003 11.122 1.00 21.18 H new ATOM 0 HD11 ILE A 303 8.575 6.723 9.362 1.00 21.32 H new ATOM 0 HD12 ILE A 303 8.012 7.625 8.188 1.00 21.32 H new ATOM 0 HD13 ILE A 303 8.255 8.253 9.622 1.00 21.32 H new ATOM 784 N PRO A 304 2.195 9.129 10.245 1.00 25.32 N ATOM 785 CA PRO A 304 1.172 10.167 9.948 1.00 26.84 C ATOM 786 C PRO A 304 1.782 11.412 9.346 1.00 27.83 C ATOM 787 O PRO A 304 2.773 11.940 9.875 1.00 27.52 O ATOM 788 CB PRO A 304 0.575 10.473 11.322 1.00 29.39 C ATOM 789 CG PRO A 304 0.690 9.164 12.050 1.00 25.14 C ATOM 790 CD PRO A 304 2.017 8.566 11.603 1.00 22.55 C ATOM 0 HA PRO A 304 0.520 9.864 9.297 1.00 26.84 H new ATOM 0 HB2 PRO A 304 1.063 11.178 11.775 1.00 29.39 H new ATOM 0 HB3 PRO A 304 -0.348 10.765 11.254 1.00 29.39 H new ATOM 0 HG2 PRO A 304 0.672 9.296 13.011 1.00 25.14 H new ATOM 0 HG3 PRO A 304 -0.050 8.576 11.831 1.00 25.14 H new ATOM 0 HD2 PRO A 304 2.743 8.819 12.195 1.00 22.55 H new ATOM 0 HD3 PRO A 304 1.988 7.597 11.589 1.00 22.55 H new ATOM 791 N GLY A 305 1.199 11.860 8.232 1.00 27.52 N ATOM 792 CA GLY A 305 1.587 13.090 7.551 1.00 28.08 C ATOM 793 C GLY A 305 2.606 12.941 6.424 1.00 29.51 C ATOM 794 O GLY A 305 2.677 13.783 5.524 1.00 23.23 O ATOM 0 H GLY A 305 0.553 11.445 7.845 1.00 27.52 H new ATOM 0 HA2 GLY A 305 0.788 13.503 7.188 1.00 28.08 H new ATOM 0 HA3 GLY A 305 1.948 13.703 8.210 1.00 28.08 H new ATOM 795 N PHE A 306 3.414 11.884 6.476 1.00 27.29 N ATOM 796 CA PHE A 306 4.435 11.670 5.453 1.00 25.76 C ATOM 797 C PHE A 306 3.877 11.696 4.010 1.00 25.74 C ATOM 798 O PHE A 306 4.480 12.311 3.115 1.00 27.33 O ATOM 799 CB PHE A 306 5.169 10.333 5.707 1.00 23.42 C ATOM 800 CG PHE A 306 6.264 10.051 4.705 1.00 25.98 C ATOM 801 CD1 PHE A 306 7.544 10.539 4.898 1.00 21.58 C ATOM 802 CD2 PHE A 306 6.009 9.287 3.586 1.00 22.44 C ATOM 803 CE1 PHE A 306 8.569 10.283 3.986 1.00 23.00 C ATOM 804 CE2 PHE A 306 7.043 9.026 2.624 1.00 15.25 C ATOM 805 CZ PHE A 306 8.321 9.544 2.846 1.00 17.51 C ATOM 0 H PHE A 306 3.388 11.283 7.091 1.00 27.29 H new ATOM 0 HA PHE A 306 5.054 12.413 5.525 1.00 25.76 H new ATOM 0 HB2 PHE A 306 5.551 10.345 6.599 1.00 23.42 H new ATOM 0 HB3 PHE A 306 4.525 9.608 5.685 1.00 23.42 H new ATOM 0 HD1 PHE A 306 7.726 11.050 5.654 1.00 21.58 H new ATOM 0 HD2 PHE A 306 5.158 8.937 3.453 1.00 22.44 H new ATOM 0 HE1 PHE A 306 9.424 10.612 4.147 1.00 23.00 H new ATOM 0 HE2 PHE A 306 6.864 8.520 1.865 1.00 15.25 H new ATOM 0 HZ PHE A 306 9.001 9.392 2.230 1.00 17.51 H new ATOM 806 N VAL A 307 2.771 11.005 3.773 1.00 27.13 N ATOM 807 CA VAL A 307 2.273 10.863 2.404 1.00 33.14 C ATOM 808 C VAL A 307 1.591 12.147 1.902 1.00 38.04 C ATOM 809 O VAL A 307 1.398 12.321 0.687 1.00 38.89 O ATOM 810 CB VAL A 307 1.335 9.655 2.199 1.00 32.58 C ATOM 811 CG1 VAL A 307 2.061 8.352 2.489 1.00 31.91 C ATOM 812 CG2 VAL A 307 0.074 9.803 3.027 1.00 39.58 C ATOM 0 H VAL A 307 2.298 10.615 4.376 1.00 27.13 H new ATOM 0 HA VAL A 307 3.067 10.697 1.872 1.00 33.14 H new ATOM 0 HB VAL A 307 1.063 9.630 1.268 1.00 32.58 H new ATOM 0 HG11 VAL A 307 1.455 7.607 2.354 1.00 31.91 H new ATOM 0 HG12 VAL A 307 2.819 8.264 1.891 1.00 31.91 H new ATOM 0 HG13 VAL A 307 2.373 8.353 3.407 1.00 31.91 H new ATOM 0 HG21 VAL A 307 -0.500 9.034 2.883 1.00 39.58 H new ATOM 0 HG22 VAL A 307 0.308 9.860 3.967 1.00 39.58 H new ATOM 0 HG23 VAL A 307 -0.395 10.610 2.762 1.00 39.58 H new ATOM 813 N ASN A 308 1.279 13.064 2.816 1.00 38.42 N ATOM 814 CA ASN A 308 0.793 14.370 2.401 1.00 37.00 C ATOM 815 C ASN A 308 1.894 15.357 2.106 1.00 37.11 C ATOM 816 O ASN A 308 1.602 16.473 1.695 1.00 36.96 O ATOM 817 CB ASN A 308 -0.153 14.949 3.439 1.00 39.00 C ATOM 818 CG ASN A 308 -1.245 13.990 3.809 1.00 39.54 C ATOM 819 OD1 ASN A 308 -2.000 13.546 2.959 1.00 47.47 O ATOM 820 ND2 ASN A 308 -1.337 13.661 5.079 1.00 48.72 N ATOM 0 H ASN A 308 1.341 12.950 3.666 1.00 38.42 H new ATOM 0 HA ASN A 308 0.317 14.222 1.569 1.00 37.00 H new ATOM 0 HB2 ASN A 308 0.349 15.187 4.234 1.00 39.00 H new ATOM 0 HB3 ASN A 308 -0.546 15.767 3.096 1.00 39.00 H new ATOM 0 HD21 ASN A 308 -1.947 13.113 5.338 1.00 48.72 H new ATOM 0 HD22 ASN A 308 -0.787 13.994 5.650 1.00 48.72 H new ATOM 821 N LEU A 309 3.152 14.973 2.316 1.00 32.44 N ATOM 822 CA LEU A 309 4.261 15.843 1.949 1.00 33.24 C ATOM 823 C LEU A 309 4.376 15.975 0.438 1.00 34.85 C ATOM 824 O LEU A 309 3.850 15.159 -0.290 1.00 37.56 O ATOM 825 CB LEU A 309 5.598 15.340 2.510 1.00 32.66 C ATOM 826 CG LEU A 309 5.763 15.197 4.023 1.00 31.90 C ATOM 827 CD1 LEU A 309 7.025 14.391 4.399 1.00 27.12 C ATOM 828 CD2 LEU A 309 5.789 16.528 4.705 1.00 28.73 C ATOM 0 H LEU A 309 3.381 14.221 2.666 1.00 32.44 H new ATOM 0 HA LEU A 309 4.069 16.711 2.338 1.00 33.24 H new ATOM 0 HB2 LEU A 309 5.774 14.472 2.113 1.00 32.66 H new ATOM 0 HB3 LEU A 309 6.292 15.941 2.196 1.00 32.66 H new ATOM 0 HG LEU A 309 4.987 14.704 4.333 1.00 31.90 H new ATOM 0 HD11 LEU A 309 7.091 14.325 5.364 1.00 27.12 H new ATOM 0 HD12 LEU A 309 6.967 13.501 4.017 1.00 27.12 H new ATOM 0 HD13 LEU A 309 7.811 14.840 4.052 1.00 27.12 H new ATOM 0 HD21 LEU A 309 5.895 16.400 5.661 1.00 28.73 H new ATOM 0 HD22 LEU A 309 6.532 17.051 4.365 1.00 28.73 H new ATOM 0 HD23 LEU A 309 4.958 16.997 4.532 1.00 28.73 H new ATOM 829 N ASP A 310 5.072 17.001 -0.031 1.00 35.08 N ATOM 830 CA ASP A 310 5.474 17.040 -1.423 1.00 37.72 C ATOM 831 C ASP A 310 6.135 15.724 -1.770 1.00 37.13 C ATOM 832 O ASP A 310 7.075 15.302 -1.074 1.00 36.35 O ATOM 833 CB ASP A 310 6.488 18.152 -1.634 1.00 36.64 C ATOM 834 CG ASP A 310 6.775 18.400 -3.091 1.00 49.07 C ATOM 835 OD1 ASP A 310 5.888 18.930 -3.796 1.00 56.29 O ATOM 836 OD2 ASP A 310 7.894 18.078 -3.535 1.00 59.81 O ATOM 0 H ASP A 310 5.319 17.678 0.438 1.00 35.08 H new ATOM 0 HA ASP A 310 4.696 17.195 -1.981 1.00 37.72 H new ATOM 0 HB2 ASP A 310 6.157 18.969 -1.229 1.00 36.64 H new ATOM 0 HB3 ASP A 310 7.314 17.924 -1.179 1.00 36.64 H new ATOM 837 N LEU A 311 5.688 15.107 -2.865 1.00 37.53 N ATOM 838 CA LEU A 311 6.244 13.840 -3.339 1.00 36.89 C ATOM 839 C LEU A 311 7.738 13.859 -3.581 1.00 35.29 C ATOM 840 O LEU A 311 8.424 12.856 -3.336 1.00 34.11 O ATOM 841 CB LEU A 311 5.491 13.341 -4.578 1.00 39.55 C ATOM 842 CG LEU A 311 5.781 11.958 -5.171 1.00 40.52 C ATOM 843 CD1 LEU A 311 6.022 10.876 -4.118 1.00 38.17 C ATOM 844 CD2 LEU A 311 4.621 11.572 -6.051 1.00 45.39 C ATOM 0 H LEU A 311 5.051 15.414 -3.355 1.00 37.53 H new ATOM 0 HA LEU A 311 6.113 13.214 -2.610 1.00 36.89 H new ATOM 0 HB2 LEU A 311 4.545 13.367 -4.366 1.00 39.55 H new ATOM 0 HB3 LEU A 311 5.641 13.990 -5.283 1.00 39.55 H new ATOM 0 HG LEU A 311 6.606 12.021 -5.677 1.00 40.52 H new ATOM 0 HD11 LEU A 311 6.199 10.030 -4.558 1.00 38.17 H new ATOM 0 HD12 LEU A 311 6.785 11.121 -3.571 1.00 38.17 H new ATOM 0 HD13 LEU A 311 5.236 10.790 -3.556 1.00 38.17 H new ATOM 0 HD21 LEU A 311 4.785 10.697 -6.437 1.00 45.39 H new ATOM 0 HD22 LEU A 311 3.808 11.544 -5.522 1.00 45.39 H new ATOM 0 HD23 LEU A 311 4.522 12.225 -6.761 1.00 45.39 H new ATOM 845 N ASN A 312 8.256 14.984 -4.058 1.00 32.79 N ATOM 846 CA ASN A 312 9.693 15.132 -4.261 1.00 33.52 C ATOM 847 C ASN A 312 10.451 15.116 -2.930 1.00 31.46 C ATOM 848 O ASN A 312 11.627 14.701 -2.843 1.00 30.52 O ATOM 849 CB ASN A 312 9.986 16.480 -4.934 1.00 34.57 C ATOM 850 CG ASN A 312 9.927 16.423 -6.479 1.00 41.33 C ATOM 851 OD1 ASN A 312 10.317 17.378 -7.144 1.00 50.71 O ATOM 852 ND2 ASN A 312 9.452 15.316 -7.036 1.00 40.11 N ATOM 0 H ASN A 312 7.792 15.676 -4.271 1.00 32.79 H new ATOM 0 HA ASN A 312 9.983 14.389 -4.813 1.00 33.52 H new ATOM 0 HB2 ASN A 312 9.347 17.137 -4.617 1.00 34.57 H new ATOM 0 HB3 ASN A 312 10.866 16.785 -4.662 1.00 34.57 H new ATOM 0 HD21 ASN A 312 9.409 15.250 -7.892 1.00 40.11 H new ATOM 0 HD22 ASN A 312 9.187 14.665 -6.541 1.00 40.11 H new ATOM 853 N ASP A 313 9.817 15.684 -1.917 1.00 30.30 N ATOM 854 CA ASP A 313 10.357 15.626 -0.550 1.00 28.21 C ATOM 855 C ASP A 313 10.245 14.198 -0.005 1.00 25.72 C ATOM 856 O ASP A 313 11.171 13.725 0.606 1.00 25.66 O ATOM 857 CB ASP A 313 9.593 16.567 0.382 1.00 28.56 C ATOM 858 CG ASP A 313 10.013 18.010 0.206 1.00 36.29 C ATOM 859 OD1 ASP A 313 10.790 18.265 -0.747 1.00 36.50 O ATOM 860 OD2 ASP A 313 9.545 18.884 0.997 1.00 35.77 O ATOM 0 H ASP A 313 9.073 16.109 -1.990 1.00 30.30 H new ATOM 0 HA ASP A 313 11.287 15.900 -0.585 1.00 28.21 H new ATOM 0 HB2 ASP A 313 8.641 16.486 0.212 1.00 28.56 H new ATOM 0 HB3 ASP A 313 9.741 16.299 1.302 1.00 28.56 H new ATOM 861 N GLN A 314 9.123 13.525 -0.235 1.00 23.34 N ATOM 862 CA GLN A 314 9.051 12.134 0.161 1.00 25.35 C ATOM 863 C GLN A 314 10.257 11.365 -0.413 1.00 26.29 C ATOM 864 O GLN A 314 10.914 10.601 0.287 1.00 26.61 O ATOM 865 CB GLN A 314 7.744 11.508 -0.266 1.00 22.75 C ATOM 866 CG GLN A 314 6.558 12.029 0.462 1.00 21.70 C ATOM 867 CD GLN A 314 5.309 11.358 -0.032 1.00 25.72 C ATOM 868 OE1 GLN A 314 5.217 10.113 -0.041 1.00 32.41 O ATOM 869 NE2 GLN A 314 4.341 12.152 -0.487 1.00 26.15 N ATOM 0 H GLN A 314 8.417 13.845 -0.607 1.00 23.34 H new ATOM 0 HA GLN A 314 9.085 12.085 1.129 1.00 25.35 H new ATOM 0 HB2 GLN A 314 7.620 11.657 -1.216 1.00 22.75 H new ATOM 0 HB3 GLN A 314 7.797 10.548 -0.134 1.00 22.75 H new ATOM 0 HG2 GLN A 314 6.661 11.874 1.414 1.00 21.70 H new ATOM 0 HG3 GLN A 314 6.489 12.988 0.336 1.00 21.70 H new ATOM 0 HE21 GLN A 314 4.439 13.006 -0.465 1.00 26.15 H new ATOM 0 HE22 GLN A 314 3.618 11.811 -0.803 1.00 26.15 H new ATOM 870 N VAL A 315 10.579 11.589 -1.676 1.00 25.14 N ATOM 871 CA VAL A 315 11.702 10.911 -2.281 1.00 25.32 C ATOM 872 C VAL A 315 13.007 11.302 -1.614 1.00 25.20 C ATOM 873 O VAL A 315 13.876 10.472 -1.410 1.00 26.02 O ATOM 874 CB VAL A 315 11.773 11.192 -3.815 1.00 27.09 C ATOM 875 CG1 VAL A 315 13.023 10.612 -4.402 1.00 28.50 C ATOM 876 CG2 VAL A 315 10.596 10.604 -4.495 1.00 24.11 C ATOM 0 H VAL A 315 10.159 12.129 -2.197 1.00 25.14 H new ATOM 0 HA VAL A 315 11.567 9.959 -2.151 1.00 25.32 H new ATOM 0 HB VAL A 315 11.779 12.153 -3.946 1.00 27.09 H new ATOM 0 HG11 VAL A 315 13.049 10.796 -5.354 1.00 28.50 H new ATOM 0 HG12 VAL A 315 13.797 11.011 -3.974 1.00 28.50 H new ATOM 0 HG13 VAL A 315 13.033 9.653 -4.258 1.00 28.50 H new ATOM 0 HG21 VAL A 315 10.649 10.784 -5.447 1.00 24.11 H new ATOM 0 HG22 VAL A 315 10.582 9.645 -4.347 1.00 24.11 H new ATOM 0 HG23 VAL A 315 9.785 10.997 -4.137 1.00 24.11 H new ATOM 877 N THR A 316 13.184 12.587 -1.318 1.00 26.64 N ATOM 878 CA THR A 316 14.446 13.041 -0.750 1.00 25.91 C ATOM 879 C THR A 316 14.619 12.455 0.666 1.00 24.71 C ATOM 880 O THR A 316 15.731 12.125 1.101 1.00 23.26 O ATOM 881 CB THR A 316 14.448 14.592 -0.679 1.00 31.07 C ATOM 882 OG1 THR A 316 14.582 15.111 -2.000 1.00 34.11 O ATOM 883 CG2 THR A 316 15.587 15.114 0.149 1.00 27.60 C ATOM 0 H THR A 316 12.595 13.202 -1.437 1.00 26.64 H new ATOM 0 HA THR A 316 15.180 12.742 -1.309 1.00 25.91 H new ATOM 0 HB THR A 316 13.616 14.873 -0.267 1.00 31.07 H new ATOM 0 HG1 THR A 316 14.153 15.830 -2.064 1.00 34.11 H new ATOM 0 HG21 THR A 316 15.555 16.083 0.170 1.00 27.60 H new ATOM 0 HG22 THR A 316 15.515 14.769 1.053 1.00 27.60 H new ATOM 0 HG23 THR A 316 16.428 14.827 -0.240 1.00 27.60 H new ATOM 884 N LEU A 317 13.520 12.369 1.413 1.00 22.69 N ATOM 885 CA LEU A 317 13.656 11.875 2.807 1.00 26.05 C ATOM 886 C LEU A 317 14.134 10.423 2.770 1.00 24.49 C ATOM 887 O LEU A 317 15.069 10.043 3.510 1.00 22.91 O ATOM 888 CB LEU A 317 12.330 11.982 3.572 1.00 26.57 C ATOM 889 CG LEU A 317 11.946 13.423 3.887 1.00 22.46 C ATOM 890 CD1 LEU A 317 10.641 13.490 4.669 1.00 23.67 C ATOM 891 CD2 LEU A 317 13.092 14.166 4.628 1.00 24.52 C ATOM 0 H LEU A 317 12.724 12.576 1.161 1.00 22.69 H new ATOM 0 HA LEU A 317 14.303 12.426 3.274 1.00 26.05 H new ATOM 0 HB2 LEU A 317 11.625 11.571 3.048 1.00 26.57 H new ATOM 0 HB3 LEU A 317 12.397 11.481 4.400 1.00 26.57 H new ATOM 0 HG LEU A 317 11.803 13.879 3.043 1.00 22.46 H new ATOM 0 HD11 LEU A 317 10.422 14.417 4.855 1.00 23.67 H new ATOM 0 HD12 LEU A 317 9.929 13.089 4.146 1.00 23.67 H new ATOM 0 HD13 LEU A 317 10.739 13.008 5.505 1.00 23.67 H new ATOM 0 HD21 LEU A 317 12.819 15.078 4.814 1.00 24.52 H new ATOM 0 HD22 LEU A 317 13.287 13.710 5.462 1.00 24.52 H new ATOM 0 HD23 LEU A 317 13.886 14.174 4.071 1.00 24.52 H new ATOM 892 N LEU A 318 13.535 9.612 1.890 1.00 21.35 N ATOM 893 CA LEU A 318 14.007 8.219 1.741 1.00 23.42 C ATOM 894 C LEU A 318 15.414 8.102 1.157 1.00 25.35 C ATOM 895 O LEU A 318 16.281 7.407 1.703 1.00 22.27 O ATOM 896 CB LEU A 318 13.014 7.422 0.905 1.00 23.06 C ATOM 897 CG LEU A 318 11.739 7.281 1.724 1.00 26.30 C ATOM 898 CD1 LEU A 318 10.583 6.944 0.827 1.00 39.07 C ATOM 899 CD2 LEU A 318 11.969 6.161 2.736 1.00 35.08 C ATOM 0 H LEU A 318 12.876 9.834 1.384 1.00 21.35 H new ATOM 0 HA LEU A 318 14.061 7.850 2.636 1.00 23.42 H new ATOM 0 HB2 LEU A 318 12.833 7.875 0.066 1.00 23.06 H new ATOM 0 HB3 LEU A 318 13.376 6.550 0.684 1.00 23.06 H new ATOM 0 HG LEU A 318 11.529 8.112 2.178 1.00 26.30 H new ATOM 0 HD11 LEU A 318 9.776 6.856 1.358 1.00 39.07 H new ATOM 0 HD12 LEU A 318 10.464 7.650 0.173 1.00 39.07 H new ATOM 0 HD13 LEU A 318 10.761 6.107 0.370 1.00 39.07 H new ATOM 0 HD21 LEU A 318 11.172 6.044 3.277 1.00 35.08 H new ATOM 0 HD22 LEU A 318 12.164 5.335 2.266 1.00 35.08 H new ATOM 0 HD23 LEU A 318 12.717 6.391 3.309 1.00 35.08 H new ATOM 900 N LYS A 319 15.671 8.799 0.056 1.00 22.76 N ATOM 901 CA LYS A 319 17.042 8.811 -0.466 1.00 21.60 C ATOM 902 C LYS A 319 18.036 8.907 0.652 1.00 21.40 C ATOM 903 O LYS A 319 18.975 8.100 0.743 1.00 22.83 O ATOM 904 CB LYS A 319 17.260 9.998 -1.445 1.00 21.86 C ATOM 905 CG LYS A 319 18.544 9.919 -2.268 1.00 22.19 C ATOM 906 CD LYS A 319 18.631 11.189 -3.153 1.00 24.70 C ATOM 907 CE LYS A 319 19.996 11.283 -3.756 1.00 20.75 C ATOM 908 NZ LYS A 319 20.053 10.159 -4.766 1.00 24.98 N ATOM 0 H LYS A 319 15.096 9.256 -0.391 1.00 22.76 H new ATOM 0 HA LYS A 319 17.175 7.978 -0.945 1.00 21.60 H new ATOM 0 HB2 LYS A 319 16.504 10.044 -2.051 1.00 21.86 H new ATOM 0 HB3 LYS A 319 17.267 10.824 -0.936 1.00 21.86 H new ATOM 0 HG2 LYS A 319 19.317 9.860 -1.685 1.00 22.19 H new ATOM 0 HG3 LYS A 319 18.543 9.121 -2.820 1.00 22.19 H new ATOM 0 HD2 LYS A 319 17.960 11.155 -3.852 1.00 24.70 H new ATOM 0 HD3 LYS A 319 18.447 11.979 -2.621 1.00 24.70 H new ATOM 0 HE2 LYS A 319 20.134 12.144 -4.180 1.00 20.75 H new ATOM 0 HE3 LYS A 319 20.686 11.185 -3.081 1.00 20.75 H new ATOM 0 HZ1 LYS A 319 20.572 10.399 -5.448 1.00 24.98 H new ATOM 0 HZ2 LYS A 319 20.388 9.430 -4.381 1.00 24.98 H new ATOM 0 HZ3 LYS A 319 19.233 9.986 -5.064 1.00 24.98 H new ATOM 909 N TYR A 320 17.879 9.931 1.495 1.00 25.62 N ATOM 910 CA TYR A 320 18.944 10.278 2.461 1.00 23.67 C ATOM 911 C TYR A 320 18.814 9.485 3.754 1.00 25.86 C ATOM 912 O TYR A 320 19.707 9.518 4.600 1.00 28.40 O ATOM 913 CB TYR A 320 18.947 11.789 2.754 1.00 26.94 C ATOM 914 CG TYR A 320 19.612 12.557 1.637 1.00 27.30 C ATOM 915 CD1 TYR A 320 20.998 12.583 1.519 1.00 37.61 C ATOM 916 CD2 TYR A 320 18.865 13.211 0.694 1.00 30.63 C ATOM 917 CE1 TYR A 320 21.611 13.265 0.482 1.00 40.38 C ATOM 918 CE2 TYR A 320 19.460 13.864 -0.337 1.00 31.57 C ATOM 919 CZ TYR A 320 20.831 13.887 -0.445 1.00 33.75 C ATOM 920 OH TYR A 320 21.402 14.571 -1.507 1.00 41.45 O ATOM 0 H TYR A 320 17.181 10.432 1.529 1.00 25.62 H new ATOM 0 HA TYR A 320 19.791 10.039 2.053 1.00 23.67 H new ATOM 0 HB2 TYR A 320 18.036 12.101 2.868 1.00 26.94 H new ATOM 0 HB3 TYR A 320 19.411 11.959 3.589 1.00 26.94 H new ATOM 0 HD1 TYR A 320 21.520 12.136 2.146 1.00 37.61 H new ATOM 0 HD2 TYR A 320 17.937 13.208 0.761 1.00 30.63 H new ATOM 0 HE1 TYR A 320 22.538 13.298 0.420 1.00 40.38 H new ATOM 0 HE2 TYR A 320 18.938 14.298 -0.973 1.00 31.57 H new ATOM 0 HH TYR A 320 21.998 14.095 -1.859 1.00 41.45 H new ATOM 921 N GLY A 321 17.676 8.819 3.925 1.00 23.51 N ATOM 922 CA GLY A 321 17.322 8.218 5.206 1.00 20.77 C ATOM 923 C GLY A 321 17.646 6.718 5.213 1.00 24.36 C ATOM 924 O GLY A 321 18.047 6.156 6.229 1.00 20.79 O ATOM 0 H GLY A 321 17.091 8.703 3.306 1.00 23.51 H new ATOM 0 HA2 GLY A 321 17.806 8.661 5.920 1.00 20.77 H new ATOM 0 HA3 GLY A 321 16.377 8.350 5.380 1.00 20.77 H new ATOM 925 N VAL A 322 17.433 6.053 4.081 1.00 19.99 N ATOM 926 CA VAL A 322 17.462 4.597 4.058 1.00 22.06 C ATOM 927 C VAL A 322 18.766 3.972 4.545 1.00 20.35 C ATOM 928 O VAL A 322 18.738 2.938 5.215 1.00 20.12 O ATOM 929 CB VAL A 322 17.028 4.044 2.688 1.00 21.13 C ATOM 930 CG1 VAL A 322 17.223 2.588 2.681 1.00 33.80 C ATOM 931 CG2 VAL A 322 15.518 4.346 2.497 1.00 23.92 C ATOM 0 H VAL A 322 17.271 6.424 3.322 1.00 19.99 H new ATOM 0 HA VAL A 322 16.805 4.323 4.717 1.00 22.06 H new ATOM 0 HB VAL A 322 17.548 4.452 1.978 1.00 21.13 H new ATOM 0 HG11 VAL A 322 16.952 2.229 1.821 1.00 33.80 H new ATOM 0 HG12 VAL A 322 18.159 2.386 2.835 1.00 33.80 H new ATOM 0 HG13 VAL A 322 16.686 2.186 3.382 1.00 33.80 H new ATOM 0 HG21 VAL A 322 15.226 4.004 1.638 1.00 23.92 H new ATOM 0 HG22 VAL A 322 15.010 3.918 3.204 1.00 23.92 H new ATOM 0 HG23 VAL A 322 15.373 5.305 2.530 1.00 23.92 H new ATOM 932 N HIS A 323 19.923 4.546 4.206 1.00 21.95 N ATOM 933 CA HIS A 323 21.140 3.919 4.680 1.00 20.94 C ATOM 934 C HIS A 323 21.274 3.940 6.209 1.00 22.41 C ATOM 935 O HIS A 323 21.791 2.974 6.795 1.00 20.72 O ATOM 936 CB HIS A 323 22.386 4.527 4.059 1.00 23.51 C ATOM 937 CG HIS A 323 22.642 4.075 2.658 1.00 30.56 C ATOM 938 ND1 HIS A 323 22.009 4.640 1.571 1.00 32.40 N ATOM 939 CD2 HIS A 323 23.478 3.127 2.162 1.00 37.35 C ATOM 940 CE1 HIS A 323 22.416 4.031 0.468 1.00 36.37 C ATOM 941 NE2 HIS A 323 23.313 3.118 0.796 1.00 34.85 N ATOM 0 H HIS A 323 20.018 5.256 3.731 1.00 21.95 H new ATOM 0 HA HIS A 323 21.066 2.994 4.396 1.00 20.94 H new ATOM 0 HB2 HIS A 323 22.303 5.493 4.068 1.00 23.51 H new ATOM 0 HB3 HIS A 323 23.154 4.303 4.608 1.00 23.51 H new ATOM 0 HD2 HIS A 323 24.053 2.586 2.653 1.00 37.35 H new ATOM 0 HE1 HIS A 323 22.120 4.215 -0.394 1.00 36.37 H new ATOM 0 HE2 HIS A 323 23.726 2.602 0.246 1.00 34.85 H new ATOM 942 N GLU A 324 20.850 5.042 6.851 1.00 20.55 N ATOM 943 CA GLU A 324 21.046 5.178 8.293 1.00 22.11 C ATOM 944 C GLU A 324 20.129 4.119 8.917 1.00 18.95 C ATOM 945 O GLU A 324 20.472 3.526 9.903 1.00 20.50 O ATOM 946 CB GLU A 324 20.679 6.596 8.773 1.00 20.78 C ATOM 947 CG GLU A 324 21.680 7.689 8.325 1.00 21.74 C ATOM 948 CD GLU A 324 21.096 9.087 8.309 1.00 27.07 C ATOM 949 OE1 GLU A 324 20.096 9.356 9.057 1.00 30.02 O ATOM 950 OE2 GLU A 324 21.633 9.935 7.541 1.00 34.79 O ATOM 0 H GLU A 324 20.455 5.706 6.473 1.00 20.55 H new ATOM 0 HA GLU A 324 21.972 5.048 8.549 1.00 22.11 H new ATOM 0 HB2 GLU A 324 19.796 6.822 8.440 1.00 20.78 H new ATOM 0 HB3 GLU A 324 20.626 6.596 9.742 1.00 20.78 H new ATOM 0 HG2 GLU A 324 22.447 7.675 8.918 1.00 21.74 H new ATOM 0 HG3 GLU A 324 22.005 7.473 7.437 1.00 21.74 H new ATOM 951 N ILE A 325 18.973 3.894 8.320 1.00 17.58 N ATOM 952 CA ILE A 325 17.996 2.955 8.870 1.00 18.33 C ATOM 953 C ILE A 325 18.580 1.560 8.708 1.00 19.59 C ATOM 954 O ILE A 325 18.430 0.696 9.578 1.00 18.71 O ATOM 955 CB ILE A 325 16.615 3.057 8.176 1.00 20.58 C ATOM 956 CG1 ILE A 325 15.957 4.443 8.328 1.00 21.85 C ATOM 957 CG2 ILE A 325 15.623 1.999 8.675 1.00 13.47 C ATOM 958 CD1 ILE A 325 15.919 4.902 9.649 1.00 27.33 C ATOM 0 H ILE A 325 18.728 4.275 7.589 1.00 17.58 H new ATOM 0 HA ILE A 325 17.835 3.165 9.803 1.00 18.33 H new ATOM 0 HB ILE A 325 16.811 2.903 7.239 1.00 20.58 H new ATOM 0 HG12 ILE A 325 16.441 5.084 7.784 1.00 21.85 H new ATOM 0 HG13 ILE A 325 15.052 4.403 7.981 1.00 21.85 H new ATOM 0 HG21 ILE A 325 14.777 2.104 8.212 1.00 13.47 H new ATOM 0 HG22 ILE A 325 15.979 1.114 8.500 1.00 13.47 H new ATOM 0 HG23 ILE A 325 15.485 2.109 9.629 1.00 13.47 H new ATOM 0 HD11 ILE A 325 15.495 5.774 9.677 1.00 27.33 H new ATOM 0 HD12 ILE A 325 15.412 4.279 10.194 1.00 27.33 H new ATOM 0 HD13 ILE A 325 16.823 4.971 9.994 1.00 27.33 H new ATOM 959 N ILE A 326 19.295 1.327 7.615 1.00 16.59 N ATOM 960 CA ILE A 326 19.729 -0.035 7.325 1.00 15.43 C ATOM 961 C ILE A 326 20.798 -0.396 8.318 1.00 16.56 C ATOM 962 O ILE A 326 20.815 -1.527 8.826 1.00 18.12 O ATOM 963 CB ILE A 326 20.193 -0.205 5.790 1.00 19.90 C ATOM 964 CG1 ILE A 326 18.967 -0.292 4.857 1.00 16.69 C ATOM 965 CG2 ILE A 326 21.133 -1.418 5.584 1.00 18.41 C ATOM 966 CD1 ILE A 326 19.317 -0.133 3.350 1.00 22.17 C ATOM 0 H ILE A 326 19.534 1.923 7.043 1.00 16.59 H new ATOM 0 HA ILE A 326 18.989 -0.655 7.422 1.00 15.43 H new ATOM 0 HB ILE A 326 20.705 0.586 5.559 1.00 19.90 H new ATOM 0 HG12 ILE A 326 18.529 -1.147 4.991 1.00 16.69 H new ATOM 0 HG13 ILE A 326 18.330 0.396 5.107 1.00 16.69 H new ATOM 0 HG21 ILE A 326 21.384 -1.478 4.649 1.00 18.41 H new ATOM 0 HG22 ILE A 326 21.930 -1.306 6.125 1.00 18.41 H new ATOM 0 HG23 ILE A 326 20.675 -2.231 5.849 1.00 18.41 H new ATOM 0 HD11 ILE A 326 18.507 -0.197 2.821 1.00 22.17 H new ATOM 0 HD12 ILE A 326 19.731 0.732 3.203 1.00 22.17 H new ATOM 0 HD13 ILE A 326 19.932 -0.834 3.085 1.00 22.17 H new ATOM 967 N TYR A 327 21.686 0.560 8.641 1.00 16.49 N ATOM 968 CA TYR A 327 22.642 0.332 9.690 1.00 16.86 C ATOM 969 C TYR A 327 21.984 0.030 11.037 1.00 18.91 C ATOM 970 O TYR A 327 22.478 -0.780 11.813 1.00 19.86 O ATOM 971 CB TYR A 327 23.608 1.560 9.816 1.00 21.68 C ATOM 972 CG TYR A 327 24.773 1.487 8.842 1.00 27.74 C ATOM 973 CD1 TYR A 327 25.911 0.736 9.130 1.00 34.31 C ATOM 974 CD2 TYR A 327 24.720 2.145 7.619 1.00 34.85 C ATOM 975 CE1 TYR A 327 26.982 0.660 8.217 1.00 29.09 C ATOM 976 CE2 TYR A 327 25.785 2.079 6.705 1.00 29.78 C ATOM 977 CZ TYR A 327 26.913 1.342 7.020 1.00 35.81 C ATOM 978 OH TYR A 327 27.968 1.273 6.128 1.00 36.91 O ATOM 0 H TYR A 327 21.737 1.330 8.261 1.00 16.49 H new ATOM 0 HA TYR A 327 23.150 -0.457 9.445 1.00 16.86 H new ATOM 0 HB2 TYR A 327 23.110 2.377 9.659 1.00 21.68 H new ATOM 0 HB3 TYR A 327 23.951 1.607 10.722 1.00 21.68 H new ATOM 0 HD1 TYR A 327 25.965 0.278 9.937 1.00 34.31 H new ATOM 0 HD2 TYR A 327 23.963 2.640 7.401 1.00 34.85 H new ATOM 0 HE1 TYR A 327 27.733 0.151 8.421 1.00 29.09 H new ATOM 0 HE2 TYR A 327 25.732 2.528 5.892 1.00 29.78 H new ATOM 0 HH TYR A 327 27.678 1.352 5.344 1.00 36.91 H new ATOM 979 N THR A 328 20.890 0.709 11.353 1.00 20.48 N ATOM 980 CA THR A 328 20.186 0.423 12.613 1.00 20.49 C ATOM 981 C THR A 328 19.526 -0.972 12.601 1.00 21.59 C ATOM 982 O THR A 328 19.565 -1.690 13.581 1.00 21.16 O ATOM 983 CB THR A 328 19.113 1.525 12.966 1.00 21.42 C ATOM 984 OG1 THR A 328 17.969 1.330 12.175 1.00 38.09 O ATOM 985 CG2 THR A 328 19.643 2.943 12.695 1.00 13.18 C ATOM 0 H THR A 328 20.539 1.327 10.869 1.00 20.48 H new ATOM 0 HA THR A 328 20.866 0.435 13.305 1.00 20.49 H new ATOM 0 HB THR A 328 18.907 1.442 13.910 1.00 21.42 H new ATOM 0 HG1 THR A 328 18.200 1.153 11.387 1.00 38.09 H new ATOM 0 HG21 THR A 328 18.960 3.593 12.922 1.00 13.18 H new ATOM 0 HG22 THR A 328 20.433 3.102 13.235 1.00 13.18 H new ATOM 0 HG23 THR A 328 19.871 3.029 11.756 1.00 13.18 H new ATOM 986 N MET A 329 18.893 -1.354 11.498 1.00 19.69 N ATOM 987 CA MET A 329 18.371 -2.707 11.382 1.00 22.78 C ATOM 988 C MET A 329 19.402 -3.809 11.462 1.00 21.48 C ATOM 989 O MET A 329 19.186 -4.798 12.112 1.00 21.87 O ATOM 990 CB MET A 329 17.616 -2.828 10.108 1.00 19.62 C ATOM 991 CG MET A 329 16.420 -1.930 10.180 1.00 28.34 C ATOM 992 SD MET A 329 15.306 -2.057 8.782 1.00 44.77 S ATOM 993 CE MET A 329 16.336 -1.930 7.458 1.00 18.43 C ATOM 0 H MET A 329 18.757 -0.851 10.814 1.00 19.69 H new ATOM 0 HA MET A 329 17.801 -2.835 12.157 1.00 22.78 H new ATOM 0 HB2 MET A 329 18.179 -2.581 9.358 1.00 19.62 H new ATOM 0 HB3 MET A 329 17.340 -3.747 9.965 1.00 19.62 H new ATOM 0 HG2 MET A 329 15.927 -2.132 10.991 1.00 28.34 H new ATOM 0 HG3 MET A 329 16.724 -1.012 10.254 1.00 28.34 H new ATOM 0 HE1 MET A 329 15.812 -1.829 6.648 1.00 18.43 H new ATOM 0 HE2 MET A 329 16.911 -1.157 7.568 1.00 18.43 H new ATOM 0 HE3 MET A 329 16.880 -2.731 7.393 1.00 18.43 H new ATOM 994 N LEU A 330 20.514 -3.633 10.782 1.00 17.66 N ATOM 995 CA LEU A 330 21.613 -4.571 10.829 1.00 22.22 C ATOM 996 C LEU A 330 22.045 -4.849 12.273 1.00 21.11 C ATOM 997 O LEU A 330 22.368 -5.983 12.623 1.00 21.58 O ATOM 998 CB LEU A 330 22.782 -3.968 10.050 1.00 23.88 C ATOM 999 CG LEU A 330 23.911 -4.941 9.716 1.00 28.96 C ATOM 1000 CD1 LEU A 330 23.427 -6.080 8.829 1.00 26.96 C ATOM 1001 CD2 LEU A 330 25.193 -4.211 9.196 1.00 27.54 C ATOM 0 H LEU A 330 20.655 -2.955 10.272 1.00 17.66 H new ATOM 0 HA LEU A 330 21.333 -5.413 10.438 1.00 22.22 H new ATOM 0 HB2 LEU A 330 22.442 -3.593 9.223 1.00 23.88 H new ATOM 0 HB3 LEU A 330 23.150 -3.232 10.564 1.00 23.88 H new ATOM 0 HG LEU A 330 24.193 -5.363 10.543 1.00 28.96 H new ATOM 0 HD11 LEU A 330 24.167 -6.677 8.637 1.00 26.96 H new ATOM 0 HD12 LEU A 330 22.726 -6.571 9.286 1.00 26.96 H new ATOM 0 HD13 LEU A 330 23.080 -5.719 7.999 1.00 26.96 H new ATOM 0 HD21 LEU A 330 25.880 -4.866 8.997 1.00 27.54 H new ATOM 0 HD22 LEU A 330 24.979 -3.714 8.391 1.00 27.54 H new ATOM 0 HD23 LEU A 330 25.516 -3.600 9.877 1.00 27.54 H new ATOM 1002 N ALA A 331 22.024 -3.829 13.140 1.00 16.31 N ATOM 1003 CA ALA A 331 22.496 -4.013 14.524 1.00 18.67 C ATOM 1004 C ALA A 331 21.598 -4.984 15.295 1.00 19.44 C ATOM 1005 O ALA A 331 22.077 -5.790 16.077 1.00 23.89 O ATOM 1006 CB ALA A 331 22.580 -2.653 15.243 1.00 17.89 C ATOM 0 H ALA A 331 21.746 -3.037 12.954 1.00 16.31 H new ATOM 0 HA ALA A 331 23.384 -4.402 14.491 1.00 18.67 H new ATOM 0 HB1 ALA A 331 22.891 -2.786 16.152 1.00 17.89 H new ATOM 0 HB2 ALA A 331 23.199 -2.075 14.771 1.00 17.89 H new ATOM 0 HB3 ALA A 331 21.702 -2.241 15.259 1.00 17.89 H new ATOM 1007 N SER A 332 20.287 -4.929 15.061 1.00 19.47 N ATOM 1008 CA SER A 332 19.382 -5.868 15.701 1.00 22.04 C ATOM 1009 C SER A 332 19.695 -7.314 15.284 1.00 21.24 C ATOM 1010 O SER A 332 19.308 -8.236 15.953 1.00 22.32 O ATOM 1011 CB SER A 332 17.951 -5.577 15.288 1.00 21.31 C ATOM 1012 OG SER A 332 17.628 -4.230 15.634 1.00 33.80 O ATOM 0 H SER A 332 19.909 -4.359 14.539 1.00 19.47 H new ATOM 0 HA SER A 332 19.495 -5.768 16.659 1.00 22.04 H new ATOM 0 HB2 SER A 332 17.845 -5.712 14.333 1.00 21.31 H new ATOM 0 HB3 SER A 332 17.344 -6.191 15.730 1.00 21.31 H new ATOM 0 HG SER A 332 18.208 -3.930 16.162 1.00 33.80 H new ATOM 1013 N LEU A 333 20.340 -7.500 14.146 1.00 21.14 N ATOM 1014 CA LEU A 333 20.622 -8.861 13.640 1.00 19.45 C ATOM 1015 C LEU A 333 21.996 -9.389 14.074 1.00 21.50 C ATOM 1016 O LEU A 333 22.340 -10.550 13.819 1.00 20.14 O ATOM 1017 CB LEU A 333 20.596 -8.821 12.109 1.00 19.92 C ATOM 1018 CG LEU A 333 19.278 -8.376 11.472 1.00 17.91 C ATOM 1019 CD1 LEU A 333 19.479 -8.292 9.992 1.00 18.42 C ATOM 1020 CD2 LEU A 333 18.146 -9.278 11.802 1.00 19.65 C ATOM 0 H LEU A 333 20.627 -6.864 13.644 1.00 21.14 H new ATOM 0 HA LEU A 333 19.947 -9.452 14.008 1.00 19.45 H new ATOM 0 HB2 LEU A 333 21.298 -8.224 11.807 1.00 19.92 H new ATOM 0 HB3 LEU A 333 20.813 -9.706 11.776 1.00 19.92 H new ATOM 0 HG LEU A 333 19.038 -7.508 11.833 1.00 17.91 H new ATOM 0 HD11 LEU A 333 18.653 -8.011 9.568 1.00 18.42 H new ATOM 0 HD12 LEU A 333 20.178 -7.648 9.796 1.00 18.42 H new ATOM 0 HD13 LEU A 333 19.737 -9.162 9.650 1.00 18.42 H new ATOM 0 HD21 LEU A 333 17.338 -8.953 11.376 1.00 19.65 H new ATOM 0 HD22 LEU A 333 18.342 -10.173 11.483 1.00 19.65 H new ATOM 0 HD23 LEU A 333 18.018 -9.299 12.763 1.00 19.65 H new ATOM 1021 N MET A 334 22.801 -8.518 14.682 1.00 18.81 N ATOM 1022 CA MET A 334 24.176 -8.845 15.039 1.00 20.70 C ATOM 1023 C MET A 334 24.384 -8.992 16.549 1.00 22.29 C ATOM 1024 O MET A 334 23.801 -8.234 17.333 1.00 22.23 O ATOM 1025 CB MET A 334 25.104 -7.721 14.565 1.00 18.42 C ATOM 1026 CG MET A 334 25.112 -7.483 13.076 1.00 21.62 C ATOM 1027 SD MET A 334 26.374 -6.232 12.681 1.00 26.91 S ATOM 1028 CE MET A 334 27.683 -6.881 13.677 1.00 35.06 C ATOM 0 H MET A 334 22.563 -7.721 14.898 1.00 18.81 H new ATOM 0 HA MET A 334 24.375 -9.694 14.614 1.00 20.70 H new ATOM 0 HB2 MET A 334 24.845 -6.898 15.009 1.00 18.42 H new ATOM 0 HB3 MET A 334 26.008 -7.925 14.851 1.00 18.42 H new ATOM 0 HG2 MET A 334 25.302 -8.310 12.606 1.00 21.62 H new ATOM 0 HG3 MET A 334 24.238 -7.182 12.780 1.00 21.62 H new ATOM 0 HE1 MET A 334 28.537 -6.664 13.271 1.00 35.06 H new ATOM 0 HE2 MET A 334 27.639 -6.491 14.564 1.00 35.06 H new ATOM 0 HE3 MET A 334 27.592 -7.845 13.743 1.00 35.06 H new ATOM 1029 N ASN A 335 25.233 -9.939 16.941 1.00 21.77 N ATOM 1030 CA ASN A 335 25.980 -9.905 18.219 1.00 22.01 C ATOM 1031 C ASN A 335 27.473 -9.920 17.969 1.00 24.98 C ATOM 1032 O ASN A 335 27.921 -9.715 16.851 1.00 24.44 O ATOM 1033 CB ASN A 335 25.522 -11.060 19.132 1.00 23.63 C ATOM 1034 CG ASN A 335 25.813 -12.402 18.556 1.00 26.40 C ATOM 1035 OD1 ASN A 335 26.656 -12.527 17.681 1.00 21.38 O ATOM 1036 ND2 ASN A 335 25.164 -13.439 19.080 1.00 29.38 N ATOM 0 H ASN A 335 25.401 -10.637 16.468 1.00 21.77 H new ATOM 0 HA ASN A 335 25.784 -9.075 18.682 1.00 22.01 H new ATOM 0 HB2 ASN A 335 25.962 -10.980 19.993 1.00 23.63 H new ATOM 0 HB3 ASN A 335 24.569 -10.981 19.292 1.00 23.63 H new ATOM 0 HD21 ASN A 335 25.332 -14.236 18.804 1.00 29.38 H new ATOM 0 HD22 ASN A 335 24.576 -13.312 19.695 1.00 29.38 H new ATOM 1037 N LYS A 336 28.273 -10.110 19.005 1.00 24.65 N ATOM 1038 CA LYS A 336 29.710 -9.942 18.894 1.00 23.74 C ATOM 1039 C LYS A 336 30.375 -10.976 17.969 1.00 22.75 C ATOM 1040 O LYS A 336 31.493 -10.795 17.568 1.00 25.83 O ATOM 1041 CB LYS A 336 30.354 -10.074 20.296 1.00 24.81 C ATOM 1042 CG LYS A 336 30.972 -8.787 20.788 1.00 36.20 C ATOM 1043 CD LYS A 336 31.028 -8.719 22.332 1.00 47.37 C ATOM 1044 CE LYS A 336 29.783 -7.984 22.909 1.00 52.76 C ATOM 1045 NZ LYS A 336 29.880 -7.719 24.384 1.00 50.71 N ATOM 0 H LYS A 336 28.000 -10.339 19.788 1.00 24.65 H new ATOM 0 HA LYS A 336 29.853 -9.063 18.511 1.00 23.74 H new ATOM 0 HB2 LYS A 336 29.680 -10.365 20.929 1.00 24.81 H new ATOM 0 HB3 LYS A 336 31.035 -10.764 20.269 1.00 24.81 H new ATOM 0 HG2 LYS A 336 31.869 -8.703 20.429 1.00 36.20 H new ATOM 0 HG3 LYS A 336 30.460 -8.035 20.451 1.00 36.20 H new ATOM 0 HD2 LYS A 336 31.074 -9.617 22.696 1.00 47.37 H new ATOM 0 HD3 LYS A 336 31.836 -8.259 22.609 1.00 47.37 H new ATOM 0 HE2 LYS A 336 29.668 -7.141 22.442 1.00 52.76 H new ATOM 0 HE3 LYS A 336 28.991 -8.516 22.734 1.00 52.76 H new ATOM 0 HZ1 LYS A 336 29.145 -7.299 24.659 1.00 50.71 H new ATOM 0 HZ2 LYS A 336 29.961 -8.491 24.820 1.00 50.71 H new ATOM 0 HZ3 LYS A 336 30.591 -7.210 24.548 1.00 50.71 H new ATOM 1046 N ASP A 337 29.654 -12.049 17.673 1.00 24.87 N ATOM 1047 CA ASP A 337 30.167 -13.302 17.072 1.00 24.93 C ATOM 1048 C ASP A 337 29.669 -13.512 15.607 1.00 21.48 C ATOM 1049 O ASP A 337 30.152 -14.397 14.914 1.00 20.38 O ATOM 1050 CB ASP A 337 29.639 -14.492 17.896 1.00 24.37 C ATOM 1051 CG ASP A 337 30.226 -14.549 19.321 1.00 39.39 C ATOM 1052 OD1 ASP A 337 31.274 -13.906 19.578 1.00 43.39 O ATOM 1053 OD2 ASP A 337 29.641 -15.266 20.179 1.00 47.27 O ATOM 0 H ASP A 337 28.807 -12.080 17.820 1.00 24.87 H new ATOM 0 HA ASP A 337 31.135 -13.243 17.070 1.00 24.93 H new ATOM 0 HB2 ASP A 337 28.672 -14.436 17.952 1.00 24.37 H new ATOM 0 HB3 ASP A 337 29.849 -15.318 17.432 1.00 24.37 H new ATOM 1054 N GLY A 338 28.696 -12.727 15.159 1.00 18.86 N ATOM 1055 CA GLY A 338 28.141 -12.888 13.802 1.00 16.24 C ATOM 1056 C GLY A 338 26.811 -12.231 13.590 1.00 17.92 C ATOM 1057 O GLY A 338 26.354 -11.385 14.407 1.00 20.82 O ATOM 0 H GLY A 338 28.338 -12.094 15.618 1.00 18.86 H new ATOM 0 HA2 GLY A 338 28.773 -12.526 13.162 1.00 16.24 H new ATOM 0 HA3 GLY A 338 28.055 -13.835 13.611 1.00 16.24 H new ATOM 1058 N VAL A 339 26.172 -12.596 12.478 1.00 17.81 N ATOM 1059 CA VAL A 339 25.035 -11.853 12.014 1.00 16.19 C ATOM 1060 C VAL A 339 23.992 -12.814 11.509 1.00 18.76 C ATOM 1061 O VAL A 339 24.306 -13.794 10.801 1.00 15.92 O ATOM 1062 CB VAL A 339 25.453 -10.804 10.937 1.00 17.34 C ATOM 1063 CG1 VAL A 339 26.061 -11.517 9.704 1.00 16.98 C ATOM 1064 CG2 VAL A 339 24.214 -9.935 10.506 1.00 14.68 C ATOM 0 H VAL A 339 26.390 -13.269 11.989 1.00 17.81 H new ATOM 0 HA VAL A 339 24.651 -11.348 12.748 1.00 16.19 H new ATOM 0 HB VAL A 339 26.123 -10.217 11.321 1.00 17.34 H new ATOM 0 HG11 VAL A 339 26.317 -10.856 9.042 1.00 16.98 H new ATOM 0 HG12 VAL A 339 26.843 -12.022 9.975 1.00 16.98 H new ATOM 0 HG13 VAL A 339 25.404 -12.120 9.322 1.00 16.98 H new ATOM 0 HG21 VAL A 339 24.489 -9.288 9.837 1.00 14.68 H new ATOM 0 HG22 VAL A 339 23.528 -10.511 10.135 1.00 14.68 H new ATOM 0 HG23 VAL A 339 23.861 -9.469 11.280 1.00 14.68 H new ATOM 1065 N LEU A 340 22.750 -12.578 11.913 1.00 18.64 N ATOM 1066 CA LEU A 340 21.642 -13.385 11.430 1.00 19.71 C ATOM 1067 C LEU A 340 21.368 -13.068 9.972 1.00 22.44 C ATOM 1068 O LEU A 340 21.296 -11.875 9.598 1.00 20.04 O ATOM 1069 CB LEU A 340 20.360 -13.095 12.232 1.00 18.08 C ATOM 1070 CG LEU A 340 20.162 -13.650 13.641 1.00 21.93 C ATOM 1071 CD1 LEU A 340 18.758 -13.346 14.227 1.00 19.46 C ATOM 1072 CD2 LEU A 340 20.465 -15.177 13.729 1.00 17.06 C ATOM 0 H LEU A 340 22.529 -11.957 12.465 1.00 18.64 H new ATOM 0 HA LEU A 340 21.888 -14.317 11.536 1.00 19.71 H new ATOM 0 HB2 LEU A 340 20.277 -12.131 12.294 1.00 18.08 H new ATOM 0 HB3 LEU A 340 19.615 -13.410 11.697 1.00 18.08 H new ATOM 0 HG LEU A 340 20.812 -13.180 14.187 1.00 21.93 H new ATOM 0 HD11 LEU A 340 18.691 -13.721 15.119 1.00 19.46 H new ATOM 0 HD12 LEU A 340 18.626 -12.386 14.270 1.00 19.46 H new ATOM 0 HD13 LEU A 340 18.078 -13.741 13.659 1.00 19.46 H new ATOM 0 HD21 LEU A 340 20.326 -15.483 14.639 1.00 17.06 H new ATOM 0 HD22 LEU A 340 19.872 -15.660 13.132 1.00 17.06 H new ATOM 0 HD23 LEU A 340 21.386 -15.340 13.471 1.00 17.06 H new ATOM 1073 N ILE A 341 21.120 -14.114 9.156 1.00 17.97 N ATOM 1074 CA ILE A 341 20.871 -13.950 7.741 1.00 17.18 C ATOM 1075 C ILE A 341 19.657 -14.749 7.336 1.00 18.28 C ATOM 1076 O ILE A 341 19.122 -15.485 8.122 1.00 17.82 O ATOM 1077 CB ILE A 341 22.061 -14.413 6.884 1.00 16.49 C ATOM 1078 CG1 ILE A 341 22.189 -15.946 6.906 1.00 17.54 C ATOM 1079 CG2 ILE A 341 23.367 -13.790 7.423 1.00 23.39 C ATOM 1080 CD1 ILE A 341 23.445 -16.422 6.111 1.00 23.57 C ATOM 0 H ILE A 341 21.095 -14.931 9.424 1.00 17.97 H new ATOM 0 HA ILE A 341 20.729 -13.003 7.588 1.00 17.18 H new ATOM 0 HB ILE A 341 21.907 -14.124 5.971 1.00 16.49 H new ATOM 0 HG12 ILE A 341 22.249 -16.254 7.824 1.00 17.54 H new ATOM 0 HG13 ILE A 341 21.392 -16.345 6.524 1.00 17.54 H new ATOM 0 HG21 ILE A 341 24.115 -14.085 6.880 1.00 23.39 H new ATOM 0 HG22 ILE A 341 23.303 -12.823 7.387 1.00 23.39 H new ATOM 0 HG23 ILE A 341 23.505 -14.071 8.341 1.00 23.39 H new ATOM 0 HD11 ILE A 341 23.500 -17.390 6.142 1.00 23.57 H new ATOM 0 HD12 ILE A 341 23.373 -16.132 5.188 1.00 23.57 H new ATOM 0 HD13 ILE A 341 24.243 -16.040 6.508 1.00 23.57 H new ATOM 1081 N SER A 342 19.190 -14.543 6.124 1.00 18.32 N ATOM 1082 CA SER A 342 17.982 -15.247 5.630 1.00 24.68 C ATOM 1083 C SER A 342 16.832 -15.122 6.594 1.00 25.82 C ATOM 1084 O SER A 342 16.195 -16.112 6.930 1.00 28.00 O ATOM 1085 CB SER A 342 18.248 -16.725 5.395 1.00 23.77 C ATOM 1086 OG SER A 342 17.097 -17.379 4.822 1.00 29.77 O ATOM 0 H SER A 342 19.545 -14.003 5.557 1.00 18.32 H new ATOM 0 HA SER A 342 17.750 -14.821 4.790 1.00 24.68 H new ATOM 0 HB2 SER A 342 19.010 -16.829 4.803 1.00 23.77 H new ATOM 0 HB3 SER A 342 18.481 -17.152 6.235 1.00 23.77 H new ATOM 0 HG SER A 342 16.415 -17.197 5.278 1.00 29.77 H new ATOM 1087 N GLU A 343 16.577 -13.913 7.077 1.00 28.61 N ATOM 1088 CA GLU A 343 15.423 -13.686 7.965 1.00 28.98 C ATOM 1089 C GLU A 343 15.525 -14.532 9.208 1.00 28.22 C ATOM 1090 O GLU A 343 14.534 -15.070 9.682 1.00 28.11 O ATOM 1091 CB GLU A 343 14.117 -14.000 7.245 1.00 31.85 C ATOM 1092 CG GLU A 343 14.118 -13.644 5.784 1.00 32.72 C ATOM 1093 CD GLU A 343 13.708 -12.190 5.555 1.00 54.10 C ATOM 1094 OE1 GLU A 343 13.164 -11.576 6.511 1.00 60.94 O ATOM 1095 OE2 GLU A 343 13.936 -11.657 4.435 1.00 56.23 O ATOM 0 H GLU A 343 17.048 -13.213 6.910 1.00 28.61 H new ATOM 0 HA GLU A 343 15.429 -12.750 8.219 1.00 28.98 H new ATOM 0 HB2 GLU A 343 13.928 -14.947 7.337 1.00 31.85 H new ATOM 0 HB3 GLU A 343 13.395 -13.523 7.683 1.00 31.85 H new ATOM 0 HG2 GLU A 343 15.003 -13.793 5.415 1.00 32.72 H new ATOM 0 HG3 GLU A 343 13.510 -14.231 5.308 1.00 32.72 H new ATOM 1096 N GLY A 344 16.738 -14.620 9.747 1.00 28.37 N ATOM 1097 CA GLY A 344 16.974 -15.307 10.990 1.00 24.81 C ATOM 1098 C GLY A 344 17.194 -16.805 10.932 1.00 23.96 C ATOM 1099 O GLY A 344 17.487 -17.406 11.940 1.00 21.78 O ATOM 0 H GLY A 344 17.444 -14.278 9.393 1.00 28.37 H new ATOM 0 HA2 GLY A 344 17.751 -14.907 11.410 1.00 24.81 H new ATOM 0 HA3 GLY A 344 16.218 -15.138 11.573 1.00 24.81 H new ATOM 1100 N GLN A 345 17.111 -17.376 9.750 1.00 23.55 N ATOM 1101 CA GLN A 345 17.268 -18.799 9.554 1.00 23.08 C ATOM 1102 C GLN A 345 18.713 -19.266 9.489 1.00 21.28 C ATOM 1103 O GLN A 345 18.959 -20.427 9.701 1.00 22.88 O ATOM 1104 CB GLN A 345 16.584 -19.225 8.267 1.00 23.65 C ATOM 1105 CG GLN A 345 15.072 -19.226 8.329 1.00 32.69 C ATOM 1106 CD GLN A 345 14.508 -19.821 7.036 1.00 49.73 C ATOM 1107 OE1 GLN A 345 13.485 -20.496 7.036 1.00 52.05 O ATOM 1108 NE2 GLN A 345 15.217 -19.605 5.934 1.00 57.38 N ATOM 0 H GLN A 345 16.959 -16.940 9.024 1.00 23.55 H new ATOM 0 HA GLN A 345 16.863 -19.209 10.334 1.00 23.08 H new ATOM 0 HB2 GLN A 345 16.866 -18.633 7.553 1.00 23.65 H new ATOM 0 HB3 GLN A 345 16.887 -20.116 8.033 1.00 23.65 H new ATOM 0 HG2 GLN A 345 14.770 -19.743 9.093 1.00 32.69 H new ATOM 0 HG3 GLN A 345 14.743 -18.322 8.451 1.00 32.69 H new ATOM 0 HE21 GLN A 345 15.931 -19.126 5.969 1.00 57.38 H new ATOM 0 HE22 GLN A 345 14.963 -19.944 5.186 1.00 57.38 H new ATOM 1109 N GLY A 346 19.657 -18.377 9.185 1.00 21.76 N ATOM 1110 CA GLY A 346 21.077 -18.713 9.258 1.00 20.53 C ATOM 1111 C GLY A 346 21.910 -17.685 10.021 1.00 20.75 C ATOM 1112 O GLY A 346 21.412 -16.645 10.442 1.00 16.20 O ATOM 0 H GLY A 346 19.495 -17.571 8.933 1.00 21.76 H new ATOM 0 HA2 GLY A 346 21.175 -19.579 9.685 1.00 20.53 H new ATOM 0 HA3 GLY A 346 21.428 -18.799 8.358 1.00 20.53 H new ATOM 1113 N PHE A 347 23.195 -17.941 10.177 1.00 17.10 N ATOM 1114 CA PHE A 347 24.015 -17.063 11.052 1.00 19.79 C ATOM 1115 C PHE A 347 25.349 -17.107 10.415 1.00 18.09 C ATOM 1116 O PHE A 347 25.894 -18.189 10.232 1.00 19.02 O ATOM 1117 CB PHE A 347 24.111 -17.660 12.451 1.00 15.63 C ATOM 1118 CG PHE A 347 24.907 -16.854 13.422 1.00 19.52 C ATOM 1119 CD1 PHE A 347 24.385 -15.696 13.974 1.00 19.80 C ATOM 1120 CD2 PHE A 347 26.130 -17.305 13.869 1.00 19.32 C ATOM 1121 CE1 PHE A 347 25.101 -14.982 14.890 1.00 18.80 C ATOM 1122 CE2 PHE A 347 26.859 -16.585 14.798 1.00 24.05 C ATOM 1123 CZ PHE A 347 26.341 -15.407 15.290 1.00 24.18 C ATOM 0 H PHE A 347 23.618 -18.592 9.806 1.00 17.10 H new ATOM 0 HA PHE A 347 23.650 -16.169 11.142 1.00 19.79 H new ATOM 0 HB2 PHE A 347 23.214 -17.773 12.803 1.00 15.63 H new ATOM 0 HB3 PHE A 347 24.504 -18.544 12.385 1.00 15.63 H new ATOM 0 HD1 PHE A 347 23.540 -15.403 13.718 1.00 19.80 H new ATOM 0 HD2 PHE A 347 26.470 -18.106 13.541 1.00 19.32 H new ATOM 0 HE1 PHE A 347 24.745 -14.200 15.246 1.00 18.80 H new ATOM 0 HE2 PHE A 347 27.688 -16.892 15.087 1.00 24.05 H new ATOM 0 HZ PHE A 347 26.833 -14.900 15.894 1.00 24.18 H new ATOM 1124 N MET A 348 25.867 -15.970 10.031 1.00 18.04 N ATOM 1125 CA MET A 348 27.186 -15.977 9.444 1.00 20.36 C ATOM 1126 C MET A 348 28.200 -15.418 10.463 1.00 19.57 C ATOM 1127 O MET A 348 27.984 -14.370 11.057 1.00 16.95 O ATOM 1128 CB MET A 348 27.200 -15.152 8.175 1.00 20.82 C ATOM 1129 CG MET A 348 28.432 -15.457 7.305 1.00 27.40 C ATOM 1130 SD MET A 348 28.553 -14.445 5.866 1.00 29.16 S ATOM 1131 CE MET A 348 27.226 -15.115 4.892 1.00 26.99 C ATOM 0 H MET A 348 25.489 -15.200 10.096 1.00 18.04 H new ATOM 0 HA MET A 348 27.432 -16.887 9.216 1.00 20.36 H new ATOM 0 HB2 MET A 348 26.393 -15.329 7.666 1.00 20.82 H new ATOM 0 HB3 MET A 348 27.191 -14.209 8.403 1.00 20.82 H new ATOM 0 HG2 MET A 348 29.233 -15.341 7.840 1.00 27.40 H new ATOM 0 HG3 MET A 348 28.404 -16.388 7.034 1.00 27.40 H new ATOM 0 HE1 MET A 348 27.289 -14.779 3.984 1.00 26.99 H new ATOM 0 HE2 MET A 348 27.288 -16.083 4.883 1.00 26.99 H new ATOM 0 HE3 MET A 348 26.376 -14.849 5.277 1.00 26.99 H new ATOM 1132 N THR A 349 29.286 -16.072 10.755 1.00 20.00 N ATOM 1133 CA THR A 349 30.165 -15.666 11.843 1.00 20.00 C ATOM 1134 C THR A 349 30.973 -14.428 11.467 1.00 20.00 C ATOM 1135 O THR A 349 31.393 -14.281 10.317 1.00 20.93 O ATOM 1136 CB THR A 349 31.112 -16.817 12.231 1.00 20.00 C ATOM 1137 OG1 THR A 349 31.958 -17.139 11.121 1.00 20.00 O ATOM 1138 CG2 THR A 349 30.327 -18.100 12.457 1.00 20.00 C ATOM 0 H THR A 349 29.549 -16.773 10.332 1.00 20.00 H new ATOM 0 HA THR A 349 29.608 -15.445 12.606 1.00 20.00 H new ATOM 0 HB THR A 349 31.597 -16.529 13.020 1.00 20.00 H new ATOM 0 HG1 THR A 349 32.475 -17.766 11.335 1.00 20.00 H new ATOM 0 HG21 THR A 349 30.937 -18.814 12.700 1.00 20.00 H new ATOM 0 HG22 THR A 349 29.686 -17.965 13.172 1.00 20.00 H new ATOM 0 HG23 THR A 349 29.857 -18.340 11.643 1.00 20.00 H new ATOM 1139 N ARG A 350 31.316 -13.723 12.388 1.00 22.79 N ATOM 1140 CA ARG A 350 32.134 -12.534 12.175 1.00 22.54 C ATOM 1141 C ARG A 350 33.509 -12.942 11.633 1.00 23.09 C ATOM 1142 O ARG A 350 34.053 -12.297 10.761 1.00 22.35 O ATOM 1143 CB ARG A 350 32.346 -11.876 13.557 1.00 23.16 C ATOM 1144 CG ARG A 350 33.155 -10.579 13.533 1.00 25.41 C ATOM 1145 CD ARG A 350 33.032 -9.931 14.907 1.00 31.66 C ATOM 1146 NE ARG A 350 33.777 -8.683 14.977 1.00 34.19 N ATOM 1147 CZ ARG A 350 33.769 -7.875 16.032 1.00 39.46 C ATOM 1148 NH1 ARG A 350 33.053 -8.208 17.095 1.00 33.80 N ATOM 1149 NH2 ARG A 350 34.490 -6.754 16.026 1.00 29.40 N ATOM 0 H ARG A 350 31.107 -13.869 13.209 1.00 22.79 H new ATOM 0 HA ARG A 350 31.701 -11.935 11.547 1.00 22.54 H new ATOM 0 HB2 ARG A 350 31.478 -11.694 13.951 1.00 23.16 H new ATOM 0 HB3 ARG A 350 32.794 -12.511 14.138 1.00 23.16 H new ATOM 0 HG2 ARG A 350 34.085 -10.761 13.325 1.00 25.41 H new ATOM 0 HG3 ARG A 350 32.822 -9.983 12.844 1.00 25.41 H new ATOM 0 HD2 ARG A 350 32.097 -9.763 15.104 1.00 31.66 H new ATOM 0 HD3 ARG A 350 33.359 -10.543 15.585 1.00 31.66 H new ATOM 0 HE ARG A 350 34.250 -8.455 14.296 1.00 34.19 H new ATOM 0 HH11 ARG A 350 32.601 -8.939 17.097 1.00 33.80 H new ATOM 0 HH12 ARG A 350 33.040 -7.693 17.783 1.00 33.80 H new ATOM 0 HH21 ARG A 350 34.963 -6.551 15.337 1.00 29.40 H new ATOM 0 HH22 ARG A 350 34.482 -6.234 16.711 1.00 29.40 H new ATOM 1150 N GLU A 351 34.091 -13.992 12.190 1.00 24.39 N ATOM 1151 CA GLU A 351 35.394 -14.463 11.723 1.00 26.67 C ATOM 1152 C GLU A 351 35.449 -14.904 10.262 1.00 27.90 C ATOM 1153 O GLU A 351 36.466 -14.694 9.597 1.00 27.60 O ATOM 1154 CB GLU A 351 35.970 -15.544 12.625 1.00 29.01 C ATOM 1155 CG GLU A 351 36.134 -15.139 14.129 1.00 45.46 C ATOM 1156 CD GLU A 351 36.907 -13.819 14.388 1.00 54.71 C ATOM 1157 OE1 GLU A 351 38.151 -13.820 14.255 1.00 62.49 O ATOM 1158 OE2 GLU A 351 36.276 -12.796 14.772 1.00 54.78 O ATOM 0 H GLU A 351 33.754 -14.447 12.837 1.00 24.39 H new ATOM 0 HA GLU A 351 35.951 -13.671 11.775 1.00 26.67 H new ATOM 0 HB2 GLU A 351 35.397 -16.325 12.576 1.00 29.01 H new ATOM 0 HB3 GLU A 351 36.837 -15.806 12.279 1.00 29.01 H new ATOM 0 HG2 GLU A 351 35.252 -15.061 14.524 1.00 45.46 H new ATOM 0 HG3 GLU A 351 36.590 -15.858 14.593 1.00 45.46 H new ATOM 1159 N PHE A 352 34.355 -15.488 9.766 1.00 22.47 N ATOM 1160 CA PHE A 352 34.259 -15.901 8.389 1.00 22.92 C ATOM 1161 C PHE A 352 34.310 -14.673 7.501 1.00 22.93 C ATOM 1162 O PHE A 352 35.084 -14.588 6.539 1.00 19.18 O ATOM 1163 CB PHE A 352 32.951 -16.673 8.144 1.00 18.75 C ATOM 1164 CG PHE A 352 32.728 -17.012 6.671 1.00 21.92 C ATOM 1165 CD1 PHE A 352 33.496 -17.994 6.039 1.00 22.92 C ATOM 1166 CD2 PHE A 352 31.766 -16.356 5.938 1.00 20.04 C ATOM 1167 CE1 PHE A 352 33.294 -18.308 4.687 1.00 18.62 C ATOM 1168 CE2 PHE A 352 31.560 -16.649 4.576 1.00 20.96 C ATOM 1169 CZ PHE A 352 32.305 -17.608 3.964 1.00 19.96 C ATOM 0 H PHE A 352 33.650 -15.651 10.231 1.00 22.47 H new ATOM 0 HA PHE A 352 35.001 -16.490 8.180 1.00 22.92 H new ATOM 0 HB2 PHE A 352 32.963 -17.493 8.662 1.00 18.75 H new ATOM 0 HB3 PHE A 352 32.204 -16.145 8.466 1.00 18.75 H new ATOM 0 HD1 PHE A 352 34.150 -18.446 6.522 1.00 22.92 H new ATOM 0 HD2 PHE A 352 31.242 -15.707 6.350 1.00 20.04 H new ATOM 0 HE1 PHE A 352 33.804 -18.967 4.274 1.00 18.62 H new ATOM 0 HE2 PHE A 352 30.913 -16.186 4.094 1.00 20.96 H new ATOM 0 HZ PHE A 352 32.162 -17.803 3.066 1.00 19.96 H new ATOM 1170 N LEU A 353 33.513 -13.682 7.851 1.00 23.34 N ATOM 1171 CA LEU A 353 33.442 -12.477 7.052 1.00 22.79 C ATOM 1172 C LEU A 353 34.751 -11.727 7.181 1.00 24.54 C ATOM 1173 O LEU A 353 35.147 -10.991 6.288 1.00 22.91 O ATOM 1174 CB LEU A 353 32.292 -11.590 7.576 1.00 22.76 C ATOM 1175 CG LEU A 353 30.855 -12.035 7.313 1.00 22.91 C ATOM 1176 CD1 LEU A 353 29.857 -11.471 8.418 1.00 15.50 C ATOM 1177 CD2 LEU A 353 30.448 -11.570 5.943 1.00 23.16 C ATOM 0 H LEU A 353 33.006 -13.687 8.546 1.00 23.34 H new ATOM 0 HA LEU A 353 33.281 -12.703 6.122 1.00 22.79 H new ATOM 0 HB2 LEU A 353 32.402 -11.499 8.535 1.00 22.76 H new ATOM 0 HB3 LEU A 353 32.402 -10.706 7.193 1.00 22.76 H new ATOM 0 HG LEU A 353 30.811 -13.003 7.359 1.00 22.91 H new ATOM 0 HD11 LEU A 353 28.955 -11.771 8.223 1.00 15.50 H new ATOM 0 HD12 LEU A 353 30.124 -11.797 9.292 1.00 15.50 H new ATOM 0 HD13 LEU A 353 29.883 -10.501 8.413 1.00 15.50 H new ATOM 0 HD21 LEU A 353 29.536 -11.847 5.765 1.00 23.16 H new ATOM 0 HD22 LEU A 353 30.506 -10.603 5.899 1.00 23.16 H new ATOM 0 HD23 LEU A 353 31.039 -11.959 5.280 1.00 23.16 H new ATOM 1178 N LYS A 354 35.401 -11.859 8.331 1.00 26.01 N ATOM 1179 CA LYS A 354 36.677 -11.162 8.553 1.00 30.93 C ATOM 1180 C LYS A 354 37.796 -11.792 7.703 1.00 28.45 C ATOM 1181 O LYS A 354 38.824 -11.172 7.449 1.00 29.20 O ATOM 1182 CB LYS A 354 37.000 -11.210 10.065 1.00 27.96 C ATOM 1183 CG LYS A 354 38.305 -10.602 10.513 1.00 38.45 C ATOM 1184 CD LYS A 354 38.330 -10.466 12.046 1.00 39.41 C ATOM 1185 CE LYS A 354 39.647 -9.829 12.508 1.00 52.63 C ATOM 1186 NZ LYS A 354 40.157 -10.427 13.779 1.00 54.09 N ATOM 0 H LYS A 354 35.130 -12.339 8.991 1.00 26.01 H new ATOM 0 HA LYS A 354 36.608 -10.235 8.275 1.00 30.93 H new ATOM 0 HB2 LYS A 354 36.282 -10.763 10.540 1.00 27.96 H new ATOM 0 HB3 LYS A 354 36.990 -12.139 10.345 1.00 27.96 H new ATOM 0 HG2 LYS A 354 39.045 -11.156 10.219 1.00 38.45 H new ATOM 0 HG3 LYS A 354 38.421 -9.731 10.102 1.00 38.45 H new ATOM 0 HD2 LYS A 354 37.582 -9.924 12.340 1.00 39.41 H new ATOM 0 HD3 LYS A 354 38.226 -11.339 12.455 1.00 39.41 H new ATOM 0 HE2 LYS A 354 40.315 -9.935 11.813 1.00 52.63 H new ATOM 0 HE3 LYS A 354 39.516 -8.876 12.632 1.00 52.63 H new ATOM 0 HZ1 LYS A 354 40.919 -10.030 14.009 1.00 54.09 H new ATOM 0 HZ2 LYS A 354 39.555 -10.311 14.424 1.00 54.09 H new ATOM 0 HZ3 LYS A 354 40.300 -11.297 13.661 1.00 54.09 H new ATOM 1187 N SER A 355 37.601 -13.043 7.298 1.00 28.46 N ATOM 1188 CA SER A 355 38.545 -13.765 6.433 1.00 27.58 C ATOM 1189 C SER A 355 38.345 -13.622 4.897 1.00 28.82 C ATOM 1190 O SER A 355 39.125 -14.198 4.123 1.00 29.98 O ATOM 1191 CB SER A 355 38.607 -15.246 6.830 1.00 29.25 C ATOM 1192 OG SER A 355 37.450 -15.944 6.375 1.00 32.23 O ATOM 0 H SER A 355 36.910 -13.506 7.518 1.00 28.46 H new ATOM 0 HA SER A 355 39.392 -13.322 6.596 1.00 27.58 H new ATOM 0 HB2 SER A 355 39.403 -15.652 6.454 1.00 29.25 H new ATOM 0 HB3 SER A 355 38.678 -15.323 7.794 1.00 29.25 H new ATOM 0 HG SER A 355 36.774 -15.454 6.463 1.00 32.23 H new ATOM 1193 N LEU A 356 37.334 -12.877 4.439 1.00 26.32 N ATOM 1194 CA LEU A 356 37.201 -12.663 3.016 1.00 27.20 C ATOM 1195 C LEU A 356 38.378 -11.838 2.499 1.00 29.05 C ATOM 1196 O LEU A 356 38.947 -11.052 3.246 1.00 25.60 O ATOM 1197 CB LEU A 356 35.831 -12.044 2.662 1.00 27.31 C ATOM 1198 CG LEU A 356 34.627 -12.966 3.014 1.00 24.52 C ATOM 1199 CD1 LEU A 356 33.304 -12.256 2.749 1.00 31.00 C ATOM 1200 CD2 LEU A 356 34.698 -14.289 2.160 1.00 21.39 C ATOM 0 H LEU A 356 36.735 -12.500 4.928 1.00 26.32 H new ATOM 0 HA LEU A 356 37.227 -13.521 2.565 1.00 27.20 H new ATOM 0 HB2 LEU A 356 35.733 -11.201 3.132 1.00 27.31 H new ATOM 0 HB3 LEU A 356 35.810 -11.843 1.713 1.00 27.31 H new ATOM 0 HG LEU A 356 34.676 -13.185 3.958 1.00 24.52 H new ATOM 0 HD11 LEU A 356 32.569 -12.847 2.974 1.00 31.00 H new ATOM 0 HD12 LEU A 356 33.252 -11.454 3.292 1.00 31.00 H new ATOM 0 HD13 LEU A 356 33.248 -12.015 1.811 1.00 31.00 H new ATOM 0 HD21 LEU A 356 33.946 -14.859 2.383 1.00 21.39 H new ATOM 0 HD22 LEU A 356 34.666 -14.067 1.216 1.00 21.39 H new ATOM 0 HD23 LEU A 356 35.526 -14.756 2.354 1.00 21.39 H new ATOM 1201 N ARG A 357 38.748 -12.024 1.233 1.00 29.78 N ATOM 1202 CA ARG A 357 39.905 -11.311 0.680 1.00 35.03 C ATOM 1203 C ARG A 357 39.883 -9.807 0.976 1.00 36.98 C ATOM 1204 O ARG A 357 38.852 -9.112 0.837 1.00 32.20 O ATOM 1205 CB ARG A 357 40.125 -11.569 -0.828 1.00 34.73 C ATOM 1206 CG ARG A 357 38.859 -11.719 -1.683 1.00 43.32 C ATOM 1207 CD ARG A 357 39.112 -11.416 -3.184 1.00 40.49 C ATOM 1208 NE ARG A 357 39.196 -9.987 -3.378 1.00 53.02 N ATOM 1209 CZ ARG A 357 38.584 -9.288 -4.329 1.00 48.33 C ATOM 1210 NH1 ARG A 357 37.811 -9.855 -5.247 1.00 45.28 N ATOM 1211 NH2 ARG A 357 38.764 -7.986 -4.348 1.00 49.40 N ATOM 0 H ARG A 357 38.350 -12.551 0.682 1.00 29.78 H new ATOM 0 HA ARG A 357 40.666 -11.689 1.147 1.00 35.03 H new ATOM 0 HB2 ARG A 357 40.651 -10.838 -1.188 1.00 34.73 H new ATOM 0 HB3 ARG A 357 40.655 -12.375 -0.925 1.00 34.73 H new ATOM 0 HG2 ARG A 357 38.517 -12.622 -1.592 1.00 43.32 H new ATOM 0 HG3 ARG A 357 38.173 -11.121 -1.347 1.00 43.32 H new ATOM 0 HD2 ARG A 357 39.934 -11.841 -3.476 1.00 40.49 H new ATOM 0 HD3 ARG A 357 38.395 -11.784 -3.724 1.00 40.49 H new ATOM 0 HE ARG A 357 39.688 -9.547 -2.827 1.00 53.02 H new ATOM 0 HH11 ARG A 357 37.690 -10.706 -5.241 1.00 45.28 H new ATOM 0 HH12 ARG A 357 37.431 -9.371 -5.848 1.00 45.28 H new ATOM 0 HH21 ARG A 357 39.265 -7.612 -3.757 1.00 49.40 H new ATOM 0 HH22 ARG A 357 38.381 -7.508 -4.951 1.00 49.40 H new ATOM 1212 N LYS A 358 41.017 -9.340 1.474 1.00 40.63 N ATOM 1213 CA LYS A 358 41.741 -8.222 0.902 1.00 44.81 C ATOM 1214 C LYS A 358 41.163 -6.824 1.014 1.00 45.26 C ATOM 1215 O LYS A 358 41.665 -6.029 1.825 1.00 47.11 O ATOM 1216 CB LYS A 358 42.255 -8.565 -0.503 1.00 48.86 C ATOM 1217 CG LYS A 358 43.159 -9.812 -0.481 1.00 49.29 C ATOM 1218 CD LYS A 358 43.561 -10.287 -1.856 1.00 46.67 C ATOM 1219 CE LYS A 358 44.996 -10.793 -1.780 1.00 42.44 C ATOM 1220 NZ LYS A 358 45.606 -10.923 -3.102 1.00 35.41 N ATOM 0 H LYS A 358 41.395 -9.673 2.171 1.00 40.63 H new ATOM 0 HA LYS A 358 42.487 -8.122 1.513 1.00 44.81 H new ATOM 0 HB2 LYS A 358 41.503 -8.719 -1.096 1.00 48.86 H new ATOM 0 HB3 LYS A 358 42.749 -7.811 -0.862 1.00 48.86 H new ATOM 0 HG2 LYS A 358 43.958 -9.614 0.032 1.00 49.29 H new ATOM 0 HG3 LYS A 358 42.697 -10.530 -0.021 1.00 49.29 H new ATOM 0 HD2 LYS A 358 42.968 -10.993 -2.157 1.00 46.67 H new ATOM 0 HD3 LYS A 358 43.490 -9.564 -2.499 1.00 46.67 H new ATOM 0 HE2 LYS A 358 45.524 -10.184 -1.240 1.00 42.44 H new ATOM 0 HE3 LYS A 358 45.011 -11.654 -1.333 1.00 42.44 H new ATOM 0 HZ1 LYS A 358 46.441 -11.220 -3.016 1.00 35.41 H new ATOM 0 HZ2 LYS A 358 45.135 -11.499 -3.591 1.00 35.41 H new ATOM 0 HZ3 LYS A 358 45.614 -10.129 -3.505 1.00 35.41 H new ATOM 1221 N PRO A 359 40.161 -6.483 0.171 1.00 42.89 N ATOM 1222 CA PRO A 359 39.292 -5.392 0.566 1.00 40.96 C ATOM 1223 C PRO A 359 38.263 -5.851 1.613 1.00 40.78 C ATOM 1224 O PRO A 359 38.282 -5.372 2.753 1.00 40.71 O ATOM 1225 CB PRO A 359 38.615 -4.950 -0.749 1.00 42.32 C ATOM 1226 CG PRO A 359 39.109 -5.877 -1.821 1.00 41.84 C ATOM 1227 CD PRO A 359 39.806 -7.045 -1.139 1.00 42.69 C ATOM 0 HA PRO A 359 39.775 -4.665 0.988 1.00 40.96 H new ATOM 0 HB2 PRO A 359 37.649 -4.996 -0.672 1.00 42.32 H new ATOM 0 HB3 PRO A 359 38.839 -4.030 -0.959 1.00 42.32 H new ATOM 0 HG2 PRO A 359 38.370 -6.192 -2.365 1.00 41.84 H new ATOM 0 HG3 PRO A 359 39.721 -5.415 -2.415 1.00 41.84 H new ATOM 0 HD2 PRO A 359 39.222 -7.815 -1.055 1.00 42.69 H new ATOM 0 HD3 PRO A 359 40.589 -7.335 -1.632 1.00 42.69 H new ATOM 1228 N PHE A 360 37.402 -6.791 1.229 1.00 37.97 N ATOM 1229 CA PHE A 360 36.125 -7.078 1.914 1.00 38.12 C ATOM 1230 C PHE A 360 36.232 -7.486 3.385 1.00 37.40 C ATOM 1231 O PHE A 360 35.406 -7.074 4.217 1.00 38.28 O ATOM 1232 CB PHE A 360 35.355 -8.139 1.127 1.00 36.26 C ATOM 1233 CG PHE A 360 35.024 -7.704 -0.285 1.00 36.07 C ATOM 1234 CD1 PHE A 360 33.886 -6.974 -0.548 1.00 40.41 C ATOM 1235 CD2 PHE A 360 35.868 -8.001 -1.332 1.00 37.33 C ATOM 1236 CE1 PHE A 360 33.582 -6.576 -1.826 1.00 34.12 C ATOM 1237 CE2 PHE A 360 35.583 -7.579 -2.627 1.00 35.16 C ATOM 1238 CZ PHE A 360 34.433 -6.872 -2.868 1.00 35.42 C ATOM 0 H PHE A 360 37.541 -7.296 0.547 1.00 37.97 H new ATOM 0 HA PHE A 360 35.650 -6.233 1.933 1.00 38.12 H new ATOM 0 HB2 PHE A 360 35.879 -8.954 1.094 1.00 36.26 H new ATOM 0 HB3 PHE A 360 34.533 -8.349 1.596 1.00 36.26 H new ATOM 0 HD1 PHE A 360 33.315 -6.747 0.150 1.00 40.41 H new ATOM 0 HD2 PHE A 360 36.641 -8.492 -1.171 1.00 37.33 H new ATOM 0 HE1 PHE A 360 32.797 -6.104 -1.989 1.00 34.12 H new ATOM 0 HE2 PHE A 360 36.168 -7.775 -3.323 1.00 35.16 H new ATOM 0 HZ PHE A 360 34.228 -6.593 -3.731 1.00 35.42 H new ATOM 1239 N GLY A 361 37.251 -8.277 3.694 1.00 35.91 N ATOM 1240 CA GLY A 361 37.462 -8.819 5.029 1.00 36.92 C ATOM 1241 C GLY A 361 37.797 -7.803 6.112 1.00 38.62 C ATOM 1242 O GLY A 361 37.704 -8.116 7.286 1.00 39.38 O ATOM 0 H GLY A 361 37.849 -8.518 3.125 1.00 35.91 H new ATOM 0 HA2 GLY A 361 36.662 -9.298 5.295 1.00 36.92 H new ATOM 0 HA3 GLY A 361 38.181 -9.469 4.986 1.00 36.92 H new ATOM 1243 N ASP A 362 38.220 -6.601 5.733 1.00 38.95 N ATOM 1244 CA ASP A 362 38.437 -5.520 6.727 1.00 42.13 C ATOM 1245 C ASP A 362 37.168 -4.692 7.016 1.00 40.06 C ATOM 1246 O ASP A 362 37.160 -3.873 7.928 1.00 41.39 O ATOM 1247 CB ASP A 362 39.553 -4.568 6.260 1.00 42.95 C ATOM 1248 CG ASP A 362 40.944 -5.154 6.434 1.00 48.62 C ATOM 1249 OD1 ASP A 362 41.269 -5.666 7.526 1.00 59.65 O ATOM 1250 OD2 ASP A 362 41.729 -5.084 5.473 1.00 58.31 O ATOM 0 H ASP A 362 38.389 -6.381 4.919 1.00 38.95 H new ATOM 0 HA ASP A 362 38.692 -5.967 7.549 1.00 42.13 H new ATOM 0 HB2 ASP A 362 39.414 -4.349 5.325 1.00 42.95 H new ATOM 0 HB3 ASP A 362 39.493 -3.738 6.758 1.00 42.95 H new ATOM 1251 N PHE A 363 36.111 -4.903 6.233 1.00 38.00 N ATOM 1252 CA PHE A 363 35.004 -3.948 6.135 1.00 40.04 C ATOM 1253 C PHE A 363 33.741 -4.251 6.962 1.00 39.66 C ATOM 1254 O PHE A 363 32.889 -3.390 7.101 1.00 39.40 O ATOM 1255 CB PHE A 363 34.611 -3.753 4.673 1.00 42.30 C ATOM 1256 CG PHE A 363 35.647 -3.017 3.868 1.00 47.08 C ATOM 1257 CD1 PHE A 363 36.703 -2.362 4.500 1.00 46.26 C ATOM 1258 CD2 PHE A 363 35.567 -2.976 2.487 1.00 49.46 C ATOM 1259 CE1 PHE A 363 37.659 -1.687 3.773 1.00 53.57 C ATOM 1260 CE2 PHE A 363 36.516 -2.298 1.760 1.00 46.91 C ATOM 1261 CZ PHE A 363 37.565 -1.655 2.401 1.00 51.58 C ATOM 0 H PHE A 363 36.014 -5.603 5.743 1.00 38.00 H new ATOM 0 HA PHE A 363 35.365 -3.140 6.532 1.00 40.04 H new ATOM 0 HB2 PHE A 363 34.454 -4.621 4.269 1.00 42.30 H new ATOM 0 HB3 PHE A 363 33.773 -3.265 4.633 1.00 42.30 H new ATOM 0 HD1 PHE A 363 36.763 -2.381 5.428 1.00 46.26 H new ATOM 0 HD2 PHE A 363 34.869 -3.408 2.050 1.00 49.46 H new ATOM 0 HE1 PHE A 363 38.361 -1.257 4.206 1.00 53.57 H new ATOM 0 HE2 PHE A 363 36.455 -2.270 0.832 1.00 46.91 H new ATOM 0 HZ PHE A 363 38.206 -1.202 1.902 1.00 51.58 H new ATOM 1262 N MET A 364 33.617 -5.465 7.490 1.00 39.20 N ATOM 1263 CA MET A 364 32.487 -5.800 8.367 1.00 39.24 C ATOM 1264 C MET A 364 32.756 -5.370 9.787 1.00 39.61 C ATOM 1265 O MET A 364 31.826 -5.039 10.513 1.00 40.87 O ATOM 1266 CB MET A 364 32.175 -7.302 8.334 1.00 39.70 C ATOM 1267 CG MET A 364 31.219 -7.713 7.209 1.00 40.74 C ATOM 1268 SD MET A 364 29.735 -6.686 7.001 1.00 44.47 S ATOM 1269 CE MET A 364 28.821 -7.106 8.476 1.00 33.14 C ATOM 0 H MET A 364 34.171 -6.109 7.357 1.00 39.20 H new ATOM 0 HA MET A 364 31.715 -5.317 8.032 1.00 39.24 H new ATOM 0 HB2 MET A 364 33.005 -7.794 8.237 1.00 39.70 H new ATOM 0 HB3 MET A 364 31.789 -7.562 9.185 1.00 39.70 H new ATOM 0 HG2 MET A 364 31.712 -7.709 6.374 1.00 40.74 H new ATOM 0 HG3 MET A 364 30.937 -8.627 7.368 1.00 40.74 H new ATOM 0 HE1 MET A 364 27.985 -6.614 8.490 1.00 33.14 H new ATOM 0 HE2 MET A 364 28.635 -8.058 8.482 1.00 33.14 H new ATOM 0 HE3 MET A 364 29.345 -6.875 9.259 1.00 33.14 H new ATOM 1270 N GLU A 365 34.033 -5.355 10.178 1.00 39.93 N ATOM 1271 CA GLU A 365 34.406 -5.130 11.569 1.00 40.60 C ATOM 1272 C GLU A 365 33.834 -3.835 12.185 1.00 40.44 C ATOM 1273 O GLU A 365 33.461 -3.830 13.361 1.00 39.77 O ATOM 1274 CB GLU A 365 35.925 -5.221 11.747 1.00 40.47 C ATOM 1275 CG GLU A 365 36.471 -6.636 11.654 1.00 41.92 C ATOM 1276 CD GLU A 365 36.079 -7.522 12.852 1.00 49.26 C ATOM 1277 OE1 GLU A 365 36.543 -7.260 13.996 1.00 50.65 O ATOM 1278 OE2 GLU A 365 35.307 -8.498 12.657 1.00 32.55 O ATOM 0 H GLU A 365 34.699 -5.474 9.647 1.00 39.93 H new ATOM 0 HA GLU A 365 33.988 -5.846 12.072 1.00 40.60 H new ATOM 0 HB2 GLU A 365 36.355 -4.673 11.072 1.00 40.47 H new ATOM 0 HB3 GLU A 365 36.164 -4.847 12.610 1.00 40.47 H new ATOM 0 HG2 GLU A 365 36.148 -7.047 10.837 1.00 41.92 H new ATOM 0 HG3 GLU A 365 37.438 -6.599 11.590 1.00 41.92 H new ATOM 1279 N PRO A 366 33.784 -2.737 11.396 1.00 41.37 N ATOM 1280 CA PRO A 366 33.025 -1.514 11.719 1.00 40.42 C ATOM 1281 C PRO A 366 31.534 -1.669 11.956 1.00 38.11 C ATOM 1282 O PRO A 366 30.986 -0.978 12.820 1.00 34.85 O ATOM 1283 CB PRO A 366 33.237 -0.632 10.489 1.00 42.05 C ATOM 1284 CG PRO A 366 34.542 -1.097 9.925 1.00 38.76 C ATOM 1285 CD PRO A 366 34.537 -2.577 10.131 1.00 41.92 C ATOM 0 HA PRO A 366 33.347 -1.168 12.566 1.00 40.42 H new ATOM 0 HB2 PRO A 366 32.516 -0.738 9.849 1.00 42.05 H new ATOM 0 HB3 PRO A 366 33.269 0.308 10.728 1.00 42.05 H new ATOM 0 HG2 PRO A 366 34.620 -0.872 8.985 1.00 38.76 H new ATOM 0 HG3 PRO A 366 35.291 -0.680 10.379 1.00 38.76 H new ATOM 0 HD2 PRO A 366 34.106 -3.040 9.396 1.00 41.92 H new ATOM 0 HD3 PRO A 366 35.437 -2.932 10.202 1.00 41.92 H new ATOM 1286 N LYS A 367 30.882 -2.509 11.162 1.00 36.73 N ATOM 1287 CA LYS A 367 29.483 -2.832 11.385 1.00 34.82 C ATOM 1288 C LYS A 367 29.301 -3.429 12.776 1.00 33.20 C ATOM 1289 O LYS A 367 28.429 -2.995 13.515 1.00 34.08 O ATOM 1290 CB LYS A 367 28.989 -3.818 10.335 1.00 34.32 C ATOM 1291 CG LYS A 367 28.508 -3.162 9.049 1.00 40.60 C ATOM 1292 CD LYS A 367 29.590 -2.283 8.503 1.00 44.14 C ATOM 1293 CE LYS A 367 29.584 -2.281 7.000 1.00 42.46 C ATOM 1294 NZ LYS A 367 30.898 -1.742 6.583 1.00 47.24 N ATOM 0 H LYS A 367 31.236 -2.904 10.485 1.00 36.73 H new ATOM 0 HA LYS A 367 28.964 -2.015 11.316 1.00 34.82 H new ATOM 0 HB2 LYS A 367 29.705 -4.437 10.123 1.00 34.32 H new ATOM 0 HB3 LYS A 367 28.264 -4.341 10.711 1.00 34.32 H new ATOM 0 HG2 LYS A 367 28.269 -3.840 8.398 1.00 40.60 H new ATOM 0 HG3 LYS A 367 27.709 -2.640 9.220 1.00 40.60 H new ATOM 0 HD2 LYS A 367 29.470 -1.378 8.830 1.00 44.14 H new ATOM 0 HD3 LYS A 367 30.452 -2.590 8.825 1.00 44.14 H new ATOM 0 HE2 LYS A 367 29.451 -3.177 6.653 1.00 42.46 H new ATOM 0 HE3 LYS A 367 28.860 -1.734 6.657 1.00 42.46 H new ATOM 0 HZ1 LYS A 367 30.789 -1.202 5.884 1.00 47.24 H new ATOM 0 HZ2 LYS A 367 31.259 -1.286 7.257 1.00 47.24 H new ATOM 0 HZ3 LYS A 367 31.436 -2.414 6.357 1.00 47.24 H new ATOM 1295 N PHE A 368 30.136 -4.418 13.098 1.00 30.06 N ATOM 1296 CA PHE A 368 30.178 -5.141 14.379 1.00 30.55 C ATOM 1297 C PHE A 368 30.415 -4.273 15.622 1.00 28.77 C ATOM 1298 O PHE A 368 29.724 -4.404 16.624 1.00 24.16 O ATOM 1299 CB PHE A 368 31.162 -6.313 14.308 1.00 26.36 C ATOM 1300 CG PHE A 368 30.603 -7.497 13.560 1.00 28.34 C ATOM 1301 CD1 PHE A 368 29.593 -8.284 14.141 1.00 22.30 C ATOM 1302 CD2 PHE A 368 31.045 -7.805 12.287 1.00 30.43 C ATOM 1303 CE1 PHE A 368 29.021 -9.329 13.455 1.00 22.38 C ATOM 1304 CE2 PHE A 368 30.493 -8.899 11.571 1.00 28.69 C ATOM 1305 CZ PHE A 368 29.464 -9.647 12.142 1.00 20.89 C ATOM 0 H PHE A 368 30.729 -4.704 12.545 1.00 30.06 H new ATOM 0 HA PHE A 368 29.279 -5.483 14.504 1.00 30.55 H new ATOM 0 HB2 PHE A 368 31.979 -6.019 13.876 1.00 26.36 H new ATOM 0 HB3 PHE A 368 31.399 -6.586 15.208 1.00 26.36 H new ATOM 0 HD1 PHE A 368 29.307 -8.094 15.005 1.00 22.30 H new ATOM 0 HD2 PHE A 368 31.712 -7.289 11.895 1.00 30.43 H new ATOM 0 HE1 PHE A 368 28.343 -9.829 13.850 1.00 22.38 H new ATOM 0 HE2 PHE A 368 30.816 -9.116 10.726 1.00 28.69 H new ATOM 0 HZ PHE A 368 29.072 -10.346 11.670 1.00 20.89 H new ATOM 1306 N GLU A 369 31.379 -3.378 15.534 1.00 30.40 N ATOM 1307 CA GLU A 369 31.716 -2.460 16.630 1.00 28.36 C ATOM 1308 C GLU A 369 30.601 -1.451 16.811 1.00 27.50 C ATOM 1309 O GLU A 369 30.176 -1.189 17.929 1.00 28.58 O ATOM 1310 CB GLU A 369 33.031 -1.724 16.299 1.00 30.49 C ATOM 1311 CG GLU A 369 34.246 -2.632 16.275 1.00 39.11 C ATOM 1312 CD GLU A 369 35.238 -2.309 15.153 1.00 53.73 C ATOM 1313 OE1 GLU A 369 34.935 -1.431 14.305 1.00 59.89 O ATOM 1314 OE2 GLU A 369 36.330 -2.942 15.114 1.00 58.15 O ATOM 0 H GLU A 369 31.867 -3.277 14.833 1.00 30.40 H new ATOM 0 HA GLU A 369 31.827 -2.965 17.450 1.00 28.36 H new ATOM 0 HB2 GLU A 369 32.942 -1.292 15.435 1.00 30.49 H new ATOM 0 HB3 GLU A 369 33.174 -1.023 16.954 1.00 30.49 H new ATOM 0 HG2 GLU A 369 34.704 -2.568 17.128 1.00 39.11 H new ATOM 0 HG3 GLU A 369 33.951 -3.551 16.179 1.00 39.11 H new ATOM 1315 N PHE A 370 30.094 -0.895 15.715 1.00 26.76 N ATOM 1316 CA PHE A 370 28.867 -0.137 15.820 1.00 27.12 C ATOM 1317 C PHE A 370 27.733 -0.861 16.560 1.00 25.24 C ATOM 1318 O PHE A 370 27.117 -0.292 17.472 1.00 23.90 O ATOM 1319 CB PHE A 370 28.368 0.420 14.490 1.00 26.58 C ATOM 1320 CG PHE A 370 27.065 1.178 14.632 1.00 31.61 C ATOM 1321 CD1 PHE A 370 27.052 2.487 15.143 1.00 32.84 C ATOM 1322 CD2 PHE A 370 25.849 0.558 14.345 1.00 30.77 C ATOM 1323 CE1 PHE A 370 25.846 3.178 15.327 1.00 26.85 C ATOM 1324 CE2 PHE A 370 24.642 1.238 14.509 1.00 29.04 C ATOM 1325 CZ PHE A 370 24.632 2.545 14.995 1.00 30.93 C ATOM 0 H PHE A 370 30.436 -0.945 14.928 1.00 26.76 H new ATOM 0 HA PHE A 370 29.126 0.617 16.373 1.00 27.12 H new ATOM 0 HB2 PHE A 370 29.042 1.009 14.116 1.00 26.58 H new ATOM 0 HB3 PHE A 370 28.248 -0.309 13.862 1.00 26.58 H new ATOM 0 HD1 PHE A 370 27.855 2.901 15.362 1.00 32.84 H new ATOM 0 HD2 PHE A 370 25.843 -0.321 14.040 1.00 30.77 H new ATOM 0 HE1 PHE A 370 25.847 4.045 15.664 1.00 26.85 H new ATOM 0 HE2 PHE A 370 23.841 0.818 14.293 1.00 29.04 H new ATOM 0 HZ PHE A 370 23.826 2.997 15.100 1.00 30.93 H new ATOM 1326 N ALA A 371 27.413 -2.092 16.137 1.00 23.16 N ATOM 1327 CA ALA A 371 26.248 -2.804 16.658 1.00 19.39 C ATOM 1328 C ALA A 371 26.450 -3.037 18.137 1.00 21.91 C ATOM 1329 O ALA A 371 25.562 -2.866 18.937 1.00 24.99 O ATOM 1330 CB ALA A 371 26.014 -4.188 15.913 1.00 20.65 C ATOM 0 H ALA A 371 27.862 -2.529 15.548 1.00 23.16 H new ATOM 0 HA ALA A 371 25.459 -2.262 16.503 1.00 19.39 H new ATOM 0 HB1 ALA A 371 25.235 -4.629 16.286 1.00 20.65 H new ATOM 0 HB2 ALA A 371 25.872 -4.027 14.967 1.00 20.65 H new ATOM 0 HB3 ALA A 371 26.792 -4.755 16.031 1.00 20.65 H new ATOM 1331 N VAL A 372 27.645 -3.418 18.510 1.00 24.51 N ATOM 1332 CA VAL A 372 27.924 -3.699 19.891 1.00 26.24 C ATOM 1333 C VAL A 372 27.603 -2.502 20.805 1.00 27.00 C ATOM 1334 O VAL A 372 26.887 -2.657 21.806 1.00 27.81 O ATOM 1335 CB VAL A 372 29.371 -4.244 20.047 1.00 26.69 C ATOM 1336 CG1 VAL A 372 29.812 -4.203 21.488 1.00 30.95 C ATOM 1337 CG2 VAL A 372 29.413 -5.716 19.570 1.00 27.08 C ATOM 0 H VAL A 372 28.312 -3.521 17.977 1.00 24.51 H new ATOM 0 HA VAL A 372 27.327 -4.402 20.193 1.00 26.24 H new ATOM 0 HB VAL A 372 29.964 -3.689 19.517 1.00 26.69 H new ATOM 0 HG11 VAL A 372 30.716 -4.547 21.560 1.00 30.95 H new ATOM 0 HG12 VAL A 372 29.789 -3.288 21.808 1.00 30.95 H new ATOM 0 HG13 VAL A 372 29.215 -4.748 22.025 1.00 30.95 H new ATOM 0 HG21 VAL A 372 30.314 -6.062 19.665 1.00 27.08 H new ATOM 0 HG22 VAL A 372 28.805 -6.248 20.107 1.00 27.08 H new ATOM 0 HG23 VAL A 372 29.146 -5.762 18.639 1.00 27.08 H new ATOM 1338 N LYS A 373 28.074 -1.315 20.437 1.00 25.85 N ATOM 1339 CA LYS A 373 27.753 -0.103 21.196 1.00 28.45 C ATOM 1340 C LYS A 373 26.272 0.221 21.084 1.00 27.29 C ATOM 1341 O LYS A 373 25.662 0.695 22.040 1.00 28.35 O ATOM 1342 CB LYS A 373 28.536 1.091 20.672 1.00 29.30 C ATOM 1343 CG LYS A 373 30.042 0.929 20.676 1.00 37.01 C ATOM 1344 CD LYS A 373 30.675 2.029 19.820 1.00 44.15 C ATOM 1345 CE LYS A 373 32.158 2.222 20.127 1.00 56.81 C ATOM 1346 NZ LYS A 373 33.023 1.189 19.474 1.00 60.38 N ATOM 0 H LYS A 373 28.580 -1.187 19.753 1.00 25.85 H new ATOM 0 HA LYS A 373 27.991 -0.272 22.121 1.00 28.45 H new ATOM 0 HB2 LYS A 373 28.248 1.275 19.764 1.00 29.30 H new ATOM 0 HB3 LYS A 373 28.308 1.868 21.205 1.00 29.30 H new ATOM 0 HG2 LYS A 373 30.380 0.977 21.584 1.00 37.01 H new ATOM 0 HG3 LYS A 373 30.284 0.056 20.329 1.00 37.01 H new ATOM 0 HD2 LYS A 373 30.567 1.808 18.882 1.00 44.15 H new ATOM 0 HD3 LYS A 373 30.205 2.864 19.970 1.00 44.15 H new ATOM 0 HE2 LYS A 373 32.434 3.103 19.831 1.00 56.81 H new ATOM 0 HE3 LYS A 373 32.292 2.191 21.087 1.00 56.81 H new ATOM 0 HZ1 LYS A 373 33.875 1.341 19.681 1.00 60.38 H new ATOM 0 HZ2 LYS A 373 32.788 0.380 19.762 1.00 60.38 H new ATOM 0 HZ3 LYS A 373 32.920 1.231 18.591 1.00 60.38 H new ATOM 1347 N PHE A 374 25.667 -0.069 19.940 1.00 23.46 N ATOM 1348 CA PHE A 374 24.296 0.409 19.749 1.00 20.87 C ATOM 1349 C PHE A 374 23.394 -0.535 20.521 1.00 20.52 C ATOM 1350 O PHE A 374 22.491 -0.122 21.161 1.00 19.28 O ATOM 1351 CB PHE A 374 23.920 0.445 18.263 1.00 19.11 C ATOM 1352 CG PHE A 374 22.559 0.987 17.983 1.00 19.31 C ATOM 1353 CD1 PHE A 374 22.327 2.349 17.995 1.00 23.33 C ATOM 1354 CD2 PHE A 374 21.497 0.136 17.679 1.00 21.46 C ATOM 1355 CE1 PHE A 374 21.067 2.860 17.741 1.00 27.12 C ATOM 1356 CE2 PHE A 374 20.209 0.657 17.445 1.00 17.93 C ATOM 1357 CZ PHE A 374 20.003 2.000 17.485 1.00 27.11 C ATOM 0 H PHE A 374 26.007 -0.517 19.290 1.00 23.46 H new ATOM 0 HA PHE A 374 24.201 1.318 20.073 1.00 20.87 H new ATOM 0 HB2 PHE A 374 24.574 0.982 17.788 1.00 19.11 H new ATOM 0 HB3 PHE A 374 23.978 -0.454 17.904 1.00 19.11 H new ATOM 0 HD1 PHE A 374 23.029 2.931 18.177 1.00 23.33 H new ATOM 0 HD2 PHE A 374 21.640 -0.782 17.630 1.00 21.46 H new ATOM 0 HE1 PHE A 374 20.931 3.780 17.741 1.00 27.12 H new ATOM 0 HE2 PHE A 374 19.500 0.083 17.263 1.00 17.93 H new ATOM 0 HZ PHE A 374 19.151 2.344 17.341 1.00 27.11 H new ATOM 1358 N ASN A 375 23.649 -1.816 20.427 1.00 18.84 N ATOM 1359 CA ASN A 375 22.851 -2.810 21.112 1.00 20.59 C ATOM 1360 C ASN A 375 22.984 -2.680 22.643 1.00 21.70 C ATOM 1361 O ASN A 375 22.095 -3.075 23.387 1.00 19.92 O ATOM 1362 CB ASN A 375 23.352 -4.176 20.661 1.00 17.72 C ATOM 1363 CG ASN A 375 22.831 -4.554 19.305 1.00 21.92 C ATOM 1364 OD1 ASN A 375 21.966 -3.881 18.775 1.00 20.48 O ATOM 1365 ND2 ASN A 375 23.358 -5.630 18.730 1.00 16.41 N ATOM 0 H ASN A 375 24.294 -2.142 19.961 1.00 18.84 H new ATOM 0 HA ASN A 375 21.913 -2.688 20.895 1.00 20.59 H new ATOM 0 HB2 ASN A 375 24.322 -4.173 20.643 1.00 17.72 H new ATOM 0 HB3 ASN A 375 23.082 -4.847 21.308 1.00 17.72 H new ATOM 0 HD21 ASN A 375 23.089 -5.876 17.951 1.00 16.41 H new ATOM 0 HD22 ASN A 375 23.968 -6.080 19.137 1.00 16.41 H new ATOM 1366 N ALA A 376 24.097 -2.123 23.099 1.00 22.20 N ATOM 1367 CA ALA A 376 24.272 -1.846 24.538 1.00 23.08 C ATOM 1368 C ALA A 376 23.224 -0.882 25.091 1.00 23.13 C ATOM 1369 O ALA A 376 22.940 -0.903 26.279 1.00 22.50 O ATOM 1370 CB ALA A 376 25.707 -1.323 24.833 1.00 23.25 C ATOM 0 H ALA A 376 24.763 -1.896 22.605 1.00 22.20 H new ATOM 0 HA ALA A 376 24.144 -2.691 24.997 1.00 23.08 H new ATOM 0 HB1 ALA A 376 25.799 -1.148 25.783 1.00 23.25 H new ATOM 0 HB2 ALA A 376 26.357 -1.991 24.563 1.00 23.25 H new ATOM 0 HB3 ALA A 376 25.861 -0.504 24.337 1.00 23.25 H new ATOM 1371 N LEU A 377 22.598 -0.081 24.226 1.00 23.90 N ATOM 1372 CA LEU A 377 21.436 0.712 24.630 1.00 21.74 C ATOM 1373 C LEU A 377 20.155 -0.023 24.978 1.00 23.87 C ATOM 1374 O LEU A 377 19.231 0.584 25.563 1.00 21.73 O ATOM 1375 CB LEU A 377 21.180 1.824 23.626 1.00 23.77 C ATOM 1376 CG LEU A 377 22.380 2.788 23.414 1.00 28.14 C ATOM 1377 CD1 LEU A 377 22.167 3.804 22.353 1.00 21.95 C ATOM 1378 CD2 LEU A 377 22.848 3.477 24.665 1.00 32.01 C ATOM 0 H LEU A 377 22.830 0.017 23.404 1.00 23.90 H new ATOM 0 HA LEU A 377 21.702 1.071 25.491 1.00 21.74 H new ATOM 0 HB2 LEU A 377 20.944 1.427 22.773 1.00 23.77 H new ATOM 0 HB3 LEU A 377 20.413 2.340 23.920 1.00 23.77 H new ATOM 0 HG LEU A 377 23.079 2.183 23.120 1.00 28.14 H new ATOM 0 HD11 LEU A 377 22.955 4.366 22.280 1.00 21.95 H new ATOM 0 HD12 LEU A 377 22.008 3.359 21.506 1.00 21.95 H new ATOM 0 HD13 LEU A 377 21.399 4.352 22.579 1.00 21.95 H new ATOM 0 HD21 LEU A 377 23.595 4.059 24.454 1.00 32.01 H new ATOM 0 HD22 LEU A 377 22.123 4.004 25.035 1.00 32.01 H new ATOM 0 HD23 LEU A 377 23.129 2.813 25.314 1.00 32.01 H new ATOM 1379 N GLU A 378 20.091 -1.321 24.622 1.00 22.58 N ATOM 1380 CA GLU A 378 18.968 -2.165 24.913 1.00 23.81 C ATOM 1381 C GLU A 378 17.591 -1.651 24.479 1.00 23.33 C ATOM 1382 O GLU A 378 16.567 -1.828 25.158 1.00 21.58 O ATOM 1383 CB GLU A 378 18.991 -2.566 26.391 1.00 28.24 C ATOM 1384 CG GLU A 378 20.054 -3.605 26.670 1.00 37.10 C ATOM 1385 CD GLU A 378 19.843 -4.339 27.983 1.00 55.39 C ATOM 1386 OE1 GLU A 378 19.086 -5.351 27.993 1.00 64.10 O ATOM 1387 OE2 GLU A 378 20.444 -3.911 28.997 1.00 56.92 O ATOM 0 H GLU A 378 20.722 -1.722 24.197 1.00 22.58 H new ATOM 0 HA GLU A 378 19.087 -2.945 24.349 1.00 23.81 H new ATOM 0 HB2 GLU A 378 19.153 -1.781 26.937 1.00 28.24 H new ATOM 0 HB3 GLU A 378 18.122 -2.914 26.646 1.00 28.24 H new ATOM 0 HG2 GLU A 378 20.067 -4.249 25.945 1.00 37.10 H new ATOM 0 HG3 GLU A 378 20.923 -3.175 26.683 1.00 37.10 H new ATOM 1388 N LEU A 379 17.566 -1.038 23.311 1.00 21.93 N ATOM 1389 CA LEU A 379 16.328 -0.630 22.676 1.00 21.45 C ATOM 1390 C LEU A 379 15.423 -1.810 22.295 1.00 24.24 C ATOM 1391 O LEU A 379 15.917 -2.884 21.935 1.00 19.94 O ATOM 1392 CB LEU A 379 16.676 0.207 21.437 1.00 25.41 C ATOM 1393 CG LEU A 379 17.312 1.584 21.705 1.00 23.93 C ATOM 1394 CD1 LEU A 379 17.229 2.387 20.429 1.00 26.27 C ATOM 1395 CD2 LEU A 379 16.557 2.326 22.791 1.00 19.81 C ATOM 0 H LEU A 379 18.272 -0.845 22.860 1.00 21.93 H new ATOM 0 HA LEU A 379 15.819 -0.107 23.315 1.00 21.45 H new ATOM 0 HB2 LEU A 379 17.284 -0.307 20.882 1.00 25.41 H new ATOM 0 HB3 LEU A 379 15.865 0.340 20.921 1.00 25.41 H new ATOM 0 HG LEU A 379 18.230 1.463 21.993 1.00 23.93 H new ATOM 0 HD11 LEU A 379 17.624 3.262 20.571 1.00 26.27 H new ATOM 0 HD12 LEU A 379 17.710 1.926 19.724 1.00 26.27 H new ATOM 0 HD13 LEU A 379 16.300 2.490 20.171 1.00 26.27 H new ATOM 0 HD21 LEU A 379 16.974 3.189 22.943 1.00 19.81 H new ATOM 0 HD22 LEU A 379 15.637 2.456 22.514 1.00 19.81 H new ATOM 0 HD23 LEU A 379 16.577 1.808 23.611 1.00 19.81 H new ATOM 1396 N ASP A 380 14.110 -1.622 22.384 1.00 17.96 N ATOM 1397 CA ASP A 380 13.139 -2.682 22.066 1.00 20.73 C ATOM 1398 C ASP A 380 12.607 -2.212 20.724 1.00 19.58 C ATOM 1399 O ASP A 380 12.904 -1.092 20.308 1.00 18.32 O ATOM 1400 CB ASP A 380 11.900 -2.604 23.018 1.00 26.20 C ATOM 1401 CG ASP A 380 12.178 -3.087 24.445 1.00 41.27 C ATOM 1402 OD1 ASP A 380 13.184 -3.809 24.698 1.00 54.13 O ATOM 1403 OD2 ASP A 380 11.350 -2.740 25.327 1.00 56.34 O ATOM 0 H ASP A 380 13.751 -0.880 22.629 1.00 17.96 H new ATOM 0 HA ASP A 380 13.535 -3.566 22.115 1.00 20.73 H new ATOM 0 HB2 ASP A 380 11.588 -1.686 23.052 1.00 26.20 H new ATOM 0 HB3 ASP A 380 11.181 -3.135 22.641 1.00 26.20 H new ATOM 1404 N ASP A 381 11.700 -2.995 20.126 1.00 20.71 N ATOM 1405 CA ASP A 381 11.092 -2.655 18.845 1.00 20.38 C ATOM 1406 C ASP A 381 10.202 -1.407 18.933 1.00 18.15 C ATOM 1407 O ASP A 381 10.145 -0.605 18.007 1.00 17.66 O ATOM 1408 CB ASP A 381 10.247 -3.827 18.321 1.00 19.68 C ATOM 1409 CG ASP A 381 11.110 -5.021 17.794 1.00 27.78 C ATOM 1410 OD1 ASP A 381 11.875 -4.855 16.799 1.00 26.83 O ATOM 1411 OD2 ASP A 381 11.014 -6.119 18.384 1.00 32.62 O ATOM 0 H ASP A 381 11.423 -3.739 20.457 1.00 20.71 H new ATOM 0 HA ASP A 381 11.823 -2.467 18.235 1.00 20.38 H new ATOM 0 HB2 ASP A 381 9.667 -4.143 19.031 1.00 19.68 H new ATOM 0 HB3 ASP A 381 9.673 -3.510 17.606 1.00 19.68 H new ATOM 1412 N SER A 382 9.468 -1.283 20.018 1.00 18.22 N ATOM 1413 CA SER A 382 8.730 -0.038 20.365 1.00 20.03 C ATOM 1414 C SER A 382 9.540 1.238 20.242 1.00 22.03 C ATOM 1415 O SER A 382 9.067 2.220 19.673 1.00 25.05 O ATOM 1416 CB SER A 382 8.274 -0.147 21.824 1.00 23.29 C ATOM 1417 OG SER A 382 7.001 -0.711 21.829 1.00 36.75 O ATOM 0 H SER A 382 9.370 -1.914 20.594 1.00 18.22 H new ATOM 0 HA SER A 382 8.000 0.028 19.729 1.00 20.03 H new ATOM 0 HB2 SER A 382 8.891 -0.695 22.333 1.00 23.29 H new ATOM 0 HB3 SER A 382 8.260 0.728 22.242 1.00 23.29 H new ATOM 0 HG SER A 382 6.729 -0.783 22.621 1.00 36.75 H new ATOM 1418 N ASP A 383 10.748 1.222 20.811 1.00 19.79 N ATOM 1419 CA ASP A 383 11.697 2.347 20.807 1.00 18.12 C ATOM 1420 C ASP A 383 12.236 2.559 19.380 1.00 20.16 C ATOM 1421 O ASP A 383 12.263 3.687 18.873 1.00 19.93 O ATOM 1422 CB ASP A 383 12.939 2.044 21.694 1.00 19.39 C ATOM 1423 CG ASP A 383 12.620 1.616 23.143 1.00 23.09 C ATOM 1424 OD1 ASP A 383 11.675 2.118 23.775 1.00 25.68 O ATOM 1425 OD2 ASP A 383 13.400 0.818 23.707 1.00 21.45 O ATOM 0 H ASP A 383 11.051 0.532 21.226 1.00 19.79 H new ATOM 0 HA ASP A 383 11.221 3.123 21.141 1.00 18.12 H new ATOM 0 HB2 ASP A 383 13.458 1.342 21.271 1.00 19.39 H new ATOM 0 HB3 ASP A 383 13.500 2.835 21.721 1.00 19.39 H new ATOM 1426 N LEU A 384 12.630 1.456 18.741 1.00 18.68 N ATOM 1427 CA LEU A 384 13.210 1.451 17.396 1.00 15.06 C ATOM 1428 C LEU A 384 12.233 1.998 16.325 1.00 16.17 C ATOM 1429 O LEU A 384 12.640 2.732 15.459 1.00 17.58 O ATOM 1430 CB LEU A 384 13.641 0.029 17.021 1.00 16.58 C ATOM 1431 CG LEU A 384 14.808 -0.518 17.848 1.00 18.11 C ATOM 1432 CD1 LEU A 384 15.130 -1.895 17.356 1.00 22.17 C ATOM 1433 CD2 LEU A 384 15.976 0.455 17.528 1.00 19.73 C ATOM 0 H LEU A 384 12.566 0.671 19.086 1.00 18.68 H new ATOM 0 HA LEU A 384 13.980 2.041 17.414 1.00 15.06 H new ATOM 0 HB2 LEU A 384 12.881 -0.565 17.123 1.00 16.58 H new ATOM 0 HB3 LEU A 384 13.889 0.015 16.083 1.00 16.58 H new ATOM 0 HG LEU A 384 14.627 -0.575 18.799 1.00 18.11 H new ATOM 0 HD11 LEU A 384 15.869 -2.258 17.870 1.00 22.17 H new ATOM 0 HD12 LEU A 384 14.353 -2.466 17.460 1.00 22.17 H new ATOM 0 HD13 LEU A 384 15.377 -1.854 16.419 1.00 22.17 H new ATOM 0 HD21 LEU A 384 16.768 0.181 18.016 1.00 19.73 H new ATOM 0 HD22 LEU A 384 16.161 0.437 16.576 1.00 19.73 H new ATOM 0 HD23 LEU A 384 15.729 1.355 17.792 1.00 19.73 H new ATOM 1434 N ALA A 385 10.953 1.633 16.409 1.00 15.67 N ATOM 1435 CA ALA A 385 9.911 2.152 15.497 1.00 18.81 C ATOM 1436 C ALA A 385 9.874 3.668 15.429 1.00 22.80 C ATOM 1437 O ALA A 385 9.738 4.273 14.332 1.00 20.42 O ATOM 1438 CB ALA A 385 8.556 1.618 15.902 1.00 20.24 C ATOM 0 H ALA A 385 10.657 1.077 16.995 1.00 15.67 H new ATOM 0 HA ALA A 385 10.140 1.840 14.607 1.00 18.81 H new ATOM 0 HB1 ALA A 385 7.879 1.963 15.299 1.00 20.24 H new ATOM 0 HB2 ALA A 385 8.564 0.649 15.859 1.00 20.24 H new ATOM 0 HB3 ALA A 385 8.355 1.899 16.808 1.00 20.24 H new ATOM 1439 N ILE A 386 9.950 4.307 16.599 1.00 21.29 N ATOM 1440 CA ILE A 386 9.880 5.759 16.637 1.00 17.17 C ATOM 1441 C ILE A 386 11.214 6.341 16.256 1.00 18.82 C ATOM 1442 O ILE A 386 11.260 7.354 15.566 1.00 21.01 O ATOM 1443 CB ILE A 386 9.482 6.257 18.082 1.00 19.57 C ATOM 1444 CG1 ILE A 386 8.266 5.471 18.573 1.00 21.43 C ATOM 1445 CG2 ILE A 386 9.172 7.793 18.059 1.00 17.23 C ATOM 1446 CD1 ILE A 386 7.785 5.913 19.987 1.00 22.31 C ATOM 0 H ILE A 386 10.040 3.924 17.364 1.00 21.29 H new ATOM 0 HA ILE A 386 9.203 6.053 16.007 1.00 17.17 H new ATOM 0 HB ILE A 386 10.223 6.106 18.690 1.00 19.57 H new ATOM 0 HG12 ILE A 386 7.539 5.582 17.940 1.00 21.43 H new ATOM 0 HG13 ILE A 386 8.484 4.526 18.592 1.00 21.43 H new ATOM 0 HG21 ILE A 386 8.929 8.088 18.951 1.00 17.23 H new ATOM 0 HG22 ILE A 386 9.958 8.278 17.762 1.00 17.23 H new ATOM 0 HG23 ILE A 386 8.437 7.966 17.450 1.00 17.23 H new ATOM 0 HD11 ILE A 386 7.015 5.384 20.247 1.00 22.31 H new ATOM 0 HD12 ILE A 386 8.500 5.780 20.629 1.00 22.31 H new ATOM 0 HD13 ILE A 386 7.540 6.851 19.967 1.00 22.31 H new ATOM 1447 N PHE A 387 12.304 5.735 16.720 1.00 16.68 N ATOM 1448 CA PHE A 387 13.685 6.167 16.374 1.00 18.57 C ATOM 1449 C PHE A 387 13.866 6.198 14.856 1.00 21.53 C ATOM 1450 O PHE A 387 14.421 7.134 14.269 1.00 18.23 O ATOM 1451 CB PHE A 387 14.670 5.119 16.931 1.00 20.08 C ATOM 1452 CG PHE A 387 16.119 5.398 16.614 1.00 21.01 C ATOM 1453 CD1 PHE A 387 16.785 6.476 17.201 1.00 29.20 C ATOM 1454 CD2 PHE A 387 16.837 4.584 15.754 1.00 22.79 C ATOM 1455 CE1 PHE A 387 18.140 6.728 16.933 1.00 25.59 C ATOM 1456 CE2 PHE A 387 18.181 4.845 15.458 1.00 24.90 C ATOM 1457 CZ PHE A 387 18.840 5.932 16.079 1.00 26.24 C ATOM 0 H PHE A 387 12.276 5.057 17.248 1.00 16.68 H new ATOM 0 HA PHE A 387 13.844 7.049 16.745 1.00 18.57 H new ATOM 0 HB2 PHE A 387 14.564 5.071 17.894 1.00 20.08 H new ATOM 0 HB3 PHE A 387 14.434 4.248 16.576 1.00 20.08 H new ATOM 0 HD1 PHE A 387 16.322 7.037 17.780 1.00 29.20 H new ATOM 0 HD2 PHE A 387 16.419 3.850 15.365 1.00 22.79 H new ATOM 0 HE1 PHE A 387 18.564 7.447 17.344 1.00 25.59 H new ATOM 0 HE2 PHE A 387 18.639 4.305 14.855 1.00 24.90 H new ATOM 0 HZ PHE A 387 19.738 6.100 15.906 1.00 26.24 H new ATOM 1458 N ILE A 388 13.405 5.141 14.204 1.00 20.43 N ATOM 1459 CA ILE A 388 13.409 5.114 12.776 1.00 16.80 C ATOM 1460 C ILE A 388 12.564 6.193 12.094 1.00 18.13 C ATOM 1461 O ILE A 388 13.016 6.800 11.145 1.00 18.35 O ATOM 1462 CB ILE A 388 13.061 3.716 12.262 1.00 18.52 C ATOM 1463 CG1 ILE A 388 14.246 2.775 12.511 1.00 11.63 C ATOM 1464 CG2 ILE A 388 12.750 3.717 10.758 1.00 21.61 C ATOM 1465 CD1 ILE A 388 13.757 1.244 12.345 1.00 23.07 C ATOM 0 H ILE A 388 13.088 4.435 14.580 1.00 20.43 H new ATOM 0 HA ILE A 388 14.319 5.335 12.522 1.00 16.80 H new ATOM 0 HB ILE A 388 12.271 3.418 12.739 1.00 18.52 H new ATOM 0 HG12 ILE A 388 14.962 2.967 11.885 1.00 11.63 H new ATOM 0 HG13 ILE A 388 14.603 2.917 13.402 1.00 11.63 H new ATOM 0 HG21 ILE A 388 12.535 2.816 10.471 1.00 21.61 H new ATOM 0 HG22 ILE A 388 11.995 4.300 10.584 1.00 21.61 H new ATOM 0 HG23 ILE A 388 13.524 4.036 10.268 1.00 21.61 H new ATOM 0 HD11 ILE A 388 14.505 0.646 12.502 1.00 23.07 H new ATOM 0 HD12 ILE A 388 13.054 1.057 12.987 1.00 23.07 H new ATOM 0 HD13 ILE A 388 13.418 1.108 11.446 1.00 23.07 H new ATOM 1466 N ALA A 389 11.350 6.423 12.568 1.00 14.43 N ATOM 1467 CA ALA A 389 10.492 7.477 12.015 1.00 17.59 C ATOM 1468 C ALA A 389 11.118 8.854 12.150 1.00 19.94 C ATOM 1469 O ALA A 389 10.996 9.676 11.278 1.00 20.60 O ATOM 1470 CB ALA A 389 9.103 7.425 12.688 1.00 18.85 C ATOM 0 H ALA A 389 10.996 5.980 13.214 1.00 14.43 H new ATOM 0 HA ALA A 389 10.389 7.314 11.064 1.00 17.59 H new ATOM 0 HB1 ALA A 389 8.539 8.123 12.320 1.00 18.85 H new ATOM 0 HB2 ALA A 389 8.696 6.560 12.524 1.00 18.85 H new ATOM 0 HB3 ALA A 389 9.201 7.559 13.644 1.00 18.85 H new ATOM 1471 N VAL A 390 11.781 9.119 13.271 1.00 20.66 N ATOM 1472 CA VAL A 390 12.485 10.365 13.502 1.00 21.61 C ATOM 1473 C VAL A 390 13.664 10.554 12.522 1.00 21.86 C ATOM 1474 O VAL A 390 13.911 11.656 12.064 1.00 22.71 O ATOM 1475 CB VAL A 390 13.049 10.426 14.948 1.00 18.58 C ATOM 1476 CG1 VAL A 390 14.116 11.504 15.059 1.00 22.34 C ATOM 1477 CG2 VAL A 390 11.972 10.653 15.958 1.00 19.23 C ATOM 0 H VAL A 390 11.833 8.567 13.928 1.00 20.66 H new ATOM 0 HA VAL A 390 11.836 11.072 13.363 1.00 21.61 H new ATOM 0 HB VAL A 390 13.450 9.564 15.139 1.00 18.58 H new ATOM 0 HG11 VAL A 390 14.458 11.529 15.967 1.00 22.34 H new ATOM 0 HG12 VAL A 390 14.841 11.306 14.446 1.00 22.34 H new ATOM 0 HG13 VAL A 390 13.730 12.365 14.835 1.00 22.34 H new ATOM 0 HG21 VAL A 390 12.362 10.685 16.846 1.00 19.23 H new ATOM 0 HG22 VAL A 390 11.525 11.493 15.771 1.00 19.23 H new ATOM 0 HG23 VAL A 390 11.329 9.928 15.914 1.00 19.23 H new ATOM 1478 N ILE A 391 14.424 9.507 12.222 1.00 23.02 N ATOM 1479 CA ILE A 391 15.503 9.628 11.238 1.00 20.14 C ATOM 1480 C ILE A 391 14.961 9.994 9.827 1.00 22.13 C ATOM 1481 O ILE A 391 15.531 10.850 9.092 1.00 22.43 O ATOM 1482 CB ILE A 391 16.309 8.362 11.133 1.00 22.11 C ATOM 1483 CG1 ILE A 391 17.207 8.153 12.357 1.00 21.84 C ATOM 1484 CG2 ILE A 391 17.200 8.375 9.850 1.00 24.14 C ATOM 1485 CD1 ILE A 391 17.714 6.722 12.421 1.00 26.97 C ATOM 0 H ILE A 391 14.336 8.725 12.570 1.00 23.02 H new ATOM 0 HA ILE A 391 16.074 10.345 11.556 1.00 20.14 H new ATOM 0 HB ILE A 391 15.673 7.631 11.085 1.00 22.11 H new ATOM 0 HG12 ILE A 391 17.959 8.765 12.319 1.00 21.84 H new ATOM 0 HG13 ILE A 391 16.712 8.361 13.165 1.00 21.84 H new ATOM 0 HG21 ILE A 391 17.710 7.551 9.802 1.00 24.14 H new ATOM 0 HG22 ILE A 391 16.636 8.452 9.065 1.00 24.14 H new ATOM 0 HG23 ILE A 391 17.808 9.130 9.886 1.00 24.14 H new ATOM 0 HD11 ILE A 391 18.279 6.613 13.202 1.00 26.97 H new ATOM 0 HD12 ILE A 391 16.961 6.114 12.480 1.00 26.97 H new ATOM 0 HD13 ILE A 391 18.227 6.524 11.622 1.00 26.97 H new ATOM 1486 N ILE A 392 13.866 9.358 9.455 1.00 19.70 N ATOM 1487 CA ILE A 392 13.228 9.608 8.131 1.00 18.68 C ATOM 1488 C ILE A 392 12.797 11.058 8.008 1.00 19.27 C ATOM 1489 O ILE A 392 13.130 11.713 7.035 1.00 21.48 O ATOM 1490 CB ILE A 392 12.049 8.634 7.908 1.00 15.73 C ATOM 1491 CG1 ILE A 392 12.603 7.208 7.874 1.00 18.39 C ATOM 1492 CG2 ILE A 392 11.336 8.893 6.582 1.00 18.56 C ATOM 1493 CD1 ILE A 392 11.507 6.162 7.647 1.00 17.01 C ATOM 0 H ILE A 392 13.461 8.774 9.940 1.00 19.70 H new ATOM 0 HA ILE A 392 13.880 9.442 7.433 1.00 18.68 H new ATOM 0 HB ILE A 392 11.413 8.762 8.629 1.00 15.73 H new ATOM 0 HG12 ILE A 392 13.265 7.138 7.169 1.00 18.39 H new ATOM 0 HG13 ILE A 392 13.058 7.020 8.710 1.00 18.39 H new ATOM 0 HG21 ILE A 392 10.605 8.264 6.479 1.00 18.56 H new ATOM 0 HG22 ILE A 392 10.987 9.798 6.573 1.00 18.56 H new ATOM 0 HG23 ILE A 392 11.963 8.782 5.850 1.00 18.56 H new ATOM 0 HD11 ILE A 392 11.903 5.276 7.633 1.00 17.01 H new ATOM 0 HD12 ILE A 392 10.856 6.214 8.365 1.00 17.01 H new ATOM 0 HD13 ILE A 392 11.067 6.333 6.800 1.00 17.01 H new ATOM 1494 N LEU A 393 12.089 11.575 9.014 1.00 17.88 N ATOM 1495 CA LEU A 393 11.566 12.928 8.934 1.00 20.56 C ATOM 1496 C LEU A 393 12.606 13.960 9.335 1.00 21.77 C ATOM 1497 O LEU A 393 12.299 14.844 10.147 1.00 26.57 O ATOM 1498 CB LEU A 393 10.325 13.103 9.803 1.00 12.59 C ATOM 1499 CG LEU A 393 8.986 12.562 9.265 1.00 19.45 C ATOM 1500 CD1 LEU A 393 8.445 13.531 8.180 1.00 18.72 C ATOM 1501 CD2 LEU A 393 9.110 11.190 8.663 1.00 22.85 C ATOM 0 H LEU A 393 11.904 11.158 9.743 1.00 17.88 H new ATOM 0 HA LEU A 393 11.325 13.071 8.005 1.00 20.56 H new ATOM 0 HB2 LEU A 393 10.497 12.676 10.657 1.00 12.59 H new ATOM 0 HB3 LEU A 393 10.215 14.051 9.977 1.00 12.59 H new ATOM 0 HG LEU A 393 8.380 12.499 10.020 1.00 19.45 H new ATOM 0 HD11 LEU A 393 7.602 13.195 7.838 1.00 18.72 H new ATOM 0 HD12 LEU A 393 8.309 14.409 8.569 1.00 18.72 H new ATOM 0 HD13 LEU A 393 9.086 13.595 7.454 1.00 18.72 H new ATOM 0 HD21 LEU A 393 8.243 10.898 8.341 1.00 22.85 H new ATOM 0 HD22 LEU A 393 9.737 11.216 7.923 1.00 22.85 H new ATOM 0 HD23 LEU A 393 9.431 10.569 9.336 1.00 22.85 H new ATOM 1502 N SER A 394 13.817 13.925 8.774 1.00 23.57 N ATOM 1503 CA SER A 394 14.825 14.927 9.154 1.00 22.82 C ATOM 1504 C SER A 394 14.653 16.143 8.245 1.00 28.19 C ATOM 1505 O SER A 394 14.519 15.999 7.026 1.00 25.55 O ATOM 1506 CB SER A 394 16.271 14.400 9.016 1.00 24.62 C ATOM 1507 OG SER A 394 16.544 13.237 9.846 1.00 27.12 O ATOM 0 H SER A 394 14.073 13.349 8.189 1.00 23.57 H new ATOM 0 HA SER A 394 14.688 15.151 10.088 1.00 22.82 H new ATOM 0 HB2 SER A 394 16.438 14.173 8.088 1.00 24.62 H new ATOM 0 HB3 SER A 394 16.890 15.109 9.251 1.00 24.62 H new ATOM 0 HG SER A 394 16.177 12.560 9.510 1.00 27.12 H new ATOM 1508 N GLY A 395 14.637 17.341 8.818 1.00 28.36 N ATOM 1509 CA GLY A 395 14.285 18.522 8.026 1.00 29.24 C ATOM 1510 C GLY A 395 15.484 19.087 7.286 1.00 32.31 C ATOM 1511 O GLY A 395 15.361 20.034 6.509 1.00 34.51 O ATOM 0 H GLY A 395 14.821 17.494 9.644 1.00 28.36 H new ATOM 0 HA2 GLY A 395 13.593 18.288 7.388 1.00 29.24 H new ATOM 0 HA3 GLY A 395 13.915 19.203 8.609 1.00 29.24 H new ATOM 1512 N ASP A 396 16.659 18.520 7.524 1.00 33.03 N ATOM 1513 CA ASP A 396 17.898 19.121 7.026 1.00 34.69 C ATOM 1514 C ASP A 396 18.547 18.343 5.873 1.00 34.54 C ATOM 1515 O ASP A 396 19.733 18.533 5.574 1.00 34.21 O ATOM 1516 CB ASP A 396 18.905 19.267 8.165 1.00 34.89 C ATOM 1517 CG ASP A 396 19.272 17.937 8.782 1.00 40.89 C ATOM 1518 OD1 ASP A 396 18.571 16.920 8.467 1.00 43.19 O ATOM 1519 OD2 ASP A 396 20.270 17.913 9.565 1.00 32.18 O ATOM 0 H ASP A 396 16.765 17.792 7.969 1.00 33.03 H new ATOM 0 HA ASP A 396 17.649 19.989 6.672 1.00 34.69 H new ATOM 0 HB2 ASP A 396 19.707 19.698 7.831 1.00 34.89 H new ATOM 0 HB3 ASP A 396 18.535 19.847 8.849 1.00 34.89 H new ATOM 1520 N ARG A 397 17.768 17.488 5.211 1.00 34.91 N ATOM 1521 CA ARG A 397 18.289 16.719 4.063 1.00 35.00 C ATOM 1522 C ARG A 397 18.486 17.676 2.887 1.00 37.90 C ATOM 1523 O ARG A 397 17.719 18.647 2.740 1.00 36.76 O ATOM 1524 CB ARG A 397 17.292 15.625 3.638 1.00 34.64 C ATOM 1525 CG ARG A 397 16.908 14.612 4.729 1.00 24.09 C ATOM 1526 CD ARG A 397 18.164 13.973 5.309 1.00 26.19 C ATOM 1527 NE ARG A 397 17.793 12.791 6.054 1.00 22.93 N ATOM 1528 CZ ARG A 397 18.663 12.034 6.685 1.00 21.81 C ATOM 1529 NH1 ARG A 397 19.923 12.400 6.673 1.00 19.93 N ATOM 1530 NH2 ARG A 397 18.247 10.974 7.379 1.00 23.67 N ATOM 0 H ARG A 397 16.944 17.335 5.402 1.00 34.91 H new ATOM 0 HA ARG A 397 19.125 16.300 4.320 1.00 35.00 H new ATOM 0 HB2 ARG A 397 16.483 16.054 3.319 1.00 34.64 H new ATOM 0 HB3 ARG A 397 17.670 15.140 2.888 1.00 34.64 H new ATOM 0 HG2 ARG A 397 16.407 15.056 5.431 1.00 24.09 H new ATOM 0 HG3 ARG A 397 16.330 13.928 4.357 1.00 24.09 H new ATOM 0 HD2 ARG A 397 18.780 13.740 4.597 1.00 26.19 H new ATOM 0 HD3 ARG A 397 18.623 14.602 5.887 1.00 26.19 H new ATOM 0 HE ARG A 397 16.962 12.572 6.086 1.00 22.93 H new ATOM 0 HH11 ARG A 397 20.159 13.117 6.260 1.00 19.93 H new ATOM 0 HH12 ARG A 397 20.513 11.923 7.078 1.00 19.93 H new ATOM 0 HH21 ARG A 397 17.409 10.785 7.414 1.00 23.67 H new ATOM 0 HH22 ARG A 397 18.817 10.479 7.791 1.00 23.67 H new ATOM 1531 N PRO A 398 19.517 17.425 2.057 1.00 38.09 N ATOM 1532 CA PRO A 398 19.751 18.287 0.889 1.00 38.45 C ATOM 1533 C PRO A 398 18.552 18.381 -0.084 1.00 39.23 C ATOM 1534 O PRO A 398 17.922 17.387 -0.378 1.00 39.92 O ATOM 1535 CB PRO A 398 20.971 17.640 0.210 1.00 39.62 C ATOM 1536 CG PRO A 398 21.680 16.912 1.303 1.00 40.69 C ATOM 1537 CD PRO A 398 20.554 16.384 2.184 1.00 39.12 C ATOM 0 HA PRO A 398 19.889 19.209 1.158 1.00 38.45 H new ATOM 0 HB2 PRO A 398 20.699 17.034 -0.497 1.00 39.62 H new ATOM 0 HB3 PRO A 398 21.544 18.310 -0.195 1.00 39.62 H new ATOM 0 HG2 PRO A 398 22.226 16.190 0.953 1.00 40.69 H new ATOM 0 HG3 PRO A 398 22.271 17.501 1.797 1.00 40.69 H new ATOM 0 HD2 PRO A 398 20.235 15.520 1.880 1.00 39.12 H new ATOM 0 HD3 PRO A 398 20.840 16.272 3.104 1.00 39.12 H new ATOM 1538 N GLY A 399 18.234 19.594 -0.542 1.00 38.29 N ATOM 1539 CA GLY A 399 17.209 19.793 -1.519 1.00 36.42 C ATOM 1540 C GLY A 399 15.770 19.721 -1.067 1.00 38.78 C ATOM 1541 O GLY A 399 14.878 19.570 -1.908 1.00 39.42 O ATOM 0 H GLY A 399 18.619 20.318 -0.283 1.00 38.29 H new ATOM 0 HA2 GLY A 399 17.350 20.664 -1.923 1.00 36.42 H new ATOM 0 HA3 GLY A 399 17.334 19.132 -2.218 1.00 36.42 H new ATOM 1542 N LEU A 400 15.489 19.810 0.239 1.00 40.64 N ATOM 1543 CA LEU A 400 14.078 19.694 0.618 1.00 37.28 C ATOM 1544 C LEU A 400 13.411 20.966 0.145 1.00 38.18 C ATOM 1545 O LEU A 400 14.004 22.018 0.278 1.00 38.29 O ATOM 1546 CB LEU A 400 13.894 19.447 2.106 1.00 37.54 C ATOM 1547 CG LEU A 400 14.292 18.022 2.567 1.00 35.23 C ATOM 1548 CD1 LEU A 400 14.257 17.897 4.095 1.00 31.61 C ATOM 1549 CD2 LEU A 400 13.376 16.958 1.897 1.00 28.53 C ATOM 0 H LEU A 400 16.053 19.928 0.877 1.00 40.64 H new ATOM 0 HA LEU A 400 13.669 18.920 0.201 1.00 37.28 H new ATOM 0 HB2 LEU A 400 14.422 20.095 2.599 1.00 37.54 H new ATOM 0 HB3 LEU A 400 12.965 19.603 2.337 1.00 37.54 H new ATOM 0 HG LEU A 400 15.206 17.860 2.285 1.00 35.23 H new ATOM 0 HD11 LEU A 400 14.510 16.997 4.352 1.00 31.61 H new ATOM 0 HD12 LEU A 400 14.878 18.531 4.486 1.00 31.61 H new ATOM 0 HD13 LEU A 400 13.361 18.084 4.415 1.00 31.61 H new ATOM 0 HD21 LEU A 400 13.637 16.072 2.195 1.00 28.53 H new ATOM 0 HD22 LEU A 400 12.453 17.123 2.145 1.00 28.53 H new ATOM 0 HD23 LEU A 400 13.466 17.014 0.933 1.00 28.53 H new ATOM 1550 N LEU A 401 12.213 20.857 -0.431 1.00 38.04 N ATOM 1551 CA LEU A 401 11.425 22.021 -0.847 1.00 41.46 C ATOM 1552 C LEU A 401 10.831 22.768 0.351 1.00 42.91 C ATOM 1553 O LEU A 401 11.199 23.923 0.625 1.00 43.48 O ATOM 1554 CB LEU A 401 10.282 21.582 -1.766 1.00 41.28 C ATOM 1555 CG LEU A 401 10.588 21.562 -3.258 1.00 44.02 C ATOM 1556 CD1 LEU A 401 12.076 21.471 -3.473 1.00 43.31 C ATOM 1557 CD2 LEU A 401 9.893 20.396 -3.900 1.00 43.48 C ATOM 0 H LEU A 401 11.832 20.103 -0.592 1.00 38.04 H new ATOM 0 HA LEU A 401 12.027 22.619 -1.317 1.00 41.46 H new ATOM 0 HB2 LEU A 401 10.002 20.692 -1.500 1.00 41.28 H new ATOM 0 HB3 LEU A 401 9.527 22.173 -1.618 1.00 41.28 H new ATOM 0 HG LEU A 401 10.266 22.381 -3.665 1.00 44.02 H new ATOM 0 HD11 LEU A 401 12.266 21.459 -4.424 1.00 43.31 H new ATOM 0 HD12 LEU A 401 12.509 22.238 -3.067 1.00 43.31 H new ATOM 0 HD13 LEU A 401 12.413 20.657 -3.066 1.00 43.31 H new ATOM 0 HD21 LEU A 401 10.089 20.385 -4.850 1.00 43.48 H new ATOM 0 HD22 LEU A 401 10.205 19.571 -3.496 1.00 43.48 H new ATOM 0 HD23 LEU A 401 8.935 20.478 -3.769 1.00 43.48 H new ATOM 1558 N ASN A 402 9.913 22.086 1.047 1.00 40.92 N ATOM 1559 CA ASN A 402 9.221 22.614 2.217 1.00 39.82 C ATOM 1560 C ASN A 402 9.734 21.960 3.486 1.00 38.60 C ATOM 1561 O ASN A 402 9.192 20.931 3.862 1.00 38.63 O ATOM 1562 CB ASN A 402 7.722 22.283 2.159 1.00 39.49 C ATOM 1563 CG ASN A 402 7.116 22.504 0.805 1.00 43.24 C ATOM 1564 OD1 ASN A 402 6.487 21.604 0.238 1.00 53.58 O ATOM 1565 ND2 ASN A 402 7.292 23.696 0.269 1.00 43.36 N ATOM 0 H ASN A 402 9.674 21.286 0.843 1.00 40.92 H new ATOM 0 HA ASN A 402 9.376 23.572 2.220 1.00 39.82 H new ATOM 0 HB2 ASN A 402 7.592 21.357 2.417 1.00 39.49 H new ATOM 0 HB3 ASN A 402 7.252 22.828 2.809 1.00 39.49 H new ATOM 0 HD21 ASN A 402 6.963 23.872 -0.506 1.00 43.36 H new ATOM 0 HD22 ASN A 402 7.736 24.297 0.694 1.00 43.36 H new ATOM 1566 N VAL A 403 10.730 22.552 4.156 1.00 36.91 N ATOM 1567 CA VAL A 403 11.230 21.974 5.395 1.00 36.45 C ATOM 1568 C VAL A 403 10.265 21.970 6.593 1.00 38.22 C ATOM 1569 O VAL A 403 10.344 21.088 7.446 1.00 36.02 O ATOM 1570 CB VAL A 403 12.664 22.392 5.762 1.00 35.72 C ATOM 1571 CG1 VAL A 403 13.500 22.675 4.524 1.00 35.15 C ATOM 1572 CG2 VAL A 403 12.690 23.559 6.699 1.00 41.84 C ATOM 0 H VAL A 403 11.121 23.278 3.910 1.00 36.91 H new ATOM 0 HA VAL A 403 11.284 21.034 5.160 1.00 36.45 H new ATOM 0 HB VAL A 403 13.061 21.638 6.226 1.00 35.72 H new ATOM 0 HG11 VAL A 403 14.396 22.935 4.791 1.00 35.15 H new ATOM 0 HG12 VAL A 403 13.546 21.877 3.975 1.00 35.15 H new ATOM 0 HG13 VAL A 403 13.093 23.394 4.016 1.00 35.15 H new ATOM 0 HG21 VAL A 403 13.610 23.789 6.904 1.00 41.84 H new ATOM 0 HG22 VAL A 403 12.252 24.318 6.283 1.00 41.84 H new ATOM 0 HG23 VAL A 403 12.225 23.327 7.518 1.00 41.84 H new ATOM 1573 N LYS A 404 9.333 22.924 6.644 1.00 36.58 N ATOM 1574 CA LYS A 404 8.584 23.178 7.870 1.00 37.42 C ATOM 1575 C LYS A 404 7.633 22.048 8.236 1.00 36.17 C ATOM 1576 O LYS A 404 7.499 21.693 9.417 1.00 35.76 O ATOM 1577 CB LYS A 404 7.806 24.512 7.792 1.00 40.67 C ATOM 1578 CG LYS A 404 8.646 25.748 8.197 1.00 46.31 C ATOM 1579 CD LYS A 404 9.492 26.313 7.027 1.00 58.26 C ATOM 1580 CE LYS A 404 10.939 26.625 7.441 1.00 60.22 C ATOM 1581 NZ LYS A 404 11.825 26.764 6.254 1.00 62.50 N ATOM 0 H LYS A 404 9.122 23.431 5.982 1.00 36.58 H new ATOM 0 HA LYS A 404 9.249 23.236 8.574 1.00 37.42 H new ATOM 0 HB2 LYS A 404 7.481 24.635 6.886 1.00 40.67 H new ATOM 0 HB3 LYS A 404 7.028 24.457 8.368 1.00 40.67 H new ATOM 0 HG2 LYS A 404 8.054 26.442 8.526 1.00 46.31 H new ATOM 0 HG3 LYS A 404 9.235 25.507 8.929 1.00 46.31 H new ATOM 0 HD2 LYS A 404 9.499 25.673 6.298 1.00 58.26 H new ATOM 0 HD3 LYS A 404 9.074 27.121 6.691 1.00 58.26 H new ATOM 0 HE2 LYS A 404 10.959 27.444 7.960 1.00 60.22 H new ATOM 0 HE3 LYS A 404 11.273 25.918 8.015 1.00 60.22 H new ATOM 0 HZ1 LYS A 404 12.651 26.513 6.469 1.00 62.50 H new ATOM 0 HZ2 LYS A 404 11.521 26.249 5.595 1.00 62.50 H new ATOM 0 HZ3 LYS A 404 11.833 27.613 5.987 1.00 62.50 H new ATOM 1582 N PRO A 405 6.907 21.528 7.248 1.00 33.86 N ATOM 1583 CA PRO A 405 5.990 20.438 7.533 1.00 33.87 C ATOM 1584 C PRO A 405 6.732 19.146 7.957 1.00 32.80 C ATOM 1585 O PRO A 405 6.181 18.352 8.709 1.00 31.77 O ATOM 1586 CB PRO A 405 5.203 20.272 6.230 1.00 34.95 C ATOM 1587 CG PRO A 405 6.031 20.896 5.190 1.00 36.95 C ATOM 1588 CD PRO A 405 6.865 21.962 5.848 1.00 36.19 C ATOM 0 HA PRO A 405 5.409 20.625 8.287 1.00 33.87 H new ATOM 0 HB2 PRO A 405 5.044 19.335 6.035 1.00 34.95 H new ATOM 0 HB3 PRO A 405 4.335 20.701 6.289 1.00 34.95 H new ATOM 0 HG2 PRO A 405 6.598 20.234 4.764 1.00 36.95 H new ATOM 0 HG3 PRO A 405 5.473 21.280 4.496 1.00 36.95 H new ATOM 0 HD2 PRO A 405 7.753 22.014 5.461 1.00 36.19 H new ATOM 0 HD3 PRO A 405 6.464 22.840 5.756 1.00 36.19 H new ATOM 1589 N ILE A 406 7.986 18.988 7.526 1.00 29.54 N ATOM 1590 CA ILE A 406 8.829 17.847 7.925 1.00 28.84 C ATOM 1591 C ILE A 406 9.285 18.030 9.362 1.00 29.69 C ATOM 1592 O ILE A 406 9.121 17.148 10.166 1.00 31.04 O ATOM 1593 CB ILE A 406 10.031 17.693 6.981 1.00 27.84 C ATOM 1594 CG1 ILE A 406 9.507 17.367 5.550 1.00 28.55 C ATOM 1595 CG2 ILE A 406 11.025 16.644 7.505 1.00 26.15 C ATOM 1596 CD1 ILE A 406 10.525 17.522 4.440 1.00 21.36 C ATOM 0 H ILE A 406 8.376 19.539 6.993 1.00 29.54 H new ATOM 0 HA ILE A 406 8.306 17.033 7.863 1.00 28.84 H new ATOM 0 HB ILE A 406 10.528 18.525 6.942 1.00 27.84 H new ATOM 0 HG12 ILE A 406 9.177 16.455 5.542 1.00 28.55 H new ATOM 0 HG13 ILE A 406 8.751 17.944 5.359 1.00 28.55 H new ATOM 0 HG21 ILE A 406 11.771 16.569 6.890 1.00 26.15 H new ATOM 0 HG22 ILE A 406 11.352 16.915 8.377 1.00 26.15 H new ATOM 0 HG23 ILE A 406 10.580 15.785 7.579 1.00 26.15 H new ATOM 0 HD11 ILE A 406 10.114 17.300 3.590 1.00 21.36 H new ATOM 0 HD12 ILE A 406 10.841 18.439 4.416 1.00 21.36 H new ATOM 0 HD13 ILE A 406 11.274 16.927 4.602 1.00 21.36 H new ATOM 1597 N GLU A 407 9.806 19.204 9.703 1.00 31.17 N ATOM 1598 CA GLU A 407 10.176 19.515 11.080 1.00 31.54 C ATOM 1599 C GLU A 407 9.027 19.413 12.048 1.00 30.77 C ATOM 1600 O GLU A 407 9.202 19.045 13.206 1.00 34.03 O ATOM 1601 CB GLU A 407 10.765 20.921 11.173 1.00 32.74 C ATOM 1602 CG GLU A 407 12.192 21.069 10.703 1.00 34.03 C ATOM 1603 CD GLU A 407 12.652 22.519 10.787 1.00 42.04 C ATOM 1604 OE1 GLU A 407 11.781 23.430 10.841 1.00 55.41 O ATOM 1605 OE2 GLU A 407 13.879 22.756 10.813 1.00 55.82 O ATOM 0 H GLU A 407 9.955 19.841 9.145 1.00 31.17 H new ATOM 0 HA GLU A 407 10.834 18.848 11.330 1.00 31.54 H new ATOM 0 HB2 GLU A 407 10.208 21.522 10.654 1.00 32.74 H new ATOM 0 HB3 GLU A 407 10.715 21.214 12.096 1.00 32.74 H new ATOM 0 HG2 GLU A 407 12.773 20.511 11.244 1.00 34.03 H new ATOM 0 HG3 GLU A 407 12.268 20.755 9.788 1.00 34.03 H new ATOM 1606 N ASP A 408 7.852 19.757 11.574 1.00 32.21 N ATOM 1607 CA ASP A 408 6.646 19.763 12.350 1.00 32.85 C ATOM 1608 C ASP A 408 6.201 18.357 12.712 1.00 31.09 C ATOM 1609 O ASP A 408 5.715 18.107 13.823 1.00 31.07 O ATOM 1610 CB ASP A 408 5.544 20.448 11.530 1.00 36.26 C ATOM 1611 CG ASP A 408 5.493 21.967 11.753 1.00 44.71 C ATOM 1612 OD1 ASP A 408 6.343 22.520 12.486 1.00 45.99 O ATOM 1613 OD2 ASP A 408 4.593 22.611 11.182 1.00 47.65 O ATOM 0 H ASP A 408 7.733 20.003 10.759 1.00 32.21 H new ATOM 0 HA ASP A 408 6.814 20.241 13.177 1.00 32.85 H new ATOM 0 HB2 ASP A 408 5.689 20.268 10.588 1.00 36.26 H new ATOM 0 HB3 ASP A 408 4.685 20.062 11.764 1.00 36.26 H new ATOM 1614 N ILE A 409 6.345 17.439 11.758 1.00 29.87 N ATOM 1615 CA ILE A 409 6.060 16.016 11.996 1.00 25.53 C ATOM 1616 C ILE A 409 7.129 15.463 12.914 1.00 22.45 C ATOM 1617 O ILE A 409 6.817 14.760 13.858 1.00 19.59 O ATOM 1618 CB ILE A 409 6.035 15.189 10.689 1.00 24.02 C ATOM 1619 CG1 ILE A 409 4.910 15.692 9.758 1.00 28.61 C ATOM 1620 CG2 ILE A 409 5.915 13.646 11.014 1.00 25.93 C ATOM 1621 CD1 ILE A 409 5.110 15.276 8.287 1.00 28.57 C ATOM 0 H ILE A 409 6.608 17.617 10.959 1.00 29.87 H new ATOM 0 HA ILE A 409 5.179 15.949 12.395 1.00 25.53 H new ATOM 0 HB ILE A 409 6.872 15.312 10.214 1.00 24.02 H new ATOM 0 HG12 ILE A 409 4.059 15.348 10.073 1.00 28.61 H new ATOM 0 HG13 ILE A 409 4.862 16.659 9.811 1.00 28.61 H new ATOM 0 HG21 ILE A 409 5.900 13.141 10.186 1.00 25.93 H new ATOM 0 HG22 ILE A 409 6.675 13.368 11.549 1.00 25.93 H new ATOM 0 HG23 ILE A 409 5.096 13.482 11.507 1.00 25.93 H new ATOM 0 HD11 ILE A 409 4.377 15.618 7.751 1.00 28.57 H new ATOM 0 HD12 ILE A 409 5.947 15.640 7.959 1.00 28.57 H new ATOM 0 HD13 ILE A 409 5.132 14.308 8.224 1.00 28.57 H new ATOM 1622 N GLN A 410 8.375 15.806 12.646 1.00 18.86 N ATOM 1623 CA GLN A 410 9.487 15.284 13.409 1.00 19.62 C ATOM 1624 C GLN A 410 9.434 15.709 14.856 1.00 25.45 C ATOM 1625 O GLN A 410 9.887 14.985 15.767 1.00 23.83 O ATOM 1626 CB GLN A 410 10.843 15.660 12.797 1.00 19.73 C ATOM 1627 CG GLN A 410 11.962 14.848 13.443 1.00 24.40 C ATOM 1628 CD GLN A 410 13.327 15.427 13.224 1.00 30.91 C ATOM 1629 OE1 GLN A 410 13.537 16.630 13.389 1.00 30.15 O ATOM 1630 NE2 GLN A 410 14.292 14.566 12.858 1.00 18.91 N ATOM 0 H GLN A 410 8.599 16.348 12.017 1.00 18.86 H new ATOM 0 HA GLN A 410 9.400 14.319 13.374 1.00 19.62 H new ATOM 0 HB2 GLN A 410 10.829 15.498 11.841 1.00 19.73 H new ATOM 0 HB3 GLN A 410 11.009 16.607 12.922 1.00 19.73 H new ATOM 0 HG2 GLN A 410 11.796 14.783 14.396 1.00 24.40 H new ATOM 0 HG3 GLN A 410 11.941 13.945 13.090 1.00 24.40 H new ATOM 0 HE21 GLN A 410 14.107 13.733 12.752 1.00 18.91 H new ATOM 0 HE22 GLN A 410 15.094 14.848 12.729 1.00 18.91 H new ATOM 1631 N ASP A 411 8.866 16.889 15.077 1.00 26.67 N ATOM 1632 CA ASP A 411 8.732 17.424 16.413 1.00 28.11 C ATOM 1633 C ASP A 411 7.805 16.568 17.279 1.00 25.26 C ATOM 1634 O ASP A 411 8.145 16.261 18.418 1.00 23.28 O ATOM 1635 CB ASP A 411 8.272 18.886 16.377 1.00 33.20 C ATOM 1636 CG ASP A 411 9.433 19.872 16.125 1.00 46.70 C ATOM 1637 OD1 ASP A 411 10.602 19.527 16.437 1.00 60.67 O ATOM 1638 OD2 ASP A 411 9.176 21.000 15.613 1.00 57.70 O ATOM 0 H ASP A 411 8.551 17.395 14.457 1.00 26.67 H new ATOM 0 HA ASP A 411 9.610 17.398 16.825 1.00 28.11 H new ATOM 0 HB2 ASP A 411 7.605 18.994 15.681 1.00 33.20 H new ATOM 0 HB3 ASP A 411 7.843 19.107 17.218 1.00 33.20 H new ATOM 1639 N ASN A 412 6.647 16.216 16.730 1.00 24.77 N ATOM 1640 CA ASN A 412 5.733 15.228 17.274 1.00 29.10 C ATOM 1641 C ASN A 412 6.369 13.879 17.544 1.00 24.89 C ATOM 1642 O ASN A 412 6.098 13.267 18.574 1.00 23.77 O ATOM 1643 CB ASN A 412 4.644 14.952 16.249 1.00 30.99 C ATOM 1644 CG ASN A 412 3.574 15.990 16.238 1.00 44.03 C ATOM 1645 OD1 ASN A 412 2.573 15.854 15.507 1.00 50.54 O ATOM 1646 ND2 ASN A 412 3.760 17.049 17.033 1.00 40.71 N ATOM 0 H ASN A 412 6.363 16.564 15.997 1.00 24.77 H new ATOM 0 HA ASN A 412 5.413 15.603 18.109 1.00 29.10 H new ATOM 0 HB2 ASN A 412 5.044 14.898 15.367 1.00 30.99 H new ATOM 0 HB3 ASN A 412 4.246 14.087 16.433 1.00 30.99 H new ATOM 0 HD21 ASN A 412 3.173 17.678 17.056 1.00 40.71 H new ATOM 0 HD22 ASN A 412 4.466 17.102 17.521 1.00 40.71 H new ATOM 1647 N LEU A 413 7.145 13.393 16.568 1.00 22.58 N ATOM 1648 CA LEU A 413 7.900 12.138 16.694 1.00 19.12 C ATOM 1649 C LEU A 413 8.937 12.178 17.792 1.00 19.74 C ATOM 1650 O LEU A 413 9.056 11.196 18.547 1.00 21.77 O ATOM 1651 CB LEU A 413 8.527 11.691 15.351 1.00 17.15 C ATOM 1652 CG LEU A 413 7.585 11.331 14.176 1.00 19.15 C ATOM 1653 CD1 LEU A 413 8.409 11.214 12.917 1.00 21.18 C ATOM 1654 CD2 LEU A 413 6.784 10.016 14.490 1.00 18.00 C ATOM 0 H LEU A 413 7.249 13.785 15.809 1.00 22.58 H new ATOM 0 HA LEU A 413 7.246 11.469 16.950 1.00 19.12 H new ATOM 0 HB2 LEU A 413 9.115 12.401 15.050 1.00 17.15 H new ATOM 0 HB3 LEU A 413 9.084 10.917 15.529 1.00 17.15 H new ATOM 0 HG LEU A 413 6.924 12.030 14.048 1.00 19.15 H new ATOM 0 HD11 LEU A 413 7.831 10.988 12.171 1.00 21.18 H new ATOM 0 HD12 LEU A 413 8.850 12.059 12.739 1.00 21.18 H new ATOM 0 HD13 LEU A 413 9.076 10.519 13.030 1.00 21.18 H new ATOM 0 HD21 LEU A 413 6.200 9.807 13.744 1.00 18.00 H new ATOM 0 HD22 LEU A 413 7.405 9.284 14.629 1.00 18.00 H new ATOM 0 HD23 LEU A 413 6.252 10.145 15.291 1.00 18.00 H new ATOM 1655 N LEU A 414 9.698 13.277 17.900 1.00 20.37 N ATOM 1656 CA LEU A 414 10.654 13.445 19.001 1.00 20.68 C ATOM 1657 C LEU A 414 10.022 13.496 20.385 1.00 22.12 C ATOM 1658 O LEU A 414 10.616 12.989 21.351 1.00 20.00 O ATOM 1659 CB LEU A 414 11.572 14.664 18.804 1.00 18.73 C ATOM 1660 CG LEU A 414 12.502 14.536 17.586 1.00 19.96 C ATOM 1661 CD1 LEU A 414 12.969 15.907 17.151 1.00 25.30 C ATOM 1662 CD2 LEU A 414 13.642 13.687 18.068 1.00 17.01 C ATOM 0 H LEU A 414 9.674 13.934 17.346 1.00 20.37 H new ATOM 0 HA LEU A 414 11.188 12.636 18.966 1.00 20.68 H new ATOM 0 HB2 LEU A 414 11.026 15.459 18.704 1.00 18.73 H new ATOM 0 HB3 LEU A 414 12.110 14.788 19.602 1.00 18.73 H new ATOM 0 HG LEU A 414 12.069 14.139 16.814 1.00 19.96 H new ATOM 0 HD11 LEU A 414 13.555 15.821 16.383 1.00 25.30 H new ATOM 0 HD12 LEU A 414 12.201 16.450 16.912 1.00 25.30 H new ATOM 0 HD13 LEU A 414 13.451 16.331 17.879 1.00 25.30 H new ATOM 0 HD21 LEU A 414 14.278 13.560 17.347 1.00 17.01 H new ATOM 0 HD22 LEU A 414 14.081 14.127 18.813 1.00 17.01 H new ATOM 0 HD23 LEU A 414 13.304 12.825 18.356 1.00 17.01 H new ATOM 1663 N GLN A 415 8.848 14.122 20.484 1.00 20.06 N ATOM 1664 CA GLN A 415 8.044 14.101 21.727 1.00 23.04 C ATOM 1665 C GLN A 415 7.489 12.734 22.064 1.00 21.08 C ATOM 1666 O GLN A 415 7.491 12.360 23.229 1.00 19.87 O ATOM 1667 CB GLN A 415 6.910 15.146 21.701 1.00 22.83 C ATOM 1668 CG GLN A 415 7.366 16.599 21.722 1.00 26.13 C ATOM 1669 CD GLN A 415 6.179 17.577 21.647 1.00 33.46 C ATOM 1670 OE1 GLN A 415 5.318 17.598 22.529 1.00 44.25 O ATOM 1671 NE2 GLN A 415 6.129 18.373 20.586 1.00 35.04 N ATOM 0 H GLN A 415 8.491 14.569 19.842 1.00 20.06 H new ATOM 0 HA GLN A 415 8.666 14.337 22.433 1.00 23.04 H new ATOM 0 HB2 GLN A 415 6.375 15.002 20.905 1.00 22.83 H new ATOM 0 HB3 GLN A 415 6.331 14.993 22.464 1.00 22.83 H new ATOM 0 HG2 GLN A 415 7.872 16.767 22.533 1.00 26.13 H new ATOM 0 HG3 GLN A 415 7.965 16.760 20.976 1.00 26.13 H new ATOM 0 HE21 GLN A 415 6.746 18.333 19.989 1.00 35.04 H new ATOM 0 HE22 GLN A 415 5.479 18.929 20.496 1.00 35.04 H new ATOM 1672 N ALA A 416 7.032 11.970 21.061 1.00 18.39 N ATOM 1673 CA ALA A 416 6.673 10.579 21.283 1.00 16.92 C ATOM 1674 C ALA A 416 7.875 9.738 21.700 1.00 18.49 C ATOM 1675 O ALA A 416 7.771 8.879 22.547 1.00 20.37 O ATOM 1676 CB ALA A 416 5.975 9.996 20.023 1.00 17.92 C ATOM 0 H ALA A 416 6.926 12.244 20.253 1.00 18.39 H new ATOM 0 HA ALA A 416 6.046 10.547 22.022 1.00 16.92 H new ATOM 0 HB1 ALA A 416 5.740 9.068 20.183 1.00 17.92 H new ATOM 0 HB2 ALA A 416 5.171 10.504 19.834 1.00 17.92 H new ATOM 0 HB3 ALA A 416 6.577 10.051 19.265 1.00 17.92 H new ATOM 1677 N LEU A 417 9.031 9.974 21.097 1.00 13.48 N ATOM 1678 CA LEU A 417 10.190 9.190 21.442 1.00 19.12 C ATOM 1679 C LEU A 417 10.651 9.511 22.883 1.00 17.18 C ATOM 1680 O LEU A 417 10.975 8.610 23.664 1.00 20.13 O ATOM 1681 CB LEU A 417 11.291 9.433 20.407 1.00 12.27 C ATOM 1682 CG LEU A 417 12.665 8.788 20.734 1.00 18.50 C ATOM 1683 CD1 LEU A 417 12.501 7.285 20.829 1.00 15.34 C ATOM 1684 CD2 LEU A 417 13.668 9.115 19.610 1.00 17.64 C ATOM 0 H LEU A 417 9.159 10.575 20.495 1.00 13.48 H new ATOM 0 HA LEU A 417 9.969 8.246 21.425 1.00 19.12 H new ATOM 0 HB2 LEU A 417 10.988 9.096 19.549 1.00 12.27 H new ATOM 0 HB3 LEU A 417 11.415 10.390 20.308 1.00 12.27 H new ATOM 0 HG LEU A 417 12.994 9.138 21.577 1.00 18.50 H new ATOM 0 HD11 LEU A 417 13.358 6.878 21.033 1.00 15.34 H new ATOM 0 HD12 LEU A 417 11.867 7.072 21.531 1.00 15.34 H new ATOM 0 HD13 LEU A 417 12.174 6.941 19.983 1.00 15.34 H new ATOM 0 HD21 LEU A 417 14.526 8.712 19.815 1.00 17.64 H new ATOM 0 HD22 LEU A 417 13.338 8.762 18.769 1.00 17.64 H new ATOM 0 HD23 LEU A 417 13.772 10.077 19.538 1.00 17.64 H new ATOM 1685 N GLU A 418 10.649 10.794 23.256 1.00 20.19 N ATOM 1686 CA GLU A 418 11.038 11.209 24.617 1.00 20.38 C ATOM 1687 C GLU A 418 10.125 10.536 25.668 1.00 16.39 C ATOM 1688 O GLU A 418 10.609 9.992 26.660 1.00 13.36 O ATOM 1689 CB GLU A 418 10.965 12.730 24.742 1.00 23.78 C ATOM 1690 CG GLU A 418 11.156 13.264 26.204 1.00 28.25 C ATOM 1691 CD GLU A 418 11.307 14.815 26.293 1.00 36.63 C ATOM 1692 OE1 GLU A 418 10.683 15.537 25.456 1.00 46.45 O ATOM 1693 OE2 GLU A 418 12.055 15.306 27.203 1.00 44.66 O ATOM 0 H GLU A 418 10.426 11.443 22.738 1.00 20.19 H new ATOM 0 HA GLU A 418 11.951 10.926 24.780 1.00 20.38 H new ATOM 0 HB2 GLU A 418 11.644 13.124 24.173 1.00 23.78 H new ATOM 0 HB3 GLU A 418 10.106 13.031 24.408 1.00 23.78 H new ATOM 0 HG2 GLU A 418 10.396 12.990 26.741 1.00 28.25 H new ATOM 0 HG3 GLU A 418 11.942 12.848 26.591 1.00 28.25 H new ATOM 1694 N LEU A 419 8.826 10.518 25.405 1.00 14.21 N ATOM 1695 CA LEU A 419 7.849 9.897 26.314 1.00 16.45 C ATOM 1696 C LEU A 419 8.064 8.353 26.373 1.00 18.79 C ATOM 1697 O LEU A 419 8.104 7.735 27.442 1.00 21.88 O ATOM 1698 CB LEU A 419 6.409 10.256 25.856 1.00 21.19 C ATOM 1699 CG LEU A 419 5.268 9.555 26.630 1.00 21.18 C ATOM 1700 CD1 LEU A 419 5.462 9.787 28.132 1.00 18.88 C ATOM 1701 CD2 LEU A 419 3.941 10.103 26.217 1.00 20.42 C ATOM 0 H LEU A 419 8.478 10.863 24.698 1.00 14.21 H new ATOM 0 HA LEU A 419 7.978 10.242 27.211 1.00 16.45 H new ATOM 0 HB2 LEU A 419 6.291 11.215 25.936 1.00 21.19 H new ATOM 0 HB3 LEU A 419 6.322 10.037 24.915 1.00 21.19 H new ATOM 0 HG LEU A 419 5.291 8.606 26.431 1.00 21.18 H new ATOM 0 HD11 LEU A 419 4.749 9.349 28.622 1.00 18.88 H new ATOM 0 HD12 LEU A 419 6.316 9.420 28.409 1.00 18.88 H new ATOM 0 HD13 LEU A 419 5.444 10.739 28.318 1.00 18.88 H new ATOM 0 HD21 LEU A 419 3.237 9.654 26.711 1.00 20.42 H new ATOM 0 HD22 LEU A 419 3.911 11.054 26.405 1.00 20.42 H new ATOM 0 HD23 LEU A 419 3.812 9.958 25.267 1.00 20.42 H new ATOM 1702 N GLN A 420 8.224 7.725 25.214 1.00 17.93 N ATOM 1703 CA GLN A 420 8.479 6.291 25.125 1.00 14.05 C ATOM 1704 C GLN A 420 9.684 5.858 25.964 1.00 15.31 C ATOM 1705 O GLN A 420 9.628 4.842 26.637 1.00 14.01 O ATOM 1706 CB GLN A 420 8.646 5.954 23.632 1.00 18.12 C ATOM 1707 CG GLN A 420 9.046 4.510 23.211 1.00 17.41 C ATOM 1708 CD GLN A 420 8.180 3.428 23.756 1.00 17.10 C ATOM 1709 OE1 GLN A 420 6.958 3.600 23.945 1.00 22.03 O ATOM 1710 NE2 GLN A 420 8.810 2.261 24.019 1.00 15.44 N ATOM 0 H GLN A 420 8.188 8.121 24.451 1.00 17.93 H new ATOM 0 HA GLN A 420 7.734 5.794 25.498 1.00 14.05 H new ATOM 0 HB2 GLN A 420 7.807 6.163 23.192 1.00 18.12 H new ATOM 0 HB3 GLN A 420 9.314 6.557 23.271 1.00 18.12 H new ATOM 0 HG2 GLN A 420 9.035 4.456 22.243 1.00 17.41 H new ATOM 0 HG3 GLN A 420 9.959 4.347 23.494 1.00 17.41 H new ATOM 0 HE21 GLN A 420 9.654 2.186 23.874 1.00 15.44 H new ATOM 0 HE22 GLN A 420 8.366 1.594 24.331 1.00 15.44 H new ATOM 1711 N LEU A 421 10.782 6.611 25.910 1.00 13.24 N ATOM 1712 CA LEU A 421 12.015 6.212 26.603 1.00 17.00 C ATOM 1713 C LEU A 421 11.908 6.454 28.114 1.00 17.07 C ATOM 1714 O LEU A 421 12.456 5.721 28.928 1.00 22.12 O ATOM 1715 CB LEU A 421 13.145 7.065 26.063 1.00 19.59 C ATOM 1716 CG LEU A 421 13.562 6.760 24.622 1.00 19.21 C ATOM 1717 CD1 LEU A 421 14.519 7.803 24.060 1.00 15.51 C ATOM 1718 CD2 LEU A 421 14.086 5.347 24.399 1.00 22.95 C ATOM 0 H LEU A 421 10.837 7.354 25.480 1.00 13.24 H new ATOM 0 HA LEU A 421 12.170 5.266 26.453 1.00 17.00 H new ATOM 0 HB2 LEU A 421 12.882 7.997 26.118 1.00 19.59 H new ATOM 0 HB3 LEU A 421 13.918 6.954 26.638 1.00 19.59 H new ATOM 0 HG LEU A 421 12.735 6.811 24.118 1.00 19.21 H new ATOM 0 HD11 LEU A 421 14.754 7.569 23.149 1.00 15.51 H new ATOM 0 HD12 LEU A 421 14.091 8.673 24.069 1.00 15.51 H new ATOM 0 HD13 LEU A 421 15.322 7.832 24.604 1.00 15.51 H new ATOM 0 HD21 LEU A 421 14.327 5.235 23.466 1.00 22.95 H new ATOM 0 HD22 LEU A 421 14.867 5.200 24.955 1.00 22.95 H new ATOM 0 HD23 LEU A 421 13.397 4.705 24.634 1.00 22.95 H new ATOM 1719 N LYS A 422 11.197 7.519 28.491 1.00 20.55 N ATOM 1720 CA LYS A 422 10.817 7.762 29.896 1.00 15.86 C ATOM 1721 C LYS A 422 10.065 6.583 30.485 1.00 19.40 C ATOM 1722 O LYS A 422 10.406 6.122 31.577 1.00 16.75 O ATOM 1723 CB LYS A 422 9.983 9.050 29.985 1.00 17.35 C ATOM 1724 CG LYS A 422 9.478 9.473 31.437 1.00 25.10 C ATOM 1725 CD LYS A 422 10.500 9.195 32.551 1.00 23.67 C ATOM 1726 CE LYS A 422 11.364 10.414 32.872 1.00 28.78 C ATOM 1727 NZ LYS A 422 12.148 10.153 34.168 1.00 23.81 N ATOM 0 H LYS A 422 10.920 8.122 27.944 1.00 20.55 H new ATOM 0 HA LYS A 422 11.626 7.869 30.420 1.00 15.86 H new ATOM 0 HB2 LYS A 422 10.511 9.779 29.623 1.00 17.35 H new ATOM 0 HB3 LYS A 422 9.207 8.949 29.411 1.00 17.35 H new ATOM 0 HG2 LYS A 422 9.264 10.419 31.434 1.00 25.10 H new ATOM 0 HG3 LYS A 422 8.656 8.997 31.636 1.00 25.10 H new ATOM 0 HD2 LYS A 422 10.031 8.915 33.353 1.00 23.67 H new ATOM 0 HD3 LYS A 422 11.072 8.458 32.284 1.00 23.67 H new ATOM 0 HE2 LYS A 422 11.977 10.591 32.141 1.00 28.78 H new ATOM 0 HE3 LYS A 422 10.807 11.201 32.972 1.00 28.78 H new ATOM 0 HZ1 LYS A 422 12.960 10.511 34.101 1.00 23.81 H new ATOM 0 HZ2 LYS A 422 11.718 10.521 34.855 1.00 23.81 H new ATOM 0 HZ3 LYS A 422 12.221 9.276 34.300 1.00 23.81 H new ATOM 1728 N LEU A 423 9.027 6.121 29.785 1.00 15.45 N ATOM 1729 CA LEU A 423 8.189 5.033 30.268 1.00 18.18 C ATOM 1730 C LEU A 423 8.912 3.703 30.211 1.00 19.56 C ATOM 1731 O LEU A 423 8.695 2.861 31.075 1.00 19.38 O ATOM 1732 CB LEU A 423 6.882 4.923 29.453 1.00 14.08 C ATOM 1733 CG LEU A 423 6.112 6.228 29.334 1.00 22.40 C ATOM 1734 CD1 LEU A 423 4.962 6.002 28.418 1.00 22.15 C ATOM 1735 CD2 LEU A 423 5.644 6.605 30.725 1.00 23.14 C ATOM 0 H LEU A 423 8.793 6.432 29.018 1.00 15.45 H new ATOM 0 HA LEU A 423 7.976 5.241 31.191 1.00 18.18 H new ATOM 0 HB2 LEU A 423 7.094 4.601 28.563 1.00 14.08 H new ATOM 0 HB3 LEU A 423 6.310 4.258 29.866 1.00 14.08 H new ATOM 0 HG LEU A 423 6.655 6.947 28.975 1.00 22.40 H new ATOM 0 HD11 LEU A 423 4.455 6.824 28.327 1.00 22.15 H new ATOM 0 HD12 LEU A 423 5.290 5.727 27.548 1.00 22.15 H new ATOM 0 HD13 LEU A 423 4.390 5.308 28.782 1.00 22.15 H new ATOM 0 HD21 LEU A 423 5.147 7.437 30.685 1.00 23.14 H new ATOM 0 HD22 LEU A 423 5.073 5.904 31.075 1.00 23.14 H new ATOM 0 HD23 LEU A 423 6.413 6.716 31.306 1.00 23.14 H new ATOM 1736 N ASN A 424 9.734 3.481 29.172 1.00 19.16 N ATOM 1737 CA ASN A 424 10.189 2.129 28.880 1.00 18.09 C ATOM 1738 C ASN A 424 11.579 1.944 29.431 1.00 18.35 C ATOM 1739 O ASN A 424 11.989 0.809 29.657 1.00 18.23 O ATOM 1740 CB ASN A 424 10.173 1.881 27.356 1.00 19.65 C ATOM 1741 CG ASN A 424 10.414 0.416 26.953 1.00 32.37 C ATOM 1742 OD1 ASN A 424 10.088 -0.519 27.684 1.00 40.55 O ATOM 1743 ND2 ASN A 424 10.944 0.220 25.725 1.00 41.77 N ATOM 0 H ASN A 424 10.029 4.089 28.641 1.00 19.16 H new ATOM 0 HA ASN A 424 9.593 1.488 29.298 1.00 18.09 H new ATOM 0 HB2 ASN A 424 9.317 2.167 27.001 1.00 19.65 H new ATOM 0 HB3 ASN A 424 10.852 2.436 26.941 1.00 19.65 H new ATOM 0 HD21 ASN A 424 11.063 -0.579 25.431 1.00 41.77 H new ATOM 0 HD22 ASN A 424 11.162 0.895 25.238 1.00 41.77 H new ATOM 1744 N HIS A 425 12.299 3.055 29.641 1.00 13.51 N ATOM 1745 CA HIS A 425 13.634 3.020 30.257 1.00 13.71 C ATOM 1746 C HIS A 425 13.781 4.045 31.350 1.00 16.35 C ATOM 1747 O HIS A 425 14.611 4.930 31.249 1.00 16.27 O ATOM 1748 CB HIS A 425 14.706 3.339 29.215 1.00 15.97 C ATOM 1749 CG HIS A 425 14.695 2.410 28.035 1.00 13.19 C ATOM 1750 ND1 HIS A 425 15.591 1.374 27.890 1.00 15.67 N ATOM 1751 CD2 HIS A 425 13.908 2.388 26.921 1.00 19.40 C ATOM 1752 CE1 HIS A 425 15.334 0.727 26.764 1.00 19.13 C ATOM 1753 NE2 HIS A 425 14.327 1.333 26.146 1.00 16.13 N ATOM 0 H HIS A 425 12.029 3.844 29.432 1.00 13.51 H new ATOM 0 HA HIS A 425 13.740 2.128 30.623 1.00 13.71 H new ATOM 0 HB2 HIS A 425 14.581 4.249 28.902 1.00 15.97 H new ATOM 0 HB3 HIS A 425 15.578 3.302 29.638 1.00 15.97 H new ATOM 0 HD2 HIS A 425 13.216 2.977 26.723 1.00 19.40 H new ATOM 0 HE1 HIS A 425 15.784 -0.027 26.457 1.00 19.13 H new ATOM 0 HE2 HIS A 425 13.993 1.104 25.388 1.00 16.13 H new ATOM 1754 N PRO A 426 13.024 3.894 32.429 1.00 18.75 N ATOM 1755 CA PRO A 426 12.935 4.952 33.466 1.00 20.83 C ATOM 1756 C PRO A 426 14.250 5.014 34.247 1.00 20.88 C ATOM 1757 O PRO A 426 14.542 5.991 34.937 1.00 28.05 O ATOM 1758 CB PRO A 426 11.801 4.453 34.381 1.00 19.09 C ATOM 1759 CG PRO A 426 11.744 2.958 34.139 1.00 24.30 C ATOM 1760 CD PRO A 426 12.204 2.698 32.739 1.00 20.31 C ATOM 0 HA PRO A 426 12.773 5.838 33.105 1.00 20.83 H new ATOM 0 HB2 PRO A 426 11.985 4.653 35.312 1.00 19.09 H new ATOM 0 HB3 PRO A 426 10.957 4.878 34.161 1.00 19.09 H new ATOM 0 HG2 PRO A 426 12.309 2.490 34.774 1.00 24.30 H new ATOM 0 HG3 PRO A 426 10.841 2.628 34.266 1.00 24.30 H new ATOM 0 HD2 PRO A 426 12.723 1.881 32.678 1.00 20.31 H new ATOM 0 HD3 PRO A 426 11.457 2.606 32.127 1.00 20.31 H new ATOM 1761 N GLU A 427 15.073 3.998 34.074 1.00 22.12 N ATOM 1762 CA GLU A 427 16.297 3.888 34.850 1.00 23.46 C ATOM 1763 C GLU A 427 17.491 4.496 34.083 1.00 21.15 C ATOM 1764 O GLU A 427 18.620 4.485 34.571 1.00 23.13 O ATOM 1765 CB GLU A 427 16.534 2.421 35.162 1.00 20.99 C ATOM 1766 CG GLU A 427 17.248 1.651 34.024 1.00 26.85 C ATOM 1767 CD GLU A 427 16.326 1.105 32.910 1.00 34.39 C ATOM 1768 OE1 GLU A 427 15.103 1.317 32.952 1.00 37.42 O ATOM 1769 OE2 GLU A 427 16.854 0.471 31.958 1.00 38.50 O ATOM 0 H GLU A 427 14.944 3.359 33.513 1.00 22.12 H new ATOM 0 HA GLU A 427 16.209 4.386 35.678 1.00 23.46 H new ATOM 0 HB2 GLU A 427 17.065 2.352 35.971 1.00 20.99 H new ATOM 0 HB3 GLU A 427 15.682 1.995 35.345 1.00 20.99 H new ATOM 0 HG2 GLU A 427 17.905 2.239 33.619 1.00 26.85 H new ATOM 0 HG3 GLU A 427 17.734 0.907 34.413 1.00 26.85 H new ATOM 1770 N SER A 428 17.228 5.046 32.906 1.00 17.38 N ATOM 1771 CA SER A 428 18.282 5.651 32.089 1.00 17.25 C ATOM 1772 C SER A 428 17.903 7.048 31.660 1.00 19.64 C ATOM 1773 O SER A 428 17.377 7.229 30.586 1.00 15.91 O ATOM 1774 CB SER A 428 18.500 4.831 30.854 1.00 21.73 C ATOM 1775 OG SER A 428 19.744 5.231 30.278 1.00 34.56 O ATOM 0 H SER A 428 16.443 5.081 32.557 1.00 17.38 H new ATOM 0 HA SER A 428 19.088 5.685 32.627 1.00 17.25 H new ATOM 0 HB2 SER A 428 18.515 3.886 31.072 1.00 21.73 H new ATOM 0 HB3 SER A 428 17.775 4.966 30.224 1.00 21.73 H new ATOM 0 HG SER A 428 19.666 6.000 29.949 1.00 34.56 H new ATOM 1776 N SER A 429 18.162 8.061 32.484 1.00 17.68 N ATOM 1777 CA SER A 429 17.602 9.397 32.222 1.00 19.92 C ATOM 1778 C SER A 429 18.278 10.065 31.010 1.00 18.19 C ATOM 1779 O SER A 429 17.744 11.004 30.381 1.00 17.88 O ATOM 1780 CB SER A 429 17.816 10.309 33.431 1.00 20.16 C ATOM 1781 OG SER A 429 19.204 10.531 33.639 1.00 21.03 O ATOM 0 H SER A 429 18.650 8.004 33.190 1.00 17.68 H new ATOM 0 HA SER A 429 16.656 9.276 32.043 1.00 19.92 H new ATOM 0 HB2 SER A 429 17.364 11.156 33.290 1.00 20.16 H new ATOM 0 HB3 SER A 429 17.424 9.906 34.222 1.00 20.16 H new ATOM 0 HG SER A 429 19.311 11.034 34.303 1.00 21.03 H new ATOM 1782 N GLN A 430 19.447 9.588 30.660 1.00 16.61 N ATOM 1783 CA GLN A 430 20.169 10.220 29.529 1.00 17.97 C ATOM 1784 C GLN A 430 19.993 9.515 28.175 1.00 19.93 C ATOM 1785 O GLN A 430 20.766 9.749 27.260 1.00 19.32 O ATOM 1786 CB GLN A 430 21.645 10.333 29.868 1.00 20.17 C ATOM 1787 CG GLN A 430 21.883 11.217 31.113 1.00 16.67 C ATOM 1788 CD GLN A 430 21.293 12.596 30.928 1.00 17.20 C ATOM 1789 OE1 GLN A 430 21.625 13.321 29.969 1.00 23.01 O ATOM 1790 NE2 GLN A 430 20.360 12.941 31.770 1.00 19.05 N ATOM 0 H GLN A 430 19.847 8.925 31.034 1.00 16.61 H new ATOM 0 HA GLN A 430 19.768 11.096 29.416 1.00 17.97 H new ATOM 0 HB2 GLN A 430 22.009 9.448 30.026 1.00 20.17 H new ATOM 0 HB3 GLN A 430 22.123 10.706 29.111 1.00 20.17 H new ATOM 0 HG2 GLN A 430 21.487 10.796 31.892 1.00 16.67 H new ATOM 0 HG3 GLN A 430 22.835 11.290 31.283 1.00 16.67 H new ATOM 0 HE21 GLN A 430 20.154 12.419 32.421 1.00 19.05 H new ATOM 0 HE22 GLN A 430 19.950 13.691 31.674 1.00 19.05 H new ATOM 1791 N LEU A 431 19.001 8.644 28.063 1.00 14.07 N ATOM 1792 CA LEU A 431 18.996 7.718 26.936 1.00 18.62 C ATOM 1793 C LEU A 431 18.550 8.466 25.686 1.00 20.85 C ATOM 1794 O LEU A 431 19.124 8.248 24.620 1.00 17.47 O ATOM 1795 CB LEU A 431 18.149 6.482 27.218 1.00 17.43 C ATOM 1796 CG LEU A 431 17.970 5.517 26.046 1.00 21.44 C ATOM 1797 CD1 LEU A 431 19.263 4.833 25.684 1.00 17.46 C ATOM 1798 CD2 LEU A 431 16.952 4.513 26.541 1.00 17.34 C ATOM 0 H LEU A 431 18.340 8.571 28.608 1.00 14.07 H new ATOM 0 HA LEU A 431 19.895 7.383 26.790 1.00 18.62 H new ATOM 0 HB2 LEU A 431 18.550 5.997 27.956 1.00 17.43 H new ATOM 0 HB3 LEU A 431 17.272 6.772 27.513 1.00 17.43 H new ATOM 0 HG LEU A 431 17.685 5.976 25.240 1.00 21.44 H new ATOM 0 HD11 LEU A 431 19.113 4.230 24.939 1.00 17.46 H new ATOM 0 HD12 LEU A 431 19.922 5.499 25.433 1.00 17.46 H new ATOM 0 HD13 LEU A 431 19.587 4.329 26.447 1.00 17.46 H new ATOM 0 HD21 LEU A 431 16.780 3.857 25.847 1.00 17.34 H new ATOM 0 HD22 LEU A 431 17.295 4.066 27.330 1.00 17.34 H new ATOM 0 HD23 LEU A 431 16.127 4.972 26.763 1.00 17.34 H new ATOM 1799 N PHE A 432 17.563 9.362 25.806 1.00 16.82 N ATOM 1800 CA PHE A 432 17.148 10.198 24.676 1.00 19.12 C ATOM 1801 C PHE A 432 18.368 10.902 24.067 1.00 20.49 C ATOM 1802 O PHE A 432 18.582 10.881 22.858 1.00 19.34 O ATOM 1803 CB PHE A 432 16.038 11.152 25.137 1.00 23.00 C ATOM 1804 CG PHE A 432 15.438 12.013 24.053 1.00 26.07 C ATOM 1805 CD1 PHE A 432 14.525 11.498 23.152 1.00 19.60 C ATOM 1806 CD2 PHE A 432 15.782 13.363 23.954 1.00 28.19 C ATOM 1807 CE1 PHE A 432 14.000 12.301 22.157 1.00 23.27 C ATOM 1808 CE2 PHE A 432 15.239 14.164 22.958 1.00 29.55 C ATOM 1809 CZ PHE A 432 14.345 13.628 22.077 1.00 25.56 C ATOM 0 H PHE A 432 17.123 9.500 26.532 1.00 16.82 H new ATOM 0 HA PHE A 432 16.773 9.659 23.963 1.00 19.12 H new ATOM 0 HB2 PHE A 432 15.330 10.628 25.543 1.00 23.00 H new ATOM 0 HB3 PHE A 432 16.395 11.731 25.829 1.00 23.00 H new ATOM 0 HD1 PHE A 432 14.263 10.608 23.216 1.00 19.60 H new ATOM 0 HD2 PHE A 432 16.382 13.730 24.562 1.00 28.19 H new ATOM 0 HE1 PHE A 432 13.408 11.940 21.537 1.00 23.27 H new ATOM 0 HE2 PHE A 432 15.483 15.059 22.892 1.00 29.55 H new ATOM 0 HZ PHE A 432 13.967 14.165 21.418 1.00 25.56 H new ATOM 1810 N ALA A 433 19.191 11.515 24.910 1.00 21.21 N ATOM 1811 CA ALA A 433 20.372 12.223 24.453 1.00 20.16 C ATOM 1812 C ALA A 433 21.314 11.260 23.784 1.00 18.52 C ATOM 1813 O ALA A 433 21.920 11.613 22.786 1.00 19.86 O ATOM 1814 CB ALA A 433 21.094 12.887 25.680 1.00 21.80 C ATOM 0 H ALA A 433 19.078 11.530 25.762 1.00 21.21 H new ATOM 0 HA ALA A 433 20.108 12.909 23.820 1.00 20.16 H new ATOM 0 HB1 ALA A 433 21.883 13.360 25.374 1.00 21.80 H new ATOM 0 HB2 ALA A 433 20.490 13.512 26.112 1.00 21.80 H new ATOM 0 HB3 ALA A 433 21.355 12.200 26.313 1.00 21.80 H new ATOM 1815 N LYS A 434 21.525 10.068 24.351 1.00 18.97 N ATOM 1816 CA LYS A 434 22.391 9.079 23.687 1.00 19.50 C ATOM 1817 C LYS A 434 21.866 8.686 22.307 1.00 19.82 C ATOM 1818 O LYS A 434 22.643 8.476 21.386 1.00 18.77 O ATOM 1819 CB LYS A 434 22.591 7.800 24.535 1.00 18.23 C ATOM 1820 CG LYS A 434 23.450 8.005 25.786 1.00 27.05 C ATOM 1821 CD LYS A 434 23.610 6.723 26.608 1.00 28.83 C ATOM 1822 CE LYS A 434 22.799 6.768 27.884 1.00 40.00 C ATOM 1823 NZ LYS A 434 23.503 6.004 28.944 1.00 50.19 N ATOM 0 H LYS A 434 21.187 9.814 25.100 1.00 18.97 H new ATOM 0 HA LYS A 434 23.249 9.520 23.585 1.00 19.50 H new ATOM 0 HB2 LYS A 434 21.722 7.463 24.803 1.00 18.23 H new ATOM 0 HB3 LYS A 434 23.002 7.118 23.981 1.00 18.23 H new ATOM 0 HG2 LYS A 434 24.326 8.328 25.523 1.00 27.05 H new ATOM 0 HG3 LYS A 434 23.049 8.693 26.340 1.00 27.05 H new ATOM 0 HD2 LYS A 434 23.333 5.961 26.076 1.00 28.83 H new ATOM 0 HD3 LYS A 434 24.546 6.593 26.825 1.00 28.83 H new ATOM 0 HE2 LYS A 434 22.671 7.687 28.165 1.00 40.00 H new ATOM 0 HE3 LYS A 434 21.918 6.392 27.732 1.00 40.00 H new ATOM 0 HZ1 LYS A 434 23.026 6.030 29.695 1.00 50.19 H new ATOM 0 HZ2 LYS A 434 23.602 5.158 28.685 1.00 50.19 H new ATOM 0 HZ3 LYS A 434 24.304 6.365 29.088 1.00 50.19 H new ATOM 1824 N LEU A 435 20.562 8.595 22.173 1.00 18.55 N ATOM 1825 CA LEU A 435 19.945 8.219 20.893 1.00 19.46 C ATOM 1826 C LEU A 435 20.131 9.287 19.852 1.00 20.88 C ATOM 1827 O LEU A 435 20.437 8.986 18.714 1.00 24.08 O ATOM 1828 CB LEU A 435 18.485 7.945 21.093 1.00 19.97 C ATOM 1829 CG LEU A 435 18.251 6.502 21.471 1.00 23.95 C ATOM 1830 CD1 LEU A 435 16.719 6.125 21.378 1.00 25.51 C ATOM 1831 CD2 LEU A 435 19.026 5.659 20.412 1.00 32.10 C ATOM 0 H LEU A 435 20.002 8.745 22.808 1.00 18.55 H new ATOM 0 HA LEU A 435 20.386 7.416 20.574 1.00 19.46 H new ATOM 0 HB2 LEU A 435 18.136 8.525 21.787 1.00 19.97 H new ATOM 0 HB3 LEU A 435 17.999 8.152 20.279 1.00 19.97 H new ATOM 0 HG LEU A 435 18.544 6.339 22.381 1.00 23.95 H new ATOM 0 HD11 LEU A 435 16.599 5.195 21.626 1.00 25.51 H new ATOM 0 HD12 LEU A 435 16.210 6.688 21.982 1.00 25.51 H new ATOM 0 HD13 LEU A 435 16.407 6.260 20.470 1.00 25.51 H new ATOM 0 HD21 LEU A 435 18.913 4.715 20.604 1.00 32.10 H new ATOM 0 HD22 LEU A 435 18.679 5.853 19.527 1.00 32.10 H new ATOM 0 HD23 LEU A 435 19.969 5.884 20.446 1.00 32.10 H new ATOM 1832 N LEU A 436 19.978 10.545 20.225 1.00 21.86 N ATOM 1833 CA LEU A 436 20.244 11.624 19.281 1.00 22.53 C ATOM 1834 C LEU A 436 21.689 11.588 18.874 1.00 25.31 C ATOM 1835 O LEU A 436 21.985 11.819 17.735 1.00 21.97 O ATOM 1836 CB LEU A 436 19.932 12.989 19.888 1.00 23.67 C ATOM 1837 CG LEU A 436 18.492 13.184 20.366 1.00 28.66 C ATOM 1838 CD1 LEU A 436 18.482 14.439 21.245 1.00 35.65 C ATOM 1839 CD2 LEU A 436 17.566 13.380 19.225 1.00 34.73 C ATOM 0 H LEU A 436 19.725 10.797 21.007 1.00 21.86 H new ATOM 0 HA LEU A 436 19.671 11.494 18.510 1.00 22.53 H new ATOM 0 HB2 LEU A 436 20.528 13.135 20.639 1.00 23.67 H new ATOM 0 HB3 LEU A 436 20.133 13.672 19.229 1.00 23.67 H new ATOM 0 HG LEU A 436 18.196 12.398 20.851 1.00 28.66 H new ATOM 0 HD11 LEU A 436 17.582 14.599 21.570 1.00 35.65 H new ATOM 0 HD12 LEU A 436 19.080 14.312 21.998 1.00 35.65 H new ATOM 0 HD13 LEU A 436 18.777 15.202 20.724 1.00 35.65 H new ATOM 0 HD21 LEU A 436 16.663 13.501 19.558 1.00 34.73 H new ATOM 0 HD22 LEU A 436 17.833 14.166 18.723 1.00 34.73 H new ATOM 0 HD23 LEU A 436 17.596 12.602 18.647 1.00 34.73 H new ATOM 1840 N GLN A 437 22.604 11.308 19.801 1.00 25.56 N ATOM 1841 CA GLN A 437 23.971 11.119 19.401 1.00 21.96 C ATOM 1842 C GLN A 437 24.204 9.976 18.426 1.00 23.28 C ATOM 1843 O GLN A 437 24.938 10.127 17.452 1.00 21.79 O ATOM 1844 CB GLN A 437 24.925 11.032 20.601 1.00 28.16 C ATOM 1845 CG GLN A 437 26.346 10.678 20.166 1.00 32.76 C ATOM 1846 CD GLN A 437 27.062 11.871 19.501 1.00 45.47 C ATOM 1847 OE1 GLN A 437 26.774 13.030 19.814 1.00 39.23 O ATOM 1848 NE2 GLN A 437 27.994 11.582 18.573 1.00 46.13 N ATOM 0 H GLN A 437 22.449 11.227 20.643 1.00 25.56 H new ATOM 0 HA GLN A 437 24.181 11.924 18.903 1.00 21.96 H new ATOM 0 HB2 GLN A 437 24.932 11.880 21.072 1.00 28.16 H new ATOM 0 HB3 GLN A 437 24.601 10.364 21.225 1.00 28.16 H new ATOM 0 HG2 GLN A 437 26.856 10.385 20.938 1.00 32.76 H new ATOM 0 HG3 GLN A 437 26.317 9.933 19.546 1.00 32.76 H new ATOM 0 HE21 GLN A 437 28.169 10.762 18.380 1.00 46.13 H new ATOM 0 HE22 GLN A 437 28.414 12.217 18.173 1.00 46.13 H new ATOM 1849 N LYS A 438 23.591 8.828 18.647 1.00 21.55 N ATOM 1850 CA LYS A 438 23.602 7.785 17.615 1.00 22.54 C ATOM 1851 C LYS A 438 23.176 8.255 16.240 1.00 21.26 C ATOM 1852 O LYS A 438 23.765 7.820 15.251 1.00 23.87 O ATOM 1853 CB LYS A 438 22.779 6.566 18.020 1.00 23.37 C ATOM 1854 CG LYS A 438 23.376 5.812 19.162 1.00 20.64 C ATOM 1855 CD LYS A 438 24.838 5.345 18.847 1.00 24.01 C ATOM 1856 CE LYS A 438 25.495 4.866 20.136 1.00 38.53 C ATOM 1857 NZ LYS A 438 26.778 4.194 19.884 1.00 43.88 N ATOM 0 H LYS A 438 23.169 8.626 19.369 1.00 21.55 H new ATOM 0 HA LYS A 438 24.537 7.534 17.546 1.00 22.54 H new ATOM 0 HB2 LYS A 438 21.884 6.852 18.260 1.00 23.37 H new ATOM 0 HB3 LYS A 438 22.692 5.973 17.257 1.00 23.37 H new ATOM 0 HG2 LYS A 438 23.379 6.372 19.954 1.00 20.64 H new ATOM 0 HG3 LYS A 438 22.825 5.039 19.363 1.00 20.64 H new ATOM 0 HD2 LYS A 438 24.827 4.631 18.191 1.00 24.01 H new ATOM 0 HD3 LYS A 438 25.348 6.076 18.463 1.00 24.01 H new ATOM 0 HE2 LYS A 438 25.638 5.623 20.726 1.00 38.53 H new ATOM 0 HE3 LYS A 438 24.897 4.257 20.596 1.00 38.53 H new ATOM 0 HZ1 LYS A 438 27.131 3.929 20.657 1.00 43.88 H new ATOM 0 HZ2 LYS A 438 26.645 3.486 19.361 1.00 43.88 H new ATOM 0 HZ3 LYS A 438 27.336 4.759 19.482 1.00 43.88 H new ATOM 1858 N MET A 439 22.162 9.102 16.125 1.00 20.37 N ATOM 1859 CA MET A 439 21.759 9.606 14.772 1.00 26.52 C ATOM 1860 C MET A 439 22.886 10.366 14.056 1.00 25.75 C ATOM 1861 O MET A 439 23.101 10.219 12.857 1.00 24.68 O ATOM 1862 CB MET A 439 20.508 10.491 14.820 1.00 25.22 C ATOM 1863 CG MET A 439 19.232 9.781 15.227 1.00 28.97 C ATOM 1864 SD MET A 439 17.891 10.942 15.653 1.00 36.31 S ATOM 1865 CE MET A 439 16.732 9.802 16.437 1.00 37.25 C ATOM 0 H MET A 439 21.695 9.401 16.782 1.00 20.37 H new ATOM 0 HA MET A 439 21.556 8.806 14.263 1.00 26.52 H new ATOM 0 HB2 MET A 439 20.668 11.219 15.440 1.00 25.22 H new ATOM 0 HB3 MET A 439 20.376 10.888 13.945 1.00 25.22 H new ATOM 0 HG2 MET A 439 18.940 9.206 14.502 1.00 28.97 H new ATOM 0 HG3 MET A 439 19.413 9.208 15.988 1.00 28.97 H new ATOM 0 HE1 MET A 439 15.965 10.296 16.767 1.00 37.25 H new ATOM 0 HE2 MET A 439 16.437 9.144 15.789 1.00 37.25 H new ATOM 0 HE3 MET A 439 17.170 9.353 17.177 1.00 37.25 H new ATOM 1866 N THR A 440 23.620 11.186 14.792 1.00 25.99 N ATOM 1867 CA THR A 440 24.871 11.780 14.257 1.00 25.34 C ATOM 1868 C THR A 440 25.931 10.774 13.873 1.00 26.79 C ATOM 1869 O THR A 440 26.584 10.923 12.826 1.00 27.45 O ATOM 1870 CB THR A 440 25.479 12.725 15.299 1.00 25.56 C ATOM 1871 OG1 THR A 440 24.452 13.631 15.718 1.00 28.18 O ATOM 1872 CG2 THR A 440 26.651 13.535 14.706 1.00 29.07 C ATOM 0 H THR A 440 23.427 11.419 15.597 1.00 25.99 H new ATOM 0 HA THR A 440 24.607 12.243 13.446 1.00 25.34 H new ATOM 0 HB THR A 440 25.820 12.204 16.042 1.00 25.56 H new ATOM 0 HG1 THR A 440 24.762 14.160 16.292 1.00 28.18 H new ATOM 0 HG21 THR A 440 27.015 14.123 15.386 1.00 29.07 H new ATOM 0 HG22 THR A 440 27.343 12.927 14.400 1.00 29.07 H new ATOM 0 HG23 THR A 440 26.333 14.065 13.958 1.00 29.07 H new ATOM 1873 N ASP A 441 26.185 9.779 14.732 1.00 23.96 N ATOM 1874 CA ASP A 441 27.113 8.724 14.376 1.00 24.69 C ATOM 1875 C ASP A 441 26.696 8.100 13.034 1.00 26.20 C ATOM 1876 O ASP A 441 27.514 7.990 12.111 1.00 33.13 O ATOM 1877 CB ASP A 441 27.253 7.656 15.486 1.00 25.08 C ATOM 1878 CG ASP A 441 27.727 8.247 16.818 1.00 33.94 C ATOM 1879 OD1 ASP A 441 28.171 9.415 16.814 1.00 37.03 O ATOM 1880 OD2 ASP A 441 27.648 7.553 17.873 1.00 37.17 O ATOM 0 H ASP A 441 25.831 9.705 15.512 1.00 23.96 H new ATOM 0 HA ASP A 441 27.994 9.119 14.279 1.00 24.69 H new ATOM 0 HB2 ASP A 441 26.398 7.217 15.617 1.00 25.08 H new ATOM 0 HB3 ASP A 441 27.880 6.975 15.197 1.00 25.08 H new ATOM 1881 N LEU A 442 25.433 7.720 12.902 1.00 25.30 N ATOM 1882 CA LEU A 442 24.949 7.014 11.692 1.00 22.88 C ATOM 1883 C LEU A 442 25.165 7.866 10.438 1.00 24.65 C ATOM 1884 O LEU A 442 25.509 7.338 9.393 1.00 24.07 O ATOM 1885 CB LEU A 442 23.469 6.667 11.812 1.00 24.95 C ATOM 1886 CG LEU A 442 23.035 5.517 12.735 1.00 24.16 C ATOM 1887 CD1 LEU A 442 21.512 5.629 13.075 1.00 16.97 C ATOM 1888 CD2 LEU A 442 23.357 4.193 12.114 1.00 19.55 C ATOM 0 H LEU A 442 24.828 7.856 13.498 1.00 25.30 H new ATOM 0 HA LEU A 442 25.461 6.194 11.614 1.00 22.88 H new ATOM 0 HB2 LEU A 442 23.006 7.467 12.106 1.00 24.95 H new ATOM 0 HB3 LEU A 442 23.145 6.463 10.921 1.00 24.95 H new ATOM 0 HG LEU A 442 23.531 5.584 13.566 1.00 24.16 H new ATOM 0 HD11 LEU A 442 21.256 4.897 13.657 1.00 16.97 H new ATOM 0 HD12 LEU A 442 21.341 6.472 13.523 1.00 16.97 H new ATOM 0 HD13 LEU A 442 20.994 5.587 12.256 1.00 16.97 H new ATOM 0 HD21 LEU A 442 23.077 3.480 12.709 1.00 19.55 H new ATOM 0 HD22 LEU A 442 22.890 4.110 11.268 1.00 19.55 H new ATOM 0 HD23 LEU A 442 24.313 4.130 11.962 1.00 19.55 H new ATOM 1889 N ARG A 443 24.999 9.183 10.540 1.00 26.28 N ATOM 1890 CA ARG A 443 25.311 10.027 9.387 1.00 27.95 C ATOM 1891 C ARG A 443 26.740 9.895 8.995 1.00 28.06 C ATOM 1892 O ARG A 443 27.040 9.818 7.843 1.00 31.82 O ATOM 1893 CB ARG A 443 24.990 11.488 9.620 1.00 27.58 C ATOM 1894 CG ARG A 443 23.526 11.707 9.801 1.00 26.40 C ATOM 1895 CD ARG A 443 23.170 13.181 9.765 1.00 30.77 C ATOM 1896 NE ARG A 443 21.720 13.326 9.644 1.00 33.59 N ATOM 1897 CZ ARG A 443 21.100 14.472 9.388 1.00 44.79 C ATOM 1898 NH1 ARG A 443 21.811 15.576 9.225 1.00 41.96 N ATOM 1899 NH2 ARG A 443 19.773 14.516 9.299 1.00 45.75 N ATOM 0 H ARG A 443 24.718 9.596 11.240 1.00 26.28 H new ATOM 0 HA ARG A 443 24.743 9.710 8.667 1.00 27.95 H new ATOM 0 HB2 ARG A 443 25.464 11.803 10.405 1.00 27.58 H new ATOM 0 HB3 ARG A 443 25.306 12.013 8.868 1.00 27.58 H new ATOM 0 HG2 ARG A 443 23.040 11.239 9.104 1.00 26.40 H new ATOM 0 HG3 ARG A 443 23.244 11.326 10.647 1.00 26.40 H new ATOM 0 HD2 ARG A 443 23.483 13.620 10.572 1.00 30.77 H new ATOM 0 HD3 ARG A 443 23.612 13.613 9.017 1.00 30.77 H new ATOM 0 HE ARG A 443 21.236 12.622 9.745 1.00 33.59 H new ATOM 0 HH11 ARG A 443 22.668 15.548 9.285 1.00 41.96 H new ATOM 0 HH12 ARG A 443 21.416 16.321 9.059 1.00 41.96 H new ATOM 0 HH21 ARG A 443 19.311 13.799 9.408 1.00 45.75 H new ATOM 0 HH22 ARG A 443 19.378 15.261 9.133 1.00 45.75 H new ATOM 1900 N GLN A 444 27.637 9.936 9.962 1.00 28.61 N ATOM 1901 CA GLN A 444 29.031 9.930 9.642 1.00 29.23 C ATOM 1902 C GLN A 444 29.420 8.550 9.099 1.00 28.17 C ATOM 1903 O GLN A 444 30.140 8.461 8.139 1.00 23.53 O ATOM 1904 CB GLN A 444 29.893 10.341 10.854 1.00 29.20 C ATOM 1905 CG GLN A 444 31.372 10.329 10.571 1.00 37.57 C ATOM 1906 CD GLN A 444 31.782 11.156 9.337 1.00 50.59 C ATOM 1907 OE1 GLN A 444 32.776 10.828 8.677 1.00 56.37 O ATOM 1908 NE2 GLN A 444 31.039 12.241 9.037 1.00 50.36 N ATOM 0 H GLN A 444 27.454 9.967 10.802 1.00 28.61 H new ATOM 0 HA GLN A 444 29.202 10.592 8.954 1.00 29.23 H new ATOM 0 HB2 GLN A 444 29.633 11.231 11.140 1.00 29.20 H new ATOM 0 HB3 GLN A 444 29.707 9.740 11.592 1.00 29.20 H new ATOM 0 HG2 GLN A 444 31.843 10.669 11.348 1.00 37.57 H new ATOM 0 HG3 GLN A 444 31.660 9.411 10.444 1.00 37.57 H new ATOM 0 HE21 GLN A 444 30.354 12.439 9.518 1.00 50.36 H new ATOM 0 HE22 GLN A 444 31.250 12.734 8.365 1.00 50.36 H new ATOM 1909 N ILE A 445 28.944 7.483 9.719 1.00 25.96 N ATOM 1910 CA ILE A 445 29.086 6.136 9.146 1.00 28.14 C ATOM 1911 C ILE A 445 28.625 6.042 7.680 1.00 27.81 C ATOM 1912 O ILE A 445 29.346 5.492 6.841 1.00 31.35 O ATOM 1913 CB ILE A 445 28.336 5.064 9.987 1.00 28.43 C ATOM 1914 CG1 ILE A 445 29.016 4.835 11.329 1.00 32.63 C ATOM 1915 CG2 ILE A 445 28.272 3.730 9.257 1.00 32.61 C ATOM 1916 CD1 ILE A 445 28.035 4.210 12.345 1.00 37.98 C ATOM 0 H ILE A 445 28.533 7.508 10.474 1.00 25.96 H new ATOM 0 HA ILE A 445 30.039 5.956 9.170 1.00 28.14 H new ATOM 0 HB ILE A 445 27.439 5.406 10.127 1.00 28.43 H new ATOM 0 HG12 ILE A 445 29.782 4.251 11.212 1.00 32.63 H new ATOM 0 HG13 ILE A 445 29.351 5.677 11.674 1.00 32.63 H new ATOM 0 HG21 ILE A 445 27.800 3.083 9.805 1.00 32.61 H new ATOM 0 HG22 ILE A 445 27.803 3.844 8.415 1.00 32.61 H new ATOM 0 HG23 ILE A 445 29.172 3.412 9.085 1.00 32.61 H new ATOM 0 HD11 ILE A 445 28.489 4.073 13.191 1.00 37.98 H new ATOM 0 HD12 ILE A 445 27.281 4.806 12.476 1.00 37.98 H new ATOM 0 HD13 ILE A 445 27.718 3.358 12.007 1.00 37.98 H new ATOM 1917 N VAL A 446 27.474 6.601 7.334 1.00 27.18 N ATOM 1918 CA VAL A 446 27.006 6.554 5.925 1.00 26.91 C ATOM 1919 C VAL A 446 27.980 7.338 5.023 1.00 29.37 C ATOM 1920 O VAL A 446 28.413 6.870 3.970 1.00 25.56 O ATOM 1921 CB VAL A 446 25.548 7.047 5.786 1.00 27.42 C ATOM 1922 CG1 VAL A 446 25.158 7.259 4.362 1.00 26.98 C ATOM 1923 CG2 VAL A 446 24.593 6.084 6.468 1.00 23.24 C ATOM 0 H VAL A 446 26.947 7.009 7.878 1.00 27.18 H new ATOM 0 HA VAL A 446 27.002 5.630 5.631 1.00 26.91 H new ATOM 0 HB VAL A 446 25.492 7.909 6.227 1.00 27.42 H new ATOM 0 HG11 VAL A 446 24.239 7.567 4.320 1.00 26.98 H new ATOM 0 HG12 VAL A 446 25.740 7.924 3.962 1.00 26.98 H new ATOM 0 HG13 VAL A 446 25.241 6.424 3.876 1.00 26.98 H new ATOM 0 HG21 VAL A 446 23.684 6.407 6.372 1.00 23.24 H new ATOM 0 HG22 VAL A 446 24.669 5.208 6.059 1.00 23.24 H new ATOM 0 HG23 VAL A 446 24.815 6.020 7.410 1.00 23.24 H new ATOM 1924 N THR A 447 28.385 8.506 5.473 1.00 28.18 N ATOM 1925 CA THR A 447 29.343 9.243 4.728 1.00 31.09 C ATOM 1926 C THR A 447 30.546 8.429 4.374 1.00 33.66 C ATOM 1927 O THR A 447 30.858 8.238 3.198 1.00 35.43 O ATOM 1928 CB THR A 447 29.746 10.493 5.484 1.00 31.82 C ATOM 1929 OG1 THR A 447 28.592 11.320 5.572 1.00 33.97 O ATOM 1930 CG2 THR A 447 30.822 11.229 4.746 1.00 36.02 C ATOM 0 H THR A 447 28.115 8.877 6.200 1.00 28.18 H new ATOM 0 HA THR A 447 28.922 9.497 3.892 1.00 31.09 H new ATOM 0 HB THR A 447 30.085 10.259 6.362 1.00 31.82 H new ATOM 0 HG1 THR A 447 28.136 11.094 6.240 1.00 33.97 H new ATOM 0 HG21 THR A 447 31.068 12.025 5.242 1.00 36.02 H new ATOM 0 HG22 THR A 447 31.598 10.656 4.649 1.00 36.02 H new ATOM 0 HG23 THR A 447 30.497 11.483 3.868 1.00 36.02 H new ATOM 1931 N GLU A 448 31.257 7.975 5.391 1.00 32.07 N ATOM 1932 CA GLU A 448 32.310 7.003 5.217 1.00 33.32 C ATOM 1933 C GLU A 448 31.982 5.907 4.207 1.00 33.32 C ATOM 1934 O GLU A 448 32.789 5.613 3.335 1.00 36.26 O ATOM 1935 CB GLU A 448 32.691 6.389 6.563 1.00 33.07 C ATOM 1936 CG GLU A 448 33.799 7.142 7.287 1.00 42.05 C ATOM 1937 CD GLU A 448 33.768 6.987 8.808 1.00 53.45 C ATOM 1938 OE1 GLU A 448 33.264 5.937 9.297 1.00 52.86 O ATOM 1939 OE2 GLU A 448 34.252 7.932 9.504 1.00 45.92 O ATOM 0 H GLU A 448 31.139 8.225 6.205 1.00 32.07 H new ATOM 0 HA GLU A 448 33.065 7.488 4.848 1.00 33.32 H new ATOM 0 HB2 GLU A 448 31.905 6.361 7.131 1.00 33.07 H new ATOM 0 HB3 GLU A 448 32.972 5.471 6.423 1.00 33.07 H new ATOM 0 HG2 GLU A 448 34.657 6.832 6.957 1.00 42.05 H new ATOM 0 HG3 GLU A 448 33.734 8.084 7.066 1.00 42.05 H new ATOM 1940 N HIS A 449 30.850 5.247 4.362 1.00 30.70 N ATOM 1941 CA HIS A 449 30.475 4.148 3.478 1.00 29.98 C ATOM 1942 C HIS A 449 30.363 4.550 1.998 1.00 31.32 C ATOM 1943 O HIS A 449 30.793 3.824 1.100 1.00 30.22 O ATOM 1944 CB HIS A 449 29.147 3.530 3.911 1.00 28.38 C ATOM 1945 CG HIS A 449 28.389 2.892 2.780 1.00 32.98 C ATOM 1946 ND1 HIS A 449 28.779 1.709 2.196 1.00 34.24 N ATOM 1947 CD2 HIS A 449 27.276 3.287 2.114 1.00 32.08 C ATOM 1948 CE1 HIS A 449 27.950 1.398 1.219 1.00 27.80 C ATOM 1949 NE2 HIS A 449 27.027 2.342 1.151 1.00 38.71 N ATOM 0 H HIS A 449 30.275 5.418 4.979 1.00 30.70 H new ATOM 0 HA HIS A 449 31.197 3.505 3.555 1.00 29.98 H new ATOM 0 HB2 HIS A 449 29.316 2.863 4.595 1.00 28.38 H new ATOM 0 HB3 HIS A 449 28.594 4.217 4.315 1.00 28.38 H new ATOM 0 HD1 HIS A 449 29.461 1.242 2.433 1.00 34.24 H new ATOM 0 HD2 HIS A 449 26.776 4.054 2.279 1.00 32.08 H new ATOM 0 HE1 HIS A 449 28.005 0.647 0.674 1.00 27.80 H new ATOM 1950 N VAL A 450 29.738 5.685 1.735 1.00 31.93 N ATOM 1951 CA VAL A 450 29.571 6.157 0.353 1.00 36.14 C ATOM 1952 C VAL A 450 30.926 6.425 -0.320 1.00 39.70 C ATOM 1953 O VAL A 450 31.216 5.912 -1.420 1.00 39.21 O ATOM 1954 CB VAL A 450 28.709 7.404 0.359 1.00 34.70 C ATOM 1955 CG1 VAL A 450 28.933 8.258 -0.869 1.00 39.89 C ATOM 1956 CG2 VAL A 450 27.270 6.990 0.572 1.00 33.30 C ATOM 0 H VAL A 450 29.401 6.202 2.334 1.00 31.93 H new ATOM 0 HA VAL A 450 29.133 5.464 -0.166 1.00 36.14 H new ATOM 0 HB VAL A 450 28.965 7.983 1.094 1.00 34.70 H new ATOM 0 HG11 VAL A 450 28.364 9.043 -0.826 1.00 39.89 H new ATOM 0 HG12 VAL A 450 29.862 8.534 -0.906 1.00 39.89 H new ATOM 0 HG13 VAL A 450 28.716 7.746 -1.664 1.00 39.89 H new ATOM 0 HG21 VAL A 450 26.704 7.778 0.578 1.00 33.30 H new ATOM 0 HG22 VAL A 450 26.993 6.399 -0.146 1.00 33.30 H new ATOM 0 HG23 VAL A 450 27.189 6.527 1.420 1.00 33.30 H new ATOM 1957 N GLN A 451 31.760 7.209 0.363 1.00 39.25 N ATOM 1958 CA GLN A 451 33.122 7.483 -0.068 1.00 41.09 C ATOM 1959 C GLN A 451 33.970 6.223 -0.294 1.00 41.07 C ATOM 1960 O GLN A 451 34.807 6.169 -1.214 1.00 41.04 O ATOM 1961 CB GLN A 451 33.802 8.438 0.913 1.00 43.02 C ATOM 1962 CG GLN A 451 33.282 9.861 0.777 1.00 51.07 C ATOM 1963 CD GLN A 451 33.645 10.751 1.962 1.00 64.06 C ATOM 1964 OE1 GLN A 451 34.345 10.324 2.890 1.00 63.92 O ATOM 1965 NE2 GLN A 451 33.164 12.002 1.935 1.00 68.04 N ATOM 0 H GLN A 451 31.544 7.600 1.098 1.00 39.25 H new ATOM 0 HA GLN A 451 33.055 7.906 -0.938 1.00 41.09 H new ATOM 0 HB2 GLN A 451 33.656 8.127 1.820 1.00 43.02 H new ATOM 0 HB3 GLN A 451 34.760 8.429 0.761 1.00 43.02 H new ATOM 0 HG2 GLN A 451 33.639 10.253 -0.035 1.00 51.07 H new ATOM 0 HG3 GLN A 451 32.317 9.838 0.681 1.00 51.07 H new ATOM 0 HE21 GLN A 451 32.681 12.263 1.273 1.00 68.04 H new ATOM 0 HE22 GLN A 451 33.339 12.544 2.580 1.00 68.04 H new ATOM 1966 N LEU A 452 33.753 5.207 0.526 1.00 37.09 N ATOM 1967 CA LEU A 452 34.459 3.954 0.344 1.00 36.34 C ATOM 1968 C LEU A 452 33.937 3.230 -0.872 1.00 36.26 C ATOM 1969 O LEU A 452 34.710 2.718 -1.671 1.00 36.46 O ATOM 1970 CB LEU A 452 34.299 3.079 1.565 1.00 34.80 C ATOM 1971 CG LEU A 452 35.428 2.125 1.940 1.00 40.55 C ATOM 1972 CD1 LEU A 452 36.420 2.831 2.852 1.00 48.42 C ATOM 1973 CD2 LEU A 452 34.870 0.861 2.604 1.00 41.84 C ATOM 0 H LEU A 452 33.205 5.223 1.189 1.00 37.09 H new ATOM 0 HA LEU A 452 35.400 4.149 0.216 1.00 36.34 H new ATOM 0 HB2 LEU A 452 34.142 3.661 2.325 1.00 34.80 H new ATOM 0 HB3 LEU A 452 33.496 2.549 1.443 1.00 34.80 H new ATOM 0 HG LEU A 452 35.892 1.853 1.133 1.00 40.55 H new ATOM 0 HD11 LEU A 452 37.135 2.220 3.087 1.00 48.42 H new ATOM 0 HD12 LEU A 452 36.791 3.601 2.393 1.00 48.42 H new ATOM 0 HD13 LEU A 452 35.967 3.123 3.658 1.00 48.42 H new ATOM 0 HD21 LEU A 452 35.601 0.267 2.835 1.00 41.84 H new ATOM 0 HD22 LEU A 452 34.385 1.105 3.408 1.00 41.84 H new ATOM 0 HD23 LEU A 452 34.270 0.410 1.989 1.00 41.84 H new ATOM 1974 N LEU A 453 32.621 3.172 -1.016 1.00 34.37 N ATOM 1975 CA LEU A 453 32.042 2.432 -2.118 1.00 36.69 C ATOM 1976 C LEU A 453 32.664 2.967 -3.395 1.00 41.07 C ATOM 1977 O LEU A 453 33.022 2.222 -4.301 1.00 42.87 O ATOM 1978 CB LEU A 453 30.548 2.649 -2.207 1.00 33.04 C ATOM 1979 CG LEU A 453 29.865 1.698 -3.189 1.00 35.68 C ATOM 1980 CD1 LEU A 453 30.535 0.316 -3.135 1.00 28.72 C ATOM 1981 CD2 LEU A 453 28.430 1.591 -2.807 1.00 36.27 C ATOM 0 H LEU A 453 32.054 3.550 -0.492 1.00 34.37 H new ATOM 0 HA LEU A 453 32.210 1.486 -1.987 1.00 36.69 H new ATOM 0 HB2 LEU A 453 30.156 2.534 -1.327 1.00 33.04 H new ATOM 0 HB3 LEU A 453 30.375 3.564 -2.477 1.00 33.04 H new ATOM 0 HG LEU A 453 29.943 2.036 -4.095 1.00 35.68 H new ATOM 0 HD11 LEU A 453 30.096 -0.281 -3.761 1.00 28.72 H new ATOM 0 HD12 LEU A 453 31.472 0.401 -3.372 1.00 28.72 H new ATOM 0 HD13 LEU A 453 30.461 -0.045 -2.238 1.00 28.72 H new ATOM 0 HD21 LEU A 453 27.976 0.991 -3.419 1.00 36.27 H new ATOM 0 HD22 LEU A 453 28.360 1.245 -1.904 1.00 36.27 H new ATOM 0 HD23 LEU A 453 28.017 2.468 -2.849 1.00 36.27 H new ATOM 1982 N GLN A 454 32.767 4.274 -3.473 1.00 43.62 N ATOM 1983 CA GLN A 454 32.995 4.879 -4.751 1.00 48.56 C ATOM 1984 C GLN A 454 34.496 4.830 -5.087 1.00 48.00 C ATOM 1985 O GLN A 454 34.867 4.934 -6.249 1.00 51.03 O ATOM 1986 CB GLN A 454 32.346 6.279 -4.816 1.00 50.62 C ATOM 1987 CG GLN A 454 31.002 6.360 -5.665 1.00 57.66 C ATOM 1988 CD GLN A 454 29.677 6.008 -4.920 1.00 61.32 C ATOM 1989 OE1 GLN A 454 29.554 6.180 -3.705 1.00 63.07 O ATOM 1990 NE2 GLN A 454 28.680 5.533 -5.677 1.00 59.26 N ATOM 0 H GLN A 454 32.709 4.817 -2.809 1.00 43.62 H new ATOM 0 HA GLN A 454 32.555 4.376 -5.454 1.00 48.56 H new ATOM 0 HB2 GLN A 454 32.160 6.576 -3.912 1.00 50.62 H new ATOM 0 HB3 GLN A 454 32.988 6.901 -5.192 1.00 50.62 H new ATOM 0 HG2 GLN A 454 30.921 7.260 -6.017 1.00 57.66 H new ATOM 0 HG3 GLN A 454 31.089 5.764 -6.426 1.00 57.66 H new ATOM 0 HE21 GLN A 454 28.796 5.424 -6.522 1.00 59.26 H new ATOM 0 HE22 GLN A 454 27.923 5.337 -5.318 1.00 59.26 H new ATOM 1991 N VAL A 455 35.352 4.617 -4.086 1.00 47.58 N ATOM 1992 CA VAL A 455 36.764 4.292 -4.335 1.00 48.17 C ATOM 1993 C VAL A 455 37.042 2.784 -4.555 1.00 48.28 C ATOM 1994 O VAL A 455 37.934 2.420 -5.322 1.00 49.65 O ATOM 1995 CB VAL A 455 37.759 4.957 -3.286 1.00 48.58 C ATOM 1996 CG1 VAL A 455 37.653 4.308 -1.923 1.00 50.87 C ATOM 1997 CG2 VAL A 455 39.195 4.852 -3.762 1.00 50.47 C ATOM 0 H VAL A 455 35.137 4.655 -3.254 1.00 47.58 H new ATOM 0 HA VAL A 455 36.958 4.708 -5.189 1.00 48.17 H new ATOM 0 HB VAL A 455 37.503 5.890 -3.212 1.00 48.58 H new ATOM 0 HG11 VAL A 455 38.271 4.737 -1.311 1.00 50.87 H new ATOM 0 HG12 VAL A 455 36.748 4.405 -1.588 1.00 50.87 H new ATOM 0 HG13 VAL A 455 37.872 3.366 -1.995 1.00 50.87 H new ATOM 0 HG21 VAL A 455 39.783 5.263 -3.109 1.00 50.47 H new ATOM 0 HG22 VAL A 455 39.433 3.918 -3.869 1.00 50.47 H new ATOM 0 HG23 VAL A 455 39.288 5.308 -4.613 1.00 50.47 H new ATOM 1998 N ILE A 456 36.279 1.908 -3.909 1.00 46.77 N ATOM 1999 CA ILE A 456 36.426 0.448 -4.089 1.00 44.66 C ATOM 2000 C ILE A 456 35.880 -0.023 -5.444 1.00 45.23 C ATOM 2001 O ILE A 456 36.434 -0.929 -6.072 1.00 42.58 O ATOM 2002 CB ILE A 456 35.720 -0.379 -2.928 1.00 45.76 C ATOM 2003 CG1 ILE A 456 36.462 -0.227 -1.597 1.00 41.96 C ATOM 2004 CG2 ILE A 456 35.696 -1.878 -3.239 1.00 43.39 C ATOM 2005 CD1 ILE A 456 36.412 1.153 -1.025 1.00 52.51 C ATOM 0 H ILE A 456 35.661 2.133 -3.354 1.00 46.77 H new ATOM 0 HA ILE A 456 37.380 0.277 -4.056 1.00 44.66 H new ATOM 0 HB ILE A 456 34.820 -0.024 -2.865 1.00 45.76 H new ATOM 0 HG12 ILE A 456 36.084 -0.847 -0.954 1.00 41.96 H new ATOM 0 HG13 ILE A 456 37.390 -0.481 -1.724 1.00 41.96 H new ATOM 0 HG21 ILE A 456 35.260 -2.352 -2.514 1.00 43.39 H new ATOM 0 HG22 ILE A 456 35.208 -2.030 -4.063 1.00 43.39 H new ATOM 0 HG23 ILE A 456 36.605 -2.203 -3.337 1.00 43.39 H new ATOM 0 HD11 ILE A 456 36.900 1.174 -0.187 1.00 52.51 H new ATOM 0 HD12 ILE A 456 36.815 1.777 -1.649 1.00 52.51 H new ATOM 0 HD13 ILE A 456 35.489 1.405 -0.867 1.00 52.51 H new ATOM 2006 N LYS A 457 34.782 0.577 -5.882 1.00 45.75 N ATOM 2007 CA LYS A 457 34.051 0.069 -7.042 1.00 49.87 C ATOM 2008 C LYS A 457 34.875 0.185 -8.329 1.00 50.48 C ATOM 2009 O LYS A 457 34.633 -0.540 -9.313 1.00 50.32 O ATOM 2010 CB LYS A 457 32.697 0.773 -7.185 1.00 49.07 C ATOM 2011 CG LYS A 457 31.592 -0.176 -7.620 1.00 56.35 C ATOM 2012 CD LYS A 457 30.209 0.397 -7.384 1.00 60.81 C ATOM 2013 CE LYS A 457 29.448 0.454 -8.680 1.00 65.18 C ATOM 2014 NZ LYS A 457 29.360 -0.902 -9.291 1.00 66.34 N ATOM 0 H LYS A 457 34.441 1.280 -5.524 1.00 45.75 H new ATOM 0 HA LYS A 457 33.886 -0.875 -6.893 1.00 49.87 H new ATOM 0 HB2 LYS A 457 32.456 1.179 -6.338 1.00 49.07 H new ATOM 0 HB3 LYS A 457 32.776 1.491 -7.832 1.00 49.07 H new ATOM 0 HG2 LYS A 457 31.698 -0.381 -8.562 1.00 56.35 H new ATOM 0 HG3 LYS A 457 31.679 -1.012 -7.137 1.00 56.35 H new ATOM 0 HD2 LYS A 457 29.729 -0.150 -6.742 1.00 60.81 H new ATOM 0 HD3 LYS A 457 30.280 1.286 -7.002 1.00 60.81 H new ATOM 0 HE2 LYS A 457 28.557 0.803 -8.523 1.00 65.18 H new ATOM 0 HE3 LYS A 457 29.887 1.064 -9.293 1.00 65.18 H new ATOM 0 HZ1 LYS A 457 28.630 -0.953 -9.798 1.00 66.34 H new ATOM 0 HZ2 LYS A 457 30.080 -1.049 -9.793 1.00 66.34 H new ATOM 0 HZ3 LYS A 457 29.317 -1.515 -8.648 1.00 66.34 H new ATOM 2015 N LYS A 458 35.856 1.088 -8.296 1.00 50.95 N ATOM 2016 CA LYS A 458 36.834 1.242 -9.385 1.00 53.81 C ATOM 2017 C LYS A 458 37.823 0.068 -9.517 1.00 53.63 C ATOM 2018 O LYS A 458 38.200 -0.310 -10.624 1.00 56.36 O ATOM 2019 CB LYS A 458 37.633 2.539 -9.215 1.00 53.28 C ATOM 2020 CG LYS A 458 36.891 3.777 -9.633 1.00 54.70 C ATOM 2021 CD LYS A 458 37.501 4.993 -8.984 1.00 59.15 C ATOM 2022 CE LYS A 458 36.718 6.227 -9.385 1.00 67.16 C ATOM 2023 NZ LYS A 458 35.255 6.045 -9.140 1.00 63.43 N ATOM 0 H LYS A 458 35.976 1.632 -7.641 1.00 50.95 H new ATOM 0 HA LYS A 458 36.305 1.264 -10.197 1.00 53.81 H new ATOM 0 HB2 LYS A 458 37.892 2.628 -8.285 1.00 53.28 H new ATOM 0 HB3 LYS A 458 38.451 2.474 -9.732 1.00 53.28 H new ATOM 0 HG2 LYS A 458 36.919 3.869 -10.598 1.00 54.70 H new ATOM 0 HG3 LYS A 458 35.957 3.703 -9.382 1.00 54.70 H new ATOM 0 HD2 LYS A 458 37.495 4.894 -8.019 1.00 59.15 H new ATOM 0 HD3 LYS A 458 38.428 5.085 -9.254 1.00 59.15 H new ATOM 0 HE2 LYS A 458 37.039 6.993 -8.884 1.00 67.16 H new ATOM 0 HE3 LYS A 458 36.870 6.418 -10.324 1.00 67.16 H new ATOM 0 HZ1 LYS A 458 34.850 6.837 -9.158 1.00 63.43 H new ATOM 0 HZ2 LYS A 458 34.911 5.521 -9.772 1.00 63.43 H new ATOM 0 HZ3 LYS A 458 35.132 5.668 -8.343 1.00 63.43 H new ATOM 2024 N THR A 459 38.262 -0.466 -8.383 1.00 50.57 N ATOM 2025 CA THR A 459 38.971 -1.729 -8.324 1.00 49.77 C ATOM 2026 C THR A 459 38.124 -2.950 -8.695 1.00 47.69 C ATOM 2027 O THR A 459 38.590 -3.837 -9.405 1.00 46.10 O ATOM 2028 CB THR A 459 39.520 -1.937 -6.918 1.00 49.97 C ATOM 2029 OG1 THR A 459 40.313 -0.807 -6.571 1.00 51.16 O ATOM 2030 CG2 THR A 459 40.369 -3.206 -6.838 1.00 56.09 C ATOM 0 H THR A 459 38.152 -0.095 -7.615 1.00 50.57 H new ATOM 0 HA THR A 459 39.677 -1.664 -8.986 1.00 49.77 H new ATOM 0 HB THR A 459 38.779 -2.036 -6.300 1.00 49.97 H new ATOM 0 HG1 THR A 459 40.621 -0.908 -5.796 1.00 51.16 H new ATOM 0 HG21 THR A 459 40.705 -3.314 -5.935 1.00 56.09 H new ATOM 0 HG22 THR A 459 39.826 -3.974 -7.075 1.00 56.09 H new ATOM 0 HG23 THR A 459 41.115 -3.136 -7.454 1.00 56.09 H new ATOM 2031 N GLU A 460 36.893 -3.013 -8.202 1.00 44.54 N ATOM 2032 CA GLU A 460 36.139 -4.273 -8.233 1.00 42.61 C ATOM 2033 C GLU A 460 35.068 -4.231 -9.304 1.00 42.84 C ATOM 2034 O GLU A 460 33.862 -4.149 -9.039 1.00 39.55 O ATOM 2035 CB GLU A 460 35.572 -4.616 -6.859 1.00 41.49 C ATOM 2036 CG GLU A 460 36.631 -4.707 -5.766 1.00 37.73 C ATOM 2037 CD GLU A 460 37.493 -5.956 -5.878 1.00 36.69 C ATOM 2038 OE1 GLU A 460 37.044 -6.953 -6.464 1.00 42.42 O ATOM 2039 OE2 GLU A 460 38.625 -5.948 -5.371 1.00 36.72 O ATOM 0 H GLU A 460 36.476 -2.350 -7.848 1.00 44.54 H new ATOM 0 HA GLU A 460 36.751 -4.989 -8.466 1.00 42.61 H new ATOM 0 HB2 GLU A 460 34.919 -3.944 -6.610 1.00 41.49 H new ATOM 0 HB3 GLU A 460 35.101 -5.462 -6.914 1.00 41.49 H new ATOM 0 HG2 GLU A 460 37.200 -3.922 -5.807 1.00 37.73 H new ATOM 0 HG3 GLU A 460 36.196 -4.697 -4.899 1.00 37.73 H new ATOM 2040 N THR A 461 35.552 -4.236 -10.531 1.00 44.60 N ATOM 2041 CA THR A 461 34.812 -4.753 -11.650 1.00 49.22 C ATOM 2042 C THR A 461 34.151 -6.051 -11.158 1.00 51.25 C ATOM 2043 O THR A 461 34.697 -6.739 -10.283 1.00 53.99 O ATOM 2044 CB THR A 461 35.783 -4.998 -12.863 1.00 50.15 C ATOM 2045 OG1 THR A 461 36.305 -6.334 -12.814 1.00 53.35 O ATOM 2046 CG2 THR A 461 36.960 -3.990 -12.826 1.00 46.30 C ATOM 0 H THR A 461 36.331 -3.934 -10.736 1.00 44.60 H new ATOM 0 HA THR A 461 34.134 -4.135 -11.966 1.00 49.22 H new ATOM 0 HB THR A 461 35.282 -4.874 -13.684 1.00 50.15 H new ATOM 0 HG1 THR A 461 36.821 -6.457 -13.465 1.00 53.35 H new ATOM 0 HG21 THR A 461 37.550 -4.153 -13.579 1.00 46.30 H new ATOM 0 HG22 THR A 461 36.613 -3.085 -12.877 1.00 46.30 H new ATOM 0 HG23 THR A 461 37.455 -4.100 -11.999 1.00 46.30 H new ATOM 2047 N ASP A 462 32.966 -6.364 -11.667 1.00 50.07 N ATOM 2048 CA ASP A 462 32.199 -7.482 -11.098 1.00 49.83 C ATOM 2049 C ASP A 462 31.267 -7.064 -9.969 1.00 48.12 C ATOM 2050 O ASP A 462 30.227 -7.664 -9.799 1.00 49.54 O ATOM 2051 CB ASP A 462 33.116 -8.588 -10.595 1.00 49.40 C ATOM 2052 CG ASP A 462 33.535 -9.554 -11.692 1.00 54.49 C ATOM 2053 OD1 ASP A 462 33.152 -9.357 -12.890 1.00 47.11 O ATOM 2054 OD2 ASP A 462 34.255 -10.522 -11.334 1.00 51.79 O ATOM 0 H ASP A 462 32.590 -5.957 -12.325 1.00 50.07 H new ATOM 0 HA ASP A 462 31.653 -7.811 -11.829 1.00 49.83 H new ATOM 0 HB2 ASP A 462 33.908 -8.191 -10.200 1.00 49.40 H new ATOM 0 HB3 ASP A 462 32.665 -9.081 -9.891 1.00 49.40 H new ATOM 2055 N MET A 463 31.654 -6.049 -9.207 1.00 46.23 N ATOM 2056 CA MET A 463 30.757 -5.339 -8.282 1.00 47.17 C ATOM 2057 C MET A 463 29.670 -4.547 -9.055 1.00 47.13 C ATOM 2058 O MET A 463 29.996 -3.638 -9.831 1.00 47.52 O ATOM 2059 CB MET A 463 31.595 -4.350 -7.459 1.00 45.18 C ATOM 2060 CG MET A 463 31.197 -4.225 -6.006 1.00 48.73 C ATOM 2061 SD MET A 463 32.478 -3.538 -4.916 1.00 50.20 S ATOM 2062 CE MET A 463 33.256 -5.072 -4.432 1.00 53.76 C ATOM 0 H MET A 463 32.458 -5.743 -9.208 1.00 46.23 H new ATOM 0 HA MET A 463 30.318 -5.988 -7.711 1.00 47.17 H new ATOM 0 HB2 MET A 463 32.525 -4.621 -7.503 1.00 45.18 H new ATOM 0 HB3 MET A 463 31.535 -3.475 -7.873 1.00 45.18 H new ATOM 0 HG2 MET A 463 30.407 -3.665 -5.948 1.00 48.73 H new ATOM 0 HG3 MET A 463 30.947 -5.102 -5.676 1.00 48.73 H new ATOM 0 HE1 MET A 463 33.990 -4.886 -3.826 1.00 53.76 H new ATOM 0 HE2 MET A 463 32.606 -5.638 -3.987 1.00 53.76 H new ATOM 0 HE3 MET A 463 33.595 -5.526 -5.220 1.00 53.76 H new ATOM 2063 N SER A 464 28.398 -4.881 -8.848 1.00 42.78 N ATOM 2064 CA SER A 464 27.313 -4.194 -9.552 1.00 42.32 C ATOM 2065 C SER A 464 26.234 -3.706 -8.588 1.00 39.37 C ATOM 2066 O SER A 464 25.857 -4.448 -7.682 1.00 41.00 O ATOM 2067 CB SER A 464 26.674 -5.131 -10.568 1.00 44.61 C ATOM 2068 OG SER A 464 25.393 -4.650 -10.963 1.00 50.21 O ATOM 0 H SER A 464 28.141 -5.499 -8.308 1.00 42.78 H new ATOM 0 HA SER A 464 27.700 -3.425 -9.999 1.00 42.32 H new ATOM 0 HB2 SER A 464 27.248 -5.212 -11.346 1.00 44.61 H new ATOM 0 HB3 SER A 464 26.587 -6.018 -10.186 1.00 44.61 H new ATOM 0 HG SER A 464 25.056 -5.177 -11.524 1.00 50.21 H new ATOM 2069 N LEU A 465 25.726 -2.483 -8.784 1.00 33.30 N ATOM 2070 CA LEU A 465 24.636 -1.976 -7.956 1.00 30.82 C ATOM 2071 C LEU A 465 23.277 -2.202 -8.604 1.00 28.86 C ATOM 2072 O LEU A 465 23.095 -1.975 -9.820 1.00 26.45 O ATOM 2073 CB LEU A 465 24.819 -0.485 -7.641 1.00 32.09 C ATOM 2074 CG LEU A 465 26.078 -0.172 -6.838 1.00 36.78 C ATOM 2075 CD1 LEU A 465 26.202 1.312 -6.572 1.00 38.94 C ATOM 2076 CD2 LEU A 465 26.079 -0.983 -5.552 1.00 37.54 C ATOM 0 H LEU A 465 26.000 -1.937 -9.389 1.00 33.30 H new ATOM 0 HA LEU A 465 24.664 -2.477 -7.126 1.00 30.82 H new ATOM 0 HB2 LEU A 465 24.846 0.011 -8.474 1.00 32.09 H new ATOM 0 HB3 LEU A 465 24.045 -0.170 -7.148 1.00 32.09 H new ATOM 0 HG LEU A 465 26.857 -0.426 -7.358 1.00 36.78 H new ATOM 0 HD11 LEU A 465 27.009 1.483 -6.061 1.00 38.94 H new ATOM 0 HD12 LEU A 465 26.246 1.789 -7.415 1.00 38.94 H new ATOM 0 HD13 LEU A 465 25.431 1.616 -6.069 1.00 38.94 H new ATOM 0 HD21 LEU A 465 26.880 -0.782 -5.043 1.00 37.54 H new ATOM 0 HD22 LEU A 465 25.297 -0.756 -5.025 1.00 37.54 H new ATOM 0 HD23 LEU A 465 26.061 -1.929 -5.766 1.00 37.54 H new ATOM 2077 N HIS A 466 22.321 -2.651 -7.789 1.00 23.69 N ATOM 2078 CA HIS A 466 20.956 -2.804 -8.209 1.00 18.66 C ATOM 2079 C HIS A 466 20.561 -1.411 -8.643 1.00 18.20 C ATOM 2080 O HIS A 466 20.994 -0.427 -8.030 1.00 18.96 O ATOM 2081 CB HIS A 466 20.167 -3.297 -6.978 1.00 20.89 C ATOM 2082 CG HIS A 466 18.720 -3.642 -7.233 1.00 17.73 C ATOM 2083 ND1 HIS A 466 17.767 -2.703 -7.526 1.00 20.80 N ATOM 2084 CD2 HIS A 466 18.059 -4.823 -7.162 1.00 17.09 C ATOM 2085 CE1 HIS A 466 16.584 -3.281 -7.657 1.00 17.05 C ATOM 2086 NE2 HIS A 466 16.730 -4.572 -7.433 1.00 20.41 N ATOM 0 H HIS A 466 22.462 -2.874 -6.970 1.00 23.69 H new ATOM 0 HA HIS A 466 20.797 -3.437 -8.927 1.00 18.66 H new ATOM 0 HB2 HIS A 466 20.612 -4.081 -6.620 1.00 20.89 H new ATOM 0 HB3 HIS A 466 20.204 -2.611 -6.293 1.00 20.89 H new ATOM 0 HD2 HIS A 466 18.433 -5.652 -6.966 1.00 17.09 H new ATOM 0 HE1 HIS A 466 15.787 -2.851 -7.870 1.00 17.05 H new ATOM 0 HE2 HIS A 466 16.102 -5.159 -7.453 1.00 20.41 H new ATOM 2087 N PRO A 467 19.708 -1.280 -9.667 1.00 17.14 N ATOM 2088 CA PRO A 467 19.414 0.076 -10.077 1.00 19.07 C ATOM 2089 C PRO A 467 18.703 0.931 -9.036 1.00 21.04 C ATOM 2090 O PRO A 467 18.852 2.149 -9.068 1.00 18.48 O ATOM 2091 CB PRO A 467 18.513 -0.117 -11.318 1.00 20.36 C ATOM 2092 CG PRO A 467 17.929 -1.479 -11.119 1.00 22.90 C ATOM 2093 CD PRO A 467 19.071 -2.274 -10.552 1.00 19.50 C ATOM 0 HA PRO A 467 20.237 0.563 -10.236 1.00 19.07 H new ATOM 0 HB2 PRO A 467 17.823 0.563 -11.368 1.00 20.36 H new ATOM 0 HB3 PRO A 467 19.023 -0.064 -12.141 1.00 20.36 H new ATOM 0 HG2 PRO A 467 17.173 -1.458 -10.512 1.00 22.90 H new ATOM 0 HG3 PRO A 467 17.611 -1.857 -11.954 1.00 22.90 H new ATOM 0 HD2 PRO A 467 18.766 -3.055 -10.064 1.00 19.50 H new ATOM 0 HD3 PRO A 467 19.675 -2.589 -11.242 1.00 19.50 H new ATOM 2094 N LEU A 468 17.862 0.335 -8.181 1.00 19.83 N ATOM 2095 CA LEU A 468 17.299 1.116 -7.084 1.00 17.34 C ATOM 2096 C LEU A 468 18.414 1.782 -6.271 1.00 19.68 C ATOM 2097 O LEU A 468 18.307 2.961 -5.901 1.00 20.30 O ATOM 2098 CB LEU A 468 16.446 0.226 -6.156 1.00 18.40 C ATOM 2099 CG LEU A 468 15.861 0.970 -4.930 1.00 20.53 C ATOM 2100 CD1 LEU A 468 14.966 2.185 -5.259 1.00 21.37 C ATOM 2101 CD2 LEU A 468 15.120 0.017 -4.069 1.00 18.15 C ATOM 0 H LEU A 468 17.615 -0.488 -8.218 1.00 19.83 H new ATOM 0 HA LEU A 468 16.731 1.802 -7.469 1.00 17.34 H new ATOM 0 HB2 LEU A 468 15.717 -0.155 -6.670 1.00 18.40 H new ATOM 0 HB3 LEU A 468 16.990 -0.514 -5.844 1.00 18.40 H new ATOM 0 HG LEU A 468 16.629 1.338 -4.466 1.00 20.53 H new ATOM 0 HD11 LEU A 468 14.647 2.585 -4.435 1.00 21.37 H new ATOM 0 HD12 LEU A 468 15.479 2.839 -5.758 1.00 21.37 H new ATOM 0 HD13 LEU A 468 14.209 1.895 -5.791 1.00 21.37 H new ATOM 0 HD21 LEU A 468 14.756 0.488 -3.303 1.00 18.15 H new ATOM 0 HD22 LEU A 468 14.396 -0.382 -4.576 1.00 18.15 H new ATOM 0 HD23 LEU A 468 15.722 -0.679 -3.763 1.00 18.15 H new ATOM 2102 N LEU A 469 19.474 1.037 -5.972 1.00 21.91 N ATOM 2103 CA LEU A 469 20.595 1.621 -5.226 1.00 24.69 C ATOM 2104 C LEU A 469 21.405 2.616 -6.031 1.00 29.08 C ATOM 2105 O LEU A 469 22.073 3.479 -5.473 1.00 29.15 O ATOM 2106 CB LEU A 469 21.551 0.560 -4.782 1.00 20.35 C ATOM 2107 CG LEU A 469 20.929 -0.495 -3.878 1.00 25.99 C ATOM 2108 CD1 LEU A 469 22.038 -1.362 -3.389 1.00 16.60 C ATOM 2109 CD2 LEU A 469 20.264 0.174 -2.725 1.00 21.83 C ATOM 0 H LEU A 469 19.568 0.209 -6.184 1.00 21.91 H new ATOM 0 HA LEU A 469 20.181 2.076 -4.476 1.00 24.69 H new ATOM 0 HB2 LEU A 469 21.922 0.124 -5.565 1.00 20.35 H new ATOM 0 HB3 LEU A 469 22.290 0.979 -4.314 1.00 20.35 H new ATOM 0 HG LEU A 469 20.267 -1.020 -4.354 1.00 25.99 H new ATOM 0 HD11 LEU A 469 21.679 -2.050 -2.807 1.00 16.60 H new ATOM 0 HD12 LEU A 469 22.481 -1.778 -4.145 1.00 16.60 H new ATOM 0 HD13 LEU A 469 22.677 -0.823 -2.896 1.00 16.60 H new ATOM 0 HD21 LEU A 469 19.867 -0.496 -2.147 1.00 21.83 H new ATOM 0 HD22 LEU A 469 20.920 0.684 -2.224 1.00 21.83 H new ATOM 0 HD23 LEU A 469 19.572 0.770 -3.052 1.00 21.83 H new ATOM 2110 N GLN A 470 21.415 2.456 -7.349 1.00 28.99 N ATOM 2111 CA GLN A 470 22.141 3.407 -8.176 1.00 28.90 C ATOM 2112 C GLN A 470 21.444 4.729 -8.044 1.00 29.13 C ATOM 2113 O GLN A 470 22.104 5.754 -7.888 1.00 28.35 O ATOM 2114 CB GLN A 470 22.143 2.956 -9.635 1.00 27.70 C ATOM 2115 CG GLN A 470 23.001 1.718 -9.872 1.00 32.75 C ATOM 2116 CD GLN A 470 22.970 1.267 -11.322 1.00 44.36 C ATOM 2117 OE1 GLN A 470 23.351 0.142 -11.653 1.00 40.54 O ATOM 2118 NE2 GLN A 470 22.501 2.149 -12.196 1.00 44.88 N ATOM 0 H GLN A 470 21.019 1.822 -7.774 1.00 28.99 H new ATOM 0 HA GLN A 470 23.065 3.472 -7.889 1.00 28.90 H new ATOM 0 HB2 GLN A 470 21.232 2.771 -9.913 1.00 27.70 H new ATOM 0 HB3 GLN A 470 22.468 3.680 -10.192 1.00 27.70 H new ATOM 0 HG2 GLN A 470 23.917 1.907 -9.613 1.00 32.75 H new ATOM 0 HG3 GLN A 470 22.689 0.996 -9.304 1.00 32.75 H new ATOM 0 HE21 GLN A 470 22.244 2.925 -11.928 1.00 44.88 H new ATOM 0 HE22 GLN A 470 22.454 1.945 -13.030 1.00 44.88 H new ATOM 2119 N GLU A 471 20.112 4.742 -8.131 1.00 29.22 N ATOM 2120 CA GLU A 471 19.436 6.040 -8.034 1.00 32.33 C ATOM 2121 C GLU A 471 19.652 6.676 -6.694 1.00 31.58 C ATOM 2122 O GLU A 471 19.861 7.869 -6.618 1.00 34.00 O ATOM 2123 CB GLU A 471 17.958 6.056 -8.439 1.00 36.89 C ATOM 2124 CG GLU A 471 17.101 4.909 -7.973 1.00 38.04 C ATOM 2125 CD GLU A 471 15.709 4.907 -8.611 1.00 33.16 C ATOM 2126 OE1 GLU A 471 15.528 4.600 -9.843 1.00 37.01 O ATOM 2127 OE2 GLU A 471 14.780 5.212 -7.849 1.00 31.93 O ATOM 0 H GLU A 471 19.606 4.055 -8.240 1.00 29.22 H new ATOM 0 HA GLU A 471 19.869 6.582 -8.712 1.00 32.33 H new ATOM 0 HB2 GLU A 471 17.565 6.878 -8.107 1.00 36.89 H new ATOM 0 HB3 GLU A 471 17.913 6.090 -9.407 1.00 36.89 H new ATOM 0 HG2 GLU A 471 17.548 4.073 -8.180 1.00 38.04 H new ATOM 0 HG3 GLU A 471 17.009 4.951 -7.008 1.00 38.04 H new ATOM 2128 N ILE A 472 19.614 5.866 -5.645 1.00 27.63 N ATOM 2129 CA ILE A 472 19.884 6.326 -4.298 1.00 27.76 C ATOM 2130 C ILE A 472 21.251 6.943 -4.176 1.00 28.15 C ATOM 2131 O ILE A 472 21.367 8.058 -3.664 1.00 31.55 O ATOM 2132 CB ILE A 472 19.640 5.226 -3.219 1.00 26.89 C ATOM 2133 CG1 ILE A 472 18.125 5.055 -3.050 1.00 29.04 C ATOM 2134 CG2 ILE A 472 20.221 5.661 -1.858 1.00 25.84 C ATOM 2135 CD1 ILE A 472 17.742 3.791 -2.416 1.00 23.47 C ATOM 0 H ILE A 472 19.429 5.028 -5.698 1.00 27.63 H new ATOM 0 HA ILE A 472 19.237 7.026 -4.118 1.00 27.76 H new ATOM 0 HB ILE A 472 20.067 4.403 -3.502 1.00 26.89 H new ATOM 0 HG12 ILE A 472 17.782 5.791 -2.519 1.00 29.04 H new ATOM 0 HG13 ILE A 472 17.702 5.112 -3.921 1.00 29.04 H new ATOM 0 HG21 ILE A 472 20.060 4.966 -1.200 1.00 25.84 H new ATOM 0 HG22 ILE A 472 21.176 5.808 -1.946 1.00 25.84 H new ATOM 0 HG23 ILE A 472 19.793 6.483 -1.571 1.00 25.84 H new ATOM 0 HD11 ILE A 472 16.776 3.747 -2.340 1.00 23.47 H new ATOM 0 HD12 ILE A 472 18.058 3.049 -2.956 1.00 23.47 H new ATOM 0 HD13 ILE A 472 18.138 3.739 -1.532 1.00 23.47 H new ATOM 2136 N TYR A 473 22.286 6.271 -4.674 1.00 30.65 N ATOM 2137 CA TYR A 473 23.666 6.777 -4.520 1.00 34.01 C ATOM 2138 C TYR A 473 23.952 7.973 -5.376 1.00 36.75 C ATOM 2139 O TYR A 473 24.904 8.674 -5.131 1.00 35.37 O ATOM 2140 CB TYR A 473 24.692 5.720 -4.855 1.00 31.35 C ATOM 2141 CG TYR A 473 24.845 4.683 -3.788 1.00 31.80 C ATOM 2142 CD1 TYR A 473 25.368 5.017 -2.562 1.00 33.49 C ATOM 2143 CD2 TYR A 473 24.493 3.358 -4.014 1.00 34.30 C ATOM 2144 CE1 TYR A 473 25.526 4.066 -1.578 1.00 32.95 C ATOM 2145 CE2 TYR A 473 24.645 2.393 -3.022 1.00 33.39 C ATOM 2146 CZ TYR A 473 25.157 2.770 -1.803 1.00 30.37 C ATOM 2147 OH TYR A 473 25.337 1.850 -0.808 1.00 28.37 O ATOM 0 H TYR A 473 22.221 5.527 -5.101 1.00 30.65 H new ATOM 0 HA TYR A 473 23.732 7.031 -3.586 1.00 34.01 H new ATOM 0 HB2 TYR A 473 24.440 5.286 -5.685 1.00 31.35 H new ATOM 0 HB3 TYR A 473 25.549 6.147 -5.007 1.00 31.35 H new ATOM 0 HD1 TYR A 473 25.619 5.897 -2.394 1.00 33.49 H new ATOM 0 HD2 TYR A 473 24.150 3.111 -4.842 1.00 34.30 H new ATOM 0 HE1 TYR A 473 25.886 4.308 -0.755 1.00 32.95 H new ATOM 0 HE2 TYR A 473 24.404 1.509 -3.181 1.00 33.39 H new ATOM 0 HH TYR A 473 26.022 2.048 -0.364 1.00 28.37 H new ATOM 2148 N LYS A 474 23.127 8.191 -6.397 1.00 41.84 N ATOM 2149 CA LYS A 474 23.430 9.187 -7.396 1.00 47.97 C ATOM 2150 C LYS A 474 23.861 10.538 -6.799 1.00 50.86 C ATOM 2151 O LYS A 474 25.026 10.928 -6.936 1.00 55.60 O ATOM 2152 CB LYS A 474 22.310 9.303 -8.426 1.00 49.54 C ATOM 2153 CG LYS A 474 22.541 10.351 -9.501 1.00 53.35 C ATOM 2154 CD LYS A 474 23.054 9.755 -10.800 1.00 53.79 C ATOM 2155 CE LYS A 474 23.029 10.815 -11.920 1.00 60.32 C ATOM 2156 NZ LYS A 474 21.957 11.856 -11.716 1.00 52.09 N ATOM 0 H LYS A 474 22.388 7.768 -6.522 1.00 41.84 H new ATOM 0 HA LYS A 474 24.214 8.875 -7.875 1.00 47.97 H new ATOM 0 HB2 LYS A 474 22.190 8.440 -8.853 1.00 49.54 H new ATOM 0 HB3 LYS A 474 21.482 9.509 -7.964 1.00 49.54 H new ATOM 0 HG2 LYS A 474 21.711 10.822 -9.672 1.00 53.35 H new ATOM 0 HG3 LYS A 474 23.178 11.007 -9.177 1.00 53.35 H new ATOM 0 HD2 LYS A 474 23.958 9.426 -10.678 1.00 53.79 H new ATOM 0 HD3 LYS A 474 22.507 8.995 -11.053 1.00 53.79 H new ATOM 0 HE2 LYS A 474 23.894 11.252 -11.965 1.00 60.32 H new ATOM 0 HE3 LYS A 474 22.888 10.375 -12.773 1.00 60.32 H new ATOM 0 HZ1 LYS A 474 21.864 12.337 -12.459 1.00 52.09 H new ATOM 0 HZ2 LYS A 474 21.186 11.455 -11.524 1.00 52.09 H new ATOM 0 HZ3 LYS A 474 22.187 12.392 -11.044 1.00 52.09 H new ATOM 2157 N ASP A 475 23.005 11.275 -6.113 1.00 52.52 N ATOM 2158 CA ASP A 475 23.576 12.537 -5.586 1.00 53.27 C ATOM 2159 C ASP A 475 23.853 12.638 -4.077 1.00 52.60 C ATOM 2160 O ASP A 475 23.619 13.673 -3.442 1.00 52.60 O ATOM 2161 CB ASP A 475 22.946 13.783 -6.212 1.00 55.20 C ATOM 2162 CG ASP A 475 23.181 13.857 -7.725 1.00 60.72 C ATOM 2163 OD1 ASP A 475 24.362 13.879 -8.172 1.00 60.71 O ATOM 2164 OD2 ASP A 475 22.172 13.882 -8.474 1.00 68.04 O ATOM 0 H ASP A 475 22.179 11.105 -5.946 1.00 52.52 H new ATOM 0 HA ASP A 475 24.490 12.495 -5.907 1.00 53.27 H new ATOM 0 HB2 ASP A 475 21.992 13.784 -6.035 1.00 55.20 H new ATOM 0 HB3 ASP A 475 23.314 14.575 -5.791 1.00 55.20 H new ATOM 2165 N LEU A 476 24.411 11.553 -3.533 1.00 50.76 N ATOM 2166 CA LEU A 476 24.267 11.199 -2.122 1.00 49.81 C ATOM 2167 C LEU A 476 25.578 11.345 -1.387 1.00 51.97 C ATOM 2168 O LEU A 476 26.599 10.819 -1.833 1.00 49.90 O ATOM 2169 CB LEU A 476 23.854 9.743 -1.968 1.00 47.96 C ATOM 2170 CG LEU A 476 23.500 9.404 -0.524 1.00 41.51 C ATOM 2171 CD1 LEU A 476 22.095 9.874 -0.295 1.00 31.79 C ATOM 2172 CD2 LEU A 476 23.644 7.914 -0.204 1.00 39.91 C ATOM 0 H LEU A 476 24.890 10.996 -3.981 1.00 50.76 H new ATOM 0 HA LEU A 476 23.595 11.796 -1.757 1.00 49.81 H new ATOM 0 HB2 LEU A 476 23.091 9.561 -2.539 1.00 47.96 H new ATOM 0 HB3 LEU A 476 24.576 9.169 -2.267 1.00 47.96 H new ATOM 0 HG LEU A 476 24.122 9.850 0.072 1.00 41.51 H new ATOM 0 HD11 LEU A 476 21.832 9.675 0.617 1.00 31.79 H new ATOM 0 HD12 LEU A 476 22.045 10.831 -0.444 1.00 31.79 H new ATOM 0 HD13 LEU A 476 21.497 9.420 -0.910 1.00 31.79 H new ATOM 0 HD21 LEU A 476 23.407 7.758 0.724 1.00 39.91 H new ATOM 0 HD22 LEU A 476 23.055 7.401 -0.779 1.00 39.91 H new ATOM 0 HD23 LEU A 476 24.562 7.638 -0.354 1.00 39.91 H new ATOM 2173 N TYR A 477 25.534 12.007 -0.229 1.00 56.06 N ATOM 2174 CA TYR A 477 26.758 12.460 0.441 1.00 58.99 C ATOM 2175 C TYR A 477 26.996 12.033 1.904 1.00 59.64 C ATOM 2176 O TYR A 477 26.166 11.359 2.524 1.00 60.21 O ATOM 2177 CB TYR A 477 27.026 13.953 0.143 1.00 60.92 C ATOM 2178 CG TYR A 477 27.183 14.148 -1.357 1.00 61.43 C ATOM 2179 CD1 TYR A 477 28.146 13.425 -2.052 1.00 63.92 C ATOM 2180 CD2 TYR A 477 26.333 14.979 -2.085 1.00 63.31 C ATOM 2181 CE1 TYR A 477 28.293 13.543 -3.403 1.00 61.50 C ATOM 2182 CE2 TYR A 477 26.474 15.101 -3.463 1.00 61.58 C ATOM 2183 CZ TYR A 477 27.463 14.367 -4.105 1.00 60.72 C ATOM 2184 OH TYR A 477 27.649 14.430 -5.460 1.00 64.13 O ATOM 2185 OXT TYR A 477 28.054 12.294 2.495 1.00 60.20 O ATOM 0 H TYR A 477 24.807 12.204 0.186 1.00 56.06 H new ATOM 0 HA TYR A 477 27.460 11.933 0.027 1.00 58.99 H new ATOM 0 HB2 TYR A 477 26.294 14.496 0.475 1.00 60.92 H new ATOM 0 HB3 TYR A 477 27.828 14.246 0.603 1.00 60.92 H new ATOM 0 HD1 TYR A 477 28.704 12.846 -1.584 1.00 63.92 H new ATOM 0 HD2 TYR A 477 25.666 15.456 -1.646 1.00 63.31 H new ATOM 0 HE1 TYR A 477 28.957 13.063 -3.844 1.00 61.50 H new ATOM 0 HE2 TYR A 477 25.915 15.665 -3.947 1.00 61.58 H new ATOM 0 HH TYR A 477 27.091 14.961 -5.795 1.00 64.13 H new TER 2186 TYR A 477 ATOM 2187 N THR B 601 8.992 13.084 -10.693 1.00 56.45 N ATOM 2188 CA THR B 601 9.300 11.649 -10.982 1.00 58.62 C ATOM 2189 C THR B 601 10.821 11.373 -10.982 1.00 58.22 C ATOM 2190 O THR B 601 11.274 10.275 -10.627 1.00 55.99 O ATOM 2191 CB THR B 601 8.589 11.150 -12.305 1.00 58.38 C ATOM 2192 OG1 THR B 601 9.269 11.654 -13.465 1.00 61.90 O ATOM 2193 CG2 THR B 601 7.135 11.612 -12.356 1.00 57.71 C ATOM 0 HA THR B 601 8.929 11.123 -10.256 1.00 58.62 H new ATOM 0 HB THR B 601 8.619 10.180 -12.300 1.00 58.38 H new ATOM 0 HG1 THR B 601 8.882 11.380 -14.158 1.00 61.90 H new ATOM 0 HG21 THR B 601 6.723 11.294 -13.174 1.00 57.71 H new ATOM 0 HG22 THR B 601 6.655 11.255 -11.593 1.00 57.71 H new ATOM 0 HG23 THR B 601 7.102 12.581 -12.333 1.00 57.71 H new ATOM 2194 N GLU B 602 11.595 12.394 -11.362 1.00 57.80 N ATOM 2195 CA GLU B 602 13.058 12.282 -11.541 1.00 56.71 C ATOM 2196 C GLU B 602 13.402 11.405 -12.756 1.00 52.64 C ATOM 2197 O GLU B 602 12.693 11.532 -13.746 1.00 54.00 O ATOM 2198 CB GLU B 602 13.783 11.987 -10.213 1.00 57.49 C ATOM 2199 CG GLU B 602 13.362 12.939 -9.089 1.00 57.66 C ATOM 2200 CD GLU B 602 13.486 14.414 -9.491 1.00 67.04 C ATOM 2201 OE1 GLU B 602 14.446 15.075 -9.054 1.00 66.16 O ATOM 2202 OE2 GLU B 602 12.637 14.918 -10.263 1.00 71.47 O ATOM 0 H GLU B 602 11.287 13.180 -11.526 1.00 57.80 H new ATOM 0 HA GLU B 602 13.430 13.145 -11.783 1.00 56.71 H new ATOM 0 HB2 GLU B 602 13.600 11.073 -9.944 1.00 57.49 H new ATOM 0 HB3 GLU B 602 14.741 12.056 -10.349 1.00 57.49 H new ATOM 0 HG2 GLU B 602 12.444 12.752 -8.837 1.00 57.66 H new ATOM 0 HG3 GLU B 602 13.910 12.773 -8.306 1.00 57.66 H new ATOM 2203 N ARG B 603 14.442 10.562 -12.774 1.00 48.72 N ATOM 2204 CA ARG B 603 15.578 10.503 -11.845 1.00 45.15 C ATOM 2205 C ARG B 603 15.692 9.478 -10.697 1.00 41.18 C ATOM 2206 O ARG B 603 16.752 8.863 -10.474 1.00 38.66 O ATOM 2207 CB ARG B 603 16.470 11.757 -11.771 1.00 48.25 C ATOM 2208 CG ARG B 603 17.931 11.418 -11.488 1.00 53.23 C ATOM 2209 CD ARG B 603 18.839 12.599 -11.805 1.00 62.13 C ATOM 2210 NE ARG B 603 18.233 13.861 -11.386 1.00 67.33 N ATOM 2211 CZ ARG B 603 18.406 14.429 -10.192 1.00 70.88 C ATOM 2212 NH1 ARG B 603 19.183 13.847 -9.280 1.00 71.13 N ATOM 2213 NH2 ARG B 603 17.799 15.586 -9.913 1.00 69.75 N ATOM 0 H ARG B 603 14.505 9.958 -13.383 1.00 48.72 H new ATOM 0 HA ARG B 603 16.002 9.835 -12.406 1.00 45.15 H new ATOM 0 HB2 ARG B 603 16.410 12.243 -12.608 1.00 48.25 H new ATOM 0 HB3 ARG B 603 16.137 12.347 -11.076 1.00 48.25 H new ATOM 0 HG2 ARG B 603 18.034 11.168 -10.556 1.00 53.23 H new ATOM 0 HG3 ARG B 603 18.197 10.650 -12.018 1.00 53.23 H new ATOM 0 HD2 ARG B 603 19.692 12.483 -11.358 1.00 62.13 H new ATOM 0 HD3 ARG B 603 19.019 12.625 -12.758 1.00 62.13 H new ATOM 0 HE ARG B 603 17.728 14.267 -11.951 1.00 67.33 H new ATOM 0 HH11 ARG B 603 19.575 13.103 -9.461 1.00 71.13 H new ATOM 0 HH12 ARG B 603 19.293 14.215 -8.511 1.00 71.13 H new ATOM 0 HH21 ARG B 603 17.299 15.962 -10.503 1.00 69.75 H new ATOM 0 HH22 ARG B 603 17.909 15.955 -9.144 1.00 69.75 H new ATOM 2214 N HIS B 604 14.560 9.277 -10.031 1.00 35.49 N ATOM 2215 CA HIS B 604 14.368 8.251 -9.003 1.00 32.53 C ATOM 2216 C HIS B 604 13.096 7.530 -9.370 1.00 30.73 C ATOM 2217 O HIS B 604 12.106 7.570 -8.630 1.00 30.70 O ATOM 2218 CB HIS B 604 14.241 8.903 -7.619 1.00 32.95 C ATOM 2219 CG HIS B 604 15.536 9.453 -7.090 1.00 30.42 C ATOM 2220 ND1 HIS B 604 15.966 10.737 -7.364 1.00 30.59 N ATOM 2221 CD2 HIS B 604 16.492 8.896 -6.309 1.00 29.28 C ATOM 2222 CE1 HIS B 604 17.139 10.938 -6.792 1.00 33.42 C ATOM 2223 NE2 HIS B 604 17.473 9.842 -6.132 1.00 36.01 N ATOM 0 H HIS B 604 13.855 9.750 -10.168 1.00 35.49 H new ATOM 0 HA HIS B 604 15.120 7.640 -8.962 1.00 32.53 H new ATOM 0 HB2 HIS B 604 13.590 9.620 -7.667 1.00 32.95 H new ATOM 0 HB3 HIS B 604 13.897 8.248 -6.992 1.00 32.95 H new ATOM 0 HD1 HIS B 604 15.537 11.315 -7.834 1.00 30.59 H new ATOM 0 HD2 HIS B 604 16.486 8.035 -5.958 1.00 29.28 H new ATOM 0 HE1 HIS B 604 17.644 11.717 -6.844 1.00 33.42 H new ATOM 2224 N LYS B 605 13.127 6.885 -10.539 1.00 27.51 N ATOM 2225 CA LYS B 605 11.950 6.237 -11.103 1.00 26.92 C ATOM 2226 C LYS B 605 11.415 5.130 -10.220 1.00 23.86 C ATOM 2227 O LYS B 605 10.237 5.110 -9.898 1.00 19.81 O ATOM 2228 CB LYS B 605 12.244 5.670 -12.495 1.00 25.11 C ATOM 2229 CG LYS B 605 12.140 6.728 -13.570 1.00 35.18 C ATOM 2230 CD LYS B 605 12.313 6.106 -14.964 1.00 41.47 C ATOM 2231 CE LYS B 605 13.723 5.557 -15.164 1.00 41.78 C ATOM 2232 NZ LYS B 605 14.582 6.593 -15.838 1.00 45.68 N ATOM 0 H LYS B 605 13.833 6.813 -11.024 1.00 27.51 H new ATOM 0 HA LYS B 605 11.271 6.927 -11.168 1.00 26.92 H new ATOM 0 HB2 LYS B 605 13.135 5.286 -12.505 1.00 25.11 H new ATOM 0 HB3 LYS B 605 11.622 4.951 -12.689 1.00 25.11 H new ATOM 0 HG2 LYS B 605 11.278 7.170 -13.513 1.00 35.18 H new ATOM 0 HG3 LYS B 605 12.817 7.408 -13.428 1.00 35.18 H new ATOM 0 HD2 LYS B 605 11.667 5.392 -15.083 1.00 41.47 H new ATOM 0 HD3 LYS B 605 12.126 6.774 -15.642 1.00 41.47 H new ATOM 0 HE2 LYS B 605 14.108 5.312 -14.308 1.00 41.78 H new ATOM 0 HE3 LYS B 605 13.692 4.751 -15.702 1.00 41.78 H new ATOM 0 HZ1 LYS B 605 14.764 6.333 -16.670 1.00 45.68 H new ATOM 0 HZ2 LYS B 605 14.149 7.370 -15.859 1.00 45.68 H new ATOM 0 HZ3 LYS B 605 15.342 6.689 -15.385 1.00 45.68 H new ATOM 2233 N ILE B 606 12.300 4.225 -9.812 1.00 23.81 N ATOM 2234 CA ILE B 606 11.901 3.125 -8.970 1.00 23.20 C ATOM 2235 C ILE B 606 11.357 3.594 -7.645 1.00 22.86 C ATOM 2236 O ILE B 606 10.265 3.213 -7.274 1.00 23.37 O ATOM 2237 CB ILE B 606 13.016 2.109 -8.791 1.00 24.00 C ATOM 2238 CG1 ILE B 606 13.522 1.651 -10.151 1.00 22.25 C ATOM 2239 CG2 ILE B 606 12.497 0.945 -7.987 1.00 28.43 C ATOM 2240 CD1 ILE B 606 14.903 1.036 -10.119 1.00 20.22 C ATOM 0 H ILE B 606 13.135 4.237 -10.016 1.00 23.81 H new ATOM 0 HA ILE B 606 11.177 2.673 -9.430 1.00 23.20 H new ATOM 0 HB ILE B 606 13.759 2.512 -8.315 1.00 24.00 H new ATOM 0 HG12 ILE B 606 12.898 1.004 -10.517 1.00 22.25 H new ATOM 0 HG13 ILE B 606 13.530 2.410 -10.755 1.00 22.25 H new ATOM 0 HG21 ILE B 606 13.204 0.292 -7.869 1.00 28.43 H new ATOM 0 HG22 ILE B 606 12.199 1.258 -7.119 1.00 28.43 H new ATOM 0 HG23 ILE B 606 11.753 0.534 -8.455 1.00 28.43 H new ATOM 0 HD11 ILE B 606 15.159 0.769 -11.016 1.00 20.22 H new ATOM 0 HD12 ILE B 606 15.539 1.686 -9.781 1.00 20.22 H new ATOM 0 HD13 ILE B 606 14.898 0.258 -9.539 1.00 20.22 H new ATOM 2241 N LEU B 607 12.106 4.456 -6.956 1.00 23.29 N ATOM 2242 CA LEU B 607 11.716 4.979 -5.670 1.00 23.52 C ATOM 2243 C LEU B 607 10.401 5.683 -5.784 1.00 23.01 C ATOM 2244 O LEU B 607 9.517 5.490 -4.932 1.00 25.22 O ATOM 2245 CB LEU B 607 12.742 5.994 -5.165 1.00 23.30 C ATOM 2246 CG LEU B 607 13.617 5.725 -3.958 1.00 29.91 C ATOM 2247 CD1 LEU B 607 14.309 7.007 -3.530 1.00 32.01 C ATOM 2248 CD2 LEU B 607 12.747 5.163 -2.825 1.00 34.95 C ATOM 0 H LEU B 607 12.864 4.751 -7.235 1.00 23.29 H new ATOM 0 HA LEU B 607 11.656 4.233 -5.053 1.00 23.52 H new ATOM 0 HB2 LEU B 607 13.339 6.179 -5.907 1.00 23.30 H new ATOM 0 HB3 LEU B 607 12.256 6.813 -4.980 1.00 23.30 H new ATOM 0 HG LEU B 607 14.301 5.074 -4.180 1.00 29.91 H new ATOM 0 HD11 LEU B 607 14.868 6.831 -2.757 1.00 32.01 H new ATOM 0 HD12 LEU B 607 14.859 7.337 -4.258 1.00 32.01 H new ATOM 0 HD13 LEU B 607 13.643 7.674 -3.301 1.00 32.01 H new ATOM 0 HD21 LEU B 607 13.301 4.988 -2.048 1.00 34.95 H new ATOM 0 HD22 LEU B 607 12.060 5.808 -2.594 1.00 34.95 H new ATOM 0 HD23 LEU B 607 12.329 4.337 -3.116 1.00 34.95 H new ATOM 2249 N HIS B 608 10.239 6.485 -6.839 1.00 22.16 N ATOM 2250 CA HIS B 608 8.943 7.147 -7.081 1.00 25.07 C ATOM 2251 C HIS B 608 7.800 6.148 -7.236 1.00 23.02 C ATOM 2252 O HIS B 608 6.699 6.346 -6.731 1.00 27.18 O ATOM 2253 CB HIS B 608 8.988 8.085 -8.315 1.00 28.23 C ATOM 2254 CG HIS B 608 7.625 8.588 -8.711 1.00 35.34 C ATOM 2255 ND1 HIS B 608 7.201 9.878 -8.457 1.00 46.21 N ATOM 2256 CD2 HIS B 608 6.552 7.940 -9.230 1.00 45.30 C ATOM 2257 CE1 HIS B 608 5.948 10.018 -8.855 1.00 43.52 C ATOM 2258 NE2 HIS B 608 5.524 8.854 -9.315 1.00 51.51 N ATOM 0 H HIS B 608 10.850 6.659 -7.418 1.00 22.16 H new ATOM 0 HA HIS B 608 8.772 7.684 -6.291 1.00 25.07 H new ATOM 0 HB2 HIS B 608 9.564 8.841 -8.121 1.00 28.23 H new ATOM 0 HB3 HIS B 608 9.384 7.611 -9.063 1.00 28.23 H new ATOM 0 HD2 HIS B 608 6.517 7.045 -9.482 1.00 45.30 H new ATOM 0 HE1 HIS B 608 5.450 10.802 -8.818 1.00 43.52 H new ATOM 0 HE2 HIS B 608 4.735 8.693 -9.618 1.00 51.51 H new ATOM 2259 N ARG B 609 8.030 5.056 -7.947 1.00 23.04 N ATOM 2260 CA ARG B 609 6.974 4.034 -8.051 1.00 25.58 C ATOM 2261 C ARG B 609 6.672 3.366 -6.721 1.00 26.26 C ATOM 2262 O ARG B 609 5.528 3.000 -6.495 1.00 27.49 O ATOM 2263 CB ARG B 609 7.330 2.958 -9.079 1.00 24.85 C ATOM 2264 CG ARG B 609 7.125 3.439 -10.493 1.00 31.12 C ATOM 2265 CD ARG B 609 7.237 2.321 -11.525 1.00 32.92 C ATOM 2266 NE ARG B 609 8.605 1.841 -11.721 1.00 25.01 N ATOM 2267 CZ ARG B 609 9.402 2.223 -12.702 1.00 34.73 C ATOM 2268 NH1 ARG B 609 10.620 1.712 -12.788 1.00 26.54 N ATOM 2269 NH2 ARG B 609 8.986 3.115 -13.602 1.00 45.94 N ATOM 0 H ARG B 609 8.760 4.881 -8.367 1.00 23.04 H new ATOM 0 HA ARG B 609 6.180 4.509 -8.341 1.00 25.58 H new ATOM 0 HB2 ARG B 609 8.255 2.691 -8.960 1.00 24.85 H new ATOM 0 HB3 ARG B 609 6.785 2.171 -8.924 1.00 24.85 H new ATOM 0 HG2 ARG B 609 6.251 3.852 -10.565 1.00 31.12 H new ATOM 0 HG3 ARG B 609 7.781 4.125 -10.694 1.00 31.12 H new ATOM 0 HD2 ARG B 609 6.678 1.578 -11.248 1.00 32.92 H new ATOM 0 HD3 ARG B 609 6.889 2.638 -12.373 1.00 32.92 H new ATOM 0 HE ARG B 609 8.912 1.269 -11.157 1.00 25.01 H new ATOM 0 HH11 ARG B 609 10.887 1.136 -12.208 1.00 26.54 H new ATOM 0 HH12 ARG B 609 11.145 1.956 -13.424 1.00 26.54 H new ATOM 0 HH21 ARG B 609 8.194 3.445 -13.546 1.00 45.94 H new ATOM 0 HH22 ARG B 609 9.510 3.360 -14.239 1.00 45.94 H new ATOM 2270 N LEU B 610 7.696 3.163 -5.868 1.00 25.87 N ATOM 2271 CA LEU B 610 7.496 2.523 -4.536 1.00 25.31 C ATOM 2272 C LEU B 610 6.589 3.417 -3.669 1.00 26.61 C ATOM 2273 O LEU B 610 5.760 2.939 -2.861 1.00 24.66 O ATOM 2274 CB LEU B 610 8.846 2.314 -3.797 1.00 24.81 C ATOM 2275 CG LEU B 610 9.874 1.383 -4.472 1.00 18.87 C ATOM 2276 CD1 LEU B 610 11.126 1.252 -3.708 1.00 19.98 C ATOM 2277 CD2 LEU B 610 9.308 0.000 -4.839 1.00 26.78 C ATOM 0 H LEU B 610 8.510 3.385 -6.035 1.00 25.87 H new ATOM 0 HA LEU B 610 7.085 1.656 -4.680 1.00 25.31 H new ATOM 0 HB2 LEU B 610 9.260 3.182 -3.674 1.00 24.81 H new ATOM 0 HB3 LEU B 610 8.655 1.963 -2.913 1.00 24.81 H new ATOM 0 HG LEU B 610 10.088 1.829 -5.306 1.00 18.87 H new ATOM 0 HD11 LEU B 610 11.732 0.658 -4.178 1.00 19.98 H new ATOM 0 HD12 LEU B 610 11.539 2.124 -3.612 1.00 19.98 H new ATOM 0 HD13 LEU B 610 10.933 0.888 -2.830 1.00 19.98 H new ATOM 0 HD21 LEU B 610 10.002 -0.533 -5.258 1.00 26.78 H new ATOM 0 HD22 LEU B 610 8.998 -0.447 -4.036 1.00 26.78 H new ATOM 0 HD23 LEU B 610 8.567 0.107 -5.456 1.00 26.78 H new ATOM 2278 N LEU B 611 6.759 4.712 -3.864 1.00 25.16 N ATOM 2279 CA LEU B 611 6.027 5.738 -3.108 1.00 31.71 C ATOM 2280 C LEU B 611 4.568 5.934 -3.511 1.00 35.59 C ATOM 2281 O LEU B 611 3.756 6.453 -2.722 1.00 35.23 O ATOM 2282 CB LEU B 611 6.781 7.075 -3.140 1.00 28.41 C ATOM 2283 CG LEU B 611 7.904 7.069 -2.107 1.00 31.00 C ATOM 2284 CD1 LEU B 611 8.840 8.225 -2.331 1.00 37.12 C ATOM 2285 CD2 LEU B 611 7.315 7.092 -0.708 1.00 38.84 C ATOM 0 H LEU B 611 7.307 5.034 -4.444 1.00 25.16 H new ATOM 0 HA LEU B 611 5.989 5.396 -2.201 1.00 31.71 H new ATOM 0 HB2 LEU B 611 7.147 7.227 -4.025 1.00 28.41 H new ATOM 0 HB3 LEU B 611 6.168 7.804 -2.958 1.00 28.41 H new ATOM 0 HG LEU B 611 8.422 6.255 -2.206 1.00 31.00 H new ATOM 0 HD11 LEU B 611 9.546 8.204 -1.666 1.00 37.12 H new ATOM 0 HD12 LEU B 611 9.229 8.159 -3.217 1.00 37.12 H new ATOM 0 HD13 LEU B 611 8.349 9.058 -2.255 1.00 37.12 H new ATOM 0 HD21 LEU B 611 8.032 7.088 -0.055 1.00 38.84 H new ATOM 0 HD22 LEU B 611 6.780 7.893 -0.595 1.00 38.84 H new ATOM 0 HD23 LEU B 611 6.756 6.310 -0.579 1.00 38.84 H new ATOM 2286 N GLN B 612 4.237 5.527 -4.730 1.00 39.89 N ATOM 2287 CA GLN B 612 2.852 5.454 -5.137 1.00 46.07 C ATOM 2288 C GLN B 612 2.008 4.899 -4.007 1.00 49.36 C ATOM 2289 O GLN B 612 2.404 3.930 -3.344 1.00 48.46 O ATOM 2290 CB GLN B 612 2.696 4.543 -6.342 1.00 47.43 C ATOM 2291 CG GLN B 612 3.034 5.188 -7.690 1.00 55.53 C ATOM 2292 CD GLN B 612 3.213 6.697 -7.635 1.00 64.00 C ATOM 2293 OE1 GLN B 612 3.592 7.318 -8.637 1.00 71.71 O ATOM 2294 NE2 GLN B 612 2.943 7.296 -6.472 1.00 63.22 N ATOM 0 H GLN B 612 4.803 5.290 -5.333 1.00 39.89 H new ATOM 0 HA GLN B 612 2.560 6.350 -5.366 1.00 46.07 H new ATOM 0 HB2 GLN B 612 3.264 3.766 -6.219 1.00 47.43 H new ATOM 0 HB3 GLN B 612 1.781 4.223 -6.372 1.00 47.43 H new ATOM 0 HG2 GLN B 612 3.849 4.789 -8.032 1.00 55.53 H new ATOM 0 HG3 GLN B 612 2.329 4.979 -8.322 1.00 55.53 H new ATOM 0 HE21 GLN B 612 2.682 6.829 -5.798 1.00 63.22 H new ATOM 0 HE22 GLN B 612 3.030 8.148 -6.397 1.00 63.22 H new ATOM 2295 N GLU B 613 0.834 5.502 -3.799 1.00 53.72 N ATOM 2296 CA GLU B 613 -0.255 4.810 -3.117 1.00 56.03 C ATOM 2297 C GLU B 613 -0.498 3.495 -3.866 1.00 56.58 C ATOM 2298 O GLU B 613 -0.033 3.319 -4.992 1.00 57.58 O ATOM 2299 CB GLU B 613 -1.521 5.676 -3.085 1.00 56.28 C ATOM 2300 CG GLU B 613 -2.475 5.446 -4.259 1.00 64.10 C ATOM 2301 CD GLU B 613 -2.978 6.750 -4.875 1.00 74.74 C ATOM 2302 OE1 GLU B 613 -2.706 7.829 -4.288 1.00 75.88 O ATOM 2303 OE2 GLU B 613 -3.644 6.694 -5.942 1.00 74.32 O ATOM 0 H GLU B 613 0.652 6.306 -4.044 1.00 53.72 H new ATOM 0 HA GLU B 613 -0.020 4.631 -2.193 1.00 56.03 H new ATOM 0 HB2 GLU B 613 -1.997 5.503 -2.257 1.00 56.28 H new ATOM 0 HB3 GLU B 613 -1.260 6.610 -3.073 1.00 56.28 H new ATOM 0 HG2 GLU B 613 -2.023 4.924 -4.940 1.00 64.10 H new ATOM 0 HG3 GLU B 613 -3.233 4.922 -3.957 1.00 64.10 H new ATOM 2304 N GLY B 614 -1.222 2.577 -3.238 1.00 58.55 N ATOM 2305 CA GLY B 614 -0.993 1.159 -3.443 1.00 58.79 C ATOM 2306 C GLY B 614 -0.344 0.585 -2.195 1.00 59.69 C ATOM 2307 O GLY B 614 -0.852 0.786 -1.086 1.00 60.47 O ATOM 0 H GLY B 614 -1.855 2.759 -2.685 1.00 58.55 H new ATOM 0 HA2 GLY B 614 -1.831 0.706 -3.625 1.00 58.79 H new ATOM 0 HA3 GLY B 614 -0.422 1.019 -4.214 1.00 58.79 H new ATOM 2308 N SER B 615 0.797 -0.090 -2.371 1.00 56.70 N ATOM 2309 CA SER B 615 1.080 -1.384 -1.726 1.00 53.77 C ATOM 2310 C SER B 615 1.652 -2.340 -2.782 1.00 50.25 C ATOM 2311 O SER B 615 0.987 -2.620 -3.787 1.00 49.85 O ATOM 2312 CB SER B 615 -0.188 -2.016 -1.147 1.00 53.41 C ATOM 2313 OG SER B 615 -0.708 -1.255 -0.082 1.00 58.39 O ATOM 0 H SER B 615 1.436 0.192 -2.873 1.00 56.70 H new ATOM 0 HA SER B 615 1.707 -1.232 -1.002 1.00 53.77 H new ATOM 0 HB2 SER B 615 -0.857 -2.097 -1.844 1.00 53.41 H new ATOM 0 HB3 SER B 615 0.010 -2.914 -0.838 1.00 53.41 H new ATOM 0 HG SER B 615 -1.232 -0.672 -0.384 1.00 58.39 H new ATOM 2314 N PRO B 616 2.883 -2.834 -2.573 1.00 46.95 N ATOM 2315 CA PRO B 616 3.434 -3.876 -3.467 1.00 43.67 C ATOM 2316 C PRO B 616 2.452 -5.020 -3.751 1.00 40.88 C ATOM 2317 O PRO B 616 1.610 -5.344 -2.909 1.00 41.00 O ATOM 2318 CB PRO B 616 4.652 -4.410 -2.701 1.00 41.96 C ATOM 2319 CG PRO B 616 4.723 -3.633 -1.416 1.00 46.83 C ATOM 2320 CD PRO B 616 3.840 -2.430 -1.531 1.00 45.83 C ATOM 0 HA PRO B 616 3.642 -3.506 -4.339 1.00 43.67 H new ATOM 0 HB2 PRO B 616 4.560 -5.360 -2.526 1.00 41.96 H new ATOM 0 HB3 PRO B 616 5.464 -4.294 -3.219 1.00 41.96 H new ATOM 0 HG2 PRO B 616 4.440 -4.187 -0.672 1.00 46.83 H new ATOM 0 HG3 PRO B 616 5.637 -3.363 -1.237 1.00 46.83 H new ATOM 0 HD2 PRO B 616 3.396 -2.227 -0.693 1.00 45.83 H new ATOM 0 HD3 PRO B 616 4.339 -1.639 -1.787 1.00 45.83 H new ATOM 2321 N SER B 617 2.569 -5.628 -4.927 1.00 38.45 N ATOM 2322 CA SER B 617 1.774 -6.810 -5.289 1.00 37.15 C ATOM 2323 C SER B 617 2.666 -7.850 -5.970 1.00 36.10 C ATOM 2324 O SER B 617 3.853 -7.607 -6.157 1.00 31.81 O ATOM 2325 CB SER B 617 0.687 -6.401 -6.275 1.00 36.90 C ATOM 2326 OG SER B 617 1.274 -5.790 -7.403 1.00 40.56 O ATOM 2327 OXT SER B 617 2.218 -8.927 -6.384 1.00 37.42 O ATOM 0 H SER B 617 3.112 -5.370 -5.542 1.00 38.45 H new ATOM 0 HA SER B 617 1.383 -7.184 -4.484 1.00 37.15 H new ATOM 0 HB2 SER B 617 0.175 -7.179 -6.547 1.00 36.90 H new ATOM 0 HB3 SER B 617 0.067 -5.788 -5.850 1.00 36.90 H new ATOM 0 HG SER B 617 0.673 -5.567 -7.946 1.00 40.56 H new TER 2328 SER B 617 HETATM 2329 O52 NSI A 478 18.630 -12.193 2.243 1.00 24.91 O HETATM 2330 S48 NSI A 478 19.885 -12.841 2.310 1.00 27.50 S HETATM 2331 O50 NSI A 478 19.686 -14.103 2.931 1.00 18.41 O HETATM 2332 C51 NSI A 478 20.380 -12.983 0.768 1.00 36.18 C HETATM 2333 C55 NSI A 478 20.017 -12.019 -0.192 1.00 36.88 C HETATM 2334 C56 NSI A 478 20.452 -12.156 -1.511 1.00 43.01 C HETATM 2335 C53 NSI A 478 21.259 -13.239 -1.910 1.00 39.84 C HETATM 2336 C57 NSI A 478 21.634 -14.185 -0.955 1.00 34.36 C HETATM 2337 C54 NSI A 478 21.188 -14.043 0.365 1.00 36.99 C HETATM 2338 N17 NSI A 478 21.021 -12.012 2.934 1.00 26.71 N HETATM 2339 C15 NSI A 478 21.254 -11.907 4.226 1.00 26.60 C HETATM 2340 O16 NSI A 478 20.315 -11.837 5.030 1.00 25.36 O HETATM 2341 C13 NSI A 478 22.562 -11.306 4.619 1.00 22.01 C HETATM 2342 N10 NSI A 478 22.743 -10.394 5.612 1.00 20.77 N HETATM 2343 C12 NSI A 478 21.653 -9.738 6.345 1.00 21.49 C HETATM 2344 C34 NSI A 478 21.435 -8.334 5.821 1.00 20.88 C HETATM 2345 C37 NSI A 478 22.153 -7.806 4.766 1.00 23.68 C HETATM 2346 C38 NSI A 478 21.918 -6.488 4.352 1.00 23.63 C HETATM 2347 C36 NSI A 478 20.483 -7.545 6.493 1.00 21.04 C HETATM 2348 C39 NSI A 478 20.224 -6.251 6.064 1.00 25.58 C HETATM 2349 C43 NSI A 478 19.201 -5.421 6.796 1.00 27.36 C HETATM 2350 F47 NSI A 478 18.164 -6.057 7.229 1.00 32.82 F HETATM 2351 F46 NSI A 478 19.716 -4.914 7.850 1.00 29.57 F HETATM 2352 F45 NSI A 478 18.820 -4.430 6.092 1.00 31.11 F HETATM 2353 C35 NSI A 478 20.926 -5.728 4.995 1.00 16.23 C HETATM 2354 C6 NSI A 478 24.048 -10.171 5.760 1.00 15.75 C HETATM 2355 C2 NSI A 478 24.762 -9.355 6.654 1.00 23.73 C HETATM 2356 C5 NSI A 478 26.151 -9.332 6.630 1.00 19.55 C HETATM 2357 C4 NSI A 478 26.820 -10.156 5.732 1.00 20.83 C HETATM 2358 C1 NSI A 478 26.119 -10.999 4.842 1.00 13.65 C HETATM 2359 C7 NSI A 478 23.791 -11.729 4.101 1.00 20.75 C HETATM 2360 C3 NSI A 478 24.721 -10.978 4.837 1.00 23.13 C HETATM 2361 C14 NSI A 478 24.036 -12.715 3.099 1.00 25.97 C HETATM 2362 C20 NSI A 478 24.670 -12.309 1.943 1.00 22.64 C HETATM 2363 C21 NSI A 478 25.056 -13.218 0.946 1.00 22.82 C HETATM 2364 C19 NSI A 478 23.783 -14.103 3.247 1.00 26.39 C HETATM 2365 C22 NSI A 478 24.161 -15.032 2.241 1.00 29.99 C HETATM 2366 C18 NSI A 478 24.818 -14.568 1.078 1.00 30.26 C HETATM 2367 O27 NSI A 478 25.239 -15.393 0.048 1.00 39.86 O HETATM 2368 C28 NSI A 478 25.083 -16.795 0.237 1.00 43.71 C HETATM 0 HN17 NSI A 478 21.543 -11.586 2.399 1.00 26.71 H new HETATM 0 H283 NSI A 478 25.587 -17.075 1.017 1.00 43.71 H new HETATM 0 H282 NSI A 478 24.144 -17.002 0.368 1.00 43.71 H new HETATM 0 H281 NSI A 478 25.411 -17.266 -0.545 1.00 43.71 H new HETATM 0 H122 NSI A 478 20.837 -10.254 6.253 1.00 21.49 H new HETATM 0 H121 NSI A 478 21.864 -9.707 7.291 1.00 21.49 H new HETATM 0 H57 NSI A 478 22.198 -14.934 -1.203 1.00 34.36 H new HETATM 0 H56 NSI A 478 20.193 -11.491 -2.167 1.00 43.01 H new HETATM 0 H55 NSI A 478 19.466 -11.262 0.063 1.00 36.88 H new HETATM 0 H54 NSI A 478 21.451 -14.707 1.022 1.00 36.99 H new HETATM 0 H53 NSI A 478 21.549 -13.326 -2.832 1.00 39.84 H new HETATM 0 H5 NSI A 478 26.645 -8.751 7.229 1.00 19.55 H new HETATM 0 H4 NSI A 478 27.790 -10.152 5.716 1.00 20.83 H new HETATM 0 H38 NSI A 478 22.436 -6.103 3.628 1.00 23.63 H new HETATM 0 H37 NSI A 478 22.819 -8.346 4.312 1.00 23.68 H new HETATM 0 H36 NSI A 478 20.007 -7.906 7.257 1.00 21.04 H new HETATM 0 H35 NSI A 478 20.733 -4.829 4.686 1.00 16.23 H new HETATM 0 H22 NSI A 478 23.970 -15.977 2.351 1.00 29.99 H new HETATM 0 H21 NSI A 478 25.499 -12.889 0.148 1.00 22.82 H new HETATM 0 H20 NSI A 478 24.855 -11.365 1.815 1.00 22.64 H new HETATM 0 H2 NSI A 478 24.282 -8.804 7.292 1.00 23.73 H new HETATM 0 H19 NSI A 478 23.344 -14.424 4.050 1.00 26.39 H new HETATM 0 H1 NSI A 478 26.602 -11.587 4.240 1.00 13.65 H new HETATM 2369 O52 NSI A 479 31.217 0.578 3.173 1.00 55.08 O HETATM 2370 S48 NSI A 479 31.581 -0.805 3.392 1.00 61.65 S HETATM 2371 O50 NSI A 479 32.617 -0.618 4.367 1.00 54.23 O HETATM 2372 C51 NSI A 479 31.986 -1.370 1.928 1.00 60.34 C HETATM 2373 C55 NSI A 479 32.423 -2.696 1.761 1.00 57.84 C HETATM 2374 C56 NSI A 479 32.773 -3.208 0.513 1.00 57.11 C HETATM 2375 C53 NSI A 479 32.666 -2.397 -0.611 1.00 54.75 C HETATM 2376 C57 NSI A 479 32.219 -1.086 -0.464 1.00 56.45 C HETATM 2377 C54 NSI A 479 31.883 -0.568 0.789 1.00 55.61 C HETATM 2378 N17 NSI A 479 30.309 -1.500 3.933 1.00 57.31 N HETATM 2379 C15 NSI A 479 29.343 -2.043 3.139 1.00 48.23 C HETATM 2380 O16 NSI A 479 29.111 -1.569 2.027 1.00 46.00 O HETATM 2381 C13 NSI A 479 28.217 -2.830 3.759 1.00 40.24 C HETATM 2382 N10 NSI A 479 26.984 -2.373 4.090 1.00 38.61 N HETATM 2383 C12 NSI A 479 26.516 -0.986 4.037 1.00 37.93 C HETATM 2384 C34 NSI A 479 25.456 -0.828 2.988 1.00 34.97 C HETATM 2385 C37 NSI A 479 24.215 -0.242 3.231 1.00 39.22 C HETATM 2386 C38 NSI A 479 23.323 -0.125 2.150 1.00 41.47 C HETATM 2387 C36 NSI A 479 25.760 -1.297 1.717 1.00 45.42 C HETATM 2388 C39 NSI A 479 24.872 -1.195 0.652 1.00 43.52 C HETATM 2389 C43 NSI A 479 25.325 -1.715 -0.667 1.00 48.83 C HETATM 2390 F47 NSI A 479 24.457 -1.343 -1.594 1.00 56.71 F HETATM 2391 F46 NSI A 479 25.398 -3.032 -0.643 1.00 59.75 F HETATM 2392 F45 NSI A 479 26.458 -1.183 -1.068 1.00 58.22 F HETATM 2393 C35 NSI A 479 23.631 -0.613 0.868 1.00 42.38 C HETATM 2394 C6 NSI A 479 26.236 -3.387 4.527 1.00 40.25 C HETATM 2395 C2 NSI A 479 24.919 -3.452 4.991 1.00 36.78 C HETATM 2396 C5 NSI A 479 24.388 -4.689 5.382 1.00 40.60 C HETATM 2397 C4 NSI A 479 25.170 -5.833 5.330 1.00 37.22 C HETATM 2398 C1 NSI A 479 26.481 -5.777 4.867 1.00 32.14 C HETATM 2399 C7 NSI A 479 28.279 -4.218 3.961 1.00 41.97 C HETATM 2400 C3 NSI A 479 27.011 -4.546 4.465 1.00 41.93 C HETATM 2401 C14 NSI A 479 29.196 -5.125 3.405 1.00 45.08 C HETATM 2402 C20 NSI A 479 28.735 -6.254 2.731 1.00 46.11 C HETATM 2403 C21 NSI A 479 29.602 -7.282 2.367 1.00 44.57 C HETATM 2404 C19 NSI A 479 30.549 -5.029 3.717 1.00 45.91 C HETATM 2405 C22 NSI A 479 31.430 -6.052 3.349 1.00 50.85 C HETATM 2406 C18 NSI A 479 30.963 -7.179 2.672 1.00 49.66 C HETATM 2407 O27 NSI A 479 31.854 -8.181 2.326 1.00 50.39 O HETATM 2408 C28 NSI A 479 31.807 -8.838 1.059 1.00 47.58 C HETATM 0 HN17 NSI A 479 30.205 -1.547 4.785 1.00 57.31 H new HETATM 0 H283 NSI A 479 30.946 -9.271 0.950 1.00 47.58 H new HETATM 0 H282 NSI A 479 31.933 -8.186 0.352 1.00 47.58 H new HETATM 0 H281 NSI A 479 32.511 -9.504 1.013 1.00 47.58 H new HETATM 0 H122 NSI A 479 26.164 -0.725 4.902 1.00 37.93 H new HETATM 0 H121 NSI A 479 27.260 -0.395 3.844 1.00 37.93 H new HETATM 0 H57 NSI A 479 32.139 -0.521 -1.248 1.00 56.45 H new HETATM 0 H56 NSI A 479 33.088 -4.122 0.429 1.00 57.11 H new HETATM 0 H55 NSI A 479 32.483 -3.272 2.539 1.00 57.84 H new HETATM 0 H54 NSI A 479 31.578 0.349 0.868 1.00 55.61 H new HETATM 0 H53 NSI A 479 32.900 -2.740 -1.488 1.00 54.75 H new HETATM 0 H5 NSI A 479 23.470 -4.745 5.690 1.00 40.60 H new HETATM 0 H4 NSI A 479 24.799 -6.681 5.619 1.00 37.22 H new HETATM 0 H38 NSI A 479 22.466 0.307 2.294 1.00 41.47 H new HETATM 0 H37 NSI A 479 23.975 0.074 4.116 1.00 39.22 H new HETATM 0 H36 NSI A 479 26.624 -1.711 1.566 1.00 45.42 H new HETATM 0 H35 NSI A 479 22.987 -0.544 0.146 1.00 42.38 H new HETATM 0 H22 NSI A 479 32.372 -5.977 3.566 1.00 50.85 H new HETATM 0 H21 NSI A 479 29.264 -8.065 1.905 1.00 44.57 H new HETATM 0 H20 NSI A 479 27.793 -6.326 2.511 1.00 46.11 H new HETATM 0 H2 NSI A 479 24.378 -2.649 5.042 1.00 36.78 H new HETATM 0 H19 NSI A 479 30.882 -4.251 4.191 1.00 45.91 H new HETATM 0 H1 NSI A 479 27.021 -6.582 4.823 1.00 32.14 H new HETATM 2409 O HOH A 1 22.191 -7.054 24.687 1.00 60.29 O HETATM 2410 O HOH A 2 26.904 -9.760 21.926 1.00 40.81 O HETATM 2411 O HOH A 3 19.509 -1.239 21.009 1.00 18.00 O HETATM 2412 O HOH A 4 31.162 2.688 15.532 1.00 51.22 O HETATM 2413 O HOH A 5 14.642 -6.326 -7.275 1.00 17.25 O HETATM 2414 O HOH A 6 25.226 -23.896 6.718 1.00 24.98 O HETATM 2415 O HOH A 7 17.880 12.150 27.803 1.00 22.05 O HETATM 2416 O HOH A 8 10.734 16.866 23.248 1.00 51.36 O HETATM 2417 O HOH A 9 20.762 -26.076 10.853 1.00 42.86 O HETATM 2418 O HOH A 10 35.472 -25.438 3.558 1.00 18.90 O HETATM 2419 O HOH A 11 1.714 8.880 5.897 1.00 23.92 O HETATM 2420 O HOH A 12 21.399 7.392 31.365 1.00 22.75 O HETATM 2421 O HOH A 13 25.326 -7.085 20.783 1.00 30.06 O HETATM 2422 O HOH A 14 27.047 -1.094 -11.146 1.00 36.18 O HETATM 2423 O HOH A 15 15.227 -3.741 14.128 1.00 35.17 O HETATM 2424 O HOH A 16 18.367 -11.739 8.552 1.00 27.86 O HETATM 2425 O HOH A 17 5.451 19.138 1.533 1.00 33.03 O HETATM 2426 O HOH A 19 17.039 14.702 11.937 1.00 39.84 O HETATM 2427 O HOH A 20 7.806 18.752 2.685 1.00 28.22 O HETATM 2428 O HOH A 21 6.105 25.689 4.707 1.00 51.27 O HETATM 2429 O HOH A 22 12.560 7.639 35.689 1.00 29.72 O HETATM 2430 O HOH A 23 7.067 -8.087 12.001 1.00 34.72 O HETATM 2431 O HOH A 24 17.057 15.916 -2.978 1.00 52.18 O HETATM 2432 O HOH A 26 7.361 -1.529 26.816 1.00 62.58 O HETATM 2433 O HOH A 27 0.342 13.226 17.903 1.00 49.61 O HETATM 2434 O HOH A 28 -1.561 10.677 17.571 1.00 42.84 O HETATM 2435 O HOH A 29 16.786 7.258 36.147 1.00 20.68 O HETATM 2436 O HOH A 30 20.534 6.821 2.237 1.00 24.84 O HETATM 2437 O HOH A 31 5.016 8.006 23.175 1.00 22.27 O HETATM 2438 O HOH A 32 32.290 -1.775 -10.345 1.00 37.61 O HETATM 2439 O HOH A 34 33.200 -5.651 18.607 1.00 53.55 O HETATM 2440 O HOH A 35 40.146 -15.044 1.876 1.00 27.42 O HETATM 2441 O HOH A 36 36.236 -14.340 -2.721 1.00 27.13 O HETATM 2442 O HOH A 37 31.840 -26.878 7.024 1.00 18.06 O HETATM 2443 O HOH A 39 28.542 -8.672 -11.859 1.00 51.83 O HETATM 2444 O HOH A 40 37.604 -13.813 -0.307 1.00 22.08 O HETATM 2445 O HOH A 41 34.677 -9.076 20.429 1.00 50.33 O HETATM 2446 O HOH A 42 25.232 7.761 22.094 1.00 35.51 O HETATM 2447 O HOH A 43 20.168 -3.483 31.624 1.00 43.04 O HETATM 2448 O HOH A 44 16.200 -21.987 12.134 1.00 48.90 O HETATM 2449 O HOH A 45 20.255 -4.921 22.552 1.00 26.48 O HETATM 2450 O HOH A 46 2.184 1.461 4.534 1.00 45.63 O HETATM 2451 O HOH A 47 33.502 -13.520 21.038 1.00 41.01 O HETATM 2452 O HOH A 48 13.259 17.415 -2.335 1.00 27.51 O HETATM 2453 O HOH A 49 13.806 -12.865 -7.243 1.00 21.40 O HETATM 2454 O HOH A 50 15.103 -6.519 12.939 1.00 36.65 O HETATM 2455 O HOH A 51 13.721 -11.626 22.624 1.00 27.09 O HETATM 2456 O HOH A 52 26.685 2.633 23.863 1.00 44.94 O HETATM 2457 O HOH A 53 40.154 -2.597 3.414 1.00 44.88 O HETATM 2458 O HOH A 54 8.234 -6.915 19.063 1.00 33.40 O HETATM 2459 O HOH A 55 25.627 -1.884 11.941 1.00 54.71 O HETATM 2460 O HOH A 56 17.807 -11.498 5.642 1.00 25.50 O HETATM 2461 O HOH A 60 13.481 14.809 -5.431 1.00 40.12 O HETATM 2462 O HOH A 61 0.774 -5.042 13.451 1.00 37.49 O HETATM 2463 O HOH A 62 7.152 -4.357 3.989 1.00 35.32 O HETATM 2464 O HOH A 63 27.682 7.414 20.779 1.00 50.00 O HETATM 2465 O HOH A 64 26.269 -5.021 22.792 1.00 28.83 O HETATM 2466 O HOH A 65 25.597 13.263 -12.813 1.00 39.97 O HETATM 2467 O HOH A 66 13.178 19.240 14.122 1.00 47.94 O HETATM 2468 O HOH A 70 24.374 -24.740 -10.262 1.00 49.36 O HETATM 2469 O HOH A 71 18.665 -2.140 16.182 1.00 24.24 O HETATM 2470 O HOH A 73 17.646 1.175 29.495 1.00 29.09 O HETATM 2471 O HOH A 74 23.653 -17.260 -11.370 1.00 47.40 O HETATM 2472 O HOH A 75 16.344 -19.598 13.404 1.00 38.24 O HETATM 2473 O HOH A 76 -3.298 6.319 24.108 1.00 39.56 O HETATM 2474 O HOH A 77 23.072 -22.531 15.437 1.00 40.21 O HETATM 2475 O HOH A 78 24.409 -13.479 -3.885 1.00 37.69 O HETATM 2476 O HOH A 79 36.849 -19.123 7.196 1.00 40.02 O HETATM 2477 O HOH A 82 11.373 -5.587 21.472 1.00 35.48 O HETATM 2478 O HOH A 83 18.566 -25.442 8.362 1.00 37.75 O HETATM 2479 O HOH A 84 19.823 2.026 28.036 1.00 35.67 O HETATM 2480 O HOH A 85 2.641 -8.397 11.007 1.00 51.77 O HETATM 2481 O HOH A 86 23.312 9.805 5.566 1.00 42.41 O HETATM 2482 O HOH A 87 1.335 10.276 -1.855 1.00 53.06 O HETATM 2483 O HOH A 89 16.312 3.914 -12.128 1.00 30.31 O HETATM 2484 O HOH A 90 17.361 -22.456 9.836 1.00 32.37 O HETATM 2485 O HOH A 91 23.865 -12.629 21.858 1.00 36.77 O HETATM 2486 O HOH A 92 7.893 -0.982 -1.210 1.00 36.92 O HETATM 2487 O HOH A 93 30.552 13.036 1.470 1.00 48.37 O HETATM 2488 O HOH A 94 21.825 -10.989 -5.592 1.00 44.68 O HETATM 2489 O HOH A 95 25.089 -15.241 -12.792 1.00 59.84 O HETATM 2490 O HOH A 96 26.710 1.917 -10.543 1.00 49.86 O HETATM 2491 O HOH A 98 22.237 17.435 11.694 1.00 58.02 O HETATM 2492 O HOH A 99 18.937 12.273 11.497 1.00 48.09 O HETATM 2493 O HOH A 100 25.341 10.843 5.439 1.00 31.05 O HETATM 2494 O HOH A 101 19.605 -2.460 18.714 1.00 19.03 O HETATM 2495 O HOH A 102 13.202 -6.741 -4.910 1.00 21.68 O HETATM 2496 O HOH A 103 32.423 1.780 13.610 1.00 51.24 O HETATM 2497 O HOH A 104 23.023 -5.208 25.911 1.00 53.57 O HETATM 2498 O HOH A 105 15.998 -9.998 8.304 1.00 38.88 O HETATM 2499 O HOH A 106 22.647 -25.621 12.600 1.00 54.83 O HETATM 2500 O HOH A 107 24.174 -5.575 24.149 1.00 38.20 O HETATM 2501 O HOH A 108 24.071 -8.307 25.266 1.00 44.60 O HETATM 2502 O HOH A 111 8.979 24.571 0.700 1.00 52.44 O HETATM 2503 O HOH A 113 18.231 -28.813 6.794 1.00 44.98 O HETATM 2504 O HOH A 114 3.407 16.032 -4.791 1.00 43.24 O HETATM 2505 O HOH A 115 9.014 24.076 11.962 1.00 43.88 O HETATM 2506 O HOH A 116 14.248 8.581 32.847 1.00 26.98 O HETATM 2507 O HOH A 117 -2.391 15.989 0.297 1.00 51.74 O HETATM 2508 O HOH A 119 24.674 5.847 -8.875 1.00 31.63 O HETATM 2509 O HOH A 122 2.144 -3.925 2.210 1.00 42.12 O HETATM 2510 O HOH A 123 18.146 -20.043 18.250 1.00 46.61 O HETATM 2511 O HOH A 125 14.172 -21.945 3.753 1.00 48.22 O HETATM 2512 O HOH A 126 14.708 -18.084 2.937 1.00 51.82 O HETATM 2513 O HOH A 127 9.106 25.746 4.650 1.00 51.87 O HETATM 2514 O HOH A 128 15.896 -12.922 3.101 1.00 39.27 O HETATM 2515 O HOH A 130 2.434 2.961 23.336 1.00 38.60 O HETATM 2516 O HOH A 131 28.598 13.547 8.489 1.00 45.40 O HETATM 2517 O HOH A 132 15.767 14.195 -5.851 1.00 46.10 O HETATM 2518 O HOH A 133 14.112 -18.191 -12.017 1.00 38.48 O HETATM 2519 O HOH A 134 10.558 10.870 36.084 1.00 34.30 O HETATM 2520 O HOH A 135 6.515 -3.208 23.225 1.00 41.67 O HETATM 2521 O HOH A 136 23.634 -7.816 22.595 1.00 54.11 O HETATM 2522 O HOH A 137 12.375 -20.623 4.416 1.00 40.19 O HETATM 2523 O HOH A 139 8.925 -3.760 22.089 1.00 25.63 O HETATM 2524 O HOH A 140 33.014 -15.270 14.779 1.00 24.56 O HETATM 2525 O HOH A 141 19.997 2.152 -13.867 1.00 34.99 O HETATM 2526 O HOH B 38 9.914 8.178 -15.152 1.00 43.58 O HETATM 2527 O HOH B 57 1.982 6.493 -0.673 1.00 52.92 O HETATM 2528 O HOH B 120 1.226 1.120 1.014 1.00 47.38 O HETATM 2529 O HOH B 124 16.546 6.349 -13.436 1.00 39.08 O HETATM 2530 O HOH B 129 7.955 6.639 -11.187 1.00 36.96 O CONECT 2329 2330 CONECT 2330 2329 2331 2332 2338 CONECT 2331 2330 CONECT 2332 2330 2333 2337 CONECT 2333 2332 2334 CONECT 2334 2333 2335 CONECT 2335 2334 2336 CONECT 2336 2335 2337 CONECT 2337 2332 2336 CONECT 2338 2330 2339 CONECT 2339 2338 2340 2341 CONECT 2340 2339 CONECT 2341 2339 2342 2359 CONECT 2342 2341 2343 2354 CONECT 2343 2342 2344 CONECT 2344 2343 2345 2347 CONECT 2345 2344 2346 CONECT 2346 2345 2353 CONECT 2347 2344 2348 CONECT 2348 2347 2349 2353 CONECT 2349 2348 2350 2351 2352 CONECT 2350 2349 CONECT 2351 2349 CONECT 2352 2349 CONECT 2353 2346 2348 CONECT 2354 2342 2355 2360 CONECT 2355 2354 2356 CONECT 2356 2355 2357 CONECT 2357 2356 2358 CONECT 2358 2357 2360 CONECT 2359 2341 2360 2361 CONECT 2360 2354 2358 2359 CONECT 2361 2359 2362 2364 CONECT 2362 2361 2363 CONECT 2363 2362 2366 CONECT 2364 2361 2365 CONECT 2365 2364 2366 CONECT 2366 2363 2365 2367 CONECT 2367 2366 2368 CONECT 2368 2367 CONECT 2369 2370 CONECT 2370 2369 2371 2372 2378 CONECT 2371 2370 CONECT 2372 2370 2373 2377 CONECT 2373 2372 2374 CONECT 2374 2373 2375 CONECT 2375 2374 2376 CONECT 2376 2375 2377 CONECT 2377 2372 2376 CONECT 2378 2370 2379 CONECT 2379 2378 2380 2381 CONECT 2380 2379 CONECT 2381 2379 2382 2399 CONECT 2382 2381 2383 2394 CONECT 2383 2382 2384 CONECT 2384 2383 2385 2387 CONECT 2385 2384 2386 CONECT 2386 2385 2393 CONECT 2387 2384 2388 CONECT 2388 2387 2389 2393 CONECT 2389 2388 2390 2391 2392 CONECT 2390 2389 CONECT 2391 2389 CONECT 2392 2389 CONECT 2393 2386 2388 CONECT 2394 2382 2395 2400 CONECT 2395 2394 2396 CONECT 2396 2395 2397 CONECT 2397 2396 2398 CONECT 2398 2397 2400 CONECT 2399 2381 2400 2401 CONECT 2400 2394 2398 2399 CONECT 2401 2399 2402 2404 CONECT 2402 2401 2403 CONECT 2403 2402 2406 CONECT 2404 2401 2405 CONECT 2405 2404 2406 CONECT 2406 2403 2405 2407 CONECT 2407 2406 2408 CONECT 2408 2407 END