USER MOD reduce.3.24.130724 H: found=0, std=0, add=3236, rem=0, adj=119 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER HYDROLASE/PEPTIDE 20-SEP-11 4A1X TITLE CO-COMPLEX STRUCTURE OF NS3-4A PROTEASE WITH THE INHIBITORY TITLE 2 PEPTIDE CP5-46-A (SYNCHROTRON DATA) COMPND MOL_ID: 1; COMPND 2 MOLECULE: NONSTRUCTURAL PROTEIN 4A, SERINE PROTEASE NS3; COMPND 3 CHAIN: A, B; COMPND 4 FRAGMENT: RESIDUES 1678-1690,1028-1206; COMPND 5 SYNONYM: NS3-4A PROTEASE, NS4A, HEPACIVIRIN, NS3P, P70; COMPND 6 EC: 3.4.21.98, 3.6.1.15, 3.6.4.13; COMPND 7 ENGINEERED: YES; COMPND 8 OTHER_DETAILS: FUSION PROTEIN OF 4A (1678-1690) WITH NS3 COMPND 9 (1028-1206); COMPND 0 MOL_ID: 2; COMPND 1 MOLECULE: CP5-46-A PEPTIDE; COMPND 2 CHAIN: C, D; COMPND 3 OTHER_DETAILS: DERIVED FROM PEPTIDE LIBRARY SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HEPATITIS C VIRUS SUBTYPE 1B; SOURCE 3 ORGANISM_TAXID: 31647; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 5 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_VARIANT: ROSETTA2; SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_VECTOR: PET28C; SOURCE 0 OTHER_DETAILS: HCV REPLICON I389/NS3-3'UTR (AJ242654); SOURCE 1 MOL_ID: 2; SOURCE 2 SYNTHETIC: YES; SOURCE 3 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; SOURCE 4 ORGANISM_TAXID: 32630; SOURCE 5 OTHER_DETAILS: DERIVED FROM PEPTIDE LIBRARY KEYWDS HYDROLASE-PEPTIDE COMPLEX, UNMODIFIED INHIBITORY PEPTIDES EXPDTA X-RAY DIFFRACTION AUTHOR S.SCHMELZ,J.KUEGLER,J.COLLINS,D.HEINZ REVDAT 2 05-FEB-14 4A1X 1 SOURCE JRNL REMARK SITE REVDAT 2 2 MASTER REVDAT 1 19-SEP-12 4A1X 0 JRNL AUTH J.KUGLER,S.SCHMELZ,J.GENTZSCH,S.HAID,E.POLLMANN, JRNL AUTH 2 J.VAN DEN HEUVEL,R.FRANKE,T.PIETSCHMANN,D.W.HEINZ,J.COLLINS JRNL TITL HIGH AFFINITY PEPTIDE INHIBITORS OF THE HEPATITIS C VIRUS JRNL TITL 2 NS3-4A PROTEASE REFRACTORY TO COMMON RESISTANT MUTANTS. JRNL REF J.BIOL.CHEM. V. 287 39224 2012 JRNL REFN ISSN 0021-9258 JRNL PMID 22965230 JRNL DOI 10.1074/JBC.M112.393843 REMARK 2 REMARK 2 RESOLUTION. 1.90 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.6.0117 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) : 1.90 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 80.82 REMARK 3 DATA CUTOFF (SIGMA(F)) : NONE REMARK 3 COMPLETENESS FOR RANGE (%) : 80.82 REMARK 3 NUMBER OF REFLECTIONS : 30425 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) : 0.18414 REMARK 3 R VALUE (WORKING SET) : 0.18237 REMARK 3 FREE R VALUE : 0.18237 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.1 REMARK 3 FREE R VALUE TEST SET COUNT : 1619 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) : 1.900 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.949 REMARK 3 REFLECTION IN BIN (WORKING SET) : 2178 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 99.70 REMARK 3 BIN R VALUE (WORKING SET) : 0.256 REMARK 3 BIN FREE R VALUE SET COUNT : 131 REMARK 3 BIN FREE R VALUE : 0.295 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 3189 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 15 REMARK 3 SOLVENT ATOMS : 193 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 30.170 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 28.089 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -0.39 REMARK 3 B22 (A**2) : -0.39 REMARK 3 B33 (A**2) : 0.59 REMARK 3 B12 (A**2) : -0.20 REMARK 3 B13 (A**2) : 0.00 REMARK 3 B23 (A**2) : 0.00 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.159 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.140 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.098 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 3.319 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.957 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.942 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 3268 ; 0.008 ; 0.019 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 4478 ; 1.316 ; 1.972 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 449 ; 6.072 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 108 ;23.495 ;21.852 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 500 ;13.704 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 28 ;14.122 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 523 ; 0.089 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 2486 ; 0.006 ; 0.021 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): NULL ; NULL ; NULL 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): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): NULL ; NULL ; NULL 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): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): NULL ; NULL ; NULL 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 : BABINET MODEL WITH MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.20 REMARK 3 ION PROBE RADIUS : 0.8 REMARK 3 SHRINKAGE RADIUS : 0.8 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE REMARK 3 RIDING POSITIONS. REMARK 4 REMARK 4 4A1X COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 20-SEP-11. REMARK 100 THE PDBE ID CODE IS EBI-49722. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 16-JUN-11 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 : BESSY REMARK 200 BEAMLINE : 14.1 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.91841 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD (MX-225) REMARK 200 DETECTOR MANUFACTURER : MARRESEARCH REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XDS REMARK 200 DATA SCALING SOFTWARE : XSCALE REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 32044 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.90 REMARK 200 RESOLUTION RANGE LOW (A) : 80.80 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 2.7 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.6 REMARK 200 DATA REDUNDANCY : 3.7 REMARK 200 R MERGE (I) : 0.07 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 14.60 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.90 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.95 REMARK 200 COMPLETENESS FOR SHELL (%) : 99.7 REMARK 200 DATA REDUNDANCY IN SHELL : 3.7 REMARK 200 R MERGE FOR SHELL (I) : 0.59 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 2.70 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER REMARK 200 STARTING MODEL: PDB ENTRY 1DXP REMARK 200 REMARK 200 REMARK: NONE REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 46.91 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.32 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.1 M MES PH 6.0 OR 0.1 M REMARK 280 NA CITRATE PH 5.1 AND 2.2M KCL, 5% ISOPROPANOL. REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 61 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+1/3 REMARK 290 3555 -X+Y,-X,Z+2/3 REMARK 290 4555 -X,-Y,Z+1/2 REMARK 290 5555 Y,-X+Y,Z+5/6 REMARK 290 6555 X-Y,X,Z+1/6 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 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 27.46667 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 54.93333 REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 41.20000 REMARK 290 SMTRY1 5 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 5 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 68.66667 REMARK 290 SMTRY1 6 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 13.73333 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1, 2 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: 2690 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 9160 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -105.3 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, C REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 REMARK 350 BIOMOLECULE: 2 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: 2530 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 9330 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -103.2 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: B, D REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLY A -2 REMARK 465 LYS A -1 REMARK 465 GLY A 0 REMARK 465 GLY A 1 REMARK 465 GLY A 181 REMARK 465 SER A 182 REMARK 465 HIS A 183 REMARK 465 HIS A 184 REMARK 465 HIS A 185 REMARK 465 HIS A 186 REMARK 465 HIS A 187 REMARK 465 HIS A 188 REMARK 465 GLY B -2 REMARK 465 LYS B -1 REMARK 465 SER B 182 REMARK 465 HIS B 183 REMARK 465 HIS B 184 REMARK 465 HIS B 185 REMARK 465 HIS B 186 REMARK 465 HIS B 187 REMARK 465 HIS B 188 REMARK 465 GLY C 1 REMARK 465 GLU C 2 REMARK 465 LEU C 3 REMARK 465 ASP C 21 REMARK 465 GLY D 1 REMARK 465 GLU D 2 REMARK 465 LEU D 3 REMARK 465 GLY D 4 REMARK 465 ARG D 5 REMARK 465 ASP D 21 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 ARG A 180 CG CD NE CZ NH1 NH2 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 OD2 ASP A 25 O HOH A 2007 2.16 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 PHE A 43 -168.35 -173.68 REMARK 500 THR B 38 -169.71 -103.44 REMARK 500 PHE B 43 -169.95 -173.86 REMARK 500 LEU C 9 50.56 -118.20 REMARK 500 REMARK 500 REMARK: NULL REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A1181 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 145 SG REMARK 620 2 HOH A2067 O 106.1 REMARK 620 3 CYS A 97 SG 110.3 113.7 REMARK 620 4 CYS A 99 SG 121.1 108.7 97.1 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN B1182 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS B 145 SG REMARK 620 2 CYS B 97 SG 104.4 REMARK 620 3 CYS B 99 SG 118.7 96.9 REMARK 620 4 HOH B2068 O 109.4 115.8 111.3 REMARK 620 N 1 2 3 REMARK 700 REMARK 700 SHEET REMARK 700 DETERMINATION METHOD: DSSP REMARK 700 THE SHEETS PRESENTED AS "AB" IN EACH CHAIN ON SHEET RECORDS REMARK 700 BELOW IS ACTUALLY AN 6-STRANDED BARREL THIS IS REPRESENTED BY REMARK 700 A 7-STRANDED SHEET IN WHICH THE FIRST AND LAST STRANDS REMARK 700 ARE IDENTICAL. REMARK 700 THE SHEETS PRESENTED AS "BB" IN EACH CHAIN ON SHEET RECORDS REMARK 700 BELOW IS ACTUALLY AN 6-STRANDED BARREL THIS IS REPRESENTED BY REMARK 700 A 7-STRANDED SHEET IN WHICH THE FIRST AND LAST STRANDS REMARK 700 ARE IDENTICAL. REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN A1181 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CL A1182 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CL A1183 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CL A1184 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CL A1185 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CL A1186 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CL A1187 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CL A1188 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC9 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN B1182 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CL B1183 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CL B1184 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CL B1185 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CL B1186 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CL B1187 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CL B1188 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1W3C RELATED DB: PDB REMARK 900 CRYSTAL STRUCTURE OF THE HEPATITIS C VIRUS NS3 REMARK 900 PROTEASE IN COMPLEX WITH A PEPTIDOMIMETIC INHIBITOR REMARK 900 RELATED ID: 1DXP RELATED DB: PDB REMARK 900 INHIBITION OF THE HEPATITIS C VIRUS NS3/4A PROTEASE. REMARK 900 THE CRYSTALSTRUCTURES OF TWO PROTEASE-INHIBITOR COMPLEXES REMARK 900 RELATED ID: 1DY8 RELATED DB: PDB REMARK 900 INHIBITION OF THE HEPATITIS C VIRUS NS3/4A PROTEASE. REMARK 900 THE CRYSTALSTRUCTURES OF TWO PROTEASE-INHIBITOR COMPLEXES REMARK 900 (INHIBITOR II) REMARK 900 RELATED ID: 4A1T RELATED DB: PDB REMARK 900 CO-COMPLEX OF THE OF NS3-4A PROTEASE WITH THE REMARK 900 INHIBITORY PEPTIDE CP5-46-A (IN-HOUSE DATA) REMARK 900 RELATED ID: 1DY9 RELATED DB: PDB REMARK 900 INHIBITION OF THE HEPATITIS C VIRUS NS3/4A PROTEASE. REMARK 900 THE CRYSTALSTRUCTURES OF TWO PROTEASE-INHIBITOR COMPLEXES REMARK 900 (INHIBITOR I) REMARK 900 RELATED ID: 4A1V RELATED DB: PDB REMARK 900 CO-COMPLEX STRUCTURE OF NS3-4A PROTEASE WITH THE REMARK 900 OPTIMIZED INHIBITORY PEPTIDE CP5-46A-4D5E REMARK 999 REMARK 999 SEQUENCE REMARK 999 SEQUENCE DISCREPANCIES HAVE BEEN INDICATED BY AUTHOR AS REMARK 999 NATURAL VARIANTS, AS THE REPLICON WAS CONSTRUCTED FROM THE REMARK 999 CONSENSUS-GENOME OF HCV GENOTYPE 1B. DBREF 4A1X A -14 -2 UNP P26662 POLG_HCVJA 1678 1690 DBREF 4A1X A 2 180 UNP P26662 POLG_HCVJA 1028 1206 DBREF 4A1X A -14 -2 UNP P26662 POLG_HCVJA 1678 1690 DBREF 4A1X B 2 180 UNP P26662 POLG_HCVJA 1028 1206 DBREF 4A1X C 1 21 PDB 4A1X 4A1X 1 21 DBREF 4A1X D 1 21 PDB 4A1X 4A1X 1 21 SEQADV 4A1X LYS A -1 UNP P26662 LINKER SEQADV 4A1X GLY A 0 UNP P26662 LINKER SEQADV 4A1X GLY A 1 UNP P26662 LINKER SEQADV 4A1X GLY A 181 UNP P26662 EXPRESSION TAG SEQADV 4A1X SER A 182 UNP P26662 EXPRESSION TAG SEQADV 4A1X HIS A 183 UNP P26662 EXPRESSION TAG SEQADV 4A1X HIS A 184 UNP P26662 EXPRESSION TAG SEQADV 4A1X HIS A 185 UNP P26662 EXPRESSION TAG SEQADV 4A1X HIS A 186 UNP P26662 EXPRESSION TAG SEQADV 4A1X HIS A 187 UNP P26662 EXPRESSION TAG SEQADV 4A1X HIS A 188 UNP P26662 EXPRESSION TAG SEQADV 4A1X ARG A 26 UNP P26662 LYS 1052 SEE REMARK 999 SEQADV 4A1X GLU A 30 UNP P26662 ASP 1056 SEE REMARK 999 SEQADV 4A1X VAL A 36 UNP P26662 LEU 1062 SEE REMARK 999 SEQADV 4A1X GLN A 86 UNP P26662 PRO 1112 SEE REMARK 999 SEQADV 4A1X LEU A 94 UNP P26662 MET 1120 SEE REMARK 999 SEQADV 4A1X ILE A 114 UNP P26662 VAL 1140 VARIANT SEQADV 4A1X VAL A 132 UNP P26662 ILE 1158 VARIANT SEQADV 4A1X ALA A 150 UNP P26662 VAL 1176 SEE REMARK 999 SEQADV 4A1X VAL A 170 UNP P26662 ILE 1196 SEE REMARK 999 SEQADV 4A1X LYS B -1 UNP P26662 LINKER SEQADV 4A1X GLY B 0 UNP P26662 LINKER SEQADV 4A1X GLY B 1 UNP P26662 LINKER SEQADV 4A1X GLY B 181 UNP P26662 EXPRESSION TAG SEQADV 4A1X SER B 182 UNP P26662 EXPRESSION TAG SEQADV 4A1X HIS B 183 UNP P26662 EXPRESSION TAG SEQADV 4A1X HIS B 184 UNP P26662 EXPRESSION TAG SEQADV 4A1X HIS B 185 UNP P26662 EXPRESSION TAG SEQADV 4A1X HIS B 186 UNP P26662 EXPRESSION TAG SEQADV 4A1X HIS B 187 UNP P26662 EXPRESSION TAG SEQADV 4A1X HIS B 188 UNP P26662 EXPRESSION TAG SEQADV 4A1X ARG B 26 UNP P26662 LYS 1052 SEE REMARK 999 SEQADV 4A1X GLU B 30 UNP P26662 ASP 1056 SEE REMARK 999 SEQADV 4A1X VAL B 36 UNP P26662 LEU 1062 SEE REMARK 999 SEQADV 4A1X GLN B 86 UNP P26662 PRO 1112 SEE REMARK 999 SEQADV 4A1X LEU B 94 UNP P26662 MET 1120 SEE REMARK 999 SEQADV 4A1X ILE B 114 UNP P26662 VAL 1140 SEE REMARK 999 SEQADV 4A1X VAL B 132 UNP P26662 ILE 1158 VARIANT SEQADV 4A1X ALA B 150 UNP P26662 VAL 1176 SEE REMARK 999 SEQADV 4A1X VAL B 170 UNP P26662 ILE 1196 SEE REMARK 999 SEQRES 1 A 203 GLY SER VAL VAL ILE VAL GLY ARG ILE ILE LEU SER GLY SEQRES 2 A 203 LYS GLY GLY PRO ILE THR ALA TYR SER GLN GLN THR ARG SEQRES 3 A 203 GLY LEU LEU GLY CYS ILE ILE THR SER LEU THR GLY ARG SEQRES 4 A 203 ASP ARG ASN GLN VAL GLU GLY GLU VAL GLN VAL VAL SER SEQRES 5 A 203 THR ALA THR GLN SER PHE LEU ALA THR CYS VAL ASN GLY SEQRES 6 A 203 VAL CYS TRP THR VAL TYR HIS GLY ALA GLY SER LYS THR SEQRES 7 A 203 LEU ALA GLY PRO LYS GLY PRO ILE THR GLN MET TYR THR SEQRES 8 A 203 ASN VAL ASP GLN ASP LEU VAL GLY TRP GLN ALA PRO PRO SEQRES 9 A 203 GLY ALA ARG SER LEU THR PRO CYS THR CYS GLY SER SER SEQRES 10 A 203 ASP LEU TYR LEU VAL THR ARG HIS ALA ASP VAL ILE PRO SEQRES 11 A 203 VAL ARG ARG ARG GLY ASP SER ARG GLY SER LEU LEU SER SEQRES 12 A 203 PRO ARG PRO VAL SER TYR LEU LYS GLY SER SER GLY GLY SEQRES 13 A 203 PRO LEU LEU CYS PRO SER GLY HIS ALA VAL GLY ILE PHE SEQRES 14 A 203 ARG ALA ALA VAL CYS THR ARG GLY VAL ALA LYS ALA VAL SEQRES 15 A 203 ASP PHE VAL PRO VAL GLU SER MET GLU THR THR MET ARG SEQRES 16 A 203 GLY SER HIS HIS HIS HIS HIS HIS SEQRES 1 B 203 GLY SER VAL VAL ILE VAL GLY ARG ILE ILE LEU SER GLY SEQRES 2 B 203 LYS GLY GLY PRO ILE THR ALA TYR SER GLN GLN THR ARG SEQRES 3 B 203 GLY LEU LEU GLY CYS ILE ILE THR SER LEU THR GLY ARG SEQRES 4 B 203 ASP ARG ASN GLN VAL GLU GLY GLU VAL GLN VAL VAL SER SEQRES 5 B 203 THR ALA THR GLN SER PHE LEU ALA THR CYS VAL ASN GLY SEQRES 6 B 203 VAL CYS TRP THR VAL TYR HIS GLY ALA GLY SER LYS THR SEQRES 7 B 203 LEU ALA GLY PRO LYS GLY PRO ILE THR GLN MET TYR THR SEQRES 8 B 203 ASN VAL ASP GLN ASP LEU VAL GLY TRP GLN ALA PRO PRO SEQRES 9 B 203 GLY ALA ARG SER LEU THR PRO CYS THR CYS GLY SER SER SEQRES 10 B 203 ASP LEU TYR LEU VAL THR ARG HIS ALA ASP VAL ILE PRO SEQRES 11 B 203 VAL ARG ARG ARG GLY ASP SER ARG GLY SER LEU LEU SER SEQRES 12 B 203 PRO ARG PRO VAL SER TYR LEU LYS GLY SER SER GLY GLY SEQRES 13 B 203 PRO LEU LEU CYS PRO SER GLY HIS ALA VAL GLY ILE PHE SEQRES 14 B 203 ARG ALA ALA VAL CYS THR ARG GLY VAL ALA LYS ALA VAL SEQRES 15 B 203 ASP PHE VAL PRO VAL GLU SER MET GLU THR THR MET ARG SEQRES 16 B 203 GLY SER HIS HIS HIS HIS HIS HIS SEQRES 1 C 21 GLY GLU LEU GLY ARG LEU VAL TYR LEU LEU ASP GLY PRO SEQRES 2 C 21 GLY TYR ASP PRO ILE HIS CYS ASP SEQRES 1 D 21 GLY GLU LEU GLY ARG LEU VAL TYR LEU LEU ASP GLY PRO SEQRES 2 D 21 GLY TYR ASP PRO ILE HIS CYS ASP HET ZN A1181 1 HET CL A1182 1 HET CL A1183 1 HET CL A1184 1 HET CL A1185 1 HET CL A1186 1 HET CL A1187 1 HET CL A1188 1 HET ZN B1182 1 HET CL B1183 1 HET CL B1184 1 HET CL B1185 1 HET CL B1186 1 HET CL B1187 1 HET CL B1188 1 HETNAM ZN ZINC ION HETNAM CL CHLORIDE ION FORMUL 5 ZN 2(ZN 2+) FORMUL 6 CL 13(CL 1-) FORMUL 7 HOH *193(H2 O) HELIX 1 1 GLY A 12 GLY A 23 1 12 HELIX 2 2 TYR A 56 GLY A 60 1 5 HELIX 3 3 SER A 133 LYS A 136 5 4 HELIX 4 4 VAL A 172 ARG A 180 1 9 HELIX 5 5 GLY B 12 GLY B 23 1 12 HELIX 6 6 TYR B 56 GLY B 60 1 5 HELIX 7 7 SER B 133 LYS B 136 5 4 HELIX 8 8 VAL B 172 GLY B 181 1 10 SHEET 1 AA 7 ALA A 5 GLN A 9 0 SHEET 2 AA 7 VAL A -11 LEU A -4 -1 O ARG A -7 N GLN A 8 SHEET 3 AA 7 VAL A 33 SER A 37 -1 O VAL A 33 N ILE A -6 SHEET 4 AA 7 SER A 42 VAL A 48 -1 O PHE A 43 N VAL A 36 SHEET 5 AA 7 VAL A 51 VAL A 55 -1 O VAL A 51 N VAL A 48 SHEET 6 AA 7 LEU A 82 GLN A 86 -1 O VAL A 83 N THR A 54 SHEET 7 AA 7 TYR A 75 ASN A 77 -1 O TYR A 75 N GLY A 84 SHEET 1 AB 8 ASP A 103 VAL A 107 0 SHEET 2 AB 8 VAL A 113 GLY A 120 -1 O ILE A 114 N LEU A 106 SHEET 3 AB 8 ARG A 123 PRO A 131 -1 O ARG A 123 N ARG A 119 SHEET 4 AB 8 VAL A 163 PRO A 171 -1 O ALA A 164 N ARG A 130 SHEET 5 AB 8 ALA A 150 THR A 160 13 O ILE A 153 N VAL A 170 SHEET 6 AB 8 PRO A 142 LEU A 144 -1 O LEU A 143 N VAL A 151 SHEET 7 AB 8 ASP A 103 VAL A 107 0 SHEET 1 BA 7 THR B 4 GLN B 9 0 SHEET 2 BA 7 VAL B -11 SER B -3 -1 O ARG B -7 N GLN B 8 SHEET 3 BA 7 VAL B 33 SER B 37 -1 O VAL B 33 N ILE B -6 SHEET 4 BA 7 SER B 42 VAL B 48 -1 O PHE B 43 N VAL B 36 SHEET 5 BA 7 VAL B 51 VAL B 55 -1 O VAL B 51 N VAL B 48 SHEET 6 BA 7 LEU B 82 GLN B 86 -1 O VAL B 83 N THR B 54 SHEET 7 BA 7 TYR B 75 ASN B 77 -1 O TYR B 75 N GLY B 84 SHEET 1 BB 7 ASP B 103 VAL B 107 0 SHEET 2 BB 7 VAL B 113 ARG B 118 -1 O ILE B 114 N LEU B 106 SHEET 3 BB 7 ARG B 123 PRO B 131 -1 O SER B 125 N ARG B 117 SHEET 4 BB 7 VAL B 163 PRO B 171 -1 O ALA B 164 N ARG B 130 SHEET 5 BB 7 ALA B 150 THR B 160 -1 O ILE B 153 N VAL B 170 SHEET 6 BB 7 PRO B 142 LEU B 144 -1 O LEU B 143 N VAL B 151 SHEET 7 BB 7 ASP B 103 VAL B 107 -1 O TYR B 105 N LEU B 144 SSBOND *** CYS A 47 CYS A 52 1555 1555 2.06 LINK ZN ZN A1181 SG CYS A 145 1555 1555 2.37 LINK ZN ZN A1181 O HOH A2067 1555 1555 2.32 LINK ZN ZN A1181 SG CYS A 97 1555 1555 2.31 LINK ZN ZN A1181 SG CYS A 99 1555 1555 2.39 LINK ZN ZN B1182 SG CYS B 97 1555 1555 2.42 LINK ZN ZN B1182 SG CYS B 99 1555 1555 2.57 LINK ZN ZN B1182 O HOH B2068 1555 1555 2.34 LINK ZN ZN B1182 SG CYS B 145 1555 1555 2.62 CISPEP 1 ARG B 180 GLY B 181 0 -0.25 SITE *** AC1 4 CYS A 97 CYS A 99 CYS A 145 HOH A2067 SITE *** AC2 3 THR A 38 THR A 40 GLN A 41 SITE *** AC3 4 ARG A 11 GLY A 12 GLY A 15 PRO A 70 SITE *** AC4 5 GLY A -14 GLN A 9 GLY A 12 LEU A 13 SITE *** AC4 5 HOH C2006 SITE *** AC5 2 ARG A 26 ARG B 26 SITE *** AC6 3 GLY A 60 SER A 61 LYS A 62 SITE *** AC7 3 ARG A 11 ARG A 26 HOH A2022 SITE *** AC8 3 VAL A 132 SER A 133 GLY A 162 SITE *** AC9 4 CYS B 97 CYS B 99 CYS B 145 HOH B2068 SITE *** BC1 3 SER B 61 LYS B 62 HOH D2003 SITE *** BC2 4 PRO B 131 VAL B 132 SER B 133 GLY B 162 SITE *** BC3 5 GLY B -14 THR B 38 ALA B 39 LYS B 62 SITE *** BC3 5 HOH B2043 SITE *** BC4 4 GLY B -14 GLN B 9 GLY B 12 LEU B 13 SITE *** BC5 3 LYS A 68 ASN B 27 GLN B 28 SITE *** BC6 4 ARG B 11 GLY B 12 GLY B 15 PRO B 70 CRYST1 93.320 93.320 82.400 90.00 90.00 120.00 P 61 12 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 0.010716 0.006187 0.000000 0.00000 SCALE2 0.000000 0.012374 0.000000 0.00000 SCALE3 0.000000 0.000000 0.012136 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 7 SER OG : rot 144:sc= 2.39 USER MOD Set 1.2: D 15 TYR OH : rot -13:sc= 1.29 USER MOD Set 2.1: A 7 SER OG : rot 140:sc= 2.56 USER MOD Set 2.2: C 15 TYR OH : rot -23:sc= 1.34 USER MOD Set 3.1: B 77 ASN : amide:sc= 0.00544 K(o=1.3,f=-0.34) USER MOD Set 3.2: B 178 THR OG1 : rot 90:sc= 1.34 USER MOD Set 4.1: B 57 HIS : no HE2:sc= 1.1 K(o=1.1,f=-4.8!) USER MOD Set 4.2: B 139 SER OG A: rot 130:sc= 0.00549 USER MOD Set 4.3: B 139 SER OG B: rot 170:sc= -0.0262 USER MOD Set 5.1: B 63 THR OG1 : rot 89:sc= 1.22 USER MOD Set 5.2: B -13 SER OG : rot 83:sc= 2.12 USER MOD Set 6.1: B 95 THR OG1 : rot 180:sc= -1.28 USER MOD Set 6.2: B 147 SER OG B: rot -40:sc= 1.53 USER MOD Set 6.3: B 149 HIS : no HE2:sc= -0.24 K(o=0.011,f=-9!) USER MOD Set 7.1: B 74 MET CE :methyl -150:sc=-0.00367 (180deg=0) USER MOD Set 7.2: B 75 TYR OH : rot 180:sc= 0 USER MOD Set 8.1: B 73 GLN : amide:sc= 1.8 K(o=3,f=0.042) USER MOD Set 8.2: B 76 THR OG1 : rot -83:sc= 1.17 USER MOD Set 9.1: B 47 CYS SG A: rot -150:sc=-0.00128 USER MOD Set 9.2: B 52 CYS SG B: rot -170:sc= -0.0997 USER MOD Set10.1: B 47 CYS SG B: rot -50:sc= 1.47! USER MOD Set10.2: B 93 SER OG : rot 42:sc= 2.81 USER MOD Set11.1: A 95 THR OG1 : rot -77:sc= -1.11 USER MOD Set11.2: A 147 SER OG B: rot 107:sc= 0.552 USER MOD Set11.3: A 149 HIS : no HD1:sc= 0.948 K(o=0.38,f=-3.7!) USER MOD Set12.1: A 77 ASN : amide:sc= 0.218 K(o=1.4,f=-1.3!) USER MOD Set12.2: A 178 THR OG1 : rot 78:sc= 1.16 USER MOD Set13.1: A 74 MET CE :methyl -145:sc= 0 (180deg=0) USER MOD Set13.2: A 75 TYR OH : rot 30:sc= 0 USER MOD Set14.1: A 73 GLN : amide:sc= 1.93 K(o=3.2,f=0.31) USER MOD Set14.2: A 76 THR OG1 : rot -82:sc= 1.29 USER MOD Set15.1: A 63 THR OG1 : rot -170:sc= 0.92 USER MOD Set15.2: A -13 SER OG : rot -46:sc= 2.09 USER MOD Set16.1: A 57 HIS : no HE2:sc= 2.13 K(o=3.7,f=-8.2!) USER MOD Set16.2: A 139 SER OG A: rot 173:sc= 0.621 USER MOD Set16.3: A 139 SER OG B: rot -172:sc= 0.97 USER MOD Set17.1: A 47 CYS SG B: rot -53:sc= 1.87! USER MOD Set17.2: A 93 SER OG : rot 35:sc= 3.54 USER MOD Set18.1: A 38 THR OG1 : rot 153:sc= 1.04 USER MOD Set18.2: A 40 THR OG1 : rot -29:sc= -0.818! USER MOD Single : A 4 THR OG1 : rot 85:sc= -1.87! USER MOD Single : A 6 TYR OH : rot 2:sc= 1.29 USER MOD Single : A 8 GLN : amide:sc= 0.349 K(o=0.35,f=-4.5!) USER MOD Single : A 9 GLN : amide:sc= 1.59 K(o=1.6,f=-0.91!) USER MOD Single : A -3 SER OG : rot 180:sc= 0.047 USER MOD Single : A 10 THR OG1 : rot 125:sc= 1.28 USER MOD Single : A 16 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 81:sc= 2.31 USER MOD Single : A 20 SER OG : rot 61:sc= 0.933 USER MOD Single : A 22 THR OG1 : rot -172:sc= 1.27 USER MOD Single : A 27 ASN : amide:sc= 0.938 K(o=0.94,f=-0.049) USER MOD Single : A 28 GLN : amide:sc= -1.81! X(o=-1.8!,f=-1.5) USER MOD Single : A 34 GLN : amide:sc= 1.6 K(o=1.6,f=0.093) USER MOD Single : A 37 SER OG : rot -60:sc= 1.49 USER MOD Single : A 41 GLN : amide:sc= -0.336 K(o=-0.34,f=-2.2!) USER MOD Single : A 42 SER OG : rot -96:sc= 1.98 USER MOD Single : A 46 THR OG1 : rot 87:sc= 0.684 USER MOD Single : A 49 ASN : amide:sc= -0.144 K(o=-0.14,f=-1.9) USER MOD Single : A 52 CYS SG C: rot 180:sc= -1.29 USER MOD Single : A 54 THR OG1 : rot 117:sc= 1.38 USER MOD Single : A 56 TYR OH : rot -61:sc= 1.48 USER MOD Single : A 61 SER OG A: rot 78:sc= 1.2 USER MOD Single : A 61 SER OG B: rot 70:sc= 0.0743 USER MOD Single : A 62 LYS NZ :NH3+ 170:sc= 1.3 (180deg=0.843) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 152:sc= 0.509 USER MOD Single : A 80 GLN : amide:sc=-0.000906 K(o=-0.00091,f=-1.7!) USER MOD Single : A 86 GLN : amide:sc=-0.00267 X(o=-0.0027,f=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A -14 GLY N :NH3+ -178:sc= 0.345 (180deg=0.344) USER MOD Single : A 101 SER OG : rot 180:sc= 0.357 USER MOD Single : A 102 SER OG : rot -160:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HE2:sc= 1.18 K(o=1.2,f=-1.5) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 170:sc= 0.00757 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 180:sc= -0.048 USER MOD Single : A 134 TYR OH : rot 165:sc= -0.46 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 SER OG : rot 77:sc= 2.24 USER MOD Single : A 147 SER OG A: rot 180:sc= 0 USER MOD Single : A 159 CYS SG A: rot 80:sc= -8.1! USER MOD Single : A 159 CYS SG B: rot 149:sc= -4.95! USER MOD Single : A 160 THR OG1 : rot -0:sc= 0.763! USER MOD Single : A 165 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 174 SER OG : rot 180:sc= 0 USER MOD Single : A 175 MET CE :methyl 168:sc= -0.0743 (180deg=-0.365) USER MOD Single : A 177 THR OG1 : rot 71:sc= 0.00883 USER MOD Single : A 179 MET CE :methyl -173:sc= -0.154 (180deg=-0.332) USER MOD Single : B 0 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 THR OG1 : rot -51:sc= 2.39 USER MOD Single : B 6 TYR OH : rot 180:sc=-0.00103 USER MOD Single : B 8 GLN : amide:sc= 0.821 K(o=0.82,f=-6!) USER MOD Single : B 9 GLN : amide:sc= 1.46 K(o=1.5,f=-0.79) USER MOD Single : B -3 SER OG : rot 180:sc= 0 USER MOD Single : B 10 THR OG1 : rot 180:sc= 0 USER MOD Single : B 16 CYS SG : rot 180:sc= 0 USER MOD Single : B 19 THR OG1 : rot 83:sc= 2.27 USER MOD Single : B 20 SER OG A: rot 70:sc= 1.29 USER MOD Single : B 20 SER OG B: rot -74:sc= 1.29 USER MOD Single : B 22 THR OG1 : rot -173:sc= 1.28 USER MOD Single : B 27 ASN : amide:sc= 0.968 K(o=0.97,f=-0.99) USER MOD Single : B 28 GLN : amide:sc= -1.34 X(o=-1.3,f=-0.99) USER MOD Single : B 34 GLN : amide:sc= 1.27 K(o=1.3,f=-0.23) USER MOD Single : B 37 SER OG : rot -62:sc= 1.65 USER MOD Single : B 38 THR OG1 : rot 174:sc= 1.14 USER MOD Single : B 40 THR OG1 : rot -30:sc= 0.222 USER MOD Single : B 41 GLN : amide:sc= -0.0354 K(o=-0.035,f=-2!) USER MOD Single : B 42 SER OG : rot -91:sc= 2 USER MOD Single : B 46 THR OG1 : rot 86:sc= 0.717 USER MOD Single : B 49 ASN : amide:sc= -0.149 K(o=-0.15,f=-2!) USER MOD Single : B 52 CYS SG C: rot 180:sc= -0.371 USER MOD Single : B 54 THR OG1 : rot 108:sc= 1.39 USER MOD Single : B 56 TYR OH : rot 180:sc= 0 USER MOD Single : B 61 SER OG A: rot 180:sc= 0 USER MOD Single : B 61 SER OG B: rot -56:sc= 0.908 USER MOD Single : B 62 LYS NZ :NH3+ 175:sc= 1.2 (180deg=1.05) USER MOD Single : B 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 THR OG1 : rot 180:sc= 0 USER MOD Single : B 80 GLN : amide:sc= -0.214 K(o=-0.21,f=-2.7!) USER MOD Single : B 86 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : B 98 THR OG1 : rot 180:sc= 0 USER MOD Single : B -14 GLY N :NH3+ -164:sc= 0.096 (180deg=0.0437) USER MOD Single : B 101 SER OG : rot 180:sc= 0 USER MOD Single : B 102 SER OG : rot 75:sc= 0.958 USER MOD Single : B 105 TYR OH : rot 180:sc= 0 USER MOD Single : B 108 THR OG1 : rot 157:sc= 1.02 USER MOD Single : B 110 HIS : no HD1:sc= 1.05 K(o=1.1,f=-1.3) USER MOD Single : B 122 SER OG : rot 180:sc= 0 USER MOD Single : B 125 SER OG : rot 180:sc= 0.002 USER MOD Single : B 128 SER OG : rot 180:sc= 0 USER MOD Single : B 133 SER OG : rot -133:sc= 0.218 USER MOD Single : B 134 TYR OH : rot -37:sc= -0.687 USER MOD Single : B 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 138 SER OG : rot 83:sc= 2.01 USER MOD Single : B 147 SER OG A: rot 180:sc= 0 USER MOD Single : B 159 CYS SG : rot 180:sc= -5.03! USER MOD Single : B 160 THR OG1 : rot 29:sc= 0.305 USER MOD Single : B 165 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00582) USER MOD Single : B 174 SER OG : rot 180:sc= 0 USER MOD Single : B 175 MET CE :methyl 145:sc= -0.76 (180deg=-1.65) USER MOD Single : B 177 THR OG1 : rot 180:sc= -0.57 USER MOD Single : B 179 MET CE :methyl -175:sc= 0 (180deg=-0.0425) USER MOD Single : C 8 TYR OH : rot 180:sc= 0 USER MOD Single : C 19 HIS : no HD1:sc= 0.216 K(o=0.22,f=-1) USER MOD Single : C 20 CYS SG : rot 180:sc= 0 USER MOD Single : D 8 TYR OH : rot 180:sc= 0 USER MOD Single : D 19 HIS : no HD1:sc= 1.08 K(o=1.1,f=-3.4!) USER MOD Single : D 20 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -14 17.121 -1.895 -8.420 1.00 26.76 N ATOM 2 CA GLY A -14 16.384 -1.099 -9.427 1.00 23.26 C ATOM 3 C GLY A -14 17.262 0.025 -9.939 1.00 21.91 C ATOM 4 O GLY A -14 18.468 0.007 -9.786 1.00 22.67 O ATOM 0 H1 GLY A -14 16.611 -2.571 -8.144 1.00 26.76 H new ATOM 0 H2 GLY A -14 17.867 -2.216 -8.783 1.00 26.76 H new ATOM 0 H3 GLY A -14 17.328 -1.378 -7.726 1.00 26.76 H new ATOM 0 HA2 GLY A -14 16.111 -1.668 -10.164 1.00 23.26 H new ATOM 0 HA3 GLY A -14 15.575 -0.735 -9.034 1.00 23.26 H new ATOM 5 N SER A -13 16.639 1.021 -10.541 1.00 20.03 N ATOM 6 CA SER A -13 17.363 2.133 -11.099 1.00 17.36 C ATOM 7 C SER A -13 17.729 3.121 -9.994 1.00 16.65 C ATOM 8 O SER A -13 17.088 3.160 -8.935 1.00 16.79 O ATOM 9 CB SER A -13 16.484 2.834 -12.136 1.00 18.03 C ATOM 10 OG SER A -13 16.485 2.132 -13.373 1.00 19.47 O ATOM 0 H SER A -13 15.785 1.068 -10.636 1.00 20.03 H new ATOM 0 HA SER A -13 18.175 1.810 -11.519 1.00 17.36 H new ATOM 0 HB2 SER A -13 15.576 2.902 -11.801 1.00 18.03 H new ATOM 0 HB3 SER A -13 16.803 3.739 -12.275 1.00 18.03 H new ATOM 0 HG SER A -13 17.273 1.928 -13.579 1.00 19.47 H new ATOM 11 N VAL A -12 18.775 3.888 -10.251 1.00 14.75 N ATOM 12 CA VAL A -12 19.040 5.119 -9.521 1.00 14.08 C ATOM 13 C VAL A -12 17.964 6.167 -9.877 1.00 13.20 C ATOM 14 O VAL A -12 17.595 6.308 -11.039 1.00 12.97 O ATOM 15 CB VAL A -12 20.436 5.651 -9.898 1.00 14.40 C ATOM 16 CG1 VAL A -12 20.712 6.992 -9.219 1.00 14.45 C ATOM 17 CG2 VAL A -12 21.503 4.609 -9.499 1.00 14.55 C ATOM 0 H VAL A -12 19.357 3.709 -10.858 1.00 14.75 H new ATOM 0 HA VAL A -12 19.014 4.945 -8.567 1.00 14.08 H new ATOM 0 HB VAL A -12 20.471 5.795 -10.857 1.00 14.40 H new ATOM 0 HG11 VAL A -12 21.594 7.307 -9.470 1.00 14.45 H new ATOM 0 HG12 VAL A -12 20.046 7.640 -9.499 1.00 14.45 H new ATOM 0 HG13 VAL A -12 20.671 6.882 -8.256 1.00 14.45 H new ATOM 0 HG21 VAL A -12 22.384 4.941 -9.735 1.00 14.55 H new ATOM 0 HG22 VAL A -12 21.462 4.454 -8.542 1.00 14.55 H new ATOM 0 HG23 VAL A -12 21.335 3.777 -9.969 1.00 14.55 H new ATOM 18 N VAL A -11 17.472 6.887 -8.875 1.00 12.23 N ATOM 19 CA VAL A -11 16.375 7.845 -9.061 1.00 12.12 C ATOM 20 C VAL A -11 16.791 9.224 -8.542 1.00 12.04 C ATOM 21 O VAL A -11 17.315 9.330 -7.425 1.00 11.52 O ATOM 22 CB VAL A -11 15.136 7.371 -8.258 1.00 12.76 C ATOM 23 CG1 VAL A -11 13.968 8.354 -8.406 1.00 13.43 C ATOM 24 CG2 VAL A -11 14.725 5.959 -8.717 1.00 14.27 C ATOM 0 H VAL A -11 17.761 6.837 -8.067 1.00 12.23 H new ATOM 0 HA VAL A -11 16.164 7.900 -10.006 1.00 12.12 H new ATOM 0 HB VAL A -11 15.372 7.340 -7.318 1.00 12.76 H new ATOM 0 HG11 VAL A -11 13.208 8.034 -7.895 1.00 13.43 H new ATOM 0 HG12 VAL A -11 14.235 9.226 -8.076 1.00 13.43 H new ATOM 0 HG13 VAL A -11 13.721 8.425 -9.341 1.00 13.43 H new ATOM 0 HG21 VAL A -11 13.950 5.667 -8.212 1.00 14.27 H new ATOM 0 HG22 VAL A -11 14.507 5.976 -9.662 1.00 14.27 H new ATOM 0 HG23 VAL A -11 15.459 5.343 -8.566 1.00 14.27 H new ATOM 25 N ILE A -10 16.526 10.269 -9.322 1.00 11.27 N ATOM 26 CA ILE A -10 16.731 11.627 -8.853 1.00 11.53 C ATOM 27 C ILE A -10 15.622 11.963 -7.857 1.00 11.58 C ATOM 28 O ILE A -10 14.433 11.804 -8.159 1.00 12.01 O ATOM 29 CB ILE A -10 16.717 12.616 -10.019 1.00 12.16 C ATOM 30 CG1 ILE A -10 17.945 12.358 -10.915 1.00 12.34 C ATOM 31 CG2 ILE A -10 16.661 14.059 -9.495 1.00 12.16 C ATOM 32 CD1 ILE A -10 17.882 13.151 -12.213 1.00 12.76 C ATOM 0 H ILE A -10 16.227 10.209 -10.126 1.00 11.27 H new ATOM 0 HA ILE A -10 17.598 11.695 -8.424 1.00 11.53 H new ATOM 0 HB ILE A -10 15.922 12.487 -10.559 1.00 12.16 H new ATOM 0 HG12 ILE A -10 18.752 12.594 -10.432 1.00 12.34 H new ATOM 0 HG13 ILE A -10 18.003 11.411 -11.118 1.00 12.34 H new ATOM 0 HG21 ILE A -10 16.653 14.675 -10.244 1.00 12.16 H new ATOM 0 HG22 ILE A -10 15.856 14.181 -8.967 1.00 12.16 H new ATOM 0 HG23 ILE A -10 17.439 14.233 -8.942 1.00 12.16 H new ATOM 0 HD11 ILE A -10 18.670 12.962 -12.747 1.00 12.76 H new ATOM 0 HD12 ILE A -10 17.088 12.898 -12.709 1.00 12.76 H new ATOM 0 HD13 ILE A -10 17.849 14.099 -12.012 1.00 12.76 H new ATOM 33 N VAL A -9 15.998 12.376 -6.655 1.00 11.11 N ATOM 34 CA VAL A -9 14.986 12.641 -5.616 1.00 10.77 C ATOM 35 C VAL A -9 15.081 14.084 -5.114 1.00 10.87 C ATOM 36 O VAL A -9 14.296 14.517 -4.258 1.00 10.73 O ATOM 37 CB VAL A -9 15.105 11.675 -4.413 1.00 10.37 C ATOM 38 CG1 VAL A -9 14.742 10.234 -4.812 1.00 10.84 C ATOM 39 CG2 VAL A -9 16.505 11.702 -3.801 1.00 9.86 C ATOM 0 H VAL A -9 16.813 12.509 -6.415 1.00 11.11 H new ATOM 0 HA VAL A -9 14.123 12.496 -6.035 1.00 10.77 H new ATOM 0 HB VAL A -9 14.472 11.984 -3.746 1.00 10.37 H new ATOM 0 HG11 VAL A -9 14.826 9.653 -4.040 1.00 10.84 H new ATOM 0 HG12 VAL A -9 13.829 10.209 -5.138 1.00 10.84 H new ATOM 0 HG13 VAL A -9 15.343 9.930 -5.511 1.00 10.84 H new ATOM 0 HG21 VAL A -9 16.543 11.087 -3.052 1.00 9.86 H new ATOM 0 HG22 VAL A -9 17.156 11.437 -4.470 1.00 9.86 H new ATOM 0 HG23 VAL A -9 16.706 12.599 -3.492 1.00 9.86 H new ATOM 40 N GLY A -8 16.035 14.825 -5.661 1.00 10.76 N ATOM 41 CA GLY A -8 16.181 16.239 -5.320 1.00 11.44 C ATOM 42 C GLY A -8 17.312 16.847 -6.112 1.00 11.52 C ATOM 43 O GLY A -8 17.975 16.174 -6.933 1.00 10.54 O ATOM 0 H GLY A -8 16.608 14.532 -6.231 1.00 10.76 H new ATOM 0 HA2 GLY A -8 15.355 16.711 -5.507 1.00 11.44 H new ATOM 0 HA3 GLY A -8 16.354 16.334 -4.370 1.00 11.44 H new ATOM 44 N ARG A -7 17.551 18.125 -5.890 1.00 11.84 N ATOM 45 CA ARG A -7 18.659 18.733 -6.609 1.00 13.63 C ATOM 46 C ARG A -7 19.273 19.842 -5.814 1.00 13.73 C ATOM 47 O ARG A -7 18.654 20.358 -4.884 1.00 13.91 O ATOM 48 CB ARG A -7 18.262 19.212 -8.006 1.00 14.75 C ATOM 49 CG ARG A -7 17.350 20.423 -8.067 1.00 16.82 C ATOM 50 CD ARG A -7 15.931 20.008 -7.777 1.00 19.78 C ATOM 51 NE ARG A -7 14.959 21.034 -8.143 1.00 22.59 N ATOM 52 CZ ARG A -7 14.153 21.003 -9.204 1.00 21.30 C ATOM 53 NH1 ARG A -7 14.184 20.006 -10.085 1.00 21.15 N ATOM 54 NH2 ARG A -7 13.299 21.998 -9.365 1.00 20.82 N ATOM 0 H ARG A -7 17.112 18.638 -5.357 1.00 11.84 H new ATOM 0 HA ARG A -7 19.326 18.039 -6.731 1.00 13.63 H new ATOM 0 HB2 ARG A -7 19.072 19.415 -8.500 1.00 14.75 H new ATOM 0 HB3 ARG A -7 17.826 18.479 -8.467 1.00 14.75 H new ATOM 0 HG2 ARG A -7 17.639 21.089 -7.424 1.00 16.82 H new ATOM 0 HG3 ARG A -7 17.403 20.834 -8.944 1.00 16.82 H new ATOM 0 HD2 ARG A -7 15.731 19.191 -8.261 1.00 19.78 H new ATOM 0 HD3 ARG A -7 15.843 19.807 -6.832 1.00 19.78 H new ATOM 0 HE ARG A -7 14.901 21.720 -7.628 1.00 22.59 H new ATOM 0 HH11 ARG A -7 14.736 19.355 -9.979 1.00 21.15 H new ATOM 0 HH12 ARG A -7 13.652 20.012 -10.761 1.00 21.15 H new ATOM 0 HH21 ARG A -7 13.275 22.641 -8.794 1.00 20.82 H new ATOM 0 HH22 ARG A -7 12.767 22.003 -10.041 1.00 20.82 H new ATOM 55 N ILE A -6 20.502 20.179 -6.185 1.00 13.83 N ATOM 56 CA ILE A -6 21.192 21.307 -5.593 1.00 15.02 C ATOM 57 C ILE A -6 21.487 22.297 -6.723 1.00 16.28 C ATOM 58 O ILE A -6 22.007 21.928 -7.777 1.00 15.85 O ATOM 59 CB ILE A -6 22.458 20.868 -4.839 1.00 14.90 C ATOM 60 CG1 ILE A -6 22.053 19.986 -3.643 1.00 14.76 C ATOM 61 CG2 ILE A -6 23.253 22.097 -4.390 1.00 15.56 C ATOM 62 CD1 ILE A -6 23.183 19.180 -3.019 1.00 14.83 C ATOM 0 H ILE A -6 20.955 19.760 -6.784 1.00 13.83 H new ATOM 0 HA ILE A -6 20.639 21.735 -4.921 1.00 15.02 H new ATOM 0 HB ILE A -6 23.031 20.347 -5.424 1.00 14.90 H new ATOM 0 HG12 ILE A -6 21.664 20.553 -2.959 1.00 14.76 H new ATOM 0 HG13 ILE A -6 21.359 19.373 -3.932 1.00 14.76 H new ATOM 0 HG21 ILE A -6 24.049 21.812 -3.915 1.00 15.56 H new ATOM 0 HG22 ILE A -6 23.509 22.618 -5.167 1.00 15.56 H new ATOM 0 HG23 ILE A -6 22.705 22.641 -3.803 1.00 15.56 H new ATOM 0 HD11 ILE A -6 22.838 18.658 -2.278 1.00 14.83 H new ATOM 0 HD12 ILE A -6 23.562 18.585 -3.685 1.00 14.83 H new ATOM 0 HD13 ILE A -6 23.871 19.783 -2.696 1.00 14.83 H new ATOM 63 N AILE A -5 21.133 23.550 -6.486 0.86 16.44 N ATOM 64 CA AILE A -5 21.263 24.598 -7.486 0.86 18.30 C ATOM 65 C AILE A -5 22.338 25.567 -7.005 0.86 19.05 C ATOM 66 O AILE A -5 22.254 26.067 -5.886 0.86 16.35 O ATOM 67 CB AILE A -5 19.914 25.332 -7.690 0.86 19.61 C ATOM 68 CG1AILE A -5 18.914 24.397 -8.393 0.86 21.07 C ATOM 69 CG2AILE A -5 20.098 26.588 -8.551 0.86 19.81 C ATOM 70 CD1AILE A -5 17.471 24.651 -8.003 0.86 24.16 C ATOM 71 N BILE A -5 21.099 23.546 -6.521 0.14 17.13 N ATOM 72 CA BILE A -5 21.318 24.558 -7.536 0.14 18.45 C ATOM 73 C BILE A -5 22.314 25.587 -7.040 0.14 19.59 C ATOM 74 O BILE A -5 22.157 26.150 -5.957 0.14 19.27 O ATOM 75 CB BILE A -5 19.999 25.199 -7.992 0.14 18.61 C ATOM 76 CG1BILE A -5 20.186 26.697 -8.240 0.14 18.74 C ATOM 77 CG2BILE A -5 18.914 24.935 -6.966 0.14 18.24 C ATOM 78 CD1BILE A -5 19.359 27.214 -9.393 0.14 19.04 C ATOM 0 H AILE A -5 20.809 23.819 -5.736 0.86 17.13 H new ATOM 0 H BILE A -5 20.709 23.826 -5.807 0.14 17.13 H new ATOM 0 HA AILE A -5 21.514 24.216 -8.342 0.86 18.45 H new ATOM 0 HA BILE A -5 21.697 24.130 -8.320 0.14 18.45 H new ATOM 0 HB AILE A -5 19.578 25.590 -6.817 0.86 18.61 H new ATOM 0 HB BILE A -5 19.724 24.798 -8.831 0.14 18.61 H new ATOM 0 HG12AILE A -5 19.005 24.501 -9.353 0.86 18.74 H new ATOM 0 HG12BILE A -5 19.950 27.185 -7.435 0.14 18.74 H new ATOM 0 HG13AILE A -5 19.141 23.477 -8.185 0.86 18.74 H new ATOM 0 HG13BILE A -5 21.123 26.876 -8.415 0.14 18.74 H new ATOM 0 HG21AILE A -5 19.242 27.030 -8.665 0.86 18.24 H new ATOM 0 HG21BILE A -5 18.084 25.342 -7.260 0.14 18.24 H new ATOM 0 HG22AILE A -5 20.718 27.192 -8.114 0.86 18.24 H new ATOM 0 HG22BILE A -5 18.787 23.978 -6.868 0.14 18.24 H new ATOM 0 HG23AILE A -5 20.450 26.337 -9.419 0.86 18.24 H new ATOM 0 HG23BILE A -5 19.176 25.315 -6.113 0.14 18.24 H new ATOM 0 HD11AILE A -5 16.894 24.033 -8.478 0.86 19.04 H new ATOM 0 HD11BILE A -5 19.517 28.165 -9.504 0.14 19.04 H new ATOM 0 HD12AILE A -5 17.366 24.522 -7.047 0.86 19.04 H new ATOM 0 HD12BILE A -5 19.610 26.748 -10.206 0.14 19.04 H new ATOM 0 HD13AILE A -5 17.229 25.561 -8.234 0.86 19.04 H new ATOM 0 HD13BILE A -5 18.419 27.062 -9.211 0.14 19.04 H new ATOM 79 N LEU A -4 23.348 25.797 -7.846 1.00 20.52 N ATOM 80 CA LEU A -4 24.481 26.672 -7.502 1.00 24.58 C ATOM 81 C LEU A -4 24.226 28.078 -8.013 1.00 28.21 C ATOM 82 O LEU A -4 23.552 28.260 -9.029 1.00 27.74 O ATOM 83 CB LEU A -4 25.790 26.132 -8.113 1.00 24.34 C ATOM 84 CG LEU A -4 26.150 24.687 -7.778 1.00 26.59 C ATOM 85 CD1 LEU A -4 27.358 24.234 -8.590 1.00 26.51 C ATOM 86 CD2 LEU A -4 26.427 24.554 -6.290 1.00 26.51 C ATOM 0 H ALEU A -4 23.399 25.452 -8.632 0.86 20.52 H new ATOM 0 H BLEU A -4 23.419 25.433 -8.622 0.14 20.52 H new ATOM 0 HA LEU A -4 24.570 26.690 -6.536 1.00 24.58 H new ATOM 0 HB2 LEU A -4 25.732 26.215 -9.078 1.00 24.34 H new ATOM 0 HB3 LEU A -4 26.519 26.702 -7.822 1.00 24.34 H new ATOM 0 HG LEU A -4 25.400 24.117 -8.009 1.00 26.59 H new ATOM 0 HD11 LEU A -4 27.573 23.315 -8.365 1.00 26.51 H new ATOM 0 HD12 LEU A -4 27.154 24.296 -9.536 1.00 26.51 H new ATOM 0 HD13 LEU A -4 28.117 24.802 -8.386 1.00 26.51 H new ATOM 0 HD21 LEU A -4 26.655 23.634 -6.084 1.00 26.51 H new ATOM 0 HD22 LEU A -4 27.166 25.132 -6.045 1.00 26.51 H new ATOM 0 HD23 LEU A -4 25.637 24.811 -5.789 1.00 26.51 H new ATOM 87 N SER A -3 24.755 29.066 -7.294 1.00 33.87 N ATOM 88 CA SER A -3 24.497 30.486 -7.589 1.00 36.67 C ATOM 89 C SER A -3 24.830 30.860 -9.033 1.00 40.34 C ATOM 90 O SER A -3 25.852 30.427 -9.580 1.00 44.80 O ATOM 91 CB SER A -3 25.291 31.375 -6.636 1.00 38.37 C ATOM 92 OG SER A -3 26.672 31.043 -6.689 1.00 40.85 O ATOM 0 H SER A -3 25.274 28.938 -6.621 1.00 33.87 H new ATOM 0 HA SER A -3 23.546 30.628 -7.464 1.00 36.67 H new ATOM 0 HB2 SER A -3 25.166 32.307 -6.874 1.00 38.37 H new ATOM 0 HB3 SER A -3 24.960 31.266 -5.731 1.00 38.37 H new ATOM 0 HG SER A -3 27.100 31.538 -6.163 1.00 40.85 H new ATOM 93 N PRO A 2 30.832 34.852 -5.301 1.00 48.49 N ATOM 94 CA PRO A 2 30.924 33.911 -4.186 1.00 47.36 C ATOM 95 C PRO A 2 29.950 32.743 -4.366 1.00 43.46 C ATOM 96 O PRO A 2 28.770 32.959 -4.662 1.00 43.96 O ATOM 97 CB PRO A 2 30.516 34.762 -2.980 1.00 48.26 C ATOM 98 CG PRO A 2 29.576 35.783 -3.544 1.00 49.32 C ATOM 99 CD PRO A 2 29.949 35.996 -4.995 1.00 48.55 C ATOM 0 HA PRO A 2 31.804 33.513 -4.101 1.00 47.36 H new ATOM 0 HB2 PRO A 2 30.085 34.224 -2.297 1.00 48.26 H new ATOM 0 HB3 PRO A 2 31.287 35.181 -2.566 1.00 48.26 H new ATOM 0 HG2 PRO A 2 28.658 35.479 -3.469 1.00 49.32 H new ATOM 0 HG3 PRO A 2 29.640 36.615 -3.050 1.00 49.32 H new ATOM 0 HD2 PRO A 2 29.166 36.004 -5.567 1.00 48.55 H new ATOM 0 HD3 PRO A 2 30.404 36.843 -5.125 1.00 48.55 H new ATOM 100 N ILE A 3 30.443 31.523 -4.180 1.00 39.24 N ATOM 101 CA ILE A 3 29.646 30.329 -4.481 1.00 35.22 C ATOM 102 C ILE A 3 28.642 30.008 -3.381 1.00 30.06 C ATOM 103 O ILE A 3 29.011 29.768 -2.231 1.00 27.86 O ATOM 104 CB ILE A 3 30.527 29.103 -4.795 1.00 34.94 C ATOM 105 CG1 ILE A 3 31.321 29.356 -6.084 1.00 35.93 C ATOM 106 CG2 ILE A 3 29.670 27.846 -4.929 1.00 34.22 C ATOM 107 CD1 ILE A 3 32.496 28.423 -6.279 1.00 35.90 C ATOM 0 H ILE A 3 31.233 31.361 -3.882 1.00 39.24 H new ATOM 0 HA ILE A 3 29.142 30.541 -5.282 1.00 35.22 H new ATOM 0 HB ILE A 3 31.149 28.965 -4.063 1.00 34.94 H new ATOM 0 HG12 ILE A 3 30.723 29.270 -6.843 1.00 35.93 H new ATOM 0 HG13 ILE A 3 31.644 30.271 -6.079 1.00 35.93 H new ATOM 0 HG21 ILE A 3 30.239 27.086 -5.126 1.00 34.22 H new ATOM 0 HG22 ILE A 3 29.196 27.687 -4.098 1.00 34.22 H new ATOM 0 HG23 ILE A 3 29.030 27.965 -5.648 1.00 34.22 H new ATOM 0 HD11 ILE A 3 32.948 28.641 -7.109 1.00 35.90 H new ATOM 0 HD12 ILE A 3 33.115 28.523 -5.539 1.00 35.90 H new ATOM 0 HD13 ILE A 3 32.180 27.507 -6.314 1.00 35.90 H new ATOM 108 N THR A 4 27.370 30.002 -3.758 1.00 27.08 N ATOM 109 CA THR A 4 26.312 29.592 -2.849 1.00 26.41 C ATOM 110 C THR A 4 25.454 28.509 -3.498 1.00 22.93 C ATOM 111 O THR A 4 25.520 28.280 -4.716 1.00 21.68 O ATOM 112 CB THR A 4 25.399 30.763 -2.413 1.00 29.22 C ATOM 113 OG1 THR A 4 24.861 31.387 -3.577 1.00 32.38 O ATOM 114 CG2 THR A 4 26.165 31.798 -1.569 1.00 31.68 C ATOM 0 H THR A 4 27.098 30.233 -4.541 1.00 27.08 H new ATOM 0 HA THR A 4 26.751 29.251 -2.054 1.00 26.41 H new ATOM 0 HB THR A 4 24.685 30.408 -1.860 1.00 29.22 H new ATOM 0 HG1 THR A 4 24.172 30.974 -3.824 1.00 32.38 H new ATOM 0 HG21 THR A 4 25.565 32.516 -1.314 1.00 31.68 H new ATOM 0 HG22 THR A 4 26.515 31.371 -0.772 1.00 31.68 H new ATOM 0 HG23 THR A 4 26.899 32.161 -2.089 1.00 31.68 H new ATOM 115 N ALA A 5 24.672 27.844 -2.660 1.00 19.69 N ATOM 116 CA ALA A 5 23.912 26.672 -3.073 1.00 18.67 C ATOM 117 C ALA A 5 22.658 26.544 -2.242 1.00 17.56 C ATOM 118 O ALA A 5 22.645 26.911 -1.044 1.00 18.98 O ATOM 119 CB ALA A 5 24.779 25.415 -2.909 1.00 18.17 C ATOM 0 H ALA A 5 24.566 28.059 -1.834 1.00 19.69 H new ATOM 0 HA ALA A 5 23.659 26.770 -4.004 1.00 18.67 H new ATOM 0 HB1 ALA A 5 24.273 24.634 -3.184 1.00 18.17 H new ATOM 0 HB2 ALA A 5 25.573 25.495 -3.460 1.00 18.17 H new ATOM 0 HB3 ALA A 5 25.039 25.320 -1.979 1.00 18.17 H new ATOM 120 N TYR A 6 21.600 26.014 -2.855 1.00 16.54 N ATOM 121 CA TYR A 6 20.433 25.595 -2.071 1.00 16.15 C ATOM 122 C TYR A 6 19.877 24.308 -2.668 1.00 15.30 C ATOM 123 O TYR A 6 20.127 24.006 -3.835 1.00 14.15 O ATOM 124 CB TYR A 6 19.361 26.694 -2.000 1.00 16.98 C ATOM 125 CG TYR A 6 18.744 27.063 -3.332 1.00 17.81 C ATOM 126 CD1 TYR A 6 19.285 28.076 -4.118 1.00 18.92 C ATOM 127 CD2 TYR A 6 17.582 26.431 -3.785 1.00 18.72 C ATOM 128 CE1 TYR A 6 18.714 28.425 -5.327 1.00 20.02 C ATOM 129 CE2 TYR A 6 17.012 26.774 -4.995 1.00 19.04 C ATOM 130 CZ TYR A 6 17.566 27.779 -5.750 1.00 20.31 C ATOM 131 OH TYR A 6 17.003 28.115 -6.961 1.00 24.75 O ATOM 0 H TYR A 6 21.535 25.890 -3.703 1.00 16.54 H new ATOM 0 HA TYR A 6 20.711 25.433 -1.156 1.00 16.15 H new ATOM 0 HB2 TYR A 6 18.656 26.403 -1.400 1.00 16.98 H new ATOM 0 HB3 TYR A 6 19.756 27.489 -1.609 1.00 16.98 H new ATOM 0 HD1 TYR A 6 20.044 28.526 -3.824 1.00 18.92 H new ATOM 0 HD2 TYR A 6 17.187 25.770 -3.264 1.00 18.72 H new ATOM 0 HE1 TYR A 6 19.098 29.089 -5.852 1.00 20.02 H new ATOM 0 HE2 TYR A 6 16.255 26.326 -5.298 1.00 19.04 H new ATOM 0 HH TYR A 6 17.474 28.701 -7.336 1.00 24.75 H new ATOM 132 N SER A 7 19.153 23.551 -1.847 1.00 15.33 N ATOM 133 CA SER A 7 18.635 22.244 -2.261 1.00 15.30 C ATOM 134 C SER A 7 17.124 22.320 -2.353 1.00 15.51 C ATOM 135 O SER A 7 16.512 23.200 -1.718 1.00 14.47 O ATOM 136 CB SER A 7 19.026 21.206 -1.210 1.00 16.54 C ATOM 137 OG SER A 7 18.641 19.903 -1.623 1.00 20.56 O ATOM 0 H SER A 7 18.949 23.775 -1.042 1.00 15.33 H new ATOM 0 HA SER A 7 19.002 21.995 -3.123 1.00 15.30 H new ATOM 0 HB2 SER A 7 19.984 21.233 -1.063 1.00 16.54 H new ATOM 0 HB3 SER A 7 18.603 21.420 -0.364 1.00 16.54 H new ATOM 0 HG SER A 7 19.242 19.354 -1.415 1.00 20.56 H new ATOM 138 N GLN A 8 16.523 21.409 -3.128 1.00 14.35 N ATOM 139 CA GLN A 8 15.073 21.297 -3.252 1.00 14.35 C ATOM 140 C GLN A 8 14.784 19.822 -3.387 1.00 14.19 C ATOM 141 O GLN A 8 15.374 19.140 -4.246 1.00 12.95 O ATOM 142 CB GLN A 8 14.543 22.004 -4.513 1.00 15.74 C ATOM 143 CG GLN A 8 14.664 23.527 -4.512 1.00 17.51 C ATOM 144 CD GLN A 8 14.103 24.158 -5.770 1.00 18.31 C ATOM 145 OE1 GLN A 8 14.224 23.594 -6.856 1.00 18.81 O ATOM 146 NE2 GLN A 8 13.498 25.354 -5.634 1.00 18.63 N ATOM 0 H GLN A 8 16.955 20.834 -3.600 1.00 14.35 H new ATOM 0 HA GLN A 8 14.646 21.709 -2.484 1.00 14.35 H new ATOM 0 HB2 GLN A 8 15.020 21.658 -5.284 1.00 15.74 H new ATOM 0 HB3 GLN A 8 13.609 21.769 -4.628 1.00 15.74 H new ATOM 0 HG2 GLN A 8 14.198 23.884 -3.740 1.00 17.51 H new ATOM 0 HG3 GLN A 8 15.598 23.774 -4.419 1.00 17.51 H new ATOM 0 HE21 GLN A 8 13.433 25.717 -4.857 1.00 18.63 H new ATOM 0 HE22 GLN A 8 13.177 25.754 -6.324 1.00 18.63 H new ATOM 147 N GLN A 9 13.892 19.323 -2.548 1.00 12.93 N ATOM 148 CA GLN A 9 13.391 17.971 -2.726 1.00 13.22 C ATOM 149 C GLN A 9 12.510 17.896 -3.961 1.00 13.19 C ATOM 150 O GLN A 9 11.761 18.841 -4.252 1.00 13.06 O ATOM 151 CB GLN A 9 12.567 17.559 -1.517 1.00 13.16 C ATOM 152 CG GLN A 9 12.035 16.121 -1.581 1.00 13.42 C ATOM 153 CD GLN A 9 11.460 15.707 -0.255 1.00 14.26 C ATOM 154 OE1 GLN A 9 11.264 16.558 0.618 1.00 14.61 O ATOM 155 NE2 GLN A 9 11.225 14.402 -0.068 1.00 14.19 N ATOM 0 H GLN A 9 13.565 19.746 -1.874 1.00 12.93 H new ATOM 0 HA GLN A 9 14.150 17.375 -2.828 1.00 13.22 H new ATOM 0 HB2 GLN A 9 13.110 17.657 -0.719 1.00 13.16 H new ATOM 0 HB3 GLN A 9 11.817 18.167 -1.427 1.00 13.16 H new ATOM 0 HG2 GLN A 9 11.355 16.053 -2.269 1.00 13.42 H new ATOM 0 HG3 GLN A 9 12.752 15.517 -1.831 1.00 13.42 H new ATOM 0 HE21 GLN A 9 11.375 13.843 -0.704 1.00 14.19 H new ATOM 0 HE22 GLN A 9 10.924 14.123 0.688 1.00 14.19 H new ATOM 156 N THR A 10 12.549 16.766 -4.668 1.00 13.84 N ATOM 157 CA THR A 10 11.596 16.545 -5.766 1.00 14.87 C ATOM 158 C THR A 10 10.755 15.269 -5.619 1.00 15.67 C ATOM 159 O THR A 10 9.659 15.188 -6.197 1.00 16.71 O ATOM 160 CB THR A 10 12.288 16.537 -7.151 1.00 16.23 C ATOM 161 OG1 THR A 10 13.210 15.451 -7.209 1.00 17.76 O ATOM 162 CG2 THR A 10 13.040 17.822 -7.384 1.00 16.54 C ATOM 0 H THR A 10 13.106 16.125 -4.535 1.00 13.84 H new ATOM 0 HA THR A 10 10.992 17.302 -5.708 1.00 14.87 H new ATOM 0 HB THR A 10 11.606 16.443 -7.834 1.00 16.23 H new ATOM 0 HG1 THR A 10 13.035 14.970 -7.875 1.00 17.76 H new ATOM 0 HG21 THR A 10 13.465 17.795 -8.256 1.00 16.54 H new ATOM 0 HG22 THR A 10 12.423 18.569 -7.348 1.00 16.54 H new ATOM 0 HG23 THR A 10 13.717 17.930 -6.698 1.00 16.54 H new ATOM 163 N ARG A 11 11.252 14.276 -4.882 1.00 15.36 N ATOM 164 CA ARG A 11 10.514 13.002 -4.731 1.00 16.95 C ATOM 165 C ARG A 11 10.437 12.563 -3.303 1.00 17.60 C ATOM 166 O ARG A 11 11.372 12.778 -2.533 1.00 17.68 O ATOM 167 CB ARG A 11 11.136 11.870 -5.544 1.00 17.27 C ATOM 168 CG ARG A 11 10.946 12.033 -7.043 1.00 18.78 C ATOM 169 CD ARG A 11 11.172 10.709 -7.770 1.00 20.10 C ATOM 170 NE ARG A 11 10.827 10.849 -9.181 1.00 21.78 N ATOM 171 CZ ARG A 11 9.614 10.612 -9.686 1.00 23.73 C ATOM 172 NH1 ARG A 11 8.609 10.200 -8.901 1.00 23.13 N ATOM 173 NH2 ARG A 11 9.401 10.770 -10.990 1.00 25.06 N ATOM 0 H ARG A 11 12.003 14.310 -4.464 1.00 15.36 H new ATOM 0 HA ARG A 11 9.622 13.184 -5.065 1.00 16.95 H new ATOM 0 HB2 ARG A 11 12.085 11.822 -5.348 1.00 17.27 H new ATOM 0 HB3 ARG A 11 10.746 11.027 -5.264 1.00 17.27 H new ATOM 0 HG2 ARG A 11 10.050 12.357 -7.226 1.00 18.78 H new ATOM 0 HG3 ARG A 11 11.564 12.701 -7.380 1.00 18.78 H new ATOM 0 HD2 ARG A 11 12.099 10.437 -7.681 1.00 20.10 H new ATOM 0 HD3 ARG A 11 10.632 10.013 -7.365 1.00 20.10 H new ATOM 0 HE ARG A 11 11.446 11.101 -9.723 1.00 21.78 H new ATOM 0 HH11 ARG A 11 8.741 10.085 -8.059 1.00 23.13 H new ATOM 0 HH12 ARG A 11 7.832 10.051 -9.239 1.00 23.13 H new ATOM 0 HH21 ARG A 11 10.043 11.024 -11.503 1.00 25.06 H new ATOM 0 HH22 ARG A 11 8.621 10.619 -11.320 1.00 25.06 H new ATOM 174 N GLY A 12 9.321 11.926 -2.965 1.00 18.54 N ATOM 175 CA GLY A 12 9.174 11.301 -1.671 1.00 20.12 C ATOM 176 C GLY A 12 9.635 9.860 -1.706 1.00 21.22 C ATOM 177 O GLY A 12 10.003 9.328 -2.767 1.00 20.43 O ATOM 0 H GLY A 12 8.636 11.848 -3.479 1.00 18.54 H new ATOM 0 HA2 GLY A 12 9.688 11.792 -1.011 1.00 20.12 H new ATOM 0 HA3 GLY A 12 8.245 11.340 -1.393 1.00 20.12 H new ATOM 178 N LEU A 13 9.623 9.220 -0.539 1.00 21.60 N ATOM 179 CA LEU A 13 10.217 7.898 -0.410 1.00 23.41 C ATOM 180 C LEU A 13 9.456 6.836 -1.216 1.00 23.59 C ATOM 181 O LEU A 13 10.060 5.968 -1.838 1.00 22.80 O ATOM 182 CB LEU A 13 10.366 7.490 1.064 1.00 25.45 C ATOM 183 CG LEU A 13 11.231 6.239 1.306 1.00 27.34 C ATOM 184 CD1 LEU A 13 12.629 6.431 0.724 1.00 28.51 C ATOM 185 CD2 LEU A 13 11.314 5.882 2.788 1.00 30.18 C ATOM 0 H LEU A 13 9.278 9.533 0.184 1.00 21.60 H new ATOM 0 HA LEU A 13 11.107 7.952 -0.791 1.00 23.41 H new ATOM 0 HB2 LEU A 13 10.751 8.233 1.554 1.00 25.45 H new ATOM 0 HB3 LEU A 13 9.483 7.333 1.434 1.00 25.45 H new ATOM 0 HG LEU A 13 10.801 5.498 0.851 1.00 27.34 H new ATOM 0 HD11 LEU A 13 13.159 5.635 0.885 1.00 28.51 H new ATOM 0 HD12 LEU A 13 12.563 6.587 -0.231 1.00 28.51 H new ATOM 0 HD13 LEU A 13 13.054 7.193 1.147 1.00 28.51 H new ATOM 0 HD21 LEU A 13 11.865 5.092 2.900 1.00 30.18 H new ATOM 0 HD22 LEU A 13 11.706 6.622 3.278 1.00 30.18 H new ATOM 0 HD23 LEU A 13 10.423 5.706 3.129 1.00 30.18 H new ATOM 186 N LEU A 14 8.133 6.921 -1.217 1.00 23.08 N ATOM 187 CA LEU A 14 7.329 5.954 -1.947 1.00 25.87 C ATOM 188 C LEU A 14 7.520 6.074 -3.465 1.00 26.21 C ATOM 189 O LEU A 14 7.765 5.075 -4.147 1.00 26.12 O ATOM 190 CB LEU A 14 5.849 6.082 -1.561 1.00 27.36 C ATOM 191 CG LEU A 14 4.891 5.076 -2.217 1.00 30.48 C ATOM 192 CD1 LEU A 14 5.263 3.644 -1.834 1.00 30.56 C ATOM 193 CD2 LEU A 14 3.438 5.384 -1.859 1.00 30.92 C ATOM 0 H LEU A 14 7.684 7.527 -0.804 1.00 23.08 H new ATOM 0 HA LEU A 14 7.636 5.069 -1.695 1.00 25.87 H new ATOM 0 HB2 LEU A 14 5.775 5.991 -0.598 1.00 27.36 H new ATOM 0 HB3 LEU A 14 5.551 6.978 -1.785 1.00 27.36 H new ATOM 0 HG LEU A 14 4.980 5.161 -3.179 1.00 30.48 H new ATOM 0 HD11 LEU A 14 4.647 3.025 -2.257 1.00 30.56 H new ATOM 0 HD12 LEU A 14 6.167 3.454 -2.130 1.00 30.56 H new ATOM 0 HD13 LEU A 14 5.211 3.543 -0.871 1.00 30.56 H new ATOM 0 HD21 LEU A 14 2.855 4.736 -2.285 1.00 30.92 H new ATOM 0 HD22 LEU A 14 3.325 5.337 -0.897 1.00 30.92 H new ATOM 0 HD23 LEU A 14 3.210 6.275 -2.168 1.00 30.92 H new ATOM 194 N GLY A 15 7.428 7.301 -3.977 1.00 25.10 N ATOM 195 CA GLY A 15 7.637 7.570 -5.405 1.00 26.48 C ATOM 196 C GLY A 15 9.036 7.184 -5.853 1.00 26.41 C ATOM 197 O GLY A 15 9.232 6.714 -6.981 1.00 28.01 O ATOM 0 H GLY A 15 7.244 8.000 -3.511 1.00 25.10 H new ATOM 0 HA2 GLY A 15 6.983 7.078 -5.926 1.00 26.48 H new ATOM 0 HA3 GLY A 15 7.489 8.512 -5.582 1.00 26.48 H new ATOM 198 N CYS A 16 10.003 7.383 -4.965 1.00 25.34 N ATOM 199 CA CYS A 16 11.366 6.938 -5.194 1.00 26.13 C ATOM 200 C CYS A 16 11.446 5.409 -5.405 1.00 24.84 C ATOM 201 O CYS A 16 11.992 4.944 -6.410 1.00 22.11 O ATOM 202 CB CYS A 16 12.280 7.388 -4.056 1.00 28.34 C ATOM 203 SG CYS A 16 13.947 6.716 -4.188 1.00 37.61 S ATOM 0 H CYS A 16 9.884 7.781 -4.212 1.00 25.34 H new ATOM 0 HA CYS A 16 11.675 7.354 -6.014 1.00 26.13 H new ATOM 0 HB2 CYS A 16 12.326 8.357 -4.048 1.00 28.34 H new ATOM 0 HB3 CYS A 16 11.893 7.116 -3.209 1.00 28.34 H new ATOM 0 HG CYS A 16 14.611 7.108 -3.268 1.00 37.61 H new ATOM 204 N ILE A 17 10.907 4.633 -4.466 1.00 23.66 N ATOM 205 CA ILE A 17 10.896 3.167 -4.594 1.00 24.84 C ATOM 206 C ILE A 17 10.178 2.714 -5.874 1.00 23.35 C ATOM 207 O ILE A 17 10.696 1.859 -6.600 1.00 24.60 O ATOM 208 CB ILE A 17 10.276 2.452 -3.358 1.00 27.00 C ATOM 209 CG1 ILE A 17 10.910 2.922 -2.039 1.00 29.58 C ATOM 210 CG2 ILE A 17 10.388 0.942 -3.498 1.00 28.13 C ATOM 211 CD1 ILE A 17 12.410 2.711 -1.916 1.00 31.63 C ATOM 0 H ILE A 17 10.542 4.931 -3.747 1.00 23.66 H new ATOM 0 HA ILE A 17 11.828 2.904 -4.646 1.00 24.84 H new ATOM 0 HB ILE A 17 9.337 2.694 -3.328 1.00 27.00 H new ATOM 0 HG12 ILE A 17 10.723 3.867 -1.928 1.00 29.58 H new ATOM 0 HG13 ILE A 17 10.474 2.459 -1.307 1.00 29.58 H new ATOM 0 HG21 ILE A 17 9.997 0.515 -2.720 1.00 28.13 H new ATOM 0 HG22 ILE A 17 9.916 0.655 -4.295 1.00 28.13 H new ATOM 0 HG23 ILE A 17 11.323 0.692 -3.568 1.00 28.13 H new ATOM 0 HD11 ILE A 17 12.713 3.038 -1.054 1.00 31.63 H new ATOM 0 HD12 ILE A 17 12.611 1.765 -1.992 1.00 31.63 H new ATOM 0 HD13 ILE A 17 12.864 3.195 -2.623 1.00 31.63 H new ATOM 212 N ILE A 18 9.021 3.300 -6.175 1.00 21.34 N ATOM 213 CA ILE A 18 8.263 2.915 -7.379 1.00 22.08 C ATOM 214 C ILE A 18 9.040 3.254 -8.658 1.00 22.32 C ATOM 215 O ILE A 18 9.131 2.438 -9.580 1.00 23.22 O ATOM 216 CB ILE A 18 6.865 3.597 -7.426 1.00 22.43 C ATOM 217 CG1 ILE A 18 5.944 3.008 -6.347 1.00 24.16 C ATOM 218 CG2 ILE A 18 6.227 3.482 -8.817 1.00 22.93 C ATOM 219 CD1 ILE A 18 4.704 3.852 -6.088 1.00 27.49 C ATOM 0 H ILE A 18 8.655 3.919 -5.703 1.00 21.34 H new ATOM 0 HA ILE A 18 8.135 1.955 -7.330 1.00 22.08 H new ATOM 0 HB ILE A 18 6.988 4.542 -7.243 1.00 22.43 H new ATOM 0 HG12 ILE A 18 5.671 2.117 -6.615 1.00 24.16 H new ATOM 0 HG13 ILE A 18 6.443 2.915 -5.520 1.00 24.16 H new ATOM 0 HG21 ILE A 18 5.359 3.916 -8.812 1.00 22.93 H new ATOM 0 HG22 ILE A 18 6.799 3.911 -9.472 1.00 22.93 H new ATOM 0 HG23 ILE A 18 6.119 2.546 -9.047 1.00 22.93 H new ATOM 0 HD11 ILE A 18 4.164 3.432 -5.401 1.00 27.49 H new ATOM 0 HD12 ILE A 18 4.970 4.737 -5.793 1.00 27.49 H new ATOM 0 HD13 ILE A 18 4.186 3.926 -6.905 1.00 27.49 H new ATOM 220 N THR A 19 9.573 4.473 -8.714 1.00 20.44 N ATOM 221 CA THR A 19 10.334 4.935 -9.850 1.00 20.03 C ATOM 222 C THR A 19 11.587 4.072 -10.047 1.00 19.31 C ATOM 223 O THR A 19 12.016 3.866 -11.176 1.00 19.12 O ATOM 224 CB THR A 19 10.724 6.420 -9.709 1.00 20.11 C ATOM 225 OG1 THR A 19 9.540 7.214 -9.564 1.00 21.45 O ATOM 226 CG2 THR A 19 11.523 6.904 -10.937 1.00 20.02 C ATOM 0 H THR A 19 9.498 5.054 -8.084 1.00 20.44 H new ATOM 0 HA THR A 19 9.768 4.851 -10.633 1.00 20.03 H new ATOM 0 HB THR A 19 11.285 6.515 -8.923 1.00 20.11 H new ATOM 0 HG1 THR A 19 9.274 7.179 -8.768 1.00 21.45 H new ATOM 0 HG21 THR A 19 11.756 7.839 -10.824 1.00 20.02 H new ATOM 0 HG22 THR A 19 12.333 6.378 -11.024 1.00 20.02 H new ATOM 0 HG23 THR A 19 10.983 6.800 -11.736 1.00 20.02 H new ATOM 227 N SER A 20 12.142 3.547 -8.958 1.00 18.39 N ATOM 228 CA SER A 20 13.301 2.648 -9.049 1.00 20.70 C ATOM 229 C SER A 20 12.950 1.344 -9.788 1.00 21.82 C ATOM 230 O SER A 20 13.775 0.799 -10.533 1.00 21.16 O ATOM 231 CB SER A 20 13.829 2.314 -7.654 1.00 20.23 C ATOM 232 OG SER A 20 15.085 1.682 -7.740 1.00 23.97 O ATOM 0 H SER A 20 11.867 3.695 -8.157 1.00 18.39 H new ATOM 0 HA SER A 20 13.987 3.112 -9.554 1.00 20.70 H new ATOM 0 HB2 SER A 20 13.905 3.125 -7.128 1.00 20.23 H new ATOM 0 HB3 SER A 20 13.201 1.735 -7.194 1.00 20.23 H new ATOM 0 HG SER A 20 15.633 2.197 -8.115 1.00 23.97 H new ATOM 233 N LEU A 21 11.732 0.853 -9.564 1.00 22.87 N ATOM 234 CA LEU A 21 11.283 -0.408 -10.158 1.00 25.31 C ATOM 235 C LEU A 21 10.885 -0.250 -11.611 1.00 25.20 C ATOM 236 O LEU A 21 11.115 -1.143 -12.424 1.00 26.35 O ATOM 237 CB LEU A 21 10.126 -1.014 -9.347 1.00 28.31 C ATOM 238 CG LEU A 21 10.471 -1.274 -7.876 1.00 30.22 C ATOM 239 CD1 LEU A 21 9.294 -1.902 -7.125 1.00 34.58 C ATOM 240 CD2 LEU A 21 11.736 -2.115 -7.739 1.00 32.37 C ATOM 0 H LEU A 21 11.145 1.238 -9.067 1.00 22.87 H new ATOM 0 HA LEU A 21 12.038 -1.016 -10.130 1.00 25.31 H new ATOM 0 HB2 LEU A 21 9.363 -0.416 -9.391 1.00 28.31 H new ATOM 0 HB3 LEU A 21 9.856 -1.849 -9.760 1.00 28.31 H new ATOM 0 HG LEU A 21 10.650 -0.414 -7.464 1.00 30.22 H new ATOM 0 HD11 LEU A 21 9.544 -2.053 -6.200 1.00 34.58 H new ATOM 0 HD12 LEU A 21 8.531 -1.304 -7.160 1.00 34.58 H new ATOM 0 HD13 LEU A 21 9.060 -2.748 -7.539 1.00 34.58 H new ATOM 0 HD21 LEU A 21 11.927 -2.262 -6.799 1.00 32.37 H new ATOM 0 HD22 LEU A 21 11.606 -2.969 -8.179 1.00 32.37 H new ATOM 0 HD23 LEU A 21 12.481 -1.649 -8.151 1.00 32.37 H new ATOM 241 N THR A 22 10.283 0.888 -11.941 1.00 24.41 N ATOM 242 CA THR A 22 9.825 1.106 -13.307 1.00 23.69 C ATOM 243 C THR A 22 10.924 1.677 -14.191 1.00 23.02 C ATOM 244 O THR A 22 10.924 1.450 -15.393 1.00 23.66 O ATOM 245 CB THR A 22 8.599 2.024 -13.366 1.00 24.73 C ATOM 246 OG1 THR A 22 8.997 3.360 -13.053 1.00 25.18 O ATOM 247 CG2 THR A 22 7.528 1.555 -12.364 1.00 23.75 C ATOM 0 H THR A 22 10.132 1.537 -11.398 1.00 24.41 H new ATOM 0 HA THR A 22 9.574 0.232 -13.644 1.00 23.69 H new ATOM 0 HB THR A 22 8.222 1.993 -14.259 1.00 24.73 H new ATOM 0 HG1 THR A 22 8.315 3.845 -12.977 1.00 25.18 H new ATOM 0 HG21 THR A 22 6.759 2.144 -12.412 1.00 23.75 H new ATOM 0 HG22 THR A 22 7.255 0.650 -12.582 1.00 23.75 H new ATOM 0 HG23 THR A 22 7.894 1.575 -11.466 1.00 23.75 H new ATOM 248 N GLY A 23 11.858 2.420 -13.598 1.00 21.23 N ATOM 249 CA GLY A 23 12.914 3.082 -14.367 1.00 20.25 C ATOM 250 C GLY A 23 12.428 4.288 -15.158 1.00 20.97 C ATOM 251 O GLY A 23 13.167 4.845 -15.967 1.00 18.59 O ATOM 0 H GLY A 23 11.898 2.554 -12.749 1.00 21.23 H new ATOM 0 HA2 GLY A 23 13.617 3.364 -13.761 1.00 20.25 H new ATOM 0 HA3 GLY A 23 13.308 2.441 -14.979 1.00 20.25 H new ATOM 252 N ARG A 24 11.192 4.696 -14.890 1.00 21.62 N ATOM 253 CA ARG A 24 10.534 5.754 -15.625 1.00 24.04 C ATOM 254 C ARG A 24 10.347 6.999 -14.754 1.00 24.05 C ATOM 255 O ARG A 24 9.593 6.971 -13.781 1.00 23.97 O ATOM 256 CB ARG A 24 9.172 5.249 -16.089 1.00 27.40 C ATOM 257 CG ARG A 24 8.349 6.271 -16.843 1.00 32.67 C ATOM 258 CD ARG A 24 8.780 6.349 -18.297 1.00 36.05 C ATOM 259 NE ARG A 24 8.797 5.043 -18.955 1.00 37.16 N ATOM 260 CZ ARG A 24 8.783 4.880 -20.278 1.00 37.18 C ATOM 261 NH1 ARG A 24 8.728 5.935 -21.084 1.00 35.65 N ATOM 262 NH2 ARG A 24 8.816 3.662 -20.797 1.00 38.70 N ATOM 0 H ARG A 24 10.709 4.357 -14.265 1.00 21.62 H new ATOM 0 HA ARG A 24 11.085 5.999 -16.385 1.00 24.04 H new ATOM 0 HB2 ARG A 24 9.303 4.473 -16.657 1.00 27.40 H new ATOM 0 HB3 ARG A 24 8.669 4.952 -15.315 1.00 27.40 H new ATOM 0 HG2 ARG A 24 7.409 6.036 -16.793 1.00 32.67 H new ATOM 0 HG3 ARG A 24 8.446 7.141 -16.426 1.00 32.67 H new ATOM 0 HD2 ARG A 24 8.179 6.940 -18.777 1.00 36.05 H new ATOM 0 HD3 ARG A 24 9.665 6.743 -18.347 1.00 36.05 H new ATOM 0 HE ARG A 24 8.817 4.340 -18.460 1.00 37.16 H new ATOM 0 HH11 ARG A 24 8.701 6.728 -20.753 1.00 35.65 H new ATOM 0 HH12 ARG A 24 8.719 5.825 -21.937 1.00 35.65 H new ATOM 0 HH21 ARG A 24 8.846 2.975 -20.280 1.00 38.70 H new ATOM 0 HH22 ARG A 24 8.807 3.558 -21.651 1.00 38.70 H new ATOM 263 N ASP A 25 11.028 8.086 -15.110 1.00 22.99 N ATOM 264 CA ASP A 25 10.938 9.314 -14.327 1.00 24.28 C ATOM 265 C ASP A 25 10.521 10.476 -15.209 1.00 22.92 C ATOM 266 O ASP A 25 11.317 10.936 -16.019 1.00 21.66 O ATOM 267 CB ASP A 25 12.292 9.606 -13.660 1.00 25.31 C ATOM 268 CG ASP A 25 12.302 10.916 -12.887 1.00 29.72 C ATOM 269 OD1 ASP A 25 11.238 11.590 -12.728 1.00 28.81 O ATOM 270 OD2 ASP A 25 13.404 11.276 -12.409 1.00 31.85 O ATOM 0 H ASP A 25 11.544 8.133 -15.796 1.00 22.99 H new ATOM 0 HA ASP A 25 10.265 9.199 -13.638 1.00 24.28 H new ATOM 0 HB2 ASP A 25 12.514 8.879 -13.058 1.00 25.31 H new ATOM 0 HB3 ASP A 25 12.983 9.632 -14.340 1.00 25.31 H new ATOM 271 N ARG A 26 9.295 10.963 -15.025 1.00 22.68 N ATOM 272 CA ARG A 26 8.756 12.048 -15.866 1.00 24.79 C ATOM 273 C ARG A 26 9.009 13.470 -15.350 1.00 26.24 C ATOM 274 O ARG A 26 8.670 14.433 -16.032 1.00 26.70 O ATOM 275 CB ARG A 26 7.251 11.884 -16.056 1.00 27.46 C ATOM 276 CG ARG A 26 6.791 10.558 -16.629 1.00 29.90 C ATOM 277 CD ARG A 26 5.353 10.317 -16.181 1.00 35.03 C ATOM 278 NE ARG A 26 4.831 9.062 -16.698 1.00 38.72 N ATOM 279 CZ ARG A 26 5.027 7.873 -16.138 1.00 40.74 C ATOM 280 NH1 ARG A 26 5.736 7.758 -15.016 1.00 42.85 N ATOM 281 NH2 ARG A 26 4.515 6.793 -16.711 1.00 41.82 N ATOM 0 H ARG A 26 8.754 10.682 -14.419 1.00 22.68 H new ATOM 0 HA ARG A 26 9.242 11.958 -16.700 1.00 24.79 H new ATOM 0 HB2 ARG A 26 6.819 12.011 -15.197 1.00 27.46 H new ATOM 0 HB3 ARG A 26 6.938 12.593 -16.639 1.00 27.46 H new ATOM 0 HG2 ARG A 26 6.846 10.571 -17.597 1.00 29.90 H new ATOM 0 HG3 ARG A 26 7.366 9.839 -16.322 1.00 29.90 H new ATOM 0 HD2 ARG A 26 5.313 10.310 -15.212 1.00 35.03 H new ATOM 0 HD3 ARG A 26 4.793 11.049 -16.483 1.00 35.03 H new ATOM 0 HE ARG A 26 4.362 9.091 -17.418 1.00 38.72 H new ATOM 0 HH11 ARG A 26 6.072 8.458 -14.646 1.00 42.85 H new ATOM 0 HH12 ARG A 26 5.857 6.984 -14.661 1.00 42.85 H new ATOM 0 HH21 ARG A 26 4.061 6.866 -17.438 1.00 41.82 H new ATOM 0 HH22 ARG A 26 4.637 6.019 -16.356 1.00 41.82 H new ATOM 282 N ASN A 27 9.551 13.607 -14.145 1.00 25.24 N ATOM 283 CA ASN A 27 9.812 14.917 -13.552 1.00 25.90 C ATOM 284 C ASN A 27 10.816 15.745 -14.340 1.00 26.47 C ATOM 285 O ASN A 27 11.750 15.196 -14.930 1.00 24.75 O ATOM 286 CB ASN A 27 10.380 14.759 -12.133 1.00 27.26 C ATOM 287 CG ASN A 27 9.325 14.432 -11.099 1.00 29.63 C ATOM 288 OD1 ASN A 27 8.119 14.358 -11.395 1.00 29.72 O ATOM 289 ND2 ASN A 27 9.781 14.220 -9.864 1.00 27.54 N ATOM 0 H ASN A 27 9.778 12.944 -13.647 1.00 25.24 H new ATOM 0 HA ASN A 27 8.957 15.374 -13.552 1.00 25.90 H new ATOM 0 HB2 ASN A 27 11.050 14.057 -12.136 1.00 27.26 H new ATOM 0 HB3 ASN A 27 10.830 15.580 -11.878 1.00 27.26 H new ATOM 0 HD21 ASN A 27 9.233 14.022 -9.231 1.00 27.54 H new ATOM 0 HD22 ASN A 27 10.623 14.281 -9.700 1.00 27.54 H new ATOM 290 N GLN A 28 10.643 17.070 -14.305 1.00 26.07 N ATOM 291 CA GLN A 28 11.618 17.990 -14.874 1.00 27.75 C ATOM 292 C GLN A 28 12.894 17.990 -14.013 1.00 25.84 C ATOM 293 O GLN A 28 12.838 17.926 -12.782 1.00 25.36 O ATOM 294 CB GLN A 28 11.038 19.412 -15.018 1.00 33.23 C ATOM 295 CG GLN A 28 10.912 20.209 -13.720 1.00 40.64 C ATOM 296 CD GLN A 28 10.308 21.605 -13.898 1.00 45.14 C ATOM 297 OE1 GLN A 28 9.522 21.847 -14.812 1.00 49.34 O ATOM 298 NE2 GLN A 28 10.652 22.517 -12.994 1.00 48.60 N ATOM 0 H GLN A 28 9.959 17.454 -13.952 1.00 26.07 H new ATOM 0 HA GLN A 28 11.844 17.687 -15.767 1.00 27.75 H new ATOM 0 HB2 GLN A 28 11.598 19.912 -15.632 1.00 33.23 H new ATOM 0 HB3 GLN A 28 10.160 19.346 -15.425 1.00 33.23 H new ATOM 0 HG2 GLN A 28 10.364 19.708 -13.096 1.00 40.64 H new ATOM 0 HG3 GLN A 28 11.791 20.296 -13.319 1.00 40.64 H new ATOM 0 HE21 GLN A 28 11.205 22.314 -12.367 1.00 48.60 H new ATOM 0 HE22 GLN A 28 10.322 23.310 -13.036 1.00 48.60 H new ATOM 299 N VAL A 29 14.034 18.026 -14.673 1.00 23.56 N ATOM 300 CA VAL A 29 15.312 18.058 -13.971 1.00 23.81 C ATOM 301 C VAL A 29 15.837 19.487 -14.018 1.00 24.46 C ATOM 302 O VAL A 29 15.738 20.152 -15.055 1.00 25.11 O ATOM 303 CB VAL A 29 16.304 17.061 -14.615 1.00 23.52 C ATOM 304 CG1 VAL A 29 17.663 17.099 -13.925 1.00 21.66 C ATOM 305 CG2 VAL A 29 15.730 15.643 -14.583 1.00 23.09 C ATOM 0 H VAL A 29 14.096 18.033 -15.531 1.00 23.56 H new ATOM 0 HA VAL A 29 15.203 17.787 -13.046 1.00 23.81 H new ATOM 0 HB VAL A 29 16.434 17.328 -15.538 1.00 23.52 H new ATOM 0 HG11 VAL A 29 18.260 16.464 -14.351 1.00 21.66 H new ATOM 0 HG12 VAL A 29 18.037 17.991 -13.995 1.00 21.66 H new ATOM 0 HG13 VAL A 29 17.558 16.865 -12.989 1.00 21.66 H new ATOM 0 HG21 VAL A 29 16.361 15.029 -14.989 1.00 23.09 H new ATOM 0 HG22 VAL A 29 15.569 15.379 -13.663 1.00 23.09 H new ATOM 0 HG23 VAL A 29 14.895 15.621 -15.076 1.00 23.09 H new ATOM 306 N GLU A 30 16.375 19.973 -12.903 1.00 24.32 N ATOM 307 CA GLU A 30 17.049 21.279 -12.880 1.00 24.18 C ATOM 308 C GLU A 30 18.319 21.167 -12.061 1.00 21.63 C ATOM 309 O GLU A 30 18.492 20.201 -11.333 1.00 19.68 O ATOM 310 CB GLU A 30 16.171 22.368 -12.260 1.00 29.34 C ATOM 311 CG GLU A 30 14.831 22.609 -12.951 1.00 36.51 C ATOM 312 CD GLU A 30 13.994 23.680 -12.260 1.00 42.35 C ATOM 313 OE1 GLU A 30 14.568 24.524 -11.522 1.00 45.98 O ATOM 314 OE2 GLU A 30 12.755 23.680 -12.458 1.00 45.68 O ATOM 0 H GLU A 30 16.363 19.565 -12.146 1.00 24.32 H new ATOM 0 HA GLU A 30 17.241 21.527 -13.798 1.00 24.18 H new ATOM 0 HB2 GLU A 30 16.002 22.136 -11.334 1.00 29.34 H new ATOM 0 HB3 GLU A 30 16.669 23.200 -12.257 1.00 29.34 H new ATOM 0 HG2 GLU A 30 14.989 22.872 -13.871 1.00 36.51 H new ATOM 0 HG3 GLU A 30 14.330 21.779 -12.975 1.00 36.51 H new ATOM 315 N GLY A 31 19.208 22.148 -12.190 1.00 20.15 N ATOM 316 CA GLY A 31 20.377 22.221 -11.319 1.00 20.10 C ATOM 317 C GLY A 31 21.585 21.421 -11.794 1.00 21.03 C ATOM 318 O GLY A 31 21.498 20.568 -12.696 1.00 19.91 O ATOM 0 H GLY A 31 19.153 22.778 -12.773 1.00 20.15 H new ATOM 0 HA2 GLY A 31 20.638 23.151 -11.227 1.00 20.10 H new ATOM 0 HA3 GLY A 31 20.126 21.908 -10.436 1.00 20.10 H new ATOM 319 N GLU A 32 22.710 21.692 -11.145 1.00 19.35 N ATOM 320 CA GLU A 32 24.001 21.114 -11.499 1.00 20.38 C ATOM 321 C GLU A 32 24.278 19.804 -10.772 1.00 18.70 C ATOM 322 O GLU A 32 25.028 18.961 -11.256 1.00 18.37 O ATOM 323 CB GLU A 32 25.092 22.140 -11.164 1.00 22.93 C ATOM 324 CG GLU A 32 24.996 23.399 -12.034 1.00 26.63 C ATOM 325 CD GLU A 32 24.330 24.609 -11.370 1.00 29.49 C ATOM 326 OE1 GLU A 32 23.356 24.493 -10.572 1.00 26.83 O ATOM 327 OE2 GLU A 32 24.800 25.730 -11.679 1.00 30.87 O ATOM 0 H GLU A 32 22.746 22.228 -10.473 1.00 19.35 H new ATOM 0 HA GLU A 32 23.994 20.907 -12.447 1.00 20.38 H new ATOM 0 HB2 GLU A 32 25.022 22.390 -10.229 1.00 22.93 H new ATOM 0 HB3 GLU A 32 25.964 21.732 -11.284 1.00 22.93 H new ATOM 0 HG2 GLU A 32 25.891 23.652 -12.309 1.00 26.63 H new ATOM 0 HG3 GLU A 32 24.503 23.180 -12.840 1.00 26.63 H new ATOM 328 N VAL A 33 23.672 19.655 -9.596 1.00 16.20 N ATOM 329 CA VAL A 33 23.910 18.496 -8.728 1.00 14.71 C ATOM 330 C VAL A 33 22.564 17.843 -8.459 1.00 14.08 C ATOM 331 O VAL A 33 21.604 18.529 -8.128 1.00 13.58 O ATOM 332 CB VAL A 33 24.603 18.917 -7.421 1.00 14.55 C ATOM 333 CG1 VAL A 33 24.833 17.728 -6.467 1.00 14.56 C ATOM 334 CG2 VAL A 33 25.931 19.572 -7.749 1.00 15.09 C ATOM 0 H VAL A 33 23.110 20.222 -9.276 1.00 16.20 H new ATOM 0 HA VAL A 33 24.505 17.864 -9.162 1.00 14.71 H new ATOM 0 HB VAL A 33 24.018 19.542 -6.965 1.00 14.55 H new ATOM 0 HG11 VAL A 33 25.271 18.041 -5.660 1.00 14.56 H new ATOM 0 HG12 VAL A 33 23.980 17.327 -6.237 1.00 14.56 H new ATOM 0 HG13 VAL A 33 25.393 17.067 -6.903 1.00 14.56 H new ATOM 0 HG21 VAL A 33 26.372 19.839 -6.927 1.00 15.09 H new ATOM 0 HG22 VAL A 33 26.493 18.942 -8.227 1.00 15.09 H new ATOM 0 HG23 VAL A 33 25.778 20.354 -8.303 1.00 15.09 H new ATOM 335 N GLN A 34 22.487 16.528 -8.634 1.00 13.61 N ATOM 336 CA GLN A 34 21.250 15.811 -8.351 1.00 13.53 C ATOM 337 C GLN A 34 21.455 15.015 -7.078 1.00 12.45 C ATOM 338 O GLN A 34 22.539 14.493 -6.851 1.00 12.19 O ATOM 339 CB GLN A 34 20.862 14.889 -9.509 1.00 14.39 C ATOM 340 CG GLN A 34 20.800 15.586 -10.865 1.00 15.35 C ATOM 341 CD GLN A 34 19.799 16.722 -10.880 1.00 16.43 C ATOM 342 OE1 GLN A 34 18.684 16.595 -10.346 1.00 16.59 O ATOM 343 NE2 GLN A 34 20.224 17.885 -11.417 1.00 16.68 N ATOM 0 H GLN A 34 23.134 16.036 -8.914 1.00 13.61 H new ATOM 0 HA GLN A 34 20.523 16.444 -8.241 1.00 13.53 H new ATOM 0 HB2 GLN A 34 21.502 14.161 -9.559 1.00 14.39 H new ATOM 0 HB3 GLN A 34 19.997 14.494 -9.319 1.00 14.39 H new ATOM 0 HG2 GLN A 34 21.679 15.929 -11.091 1.00 15.35 H new ATOM 0 HG3 GLN A 34 20.563 14.940 -11.548 1.00 15.35 H new ATOM 0 HE21 GLN A 34 21.003 17.933 -11.778 1.00 16.68 H new ATOM 0 HE22 GLN A 34 19.716 18.578 -11.398 1.00 16.68 H new ATOM 344 N VAL A 35 20.435 14.991 -6.221 1.00 11.25 N ATOM 345 CA VAL A 35 20.414 14.079 -5.092 1.00 11.25 C ATOM 346 C VAL A 35 19.762 12.817 -5.653 1.00 11.64 C ATOM 347 O VAL A 35 18.660 12.890 -6.202 1.00 11.78 O ATOM 348 CB VAL A 35 19.571 14.607 -3.920 1.00 11.23 C ATOM 349 CG1 VAL A 35 19.638 13.627 -2.751 1.00 11.13 C ATOM 350 CG2 VAL A 35 20.079 15.982 -3.487 1.00 11.79 C ATOM 0 H VAL A 35 19.744 15.500 -6.281 1.00 11.25 H new ATOM 0 HA VAL A 35 21.306 13.944 -4.737 1.00 11.25 H new ATOM 0 HB VAL A 35 18.648 14.693 -4.206 1.00 11.23 H new ATOM 0 HG11 VAL A 35 19.105 13.965 -2.014 1.00 11.13 H new ATOM 0 HG12 VAL A 35 19.293 12.765 -3.031 1.00 11.13 H new ATOM 0 HG13 VAL A 35 20.559 13.528 -2.464 1.00 11.13 H new ATOM 0 HG21 VAL A 35 19.542 16.308 -2.748 1.00 11.79 H new ATOM 0 HG22 VAL A 35 21.005 15.912 -3.207 1.00 11.79 H new ATOM 0 HG23 VAL A 35 20.013 16.601 -4.231 1.00 11.79 H new ATOM 351 N VAL A 36 20.444 11.684 -5.529 1.00 11.27 N ATOM 352 CA VAL A 36 19.987 10.461 -6.165 1.00 11.75 C ATOM 353 C VAL A 36 19.854 9.365 -5.129 1.00 12.62 C ATOM 354 O VAL A 36 20.480 9.413 -4.052 1.00 12.06 O ATOM 355 CB VAL A 36 20.888 10.022 -7.356 1.00 12.06 C ATOM 356 CG1 VAL A 36 20.843 11.054 -8.498 1.00 12.44 C ATOM 357 CG2 VAL A 36 22.332 9.838 -6.915 1.00 13.22 C ATOM 0 H VAL A 36 21.173 11.605 -5.080 1.00 11.27 H new ATOM 0 HA VAL A 36 19.115 10.638 -6.551 1.00 11.75 H new ATOM 0 HB VAL A 36 20.540 9.175 -7.675 1.00 12.06 H new ATOM 0 HG11 VAL A 36 21.412 10.757 -9.226 1.00 12.44 H new ATOM 0 HG12 VAL A 36 19.931 11.145 -8.817 1.00 12.44 H new ATOM 0 HG13 VAL A 36 21.158 11.912 -8.172 1.00 12.44 H new ATOM 0 HG21 VAL A 36 22.870 9.565 -7.674 1.00 13.22 H new ATOM 0 HG22 VAL A 36 22.672 10.675 -6.562 1.00 13.22 H new ATOM 0 HG23 VAL A 36 22.376 9.156 -6.227 1.00 13.22 H new ATOM 358 N SER A 37 19.006 8.388 -5.425 1.00 12.85 N ATOM 359 CA SER A 37 18.756 7.336 -4.469 1.00 14.34 C ATOM 360 C SER A 37 18.447 6.024 -5.178 1.00 15.16 C ATOM 361 O SER A 37 17.885 6.012 -6.270 1.00 13.76 O ATOM 362 CB SER A 37 17.590 7.733 -3.542 1.00 15.83 C ATOM 363 OG SER A 37 17.389 6.774 -2.492 1.00 18.64 O ATOM 0 H SER A 37 18.573 8.321 -6.165 1.00 12.85 H new ATOM 0 HA SER A 37 19.555 7.209 -3.934 1.00 14.34 H new ATOM 0 HB2 SER A 37 17.768 8.604 -3.154 1.00 15.83 H new ATOM 0 HB3 SER A 37 16.776 7.816 -4.064 1.00 15.83 H new ATOM 0 HG SER A 37 17.216 6.023 -2.827 1.00 18.64 H new ATOM 364 N THR A 38 18.866 4.928 -4.559 1.00 17.19 N ATOM 365 CA THR A 38 18.340 3.620 -4.891 1.00 20.58 C ATOM 366 C THR A 38 17.349 3.261 -3.772 1.00 22.81 C ATOM 367 O THR A 38 17.064 4.079 -2.891 1.00 21.30 O ATOM 368 CB THR A 38 19.448 2.547 -4.976 1.00 20.66 C ATOM 369 OG1 THR A 38 20.068 2.378 -3.701 1.00 22.49 O ATOM 370 CG2 THR A 38 20.537 2.945 -5.974 1.00 22.05 C ATOM 0 H THR A 38 19.461 4.925 -3.938 1.00 17.19 H new ATOM 0 HA THR A 38 17.918 3.644 -5.764 1.00 20.58 H new ATOM 0 HB THR A 38 19.026 1.724 -5.267 1.00 20.66 H new ATOM 0 HG1 THR A 38 20.371 1.597 -3.638 1.00 22.49 H new ATOM 0 HG21 THR A 38 21.216 2.253 -6.005 1.00 22.05 H new ATOM 0 HG22 THR A 38 20.145 3.052 -6.855 1.00 22.05 H new ATOM 0 HG23 THR A 38 20.941 3.782 -5.696 1.00 22.05 H new ATOM 371 N ALA A 39 16.839 2.030 -3.804 1.00 25.90 N ATOM 372 CA ALA A 39 15.994 1.516 -2.727 1.00 26.12 C ATOM 373 C ALA A 39 16.759 1.436 -1.403 1.00 26.86 C ATOM 374 O ALA A 39 16.141 1.378 -0.336 1.00 27.37 O ATOM 375 CB ALA A 39 15.441 0.136 -3.105 1.00 28.27 C ATOM 0 H ALA A 39 16.972 1.473 -4.446 1.00 25.90 H new ATOM 0 HA ALA A 39 15.256 2.134 -2.605 1.00 26.12 H new ATOM 0 HB1 ALA A 39 14.882 -0.197 -2.386 1.00 28.27 H new ATOM 0 HB2 ALA A 39 14.914 0.209 -3.916 1.00 28.27 H new ATOM 0 HB3 ALA A 39 16.177 -0.478 -3.253 1.00 28.27 H new ATOM 376 N THR A 40 18.093 1.416 -1.454 1.00 24.05 N ATOM 377 CA THR A 40 18.849 1.167 -0.228 1.00 25.11 C ATOM 378 C THR A 40 19.819 2.279 0.196 1.00 22.55 C ATOM 379 O THR A 40 20.269 2.297 1.334 1.00 23.07 O ATOM 380 CB THR A 40 19.630 -0.172 -0.276 1.00 28.09 C ATOM 381 OG1 THR A 40 20.605 -0.113 -1.322 1.00 33.85 O ATOM 382 CG2 THR A 40 18.692 -1.382 -0.504 1.00 29.81 C ATOM 0 H THR A 40 18.564 1.540 -2.163 1.00 24.05 H new ATOM 0 HA THR A 40 18.150 1.132 0.443 1.00 25.11 H new ATOM 0 HB THR A 40 20.064 -0.297 0.582 1.00 28.09 H new ATOM 0 HG1 THR A 40 20.334 0.400 -1.929 1.00 33.85 H new ATOM 0 HG21 THR A 40 19.216 -2.198 -0.528 1.00 29.81 H new ATOM 0 HG22 THR A 40 18.048 -1.433 0.219 1.00 29.81 H new ATOM 0 HG23 THR A 40 18.224 -1.274 -1.347 1.00 29.81 H new ATOM 383 N GLN A 41 20.152 3.202 -0.702 1.00 19.41 N ATOM 384 CA GLN A 41 21.147 4.211 -0.348 1.00 18.87 C ATOM 385 C GLN A 41 21.025 5.460 -1.201 1.00 16.66 C ATOM 386 O GLN A 41 20.464 5.407 -2.294 1.00 16.63 O ATOM 387 CB GLN A 41 22.570 3.635 -0.416 1.00 20.44 C ATOM 388 CG GLN A 41 22.997 3.153 -1.782 1.00 23.56 C ATOM 389 CD GLN A 41 24.007 2.011 -1.708 1.00 26.75 C ATOM 390 OE1 GLN A 41 24.136 1.344 -0.687 1.00 27.73 O ATOM 391 NE2 GLN A 41 24.715 1.784 -2.790 1.00 26.75 N ATOM 0 H GLN A 41 19.827 3.263 -1.496 1.00 19.41 H new ATOM 0 HA GLN A 41 20.969 4.473 0.569 1.00 18.87 H new ATOM 0 HB2 GLN A 41 23.194 4.315 -0.118 1.00 20.44 H new ATOM 0 HB3 GLN A 41 22.636 2.896 0.208 1.00 20.44 H new ATOM 0 HG2 GLN A 41 22.216 2.859 -2.277 1.00 23.56 H new ATOM 0 HG3 GLN A 41 23.384 3.892 -2.276 1.00 23.56 H new ATOM 0 HE21 GLN A 41 24.600 2.271 -3.489 1.00 26.75 H new ATOM 0 HE22 GLN A 41 25.294 1.148 -2.799 1.00 26.75 H new ATOM 392 N SER A 42 21.542 6.571 -0.692 1.00 14.91 N ATOM 393 CA SER A 42 21.416 7.858 -1.383 1.00 14.36 C ATOM 394 C SER A 42 22.732 8.626 -1.331 1.00 13.61 C ATOM 395 O SER A 42 23.575 8.394 -0.445 1.00 14.32 O ATOM 396 CB SER A 42 20.252 8.700 -0.840 1.00 13.80 C ATOM 397 OG SER A 42 20.558 9.224 0.452 1.00 15.77 O ATOM 0 H SER A 42 21.971 6.606 0.053 1.00 14.91 H new ATOM 0 HA SER A 42 21.209 7.670 -2.312 1.00 14.36 H new ATOM 0 HB2 SER A 42 20.063 9.429 -1.452 1.00 13.80 H new ATOM 0 HB3 SER A 42 19.451 8.156 -0.790 1.00 13.80 H new ATOM 0 HG SER A 42 20.231 8.724 1.042 1.00 15.77 H new ATOM 398 N PHE A 43 22.904 9.513 -2.312 1.00 12.76 N ATOM 399 CA PHE A 43 24.188 10.127 -2.591 1.00 12.20 C ATOM 400 C PHE A 43 23.978 11.197 -3.665 1.00 11.71 C ATOM 401 O PHE A 43 22.835 11.539 -3.987 1.00 11.03 O ATOM 402 CB PHE A 43 25.261 9.071 -2.994 1.00 12.63 C ATOM 403 CG PHE A 43 24.828 8.130 -4.111 1.00 13.85 C ATOM 404 CD1 PHE A 43 24.080 6.990 -3.833 1.00 13.98 C ATOM 405 CD2 PHE A 43 25.175 8.387 -5.431 1.00 13.59 C ATOM 406 CE1 PHE A 43 23.658 6.137 -4.859 1.00 14.65 C ATOM 407 CE2 PHE A 43 24.781 7.535 -6.452 1.00 13.95 C ATOM 408 CZ PHE A 43 24.009 6.412 -6.167 1.00 14.02 C ATOM 0 H PHE A 43 22.271 9.773 -2.834 1.00 12.76 H new ATOM 0 HA PHE A 43 24.537 10.547 -1.789 1.00 12.20 H new ATOM 0 HB2 PHE A 43 26.067 9.534 -3.270 1.00 12.63 H new ATOM 0 HB3 PHE A 43 25.490 8.544 -2.212 1.00 12.63 H new ATOM 0 HD1 PHE A 43 23.857 6.792 -2.952 1.00 13.98 H new ATOM 0 HD2 PHE A 43 25.679 9.142 -5.633 1.00 13.59 H new ATOM 0 HE1 PHE A 43 23.143 5.388 -4.661 1.00 14.65 H new ATOM 0 HE2 PHE A 43 25.033 7.714 -7.329 1.00 13.95 H new ATOM 0 HZ PHE A 43 23.731 5.850 -6.854 1.00 14.02 H new ATOM 409 N LEU A 44 25.065 11.711 -4.231 1.00 10.75 N ATOM 410 CA LEU A 44 24.959 12.853 -5.126 1.00 10.76 C ATOM 411 C LEU A 44 25.499 12.501 -6.498 1.00 10.69 C ATOM 412 O LEU A 44 26.314 11.614 -6.617 1.00 10.80 O ATOM 413 CB LEU A 44 25.725 14.048 -4.576 1.00 10.41 C ATOM 414 CG LEU A 44 25.220 14.734 -3.302 1.00 10.09 C ATOM 415 CD1 LEU A 44 26.110 15.938 -3.013 1.00 10.57 C ATOM 416 CD2 LEU A 44 23.768 15.194 -3.430 1.00 10.18 C ATOM 0 H LEU A 44 25.864 11.416 -4.111 1.00 10.75 H new ATOM 0 HA LEU A 44 24.020 13.087 -5.198 1.00 10.76 H new ATOM 0 HB2 LEU A 44 26.637 13.761 -4.412 1.00 10.41 H new ATOM 0 HB3 LEU A 44 25.761 14.719 -5.275 1.00 10.41 H new ATOM 0 HG LEU A 44 25.257 14.091 -2.577 1.00 10.09 H new ATOM 0 HD11 LEU A 44 25.802 16.383 -2.208 1.00 10.57 H new ATOM 0 HD12 LEU A 44 27.025 15.642 -2.888 1.00 10.57 H new ATOM 0 HD13 LEU A 44 26.070 16.557 -3.759 1.00 10.57 H new ATOM 0 HD21 LEU A 44 23.490 15.621 -2.605 1.00 10.18 H new ATOM 0 HD22 LEU A 44 23.692 15.826 -4.162 1.00 10.18 H new ATOM 0 HD23 LEU A 44 23.200 14.427 -3.604 1.00 10.18 H new ATOM 417 N ALA A 45 25.017 13.194 -7.519 1.00 11.46 N ATOM 418 CA ALA A 45 25.587 13.078 -8.875 1.00 12.61 C ATOM 419 C ALA A 45 25.794 14.495 -9.413 1.00 13.74 C ATOM 420 O ALA A 45 24.965 15.382 -9.182 1.00 15.55 O ATOM 421 CB ALA A 45 24.661 12.282 -9.783 1.00 12.38 C ATOM 0 H ALA A 45 24.357 13.742 -7.457 1.00 11.46 H new ATOM 0 HA ALA A 45 26.433 12.604 -8.846 1.00 12.61 H new ATOM 0 HB1 ALA A 45 25.053 12.217 -10.668 1.00 12.38 H new ATOM 0 HB2 ALA A 45 24.537 11.392 -9.419 1.00 12.38 H new ATOM 0 HB3 ALA A 45 23.802 12.729 -9.842 1.00 12.38 H new ATOM 422 N THR A 46 26.888 14.706 -10.121 1.00 14.12 N ATOM 423 CA THR A 46 27.273 16.038 -10.586 1.00 15.36 C ATOM 424 C THR A 46 27.334 16.039 -12.124 1.00 16.37 C ATOM 425 O THR A 46 27.958 15.151 -12.719 1.00 15.28 O ATOM 426 CB THR A 46 28.658 16.398 -10.023 1.00 17.23 C ATOM 427 OG1 THR A 46 28.597 16.425 -8.592 1.00 18.60 O ATOM 428 CG2 THR A 46 29.120 17.785 -10.526 1.00 18.00 C ATOM 0 H THR A 46 27.435 14.083 -10.350 1.00 14.12 H new ATOM 0 HA THR A 46 26.621 16.689 -10.283 1.00 15.36 H new ATOM 0 HB THR A 46 29.291 15.728 -10.325 1.00 17.23 H new ATOM 0 HG1 THR A 46 28.738 15.654 -8.291 1.00 18.60 H new ATOM 0 HG21 THR A 46 29.994 17.988 -10.158 1.00 18.00 H new ATOM 0 HG22 THR A 46 29.172 17.777 -11.495 1.00 18.00 H new ATOM 0 HG23 THR A 46 28.485 18.461 -10.242 1.00 18.00 H new ATOM 429 N ACYS A 47 26.685 16.999 -12.777 0.54 17.35 N ATOM 430 CA ACYS A 47 26.729 17.023 -14.242 0.54 18.77 C ATOM 431 C ACYS A 47 27.825 17.960 -14.784 0.54 18.47 C ATOM 432 O ACYS A 47 27.836 19.158 -14.496 0.54 17.96 O ATOM 433 CB ACYS A 47 25.339 17.276 -14.843 0.54 21.68 C ATOM 434 SG ACYS A 47 24.000 16.395 -13.982 0.54 26.35 S ATOM 435 N BCYS A 47 26.682 17.021 -12.743 0.46 16.74 N ATOM 436 CA BCYS A 47 26.730 17.181 -14.191 0.46 17.75 C ATOM 437 C BCYS A 47 27.983 17.953 -14.611 0.46 17.69 C ATOM 438 O BCYS A 47 28.244 19.043 -14.091 0.46 16.85 O ATOM 439 CB BCYS A 47 25.487 17.911 -14.684 0.46 18.75 C ATOM 440 SG BCYS A 47 25.254 17.762 -16.471 0.46 23.88 S ATOM 0 H ACYS A 47 26.227 17.627 -12.409 0.54 16.74 H new ATOM 0 H BCYS A 47 26.203 17.609 -12.337 0.46 16.74 H new ATOM 0 HA ACYS A 47 26.991 16.138 -14.541 0.54 17.75 H new ATOM 0 HA BCYS A 47 26.760 16.298 -14.591 0.46 17.75 H new ATOM 0 HB2ACYS A 47 25.155 18.228 -14.822 0.54 18.75 H new ATOM 0 HB2BCYS A 47 24.707 17.557 -14.229 0.46 18.75 H new ATOM 0 HB3ACYS A 47 25.345 17.008 -15.775 0.54 18.75 H new ATOM 0 HB3BCYS A 47 25.552 18.849 -14.447 0.46 18.75 H new ATOM 0 HG BCYS A 47 26.260 18.093 -17.035 0.46 23.88 H new ATOM 441 N VAL A 48 28.768 17.378 -15.524 1.00 17.99 N ATOM 442 CA VAL A 48 29.936 18.089 -16.086 1.00 19.68 C ATOM 443 C VAL A 48 29.994 17.760 -17.574 1.00 20.51 C ATOM 444 O VAL A 48 30.033 16.593 -17.937 1.00 20.71 O ATOM 445 CB VAL A 48 31.281 17.666 -15.423 1.00 20.05 C ATOM 446 CG1 VAL A 48 32.449 18.491 -15.967 1.00 20.51 C ATOM 447 CG2 VAL A 48 31.230 17.781 -13.897 1.00 19.90 C ATOM 0 H AVAL A 48 28.753 16.541 -15.722 0.54 17.99 H new ATOM 0 H BVAL A 48 28.649 16.584 -15.833 0.46 17.99 H new ATOM 0 HA VAL A 48 29.827 19.038 -15.919 1.00 19.68 H new ATOM 0 HB VAL A 48 31.421 16.733 -15.650 1.00 20.05 H new ATOM 0 HG11 VAL A 48 33.272 18.208 -15.539 1.00 20.51 H new ATOM 0 HG12 VAL A 48 32.521 18.358 -16.925 1.00 20.51 H new ATOM 0 HG13 VAL A 48 32.295 19.431 -15.782 1.00 20.51 H new ATOM 0 HG21 VAL A 48 32.083 17.510 -13.523 1.00 19.90 H new ATOM 0 HG22 VAL A 48 31.046 18.700 -13.648 1.00 19.90 H new ATOM 0 HG23 VAL A 48 30.529 17.206 -13.552 1.00 19.90 H new ATOM 448 N ASN A 49 29.974 18.792 -18.422 1.00 22.45 N ATOM 449 CA ASN A 49 29.962 18.611 -19.880 1.00 24.29 C ATOM 450 C ASN A 49 28.935 17.606 -20.391 1.00 23.95 C ATOM 451 O ASN A 49 29.272 16.708 -21.179 1.00 25.81 O ATOM 452 CB ASN A 49 31.358 18.191 -20.373 1.00 26.46 C ATOM 453 CG ASN A 49 32.329 19.348 -20.422 1.00 28.42 C ATOM 454 OD1 ASN A 49 31.967 20.494 -20.151 1.00 28.00 O ATOM 455 ND2 ASN A 49 33.576 19.055 -20.781 1.00 31.80 N ATOM 0 H ASN A 49 29.967 19.614 -18.170 1.00 22.45 H new ATOM 0 HA ASN A 49 29.704 19.474 -20.240 1.00 24.29 H new ATOM 0 HB2 ASN A 49 31.710 17.502 -19.788 1.00 26.46 H new ATOM 0 HB3 ASN A 49 31.281 17.800 -21.257 1.00 26.46 H new ATOM 0 HD21 ASN A 49 34.167 19.678 -20.831 1.00 31.80 H new ATOM 0 HD22 ASN A 49 33.791 18.243 -20.963 1.00 31.80 H new ATOM 456 N GLY A 50 27.690 17.734 -19.946 1.00 22.27 N ATOM 457 CA GLY A 50 26.616 16.904 -20.496 1.00 21.21 C ATOM 458 C GLY A 50 26.573 15.456 -20.034 1.00 20.13 C ATOM 459 O GLY A 50 25.772 14.668 -20.547 1.00 19.70 O ATOM 0 H GLY A 50 27.445 18.287 -19.334 1.00 22.27 H new ATOM 0 HA2 GLY A 50 25.768 17.319 -20.274 1.00 21.21 H new ATOM 0 HA3 GLY A 50 26.691 16.912 -21.463 1.00 21.21 H new ATOM 460 N VAL A 51 27.416 15.110 -19.061 1.00 18.77 N ATOM 461 CA VAL A 51 27.381 13.803 -18.401 1.00 17.91 C ATOM 462 C VAL A 51 27.128 13.990 -16.899 1.00 17.03 C ATOM 463 O VAL A 51 27.773 14.809 -16.262 1.00 17.05 O ATOM 464 CB VAL A 51 28.711 13.027 -18.588 1.00 17.42 C ATOM 465 CG1 VAL A 51 28.724 11.728 -17.771 1.00 17.42 C ATOM 466 CG2 VAL A 51 28.943 12.721 -20.067 1.00 19.35 C ATOM 0 H VAL A 51 28.030 15.632 -18.762 1.00 18.77 H new ATOM 0 HA VAL A 51 26.666 13.290 -18.808 1.00 17.91 H new ATOM 0 HB VAL A 51 29.430 13.591 -18.263 1.00 17.42 H new ATOM 0 HG11 VAL A 51 29.566 11.267 -17.909 1.00 17.42 H new ATOM 0 HG12 VAL A 51 28.620 11.937 -16.829 1.00 17.42 H new ATOM 0 HG13 VAL A 51 27.993 11.158 -18.058 1.00 17.42 H new ATOM 0 HG21 VAL A 51 29.777 12.236 -20.170 1.00 19.35 H new ATOM 0 HG22 VAL A 51 28.211 12.181 -20.405 1.00 19.35 H new ATOM 0 HG23 VAL A 51 28.988 13.551 -20.566 1.00 19.35 H new ATOM 467 N ACYS A 52 26.153 13.282 -16.330 0.45 18.01 N ATOM 468 CA ACYS A 52 26.031 13.297 -14.869 0.45 18.40 C ATOM 469 C ACYS A 52 26.821 12.143 -14.292 0.45 17.36 C ATOM 470 O ACYS A 52 26.570 10.962 -14.580 0.45 16.47 O ATOM 471 CB ACYS A 52 24.586 13.312 -14.362 0.45 22.17 C ATOM 472 SG ACYS A 52 23.573 14.662 -15.005 0.45 27.62 S ATOM 473 N CCYS A 52 26.220 13.181 -16.373 0.55 16.98 N ATOM 474 CA CCYS A 52 25.928 13.121 -14.959 0.55 16.89 C ATOM 475 C CCYS A 52 26.836 12.070 -14.297 0.55 16.46 C ATOM 476 O CCYS A 52 26.666 10.860 -14.528 0.55 15.50 O ATOM 477 CB CCYS A 52 24.450 12.758 -14.797 0.55 18.50 C ATOM 478 SG CCYS A 52 23.988 12.529 -13.088 0.55 21.10 S ATOM 0 H ACYS A 52 25.573 12.805 -16.749 0.45 16.98 H new ATOM 0 H CCYS A 52 25.747 12.639 -16.844 0.55 16.98 H new ATOM 0 HA ACYS A 52 26.403 14.137 -14.557 0.45 16.89 H new ATOM 0 HA CCYS A 52 26.096 13.974 -14.529 0.55 16.89 H new ATOM 0 HB2ACYS A 52 24.166 12.469 -14.595 0.45 18.50 H new ATOM 0 HB2CCYS A 52 23.903 13.458 -15.186 0.55 18.50 H new ATOM 0 HB3ACYS A 52 24.597 13.365 -13.394 0.45 18.50 H new ATOM 0 HB3CCYS A 52 24.263 11.945 -15.292 0.55 18.50 H new ATOM 0 HG CCYS A 52 22.823 12.249 -13.022 0.55 21.10 H new ATOM 479 N TRP A 53 27.783 12.527 -13.469 1.00 15.35 N ATOM 480 CA TRP A 53 28.787 11.641 -12.906 1.00 15.08 C ATOM 481 C TRP A 53 28.490 11.327 -11.489 1.00 14.49 C ATOM 482 O TRP A 53 28.016 12.185 -10.747 1.00 14.20 O ATOM 483 CB TRP A 53 30.132 12.343 -12.905 1.00 15.27 C ATOM 484 CG TRP A 53 30.636 12.653 -14.278 1.00 16.85 C ATOM 485 CD1 TRP A 53 30.558 13.857 -14.958 1.00 17.28 C ATOM 486 CD2 TRP A 53 31.316 11.730 -15.185 1.00 17.64 C ATOM 487 NE1 TRP A 53 31.140 13.744 -16.201 1.00 18.69 N ATOM 488 CE2 TRP A 53 31.621 12.492 -16.392 1.00 18.69 C ATOM 489 CE3 TRP A 53 31.679 10.382 -15.119 1.00 17.21 C ATOM 490 CZ2 TRP A 53 32.264 11.911 -17.491 1.00 19.32 C ATOM 491 CZ3 TRP A 53 32.330 9.815 -16.222 1.00 18.65 C ATOM 492 CH2 TRP A 53 32.621 10.565 -17.372 1.00 18.64 C ATOM 0 H ATRP A 53 27.873 13.343 -13.213 0.45 15.35 H new ATOM 0 H CTRP A 53 27.855 13.349 -13.225 0.55 15.35 H new ATOM 0 HA TRP A 53 28.792 10.832 -13.441 1.00 15.08 H new ATOM 0 HB2 TRP A 53 30.059 13.168 -12.400 1.00 15.27 H new ATOM 0 HB3 TRP A 53 30.781 11.786 -12.447 1.00 15.27 H new ATOM 0 HD1 TRP A 53 30.168 14.632 -14.623 1.00 17.28 H new ATOM 0 HE1 TRP A 53 31.191 14.381 -16.777 1.00 18.69 H new ATOM 0 HE3 TRP A 53 31.493 9.875 -14.362 1.00 17.21 H new ATOM 0 HZ2 TRP A 53 32.445 12.397 -18.263 1.00 19.32 H new ATOM 0 HZ3 TRP A 53 32.576 8.919 -16.192 1.00 18.65 H new ATOM 0 HH2 TRP A 53 33.066 10.153 -18.077 1.00 18.64 H new ATOM 493 N THR A 54 28.846 10.120 -11.063 1.00 14.26 N ATOM 494 CA THR A 54 28.737 9.791 -9.654 1.00 13.61 C ATOM 495 C THR A 54 29.672 8.661 -9.313 1.00 13.52 C ATOM 496 O THR A 54 30.461 8.213 -10.162 1.00 12.25 O ATOM 497 CB THR A 54 27.268 9.479 -9.235 1.00 14.54 C ATOM 498 OG1 THR A 54 27.170 9.454 -7.807 1.00 14.07 O ATOM 499 CG2 THR A 54 26.777 8.140 -9.796 1.00 14.54 C ATOM 0 H THR A 54 29.147 9.490 -11.565 1.00 14.26 H new ATOM 0 HA THR A 54 29.002 10.571 -9.141 1.00 13.61 H new ATOM 0 HB THR A 54 26.707 10.180 -9.603 1.00 14.54 H new ATOM 0 HG1 THR A 54 26.659 10.070 -7.550 1.00 14.07 H new ATOM 0 HG21 THR A 54 25.862 7.986 -9.512 1.00 14.54 H new ATOM 0 HG22 THR A 54 26.815 8.161 -10.765 1.00 14.54 H new ATOM 0 HG23 THR A 54 27.342 7.424 -9.466 1.00 14.54 H new ATOM 500 N VAL A 55 29.592 8.218 -8.070 1.00 13.28 N ATOM 501 CA VAL A 55 30.502 7.203 -7.570 1.00 14.56 C ATOM 502 C VAL A 55 30.000 5.796 -7.845 1.00 14.70 C ATOM 503 O VAL A 55 28.819 5.498 -7.658 1.00 13.29 O ATOM 504 CB VAL A 55 30.703 7.325 -6.053 1.00 15.18 C ATOM 505 CG1 VAL A 55 31.712 8.419 -5.759 1.00 15.69 C ATOM 506 CG2 VAL A 55 29.379 7.592 -5.356 1.00 14.69 C ATOM 0 H VAL A 55 29.014 8.494 -7.496 1.00 13.28 H new ATOM 0 HA VAL A 55 31.338 7.353 -8.038 1.00 14.56 H new ATOM 0 HB VAL A 55 31.049 6.487 -5.709 1.00 15.18 H new ATOM 0 HG11 VAL A 55 31.838 8.495 -4.800 1.00 15.69 H new ATOM 0 HG12 VAL A 55 32.558 8.200 -6.179 1.00 15.69 H new ATOM 0 HG13 VAL A 55 31.386 9.263 -6.109 1.00 15.69 H new ATOM 0 HG21 VAL A 55 29.525 7.666 -4.400 1.00 14.69 H new ATOM 0 HG22 VAL A 55 28.999 8.420 -5.689 1.00 14.69 H new ATOM 0 HG23 VAL A 55 28.767 6.861 -5.533 1.00 14.69 H new ATOM 507 N TYR A 56 30.923 4.928 -8.255 1.00 14.90 N ATOM 508 CA TYR A 56 30.584 3.530 -8.434 1.00 16.91 C ATOM 509 C TYR A 56 30.072 2.858 -7.139 1.00 16.60 C ATOM 510 O TYR A 56 29.146 2.033 -7.185 1.00 15.51 O ATOM 511 CB TYR A 56 31.770 2.766 -9.021 1.00 18.58 C ATOM 512 CG TYR A 56 31.433 1.314 -9.259 1.00 21.60 C ATOM 513 CD1 TYR A 56 30.690 0.939 -10.367 1.00 22.34 C ATOM 514 CD2 TYR A 56 31.838 0.320 -8.354 1.00 23.98 C ATOM 515 CE1 TYR A 56 30.369 -0.390 -10.600 1.00 24.94 C ATOM 516 CE2 TYR A 56 31.514 -1.015 -8.576 1.00 26.88 C ATOM 517 CZ TYR A 56 30.778 -1.353 -9.709 1.00 27.15 C ATOM 518 OH TYR A 56 30.436 -2.657 -9.970 1.00 32.26 O ATOM 0 H TYR A 56 31.740 5.130 -8.432 1.00 14.90 H new ATOM 0 HA TYR A 56 29.845 3.498 -9.062 1.00 16.91 H new ATOM 0 HB2 TYR A 56 32.039 3.178 -9.857 1.00 18.58 H new ATOM 0 HB3 TYR A 56 32.527 2.829 -8.417 1.00 18.58 H new ATOM 0 HD1 TYR A 56 30.401 1.590 -10.965 1.00 22.34 H new ATOM 0 HD2 TYR A 56 32.327 0.556 -7.599 1.00 23.98 H new ATOM 0 HE1 TYR A 56 29.880 -0.628 -11.354 1.00 24.94 H new ATOM 0 HE2 TYR A 56 31.785 -1.672 -7.976 1.00 26.88 H new ATOM 0 HH TYR A 56 29.599 -2.730 -9.983 1.00 32.26 H new ATOM 519 N HIS A 57 30.644 3.203 -5.981 1.00 17.21 N ATOM 520 CA HIS A 57 30.210 2.568 -4.724 1.00 17.56 C ATOM 521 C HIS A 57 28.791 2.933 -4.347 1.00 18.04 C ATOM 522 O HIS A 57 28.141 2.231 -3.578 1.00 18.21 O ATOM 523 CB HIS A 57 31.238 2.747 -3.585 1.00 19.79 C ATOM 524 CG HIS A 57 31.334 4.155 -3.043 1.00 19.53 C ATOM 525 ND1 HIS A 57 32.236 5.055 -3.502 1.00 20.72 N ATOM 526 CD2 HIS A 57 30.621 4.795 -2.030 1.00 20.26 C ATOM 527 CE1 HIS A 57 32.097 6.217 -2.826 1.00 20.17 C ATOM 528 NE2 HIS A 57 31.115 6.057 -1.920 1.00 20.90 N ATOM 0 H HIS A 57 31.270 3.787 -5.898 1.00 17.21 H new ATOM 0 HA HIS A 57 30.183 1.612 -4.886 1.00 17.56 H new ATOM 0 HB2 HIS A 57 31.006 2.148 -2.858 1.00 19.79 H new ATOM 0 HB3 HIS A 57 32.112 2.477 -3.908 1.00 19.79 H new ATOM 0 HD1 HIS A 57 32.809 4.910 -4.127 1.00 20.72 H new ATOM 0 HD2 HIS A 57 29.934 4.427 -1.523 1.00 20.26 H new ATOM 0 HE1 HIS A 57 32.593 6.992 -2.963 1.00 20.17 H new ATOM 529 N GLY A 58 28.266 3.998 -4.952 1.00 16.79 N ATOM 530 CA GLY A 58 26.866 4.375 -4.776 1.00 16.09 C ATOM 531 C GLY A 58 25.944 3.745 -5.829 1.00 16.27 C ATOM 532 O GLY A 58 24.941 3.102 -5.501 1.00 15.05 O ATOM 0 H GLY A 58 28.709 4.519 -5.473 1.00 16.79 H new ATOM 0 HA2 GLY A 58 26.572 4.106 -3.892 1.00 16.09 H new ATOM 0 HA3 GLY A 58 26.787 5.341 -4.820 1.00 16.09 H new ATOM 533 N ALA A 59 26.294 3.939 -7.097 1.00 15.58 N ATOM 534 CA ALA A 59 25.403 3.596 -8.210 1.00 14.87 C ATOM 535 C ALA A 59 25.586 2.183 -8.748 1.00 15.26 C ATOM 536 O ALA A 59 24.692 1.678 -9.432 1.00 15.01 O ATOM 537 CB ALA A 59 25.587 4.604 -9.335 1.00 15.02 C ATOM 0 H ALA A 59 27.050 4.271 -7.339 1.00 15.58 H new ATOM 0 HA ALA A 59 24.501 3.629 -7.855 1.00 14.87 H new ATOM 0 HB1 ALA A 59 24.998 4.378 -10.072 1.00 15.02 H new ATOM 0 HB2 ALA A 59 25.373 5.493 -9.011 1.00 15.02 H new ATOM 0 HB3 ALA A 59 26.508 4.584 -9.640 1.00 15.02 H new ATOM 538 N GLY A 60 26.741 1.558 -8.479 1.00 15.01 N ATOM 539 CA GLY A 60 27.082 0.261 -9.093 1.00 14.88 C ATOM 540 C GLY A 60 26.932 0.350 -10.612 1.00 14.54 C ATOM 541 O GLY A 60 27.348 1.333 -11.224 1.00 15.26 O ATOM 0 H GLY A 60 27.340 1.866 -7.945 1.00 15.01 H new ATOM 0 HA2 GLY A 60 27.992 0.015 -8.864 1.00 14.88 H new ATOM 0 HA3 GLY A 60 26.503 -0.434 -8.743 1.00 14.88 H new ATOM 542 N ASER A 61 26.321 -0.672 -11.208 0.50 14.31 N ATOM 543 CA ASER A 61 26.126 -0.733 -12.668 0.50 14.07 C ATOM 544 C ASER A 61 24.736 -0.271 -13.112 0.50 14.02 C ATOM 545 O ASER A 61 24.352 -0.460 -14.282 0.50 13.44 O ATOM 546 CB ASER A 61 26.318 -2.168 -13.158 0.50 14.17 C ATOM 547 OG ASER A 61 27.466 -2.749 -12.575 0.50 13.95 O ATOM 548 N BSER A 61 26.332 -0.665 -11.221 0.50 14.20 N ATOM 549 CA BSER A 61 26.151 -0.680 -12.679 0.50 14.06 C ATOM 550 C BSER A 61 24.729 -0.294 -13.101 0.50 14.03 C ATOM 551 O BSER A 61 24.314 -0.555 -14.245 0.50 13.48 O ATOM 552 CB BSER A 61 26.459 -2.072 -13.215 0.50 14.29 C ATOM 553 OG BSER A 61 25.728 -3.035 -12.485 0.50 14.08 O ATOM 0 H ASER A 61 26.006 -1.351 -10.784 0.50 14.20 H new ATOM 0 H BSER A 61 26.021 -1.356 -10.815 0.50 14.20 H new ATOM 0 HA ASER A 61 26.783 -0.131 -13.052 0.50 14.06 H new ATOM 0 HA BSER A 61 26.760 -0.021 -13.048 0.50 14.06 H new ATOM 0 HB2ASER A 61 25.535 -2.697 -12.937 0.50 14.29 H new ATOM 0 HB2BSER A 61 26.230 -2.124 -14.156 0.50 14.29 H new ATOM 0 HB3ASER A 61 26.402 -2.176 -14.124 0.50 14.29 H new ATOM 0 HB3BSER A 61 27.409 -2.253 -13.144 0.50 14.29 H new ATOM 0 HG ASER A 61 27.293 -2.981 -11.786 0.50 14.08 H new ATOM 0 HG BSER A 61 24.912 -2.969 -12.672 0.50 14.08 H new ATOM 554 N LYS A 62 24.003 0.348 -12.190 1.00 13.17 N ATOM 555 CA LYS A 62 22.574 0.607 -12.366 1.00 12.95 C ATOM 556 C LYS A 62 22.273 1.645 -13.437 1.00 12.11 C ATOM 557 O LYS A 62 23.047 2.564 -13.671 1.00 11.09 O ATOM 558 CB LYS A 62 21.954 1.077 -11.053 1.00 14.10 C ATOM 559 CG LYS A 62 21.951 0.018 -9.958 1.00 15.48 C ATOM 560 CD LYS A 62 21.452 0.604 -8.651 1.00 16.92 C ATOM 561 CE LYS A 62 21.169 -0.509 -7.646 1.00 19.14 C ATOM 562 NZ LYS A 62 22.470 -1.125 -7.326 1.00 21.40 N ATOM 0 H ALYS A 62 24.320 0.631 -11.442 0.50 13.17 H new ATOM 0 H BLYS A 62 24.325 0.647 -11.450 0.50 13.17 H new ATOM 0 HA LYS A 62 22.188 -0.235 -12.653 1.00 12.95 H new ATOM 0 HB2 LYS A 62 22.439 1.855 -10.737 1.00 14.10 H new ATOM 0 HB3 LYS A 62 21.041 1.360 -11.220 1.00 14.10 H new ATOM 0 HG2 LYS A 62 21.386 -0.725 -10.222 1.00 15.48 H new ATOM 0 HG3 LYS A 62 22.847 -0.334 -9.839 1.00 15.48 H new ATOM 0 HD2 LYS A 62 22.114 1.214 -8.289 1.00 16.92 H new ATOM 0 HD3 LYS A 62 20.646 1.120 -8.807 1.00 16.92 H new ATOM 0 HE2 LYS A 62 20.749 -0.154 -6.847 1.00 19.14 H new ATOM 0 HE3 LYS A 62 20.559 -1.164 -8.019 1.00 19.14 H new ATOM 0 HZ1 LYS A 62 22.374 -1.681 -6.638 1.00 21.40 H new ATOM 0 HZ2 LYS A 62 22.767 -1.577 -8.033 1.00 21.40 H new ATOM 0 HZ3 LYS A 62 23.056 -0.489 -7.114 1.00 21.40 H new ATOM 563 N THR A 63 21.115 1.481 -14.062 1.00 11.51 N ATOM 564 CA THR A 63 20.544 2.496 -14.928 1.00 11.42 C ATOM 565 C THR A 63 20.035 3.698 -14.097 1.00 11.53 C ATOM 566 O THR A 63 19.859 3.586 -12.877 1.00 11.48 O ATOM 567 CB THR A 63 19.328 1.912 -15.686 1.00 11.95 C ATOM 568 OG1 THR A 63 18.512 1.147 -14.784 1.00 12.08 O ATOM 569 CG2 THR A 63 19.779 1.038 -16.833 1.00 11.46 C ATOM 0 H THR A 63 20.636 0.770 -13.994 1.00 11.51 H new ATOM 0 HA THR A 63 21.235 2.783 -15.545 1.00 11.42 H new ATOM 0 HB THR A 63 18.809 2.648 -16.046 1.00 11.95 H new ATOM 0 HG1 THR A 63 17.933 0.723 -15.221 1.00 12.08 H new ATOM 0 HG21 THR A 63 19.003 0.683 -17.294 1.00 11.46 H new ATOM 0 HG22 THR A 63 20.309 1.564 -17.452 1.00 11.46 H new ATOM 0 HG23 THR A 63 20.315 0.305 -16.491 1.00 11.46 H new ATOM 570 N LEU A 64 19.831 4.831 -14.766 1.00 11.62 N ATOM 571 CA LEU A 64 19.232 6.019 -14.161 1.00 12.08 C ATOM 572 C LEU A 64 17.817 6.157 -14.703 1.00 12.27 C ATOM 573 O LEU A 64 17.601 6.113 -15.932 1.00 11.85 O ATOM 574 CB LEU A 64 20.054 7.254 -14.525 1.00 12.76 C ATOM 575 CG LEU A 64 19.546 8.613 -14.046 1.00 13.10 C ATOM 576 CD1 LEU A 64 19.654 8.777 -12.534 1.00 13.38 C ATOM 577 CD2 LEU A 64 20.391 9.668 -14.732 1.00 13.45 C ATOM 0 H LEU A 64 20.039 4.933 -15.594 1.00 11.62 H new ATOM 0 HA LEU A 64 19.215 5.936 -13.195 1.00 12.08 H new ATOM 0 HB2 LEU A 64 20.950 7.130 -14.174 1.00 12.76 H new ATOM 0 HB3 LEU A 64 20.130 7.288 -15.491 1.00 12.76 H new ATOM 0 HG LEU A 64 18.605 8.697 -14.267 1.00 13.10 H new ATOM 0 HD11 LEU A 64 19.321 9.652 -12.279 1.00 13.38 H new ATOM 0 HD12 LEU A 64 19.128 8.090 -12.095 1.00 13.38 H new ATOM 0 HD13 LEU A 64 20.582 8.694 -12.265 1.00 13.38 H new ATOM 0 HD21 LEU A 64 20.098 10.549 -14.453 1.00 13.45 H new ATOM 0 HD22 LEU A 64 21.322 9.545 -14.489 1.00 13.45 H new ATOM 0 HD23 LEU A 64 20.294 9.585 -15.694 1.00 13.45 H new ATOM 578 N ALA A 65 16.852 6.303 -13.808 1.00 12.47 N ATOM 579 CA ALA A 65 15.452 6.466 -14.258 1.00 12.91 C ATOM 580 C ALA A 65 15.311 7.752 -15.078 1.00 13.38 C ATOM 581 O ALA A 65 15.827 8.799 -14.709 1.00 13.67 O ATOM 582 CB ALA A 65 14.493 6.471 -13.079 1.00 12.09 C ATOM 0 H ALA A 65 16.968 6.312 -12.956 1.00 12.47 H new ATOM 0 HA ALA A 65 15.222 5.710 -14.820 1.00 12.91 H new ATOM 0 HB1 ALA A 65 13.584 6.579 -13.401 1.00 12.09 H new ATOM 0 HB2 ALA A 65 14.567 5.632 -12.598 1.00 12.09 H new ATOM 0 HB3 ALA A 65 14.714 7.205 -12.485 1.00 12.09 H new ATOM 583 N GLY A 66 14.613 7.672 -16.194 1.00 13.96 N ATOM 584 CA GLY A 66 14.508 8.839 -17.099 1.00 15.55 C ATOM 585 C GLY A 66 13.160 8.894 -17.789 1.00 17.04 C ATOM 586 O GLY A 66 12.367 7.970 -17.660 1.00 15.68 O ATOM 0 H GLY A 66 14.193 6.969 -16.457 1.00 13.96 H new ATOM 0 HA2 GLY A 66 14.646 9.655 -16.593 1.00 15.55 H new ATOM 0 HA3 GLY A 66 15.211 8.796 -17.766 1.00 15.55 H new ATOM 587 N PRO A 67 12.911 9.967 -18.560 1.00 19.81 N ATOM 588 CA PRO A 67 11.612 10.229 -19.194 1.00 21.50 C ATOM 589 C PRO A 67 11.193 9.166 -20.231 1.00 23.27 C ATOM 590 O PRO A 67 9.996 8.890 -20.406 1.00 24.47 O ATOM 591 CB PRO A 67 11.805 11.614 -19.833 1.00 21.61 C ATOM 592 CG PRO A 67 13.279 11.771 -19.999 1.00 23.08 C ATOM 593 CD PRO A 67 13.897 11.029 -18.839 1.00 21.38 C ATOM 0 HA PRO A 67 10.887 10.196 -18.550 1.00 21.50 H new ATOM 0 HB2 PRO A 67 11.349 11.672 -20.687 1.00 21.61 H new ATOM 0 HB3 PRO A 67 11.440 12.313 -19.269 1.00 21.61 H new ATOM 0 HG2 PRO A 67 13.576 11.404 -20.846 1.00 23.08 H new ATOM 0 HG3 PRO A 67 13.534 12.707 -19.990 1.00 23.08 H new ATOM 0 HD2 PRO A 67 14.765 10.662 -19.069 1.00 21.38 H new ATOM 0 HD3 PRO A 67 14.028 11.608 -18.072 1.00 21.38 H new ATOM 594 N LYS A 68 12.166 8.534 -20.873 1.00 22.90 N ATOM 595 CA LYS A 68 11.852 7.499 -21.831 1.00 23.07 C ATOM 596 C LYS A 68 12.226 6.120 -21.303 1.00 23.39 C ATOM 597 O LYS A 68 12.342 5.172 -22.072 1.00 24.72 O ATOM 598 CB LYS A 68 12.534 7.800 -23.174 1.00 27.26 C ATOM 599 CG LYS A 68 12.059 9.116 -23.767 1.00 28.23 C ATOM 600 CD LYS A 68 12.625 9.355 -25.150 1.00 32.18 C ATOM 601 CE LYS A 68 12.302 10.774 -25.583 1.00 35.24 C ATOM 602 NZ LYS A 68 12.495 10.969 -27.043 1.00 37.11 N ATOM 0 H LYS A 68 13.005 8.691 -20.767 1.00 22.90 H new ATOM 0 HA LYS A 68 10.893 7.492 -21.974 1.00 23.07 H new ATOM 0 HB2 LYS A 68 13.495 7.830 -23.049 1.00 27.26 H new ATOM 0 HB3 LYS A 68 12.352 7.080 -23.798 1.00 27.26 H new ATOM 0 HG2 LYS A 68 11.090 9.119 -23.811 1.00 28.23 H new ATOM 0 HG3 LYS A 68 12.319 9.845 -23.182 1.00 28.23 H new ATOM 0 HD2 LYS A 68 13.585 9.217 -25.147 1.00 32.18 H new ATOM 0 HD3 LYS A 68 12.249 8.720 -25.779 1.00 32.18 H new ATOM 0 HE2 LYS A 68 11.384 10.982 -25.349 1.00 35.24 H new ATOM 0 HE3 LYS A 68 12.866 11.396 -25.097 1.00 35.24 H new ATOM 0 HZ1 LYS A 68 12.297 11.809 -27.259 1.00 37.11 H new ATOM 0 HZ2 LYS A 68 13.343 10.800 -27.256 1.00 37.11 H new ATOM 0 HZ3 LYS A 68 11.961 10.414 -27.490 1.00 37.11 H new ATOM 603 N GLY A 69 12.368 6.007 -19.982 1.00 19.86 N ATOM 604 CA GLY A 69 12.750 4.755 -19.357 1.00 18.65 C ATOM 605 C GLY A 69 14.202 4.787 -18.909 1.00 17.29 C ATOM 606 O GLY A 69 14.874 5.826 -19.008 1.00 18.36 O ATOM 0 H GLY A 69 12.245 6.655 -19.430 1.00 19.86 H new ATOM 0 HA2 GLY A 69 12.177 4.583 -18.594 1.00 18.65 H new ATOM 0 HA3 GLY A 69 12.617 4.025 -19.981 1.00 18.65 H new ATOM 607 N PRO A 70 14.699 3.647 -18.394 1.00 17.21 N ATOM 608 CA PRO A 70 16.018 3.564 -17.751 1.00 16.56 C ATOM 609 C PRO A 70 17.135 3.973 -18.699 1.00 16.14 C ATOM 610 O PRO A 70 17.131 3.577 -19.877 1.00 16.44 O ATOM 611 CB PRO A 70 16.170 2.063 -17.425 1.00 17.21 C ATOM 612 CG PRO A 70 14.816 1.487 -17.511 1.00 17.99 C ATOM 613 CD PRO A 70 14.006 2.347 -18.432 1.00 17.12 C ATOM 0 HA PRO A 70 16.077 4.151 -16.981 1.00 16.56 H new ATOM 0 HB2 PRO A 70 16.771 1.631 -18.052 1.00 17.21 H new ATOM 0 HB3 PRO A 70 16.545 1.937 -16.539 1.00 17.21 H new ATOM 0 HG2 PRO A 70 14.855 0.577 -17.844 1.00 17.99 H new ATOM 0 HG3 PRO A 70 14.406 1.451 -16.633 1.00 17.99 H new ATOM 0 HD2 PRO A 70 13.981 1.982 -19.331 1.00 17.12 H new ATOM 0 HD3 PRO A 70 13.087 2.424 -18.132 1.00 17.12 H new ATOM 614 N ILE A 71 18.089 4.747 -18.193 1.00 15.03 N ATOM 615 CA ILE A 71 19.206 5.216 -19.001 1.00 15.30 C ATOM 616 C ILE A 71 20.434 4.369 -18.645 1.00 14.33 C ATOM 617 O ILE A 71 20.842 4.326 -17.482 1.00 12.74 O ATOM 618 CB ILE A 71 19.491 6.721 -18.721 1.00 15.96 C ATOM 619 CG1 ILE A 71 18.266 7.576 -19.050 1.00 16.94 C ATOM 620 CG2 ILE A 71 20.749 7.204 -19.459 1.00 17.07 C ATOM 621 CD1 ILE A 71 18.259 8.949 -18.379 1.00 18.18 C ATOM 0 H ILE A 71 18.107 5.014 -17.376 1.00 15.03 H new ATOM 0 HA ILE A 71 18.995 5.126 -19.943 1.00 15.30 H new ATOM 0 HB ILE A 71 19.670 6.822 -17.773 1.00 15.96 H new ATOM 0 HG12 ILE A 71 18.218 7.697 -20.011 1.00 16.94 H new ATOM 0 HG13 ILE A 71 17.467 7.094 -18.785 1.00 16.94 H new ATOM 0 HG21 ILE A 71 20.898 8.142 -19.264 1.00 17.07 H new ATOM 0 HG22 ILE A 71 21.515 6.687 -19.165 1.00 17.07 H new ATOM 0 HG23 ILE A 71 20.629 7.088 -20.414 1.00 17.07 H new ATOM 0 HD11 ILE A 71 17.456 9.430 -18.634 1.00 18.18 H new ATOM 0 HD12 ILE A 71 18.277 8.839 -17.415 1.00 18.18 H new ATOM 0 HD13 ILE A 71 19.039 9.451 -18.661 1.00 18.18 H new ATOM 622 N THR A 72 21.022 3.693 -19.637 1.00 13.53 N ATOM 623 CA THR A 72 22.228 2.885 -19.394 1.00 14.50 C ATOM 624 C THR A 72 23.439 3.798 -19.148 1.00 14.38 C ATOM 625 O THR A 72 23.550 4.857 -19.744 1.00 14.85 O ATOM 626 CB THR A 72 22.509 1.964 -20.608 1.00 14.64 C ATOM 627 OG1 THR A 72 21.342 1.161 -20.858 1.00 16.27 O ATOM 628 CG2 THR A 72 23.704 1.083 -20.372 1.00 14.52 C ATOM 0 H THR A 72 20.743 3.687 -20.451 1.00 13.53 H new ATOM 0 HA THR A 72 22.078 2.337 -18.607 1.00 14.50 H new ATOM 0 HB THR A 72 22.708 2.517 -21.379 1.00 14.64 H new ATOM 0 HG1 THR A 72 21.308 0.961 -21.673 1.00 16.27 H new ATOM 0 HG21 THR A 72 23.851 0.521 -21.149 1.00 14.52 H new ATOM 0 HG22 THR A 72 24.487 1.634 -20.219 1.00 14.52 H new ATOM 0 HG23 THR A 72 23.546 0.524 -19.595 1.00 14.52 H new ATOM 629 N GLN A 73 24.324 3.395 -18.249 1.00 14.88 N ATOM 630 CA GLN A 73 25.573 4.115 -18.035 1.00 15.85 C ATOM 631 C GLN A 73 26.327 4.265 -19.353 1.00 17.15 C ATOM 632 O GLN A 73 26.433 3.316 -20.125 1.00 16.15 O ATOM 633 CB GLN A 73 26.437 3.400 -17.002 1.00 14.94 C ATOM 634 CG GLN A 73 25.865 3.560 -15.600 1.00 14.13 C ATOM 635 CD GLN A 73 26.646 2.816 -14.549 1.00 14.20 C ATOM 636 OE1 GLN A 73 27.777 2.398 -14.782 1.00 14.75 O ATOM 637 NE2 GLN A 73 26.036 2.629 -13.390 1.00 13.58 N ATOM 0 H GLN A 73 24.221 2.703 -17.749 1.00 14.88 H new ATOM 0 HA GLN A 73 25.365 4.999 -17.694 1.00 15.85 H new ATOM 0 HB2 GLN A 73 26.497 2.458 -17.224 1.00 14.94 H new ATOM 0 HB3 GLN A 73 27.339 3.756 -17.029 1.00 14.94 H new ATOM 0 HG2 GLN A 73 25.844 4.503 -15.372 1.00 14.13 H new ATOM 0 HG3 GLN A 73 24.947 3.246 -15.594 1.00 14.13 H new ATOM 0 HE21 GLN A 73 25.243 2.938 -13.267 1.00 13.58 H new ATOM 0 HE22 GLN A 73 26.433 2.198 -12.760 1.00 13.58 H new ATOM 638 N MET A 74 26.791 5.478 -19.604 1.00 18.58 N ATOM 639 CA MET A 74 27.617 5.800 -20.751 1.00 22.13 C ATOM 640 C MET A 74 29.073 5.470 -20.428 1.00 22.81 C ATOM 641 O MET A 74 29.835 5.073 -21.313 1.00 22.24 O ATOM 642 CB MET A 74 27.469 7.293 -21.038 1.00 26.96 C ATOM 643 CG MET A 74 27.966 7.755 -22.389 1.00 33.72 C ATOM 644 SD MET A 74 27.550 9.502 -22.600 1.00 47.80 S ATOM 645 CE MET A 74 28.497 9.893 -24.071 1.00 44.86 C ATOM 0 H MET A 74 26.629 6.154 -19.098 1.00 18.58 H new ATOM 0 HA MET A 74 27.344 5.286 -21.527 1.00 22.13 H new ATOM 0 HB2 MET A 74 26.531 7.529 -20.959 1.00 26.96 H new ATOM 0 HB3 MET A 74 27.945 7.786 -20.351 1.00 26.96 H new ATOM 0 HG2 MET A 74 28.925 7.628 -22.455 1.00 33.72 H new ATOM 0 HG3 MET A 74 27.561 7.226 -23.094 1.00 33.72 H new ATOM 0 HE1 MET A 74 28.828 10.803 -24.011 1.00 44.86 H new ATOM 0 HE2 MET A 74 29.246 9.281 -24.146 1.00 44.86 H new ATOM 0 HE3 MET A 74 27.930 9.807 -24.853 1.00 44.86 H new ATOM 646 N TYR A 75 29.455 5.644 -19.160 1.00 22.19 N ATOM 647 CA TYR A 75 30.812 5.347 -18.667 1.00 23.79 C ATOM 648 C TYR A 75 30.782 4.585 -17.355 1.00 23.38 C ATOM 649 O TYR A 75 30.034 4.936 -16.438 1.00 22.35 O ATOM 650 CB TYR A 75 31.620 6.634 -18.492 1.00 25.84 C ATOM 651 CG TYR A 75 31.627 7.491 -19.726 1.00 29.59 C ATOM 652 CD1 TYR A 75 32.369 7.123 -20.855 1.00 31.57 C ATOM 653 CD2 TYR A 75 30.876 8.661 -19.781 1.00 31.69 C ATOM 654 CE1 TYR A 75 32.365 7.907 -21.997 1.00 34.29 C ATOM 655 CE2 TYR A 75 30.857 9.443 -20.919 1.00 34.05 C ATOM 656 CZ TYR A 75 31.609 9.067 -22.019 1.00 35.42 C ATOM 657 OH TYR A 75 31.591 9.863 -23.142 1.00 39.92 O ATOM 0 H TYR A 75 28.927 5.942 -18.550 1.00 22.19 H new ATOM 0 HA TYR A 75 31.239 4.787 -19.334 1.00 23.79 H new ATOM 0 HB2 TYR A 75 31.253 7.143 -17.752 1.00 25.84 H new ATOM 0 HB3 TYR A 75 32.533 6.408 -18.255 1.00 25.84 H new ATOM 0 HD1 TYR A 75 32.872 6.341 -20.838 1.00 31.57 H new ATOM 0 HD2 TYR A 75 30.379 8.921 -19.039 1.00 31.69 H new ATOM 0 HE1 TYR A 75 32.864 7.657 -22.741 1.00 34.29 H new ATOM 0 HE2 TYR A 75 30.342 10.217 -20.946 1.00 34.05 H new ATOM 0 HH TYR A 75 31.708 9.388 -23.825 1.00 39.92 H new ATOM 658 N THR A 76 31.572 3.521 -17.271 1.00 22.21 N ATOM 659 CA THR A 76 31.614 2.684 -16.076 1.00 23.35 C ATOM 660 C THR A 76 33.084 2.369 -15.831 1.00 26.83 C ATOM 661 O THR A 76 33.649 1.509 -16.504 1.00 29.29 O ATOM 662 CB THR A 76 30.790 1.372 -16.257 1.00 22.96 C ATOM 663 OG1 THR A 76 29.466 1.670 -16.715 1.00 20.30 O ATOM 664 CG2 THR A 76 30.688 0.589 -14.955 1.00 22.09 C ATOM 0 H THR A 76 32.097 3.264 -17.902 1.00 22.21 H new ATOM 0 HA THR A 76 31.216 3.146 -15.322 1.00 23.35 H new ATOM 0 HB THR A 76 31.257 0.832 -16.914 1.00 22.96 H new ATOM 0 HG1 THR A 76 28.986 1.890 -16.062 1.00 20.30 H new ATOM 0 HG21 THR A 76 30.171 -0.218 -15.102 1.00 22.09 H new ATOM 0 HG22 THR A 76 31.577 0.352 -14.649 1.00 22.09 H new ATOM 0 HG23 THR A 76 30.250 1.134 -14.283 1.00 22.09 H new ATOM 665 N ASN A 77 33.705 3.092 -14.900 1.00 28.62 N ATOM 666 CA ASN A 77 35.130 2.911 -14.552 1.00 29.11 C ATOM 667 C ASN A 77 35.269 2.470 -13.108 1.00 28.15 C ATOM 668 O ASN A 77 35.384 3.308 -12.197 1.00 27.60 O ATOM 669 CB ASN A 77 35.899 4.219 -14.766 1.00 30.79 C ATOM 670 CG ASN A 77 37.416 4.032 -14.765 1.00 34.93 C ATOM 671 OD1 ASN A 77 37.971 3.122 -14.116 1.00 34.04 O ATOM 672 ND2 ASN A 77 38.100 4.911 -15.492 1.00 35.03 N ATOM 0 H ASN A 77 33.314 3.708 -14.445 1.00 28.62 H new ATOM 0 HA ASN A 77 35.501 2.225 -15.130 1.00 29.11 H new ATOM 0 HB2 ASN A 77 35.628 4.612 -15.610 1.00 30.79 H new ATOM 0 HB3 ASN A 77 35.656 4.848 -14.069 1.00 30.79 H new ATOM 0 HD21 ASN A 77 38.958 4.865 -15.527 1.00 35.03 H new ATOM 0 HD22 ASN A 77 37.684 5.525 -15.927 1.00 35.03 H new ATOM 673 N VAL A 78 35.262 1.160 -12.890 1.00 26.78 N ATOM 674 CA VAL A 78 35.234 0.614 -11.529 1.00 28.02 C ATOM 675 C VAL A 78 36.496 0.991 -10.736 1.00 30.56 C ATOM 676 O VAL A 78 36.416 1.326 -9.552 1.00 29.35 O ATOM 677 CB VAL A 78 35.034 -0.920 -11.533 1.00 28.54 C ATOM 678 CG1 VAL A 78 35.078 -1.487 -10.111 1.00 28.19 C ATOM 679 CG2 VAL A 78 33.731 -1.288 -12.252 1.00 28.02 C ATOM 0 H VAL A 78 35.273 0.567 -13.513 1.00 26.78 H new ATOM 0 HA VAL A 78 34.471 1.015 -11.084 1.00 28.02 H new ATOM 0 HB VAL A 78 35.767 -1.324 -12.023 1.00 28.54 H new ATOM 0 HG11 VAL A 78 34.950 -2.448 -10.142 1.00 28.19 H new ATOM 0 HG12 VAL A 78 35.938 -1.288 -9.710 1.00 28.19 H new ATOM 0 HG13 VAL A 78 34.373 -1.084 -9.580 1.00 28.19 H new ATOM 0 HG21 VAL A 78 33.619 -2.252 -12.247 1.00 28.02 H new ATOM 0 HG22 VAL A 78 32.982 -0.873 -11.797 1.00 28.02 H new ATOM 0 HG23 VAL A 78 33.767 -0.972 -13.168 1.00 28.02 H new ATOM 680 N ASP A 79 37.653 0.971 -11.396 1.00 33.25 N ATOM 681 CA ASP A 79 38.914 1.235 -10.691 1.00 36.31 C ATOM 682 C ASP A 79 38.996 2.651 -10.128 1.00 34.89 C ATOM 683 O ASP A 79 39.479 2.845 -9.007 1.00 34.82 O ATOM 684 CB ASP A 79 40.120 0.922 -11.581 1.00 41.00 C ATOM 685 CG ASP A 79 40.296 -0.578 -11.817 1.00 46.67 C ATOM 686 OD1 ASP A 79 39.948 -1.379 -10.916 1.00 48.29 O ATOM 687 OD2 ASP A 79 40.781 -0.958 -12.905 1.00 51.64 O ATOM 0 H ASP A 79 37.733 0.810 -12.237 1.00 33.25 H new ATOM 0 HA ASP A 79 38.933 0.636 -9.928 1.00 36.31 H new ATOM 0 HB2 ASP A 79 40.014 1.371 -12.434 1.00 41.00 H new ATOM 0 HB3 ASP A 79 40.923 1.279 -11.170 1.00 41.00 H new ATOM 688 N GLN A 80 38.512 3.621 -10.904 1.00 32.25 N ATOM 689 CA GLN A 80 38.481 5.024 -10.491 1.00 31.74 C ATOM 690 C GLN A 80 37.216 5.362 -9.693 1.00 28.47 C ATOM 691 O GLN A 80 37.051 6.500 -9.274 1.00 27.35 O ATOM 692 CB GLN A 80 38.608 5.965 -11.699 1.00 34.29 C ATOM 693 CG GLN A 80 39.806 5.708 -12.613 1.00 41.83 C ATOM 694 CD GLN A 80 41.119 6.276 -12.092 1.00 48.53 C ATOM 695 OE1 GLN A 80 41.339 6.382 -10.880 1.00 54.10 O ATOM 696 NE2 GLN A 80 42.009 6.645 -13.016 1.00 52.15 N ATOM 0 H GLN A 80 38.191 3.482 -11.690 1.00 32.25 H new ATOM 0 HA GLN A 80 39.246 5.158 -9.910 1.00 31.74 H new ATOM 0 HB2 GLN A 80 37.798 5.897 -12.228 1.00 34.29 H new ATOM 0 HB3 GLN A 80 38.659 6.877 -11.374 1.00 34.29 H new ATOM 0 HG2 GLN A 80 39.906 4.751 -12.738 1.00 41.83 H new ATOM 0 HG3 GLN A 80 39.623 6.091 -13.485 1.00 41.83 H new ATOM 0 HE21 GLN A 80 41.823 6.557 -13.851 1.00 52.15 H new ATOM 0 HE22 GLN A 80 42.768 6.970 -12.776 1.00 52.15 H new ATOM 697 N ASP A 81 36.348 4.366 -9.488 1.00 25.37 N ATOM 698 CA ASP A 81 35.127 4.479 -8.676 1.00 24.00 C ATOM 699 C ASP A 81 34.171 5.498 -9.309 1.00 21.90 C ATOM 700 O ASP A 81 33.560 6.286 -8.609 1.00 22.17 O ATOM 701 CB ASP A 81 35.476 4.843 -7.207 1.00 26.66 C ATOM 702 CG ASP A 81 34.285 4.743 -6.251 1.00 28.80 C ATOM 703 OD1 ASP A 81 33.306 4.009 -6.526 1.00 29.52 O ATOM 704 OD2 ASP A 81 34.330 5.395 -5.188 1.00 29.41 O ATOM 0 H ASP A 81 36.456 3.583 -9.827 1.00 25.37 H new ATOM 0 HA ASP A 81 34.676 3.620 -8.656 1.00 24.00 H new ATOM 0 HB2 ASP A 81 36.182 4.255 -6.895 1.00 26.66 H new ATOM 0 HB3 ASP A 81 35.827 5.747 -7.180 1.00 26.66 H new ATOM 705 N LEU A 82 34.065 5.471 -10.641 1.00 19.26 N ATOM 706 CA LEU A 82 33.392 6.529 -11.386 1.00 18.89 C ATOM 707 C LEU A 82 32.393 5.956 -12.397 1.00 18.06 C ATOM 708 O LEU A 82 32.747 5.065 -13.182 1.00 18.43 O ATOM 709 CB LEU A 82 34.434 7.383 -12.114 1.00 19.66 C ATOM 710 CG LEU A 82 33.921 8.576 -12.924 1.00 21.09 C ATOM 711 CD1 LEU A 82 33.292 9.633 -12.009 1.00 20.62 C ATOM 712 CD2 LEU A 82 35.049 9.172 -13.752 1.00 22.30 C ATOM 0 H LEU A 82 34.381 4.840 -11.132 1.00 19.26 H new ATOM 0 HA LEU A 82 32.897 7.076 -10.756 1.00 18.89 H new ATOM 0 HB2 LEU A 82 35.063 7.716 -11.455 1.00 19.66 H new ATOM 0 HB3 LEU A 82 34.931 6.804 -12.713 1.00 19.66 H new ATOM 0 HG LEU A 82 33.229 8.263 -13.528 1.00 21.09 H new ATOM 0 HD11 LEU A 82 32.975 10.377 -12.544 1.00 20.62 H new ATOM 0 HD12 LEU A 82 32.547 9.242 -11.527 1.00 20.62 H new ATOM 0 HD13 LEU A 82 33.955 9.950 -11.376 1.00 20.62 H new ATOM 0 HD21 LEU A 82 34.713 9.927 -14.261 1.00 22.30 H new ATOM 0 HD22 LEU A 82 35.760 9.470 -13.163 1.00 22.30 H new ATOM 0 HD23 LEU A 82 35.394 8.500 -14.361 1.00 22.30 H new ATOM 713 N VAL A 83 31.157 6.448 -12.367 1.00 15.70 N ATOM 714 CA VAL A 83 30.192 6.128 -13.408 1.00 15.81 C ATOM 715 C VAL A 83 29.557 7.398 -13.963 1.00 14.65 C ATOM 716 O VAL A 83 29.522 8.434 -13.297 1.00 14.20 O ATOM 717 CB VAL A 83 29.094 5.119 -12.955 1.00 16.99 C ATOM 718 CG1 VAL A 83 29.704 3.886 -12.304 1.00 16.65 C ATOM 719 CG2 VAL A 83 28.090 5.760 -12.005 1.00 17.19 C ATOM 0 H VAL A 83 30.860 6.969 -11.751 1.00 15.70 H new ATOM 0 HA VAL A 83 30.693 5.684 -14.110 1.00 15.81 H new ATOM 0 HB VAL A 83 28.623 4.847 -13.758 1.00 16.99 H new ATOM 0 HG11 VAL A 83 28.997 3.279 -12.034 1.00 16.65 H new ATOM 0 HG12 VAL A 83 30.287 3.440 -12.938 1.00 16.65 H new ATOM 0 HG13 VAL A 83 30.217 4.152 -11.525 1.00 16.65 H new ATOM 0 HG21 VAL A 83 27.425 5.103 -11.746 1.00 17.19 H new ATOM 0 HG22 VAL A 83 28.552 6.081 -11.215 1.00 17.19 H new ATOM 0 HG23 VAL A 83 27.654 6.504 -12.449 1.00 17.19 H new ATOM 720 N GLY A 84 29.061 7.312 -15.187 1.00 14.05 N ATOM 721 CA GLY A 84 28.361 8.435 -15.794 1.00 14.79 C ATOM 722 C GLY A 84 27.218 8.019 -16.691 1.00 14.93 C ATOM 723 O GLY A 84 27.311 7.006 -17.390 1.00 15.36 O ATOM 0 H GLY A 84 29.118 6.613 -15.685 1.00 14.05 H new ATOM 0 HA2 GLY A 84 28.019 9.011 -15.093 1.00 14.79 H new ATOM 0 HA3 GLY A 84 28.993 8.960 -16.310 1.00 14.79 H new ATOM 724 N TRP A 85 26.144 8.808 -16.656 1.00 15.77 N ATOM 725 CA TRP A 85 25.034 8.679 -17.603 1.00 16.46 C ATOM 726 C TRP A 85 24.956 9.950 -18.388 1.00 17.96 C ATOM 727 O TRP A 85 25.306 11.027 -17.886 1.00 18.14 O ATOM 728 CB TRP A 85 23.709 8.499 -16.874 1.00 15.35 C ATOM 729 CG TRP A 85 23.633 7.384 -15.860 1.00 14.95 C ATOM 730 CD1 TRP A 85 23.253 6.055 -16.071 1.00 15.00 C ATOM 731 CD2 TRP A 85 23.812 7.506 -14.420 1.00 15.56 C ATOM 732 NE1 TRP A 85 23.246 5.355 -14.890 1.00 15.10 N ATOM 733 CE2 TRP A 85 23.574 6.175 -13.859 1.00 15.29 C ATOM 734 CE3 TRP A 85 24.153 8.551 -13.566 1.00 15.66 C ATOM 735 CZ2 TRP A 85 23.679 5.924 -12.510 1.00 15.61 C ATOM 736 CZ3 TRP A 85 24.265 8.277 -12.197 1.00 16.32 C ATOM 737 CH2 TRP A 85 24.023 6.993 -11.688 1.00 16.29 C ATOM 0 H TRP A 85 26.038 9.437 -16.079 1.00 15.77 H new ATOM 0 HA TRP A 85 25.189 7.907 -18.169 1.00 16.46 H new ATOM 0 HB2 TRP A 85 23.497 9.331 -16.424 1.00 15.35 H new ATOM 0 HB3 TRP A 85 23.017 8.351 -17.538 1.00 15.35 H new ATOM 0 HD1 TRP A 85 23.034 5.694 -16.900 1.00 15.00 H new ATOM 0 HE1 TRP A 85 23.061 4.519 -14.814 1.00 15.10 H new ATOM 0 HE3 TRP A 85 24.302 9.408 -13.895 1.00 15.66 H new ATOM 0 HZ2 TRP A 85 23.526 5.075 -12.162 1.00 15.61 H new ATOM 0 HZ3 TRP A 85 24.505 8.961 -11.614 1.00 16.32 H new ATOM 0 HH2 TRP A 85 24.095 6.851 -10.772 1.00 16.29 H new ATOM 738 N GLN A 86 24.467 9.860 -19.616 1.00 20.57 N ATOM 739 CA GLN A 86 24.145 11.067 -20.371 1.00 24.36 C ATOM 740 C GLN A 86 23.174 11.923 -19.544 1.00 24.57 C ATOM 741 O GLN A 86 22.174 11.428 -19.036 1.00 25.06 O ATOM 742 CB GLN A 86 23.555 10.709 -21.731 1.00 29.11 C ATOM 743 CG GLN A 86 23.166 11.917 -22.570 1.00 34.31 C ATOM 744 CD GLN A 86 22.539 11.504 -23.887 1.00 40.94 C ATOM 745 OE1 GLN A 86 23.205 10.913 -24.744 1.00 47.06 O ATOM 746 NE2 GLN A 86 21.247 11.795 -24.048 1.00 43.11 N ATOM 0 H GLN A 86 24.315 9.121 -20.029 1.00 20.57 H new ATOM 0 HA GLN A 86 24.953 11.577 -20.537 1.00 24.36 H new ATOM 0 HB2 GLN A 86 24.200 10.178 -22.224 1.00 29.11 H new ATOM 0 HB3 GLN A 86 22.772 10.153 -21.598 1.00 29.11 H new ATOM 0 HG2 GLN A 86 22.542 12.469 -22.073 1.00 34.31 H new ATOM 0 HG3 GLN A 86 23.952 12.460 -22.741 1.00 34.31 H new ATOM 0 HE21 GLN A 86 20.819 12.208 -23.427 1.00 43.11 H new ATOM 0 HE22 GLN A 86 20.843 11.570 -24.773 1.00 43.11 H new ATOM 747 N ALA A 87 23.510 13.194 -19.369 1.00 25.36 N ATOM 748 CA ALA A 87 22.746 14.074 -18.481 1.00 27.69 C ATOM 749 C ALA A 87 21.324 14.257 -18.981 1.00 29.56 C ATOM 750 O ALA A 87 21.115 14.481 -20.170 1.00 28.31 O ATOM 751 CB ALA A 87 23.416 15.431 -18.364 1.00 27.45 C ATOM 0 H ALA A 87 24.179 13.572 -19.755 1.00 25.36 H new ATOM 0 HA ALA A 87 22.719 13.653 -17.608 1.00 27.69 H new ATOM 0 HB1 ALA A 87 22.897 15.999 -17.773 1.00 27.45 H new ATOM 0 HB2 ALA A 87 24.310 15.321 -18.003 1.00 27.45 H new ATOM 0 HB3 ALA A 87 23.471 15.842 -19.241 1.00 27.45 H new ATOM 752 N PRO A 88 20.335 14.155 -18.071 1.00 32.72 N ATOM 753 CA PRO A 88 18.974 14.529 -18.446 1.00 33.13 C ATOM 754 C PRO A 88 18.961 15.955 -19.006 1.00 32.91 C ATOM 755 O PRO A 88 19.728 16.810 -18.540 1.00 34.87 O ATOM 756 CB PRO A 88 18.216 14.462 -17.117 1.00 33.63 C ATOM 757 CG PRO A 88 18.953 13.424 -16.341 1.00 34.96 C ATOM 758 CD PRO A 88 20.405 13.660 -16.683 1.00 33.14 C ATOM 0 HA PRO A 88 18.588 13.960 -19.130 1.00 33.13 H new ATOM 0 HB2 PRO A 88 18.221 15.318 -16.661 1.00 33.63 H new ATOM 0 HB3 PRO A 88 17.287 14.216 -17.249 1.00 33.63 H new ATOM 0 HG2 PRO A 88 18.795 13.516 -15.388 1.00 34.96 H new ATOM 0 HG3 PRO A 88 18.672 12.530 -16.590 1.00 34.96 H new ATOM 0 HD2 PRO A 88 20.814 14.309 -16.089 1.00 33.14 H new ATOM 0 HD3 PRO A 88 20.928 12.846 -16.617 1.00 33.14 H new ATOM 759 N APRO A 89 18.085 16.244 -19.983 0.48 32.95 N ATOM 760 CA APRO A 89 18.173 17.519 -20.722 0.48 31.74 C ATOM 761 C APRO A 89 18.049 18.803 -19.882 0.48 30.97 C ATOM 762 O APRO A 89 18.631 19.831 -20.237 0.48 29.85 O ATOM 763 CB APRO A 89 17.010 17.428 -21.708 0.48 32.49 C ATOM 764 CG APRO A 89 16.054 16.462 -21.088 0.48 32.31 C ATOM 765 CD APRO A 89 16.919 15.446 -20.402 0.48 32.15 C ATOM 766 N BPRO A 89 18.123 16.183 -20.028 0.52 34.53 N ATOM 767 CA BPRO A 89 17.886 17.528 -20.521 0.52 33.99 C ATOM 768 C BPRO A 89 17.254 18.318 -19.386 0.52 32.91 C ATOM 769 O BPRO A 89 16.379 17.803 -18.688 0.52 33.22 O ATOM 770 CB BPRO A 89 16.882 17.316 -21.655 0.52 35.00 C ATOM 771 CG BPRO A 89 17.018 15.879 -22.041 0.52 35.34 C ATOM 772 CD BPRO A 89 17.331 15.176 -20.757 0.52 34.34 C ATOM 0 HA APRO A 89 19.056 17.606 -21.114 0.48 33.99 H new ATOM 0 HA BPRO A 89 18.677 18.003 -20.821 0.52 33.99 H new ATOM 0 HB2APRO A 89 16.596 18.294 -21.844 0.48 35.00 H new ATOM 0 HB2BPRO A 89 15.979 17.516 -21.364 0.52 35.00 H new ATOM 0 HB3APRO A 89 17.309 17.118 -22.577 0.48 35.00 H new ATOM 0 HB3BPRO A 89 17.074 17.899 -22.406 0.52 35.00 H new ATOM 0 HG2APRO A 89 15.466 16.906 -20.457 0.48 35.34 H new ATOM 0 HG2BPRO A 89 16.201 15.541 -22.439 0.52 35.34 H new ATOM 0 HG3APRO A 89 15.489 16.047 -21.759 0.48 35.34 H new ATOM 0 HG3BPRO A 89 17.724 15.754 -22.694 0.52 35.34 H new ATOM 0 HD2APRO A 89 16.468 15.041 -19.644 0.48 34.34 H new ATOM 0 HD2BPRO A 89 16.526 14.930 -20.274 0.52 34.34 H new ATOM 0 HD3APRO A 89 17.172 14.725 -21.000 0.48 34.34 H new ATOM 0 HD3BPRO A 89 17.833 14.359 -20.905 0.52 34.34 H new ATOM 773 N AGLY A 90 17.300 18.750 -18.785 0.48 29.85 N ATOM 774 CA AGLY A 90 17.091 19.936 -17.956 0.48 30.29 C ATOM 775 C AGLY A 90 18.242 20.288 -17.023 0.48 30.86 C ATOM 776 O AGLY A 90 18.290 21.393 -16.480 0.48 30.74 O ATOM 777 N BGLY A 90 17.723 19.538 -19.173 0.52 32.31 N ATOM 778 CA BGLY A 90 17.263 20.312 -18.036 0.52 31.76 C ATOM 779 C BGLY A 90 18.292 20.353 -16.925 0.52 31.74 C ATOM 780 O BGLY A 90 18.290 21.292 -16.127 0.52 31.64 O ATOM 0 H AGLY A 90 16.905 18.040 -18.503 0.48 32.31 H new ATOM 0 H BGLY A 90 18.303 19.932 -19.671 0.52 32.31 H new ATOM 0 HA2AGLY A 90 16.922 20.694 -18.538 0.48 31.76 H new ATOM 0 HA2BGLY A 90 17.060 21.217 -18.322 0.52 31.76 H new ATOM 0 HA3AGLY A 90 16.291 19.804 -17.423 0.48 31.76 H new ATOM 0 HA3BGLY A 90 16.438 19.930 -17.698 0.52 31.76 H new ATOM 781 N ALA A 91 19.167 19.344 -16.848 1.00 30.83 N ATOM 782 CA ALA A 91 20.298 19.455 -15.916 1.00 31.23 C ATOM 783 C ALA A 91 21.234 20.511 -16.473 1.00 31.49 C ATOM 784 O ALA A 91 21.374 20.635 -17.685 1.00 31.10 O ATOM 785 CB ALA A 91 21.019 18.132 -15.752 1.00 31.12 C ATOM 0 H AALA A 91 19.156 18.600 -17.279 0.48 30.83 H new ATOM 0 H BALA A 91 19.130 18.616 -17.305 0.52 30.83 H new ATOM 0 HA ALA A 91 19.979 19.704 -15.034 1.00 31.23 H new ATOM 0 HB1 ALA A 91 21.757 18.240 -15.132 1.00 31.12 H new ATOM 0 HB2 ALA A 91 20.402 17.468 -15.406 1.00 31.12 H new ATOM 0 HB3 ALA A 91 21.359 17.840 -16.612 1.00 31.12 H new ATOM 786 N ARG A 92 21.832 21.300 -15.594 1.00 32.75 N ATOM 787 CA ARG A 92 22.765 22.336 -16.022 1.00 34.90 C ATOM 788 C ARG A 92 24.179 21.803 -15.814 1.00 33.57 C ATOM 789 O ARG A 92 24.532 21.414 -14.706 1.00 35.49 O ATOM 790 CB ARG A 92 22.548 23.611 -15.201 1.00 38.81 C ATOM 791 CG ARG A 92 23.144 24.859 -15.832 1.00 45.07 C ATOM 792 CD ARG A 92 23.215 26.023 -14.851 1.00 50.32 C ATOM 793 NE ARG A 92 24.031 27.120 -15.380 1.00 56.78 N ATOM 794 CZ ARG A 92 25.363 27.191 -15.304 1.00 59.79 C ATOM 795 NH1 ARG A 92 26.070 26.227 -14.715 1.00 60.95 N ATOM 796 NH2 ARG A 92 25.996 28.236 -15.823 1.00 62.50 N ATOM 0 H ARG A 92 21.713 21.254 -14.744 1.00 32.75 H new ATOM 0 HA ARG A 92 22.624 22.556 -16.956 1.00 34.90 H new ATOM 0 HB2 ARG A 92 21.596 23.746 -15.075 1.00 38.81 H new ATOM 0 HB3 ARG A 92 22.936 23.488 -14.320 1.00 38.81 H new ATOM 0 HG2 ARG A 92 24.035 24.660 -16.160 1.00 45.07 H new ATOM 0 HG3 ARG A 92 22.611 25.117 -16.600 1.00 45.07 H new ATOM 0 HD2 ARG A 92 22.319 26.345 -14.664 1.00 50.32 H new ATOM 0 HD3 ARG A 92 23.588 25.717 -14.010 1.00 50.32 H new ATOM 0 HE ARG A 92 23.621 27.768 -15.769 1.00 56.78 H new ATOM 0 HH11 ARG A 92 25.669 25.546 -14.376 1.00 60.95 H new ATOM 0 HH12 ARG A 92 26.927 26.286 -14.674 1.00 60.95 H new ATOM 0 HH21 ARG A 92 25.549 28.863 -16.206 1.00 62.50 H new ATOM 0 HH22 ARG A 92 26.853 28.286 -15.776 1.00 62.50 H new ATOM 797 N SER A 93 24.988 21.787 -16.866 1.00 30.76 N ATOM 798 CA SER A 93 26.336 21.216 -16.766 1.00 27.71 C ATOM 799 C SER A 93 27.365 22.191 -16.227 1.00 26.04 C ATOM 800 O SER A 93 27.354 23.352 -16.581 1.00 24.33 O ATOM 801 CB SER A 93 26.798 20.689 -18.129 1.00 29.51 C ATOM 802 OG SER A 93 26.417 19.332 -18.285 1.00 30.45 O ATOM 0 H SER A 93 24.783 22.097 -17.642 1.00 30.76 H new ATOM 0 HA SER A 93 26.271 20.488 -16.129 1.00 27.71 H new ATOM 0 HB2 SER A 93 26.410 21.224 -18.839 1.00 29.51 H new ATOM 0 HB3 SER A 93 27.761 20.772 -18.206 1.00 29.51 H new ATOM 0 HG SER A 93 25.676 19.204 -17.911 1.00 30.45 H new ATOM 803 N LEU A 94 28.255 21.703 -15.366 1.00 23.28 N ATOM 804 CA LEU A 94 29.463 22.436 -15.012 1.00 22.25 C ATOM 805 C LEU A 94 30.472 22.278 -16.154 1.00 22.96 C ATOM 806 O LEU A 94 30.423 21.316 -16.911 1.00 22.81 O ATOM 807 CB LEU A 94 30.054 21.886 -13.708 1.00 20.31 C ATOM 808 CG LEU A 94 29.215 22.085 -12.439 1.00 20.65 C ATOM 809 CD1 LEU A 94 29.748 21.297 -11.255 1.00 19.15 C ATOM 810 CD2 LEU A 94 29.133 23.574 -12.087 1.00 21.80 C ATOM 0 H LEU A 94 28.175 20.942 -14.974 1.00 23.28 H new ATOM 0 HA LEU A 94 29.254 23.374 -14.878 1.00 22.25 H new ATOM 0 HB2 LEU A 94 30.210 20.936 -13.823 1.00 20.31 H new ATOM 0 HB3 LEU A 94 30.919 22.301 -13.568 1.00 20.31 H new ATOM 0 HG LEU A 94 28.327 21.745 -12.631 1.00 20.65 H new ATOM 0 HD11 LEU A 94 29.186 21.456 -10.481 1.00 19.15 H new ATOM 0 HD12 LEU A 94 29.745 20.351 -11.468 1.00 19.15 H new ATOM 0 HD13 LEU A 94 30.655 21.581 -11.059 1.00 19.15 H new ATOM 0 HD21 LEU A 94 28.601 23.688 -11.284 1.00 21.80 H new ATOM 0 HD22 LEU A 94 30.026 23.920 -11.934 1.00 21.80 H new ATOM 0 HD23 LEU A 94 28.720 24.058 -12.819 1.00 21.80 H new ATOM 811 N THR A 95 31.375 23.232 -16.290 1.00 24.40 N ATOM 812 CA THR A 95 32.492 23.056 -17.200 1.00 26.62 C ATOM 813 C THR A 95 33.748 22.762 -16.367 1.00 25.27 C ATOM 814 O THR A 95 33.879 23.264 -15.251 1.00 24.02 O ATOM 815 CB THR A 95 32.673 24.270 -18.145 1.00 28.55 C ATOM 816 OG1 THR A 95 32.548 25.481 -17.400 1.00 34.12 O ATOM 817 CG2 THR A 95 31.592 24.276 -19.209 1.00 30.18 C ATOM 0 H THR A 95 31.362 23.982 -15.870 1.00 24.40 H new ATOM 0 HA THR A 95 32.318 22.305 -17.789 1.00 26.62 H new ATOM 0 HB THR A 95 33.549 24.204 -18.556 1.00 28.55 H new ATOM 0 HG1 THR A 95 31.737 25.632 -17.244 1.00 34.12 H new ATOM 0 HG21 THR A 95 31.717 25.040 -19.793 1.00 30.18 H new ATOM 0 HG22 THR A 95 31.646 23.459 -19.730 1.00 30.18 H new ATOM 0 HG23 THR A 95 30.721 24.332 -18.785 1.00 30.18 H new ATOM 818 N PRO A 96 34.668 21.944 -16.899 1.00 25.86 N ATOM 819 CA PRO A 96 35.864 21.589 -16.131 1.00 26.03 C ATOM 820 C PRO A 96 36.752 22.791 -15.835 1.00 28.20 C ATOM 821 O PRO A 96 36.850 23.705 -16.653 1.00 29.15 O ATOM 822 CB PRO A 96 36.585 20.587 -17.042 1.00 26.54 C ATOM 823 CG PRO A 96 35.544 20.088 -17.994 1.00 24.25 C ATOM 824 CD PRO A 96 34.632 21.257 -18.206 1.00 25.65 C ATOM 0 HA PRO A 96 35.640 21.231 -15.257 1.00 26.03 H new ATOM 0 HB2 PRO A 96 37.317 21.011 -17.516 1.00 26.54 H new ATOM 0 HB3 PRO A 96 36.965 19.858 -16.527 1.00 26.54 H new ATOM 0 HG2 PRO A 96 35.941 19.795 -18.829 1.00 24.25 H new ATOM 0 HG3 PRO A 96 35.065 19.329 -17.626 1.00 24.25 H new ATOM 0 HD2 PRO A 96 34.944 21.831 -18.923 1.00 25.65 H new ATOM 0 HD3 PRO A 96 33.734 20.975 -18.439 1.00 25.65 H new ATOM 825 N CYS A 97 37.364 22.805 -14.652 1.00 28.80 N ATOM 826 CA CYS A 97 38.293 23.865 -14.291 1.00 31.97 C ATOM 827 C CYS A 97 39.579 23.757 -15.126 1.00 34.61 C ATOM 828 O CYS A 97 40.121 22.668 -15.304 1.00 33.71 O ATOM 829 CB CYS A 97 38.610 23.806 -12.806 1.00 32.29 C ATOM 830 SG CYS A 97 39.998 24.845 -12.292 1.00 34.30 S ATOM 0 H CYS A 97 37.252 22.206 -14.045 1.00 28.80 H new ATOM 0 HA CYS A 97 37.877 24.721 -14.481 1.00 31.97 H new ATOM 0 HB2 CYS A 97 37.821 24.071 -12.308 1.00 32.29 H new ATOM 0 HB3 CYS A 97 38.803 22.886 -12.564 1.00 32.29 H new ATOM 831 N THR A 98 40.032 24.899 -15.637 1.00 38.39 N ATOM 832 CA THR A 98 41.246 24.996 -16.449 1.00 40.81 C ATOM 833 C THR A 98 42.249 25.976 -15.823 1.00 44.42 C ATOM 834 O THR A 98 43.342 26.174 -16.360 1.00 48.83 O ATOM 835 CB THR A 98 40.918 25.476 -17.881 1.00 40.50 C ATOM 836 OG1 THR A 98 40.266 26.751 -17.819 1.00 38.80 O ATOM 837 CG2 THR A 98 40.008 24.472 -18.609 1.00 40.87 C ATOM 0 H THR A 98 39.636 25.654 -15.520 1.00 38.39 H new ATOM 0 HA THR A 98 41.637 24.109 -16.485 1.00 40.81 H new ATOM 0 HB THR A 98 41.749 25.550 -18.376 1.00 40.50 H new ATOM 0 HG1 THR A 98 40.089 27.013 -18.597 1.00 38.80 H new ATOM 0 HG21 THR A 98 39.818 24.797 -19.503 1.00 40.87 H new ATOM 0 HG22 THR A 98 40.454 23.613 -18.665 1.00 40.87 H new ATOM 0 HG23 THR A 98 39.177 24.373 -18.118 1.00 40.87 H new ATOM 838 N CYS A 99 41.873 26.577 -14.691 1.00 43.34 N ATOM 839 CA CYS A 99 42.690 27.601 -14.025 1.00 42.04 C ATOM 840 C CYS A 99 43.745 27.017 -13.086 1.00 42.12 C ATOM 841 O CYS A 99 44.688 27.708 -12.695 1.00 42.93 O ATOM 842 CB CYS A 99 41.798 28.604 -13.266 1.00 41.69 C ATOM 843 SG CYS A 99 41.188 28.089 -11.624 1.00 44.70 S ATOM 0 H CYS A 99 41.135 26.403 -14.286 1.00 43.34 H new ATOM 0 HA CYS A 99 43.169 28.063 -14.730 1.00 42.04 H new ATOM 0 HB2 CYS A 99 42.296 29.429 -13.158 1.00 41.69 H new ATOM 0 HB3 CYS A 99 41.030 28.807 -13.823 1.00 41.69 H new ATOM 844 N GLY A 100 43.565 25.756 -12.702 1.00 41.99 N ATOM 845 CA GLY A 100 44.474 25.086 -11.774 1.00 38.84 C ATOM 846 C GLY A 100 44.546 25.638 -10.355 1.00 36.69 C ATOM 847 O GLY A 100 45.506 25.363 -9.645 1.00 37.29 O ATOM 0 H GLY A 100 42.913 25.264 -12.972 1.00 41.99 H new ATOM 0 HA2 GLY A 100 44.217 24.152 -11.721 1.00 38.84 H new ATOM 0 HA3 GLY A 100 45.366 25.113 -12.154 1.00 38.84 H new ATOM 848 N SER A 101 43.543 26.404 -9.923 1.00 35.36 N ATOM 849 CA SER A 101 43.517 26.904 -8.541 1.00 33.47 C ATOM 850 C SER A 101 43.567 25.754 -7.537 1.00 32.12 C ATOM 851 O SER A 101 43.026 24.677 -7.796 1.00 33.31 O ATOM 852 CB SER A 101 42.266 27.740 -8.280 1.00 33.32 C ATOM 853 OG SER A 101 42.177 28.079 -6.904 1.00 32.98 O ATOM 0 H SER A 101 42.874 26.645 -10.406 1.00 35.36 H new ATOM 0 HA SER A 101 44.303 27.461 -8.427 1.00 33.47 H new ATOM 0 HB2 SER A 101 42.291 28.547 -8.817 1.00 33.32 H new ATOM 0 HB3 SER A 101 41.477 27.245 -8.549 1.00 33.32 H new ATOM 0 HG SER A 101 41.487 28.539 -6.773 1.00 32.98 H new ATOM 854 N SER A 102 44.227 25.982 -6.405 1.00 31.15 N ATOM 855 CA SER A 102 44.210 25.017 -5.300 1.00 30.37 C ATOM 856 C SER A 102 43.210 25.423 -4.210 1.00 28.60 C ATOM 857 O SER A 102 43.069 24.726 -3.208 1.00 28.34 O ATOM 858 CB SER A 102 45.624 24.811 -4.719 1.00 32.40 C ATOM 859 OG SER A 102 46.120 26.018 -4.142 1.00 36.08 O ATOM 0 H SER A 102 44.692 26.689 -6.253 1.00 31.15 H new ATOM 0 HA SER A 102 43.912 24.167 -5.660 1.00 30.37 H new ATOM 0 HB2 SER A 102 45.603 24.112 -4.047 1.00 32.40 H new ATOM 0 HB3 SER A 102 46.225 24.512 -5.419 1.00 32.40 H new ATOM 0 HG SER A 102 46.957 25.976 -4.081 1.00 36.08 H new ATOM 860 N ASP A 103 42.520 26.545 -4.421 1.00 26.90 N ATOM 861 CA ASP A 103 41.515 27.052 -3.489 1.00 28.04 C ATOM 862 C ASP A 103 40.126 26.580 -3.925 1.00 27.14 C ATOM 863 O ASP A 103 39.532 27.116 -4.868 1.00 28.83 O ATOM 864 CB ASP A 103 41.555 28.587 -3.394 1.00 28.60 C ATOM 865 CG ASP A 103 42.893 29.121 -2.831 1.00 31.45 C ATOM 866 OD1 ASP A 103 43.385 28.600 -1.802 1.00 30.95 O ATOM 867 OD2 ASP A 103 43.451 30.074 -3.418 1.00 33.64 O ATOM 0 H ASP A 103 42.625 27.038 -5.118 1.00 26.90 H new ATOM 0 HA ASP A 103 41.714 26.701 -2.607 1.00 28.04 H new ATOM 0 HB2 ASP A 103 41.406 28.965 -4.275 1.00 28.60 H new ATOM 0 HB3 ASP A 103 40.828 28.890 -2.829 1.00 28.60 H new ATOM 868 N LEU A 104 39.616 25.567 -3.238 1.00 23.21 N ATOM 869 CA LEU A 104 38.424 24.886 -3.717 1.00 21.67 C ATOM 870 C LEU A 104 37.266 25.004 -2.757 1.00 20.74 C ATOM 871 O LEU A 104 37.416 25.422 -1.593 1.00 19.91 O ATOM 872 CB LEU A 104 38.721 23.401 -4.001 1.00 22.16 C ATOM 873 CG LEU A 104 39.979 23.010 -4.788 1.00 23.58 C ATOM 874 CD1 LEU A 104 40.090 21.492 -4.829 1.00 24.81 C ATOM 875 CD2 LEU A 104 40.003 23.607 -6.185 1.00 22.82 C ATOM 0 H LEU A 104 39.940 25.262 -2.502 1.00 23.21 H new ATOM 0 HA LEU A 104 38.165 25.326 -4.542 1.00 21.67 H new ATOM 0 HB2 LEU A 104 38.762 22.946 -3.145 1.00 22.16 H new ATOM 0 HB3 LEU A 104 37.958 23.040 -4.478 1.00 22.16 H new ATOM 0 HG LEU A 104 40.751 23.379 -4.330 1.00 23.58 H new ATOM 0 HD11 LEU A 104 40.884 21.239 -5.326 1.00 24.81 H new ATOM 0 HD12 LEU A 104 40.151 21.147 -3.924 1.00 24.81 H new ATOM 0 HD13 LEU A 104 39.306 21.122 -5.263 1.00 24.81 H new ATOM 0 HD21 LEU A 104 40.814 23.332 -6.641 1.00 22.82 H new ATOM 0 HD22 LEU A 104 39.231 23.296 -6.683 1.00 22.82 H new ATOM 0 HD23 LEU A 104 39.979 24.575 -6.124 1.00 22.82 H new ATOM 876 N TYR A 105 36.094 24.637 -3.265 1.00 20.54 N ATOM 877 CA TYR A 105 34.886 24.544 -2.462 1.00 21.94 C ATOM 878 C TYR A 105 34.267 23.168 -2.673 1.00 20.30 C ATOM 879 O TYR A 105 34.215 22.689 -3.795 1.00 19.21 O ATOM 880 CB TYR A 105 33.877 25.560 -2.938 1.00 25.81 C ATOM 881 CG TYR A 105 34.286 26.973 -2.690 1.00 29.73 C ATOM 882 CD1 TYR A 105 34.066 27.569 -1.445 1.00 31.73 C ATOM 883 CD2 TYR A 105 34.886 27.719 -3.689 1.00 31.10 C ATOM 884 CE1 TYR A 105 34.428 28.887 -1.213 1.00 36.41 C ATOM 885 CE2 TYR A 105 35.258 29.037 -3.465 1.00 37.14 C ATOM 886 CZ TYR A 105 35.026 29.611 -2.229 1.00 37.51 C ATOM 887 OH TYR A 105 35.396 30.918 -1.994 1.00 43.79 O ATOM 0 H TYR A 105 35.979 24.434 -4.093 1.00 20.54 H new ATOM 0 HA TYR A 105 35.112 24.697 -1.531 1.00 21.94 H new ATOM 0 HB2 TYR A 105 33.729 25.437 -3.889 1.00 25.81 H new ATOM 0 HB3 TYR A 105 33.030 25.394 -2.496 1.00 25.81 H new ATOM 0 HD1 TYR A 105 33.671 27.075 -0.763 1.00 31.73 H new ATOM 0 HD2 TYR A 105 35.042 27.333 -4.520 1.00 31.10 H new ATOM 0 HE1 TYR A 105 34.271 29.280 -0.385 1.00 36.41 H new ATOM 0 HE2 TYR A 105 35.661 29.531 -4.142 1.00 37.14 H new ATOM 0 HH TYR A 105 35.746 31.239 -2.687 1.00 43.79 H new ATOM 888 N LEU A 106 33.800 22.554 -1.602 1.00 18.93 N ATOM 889 CA LEU A 106 33.067 21.303 -1.709 1.00 19.87 C ATOM 890 C LEU A 106 31.604 21.648 -1.420 1.00 19.70 C ATOM 891 O LEU A 106 31.325 22.396 -0.494 1.00 18.71 O ATOM 892 CB LEU A 106 33.630 20.278 -0.714 1.00 22.10 C ATOM 893 CG LEU A 106 32.790 19.045 -0.353 1.00 24.63 C ATOM 894 CD1 LEU A 106 32.754 18.079 -1.524 1.00 25.87 C ATOM 895 CD2 LEU A 106 33.361 18.369 0.892 1.00 26.46 C ATOM 0 H LEU A 106 33.896 22.845 -0.798 1.00 18.93 H new ATOM 0 HA LEU A 106 33.149 20.899 -2.587 1.00 19.87 H new ATOM 0 HB2 LEU A 106 34.476 19.962 -1.068 1.00 22.10 H new ATOM 0 HB3 LEU A 106 33.826 20.749 0.111 1.00 22.10 H new ATOM 0 HG LEU A 106 31.881 19.324 -0.159 1.00 24.63 H new ATOM 0 HD11 LEU A 106 32.222 17.303 -1.288 1.00 25.87 H new ATOM 0 HD12 LEU A 106 32.360 18.518 -2.294 1.00 25.87 H new ATOM 0 HD13 LEU A 106 33.657 17.797 -1.739 1.00 25.87 H new ATOM 0 HD21 LEU A 106 32.825 17.592 1.113 1.00 26.46 H new ATOM 0 HD22 LEU A 106 34.275 18.093 0.720 1.00 26.46 H new ATOM 0 HD23 LEU A 106 33.347 18.993 1.635 1.00 26.46 H new ATOM 896 N VAL A 107 30.687 21.160 -2.247 1.00 19.06 N ATOM 897 CA VAL A 107 29.271 21.407 -2.018 1.00 19.42 C ATOM 898 C VAL A 107 28.708 20.123 -1.450 1.00 19.49 C ATOM 899 O VAL A 107 28.820 19.055 -2.069 1.00 19.69 O ATOM 900 CB VAL A 107 28.542 21.807 -3.315 1.00 20.82 C ATOM 901 CG1 VAL A 107 27.074 22.090 -3.021 1.00 21.47 C ATOM 902 CG2 VAL A 107 29.185 23.051 -3.928 1.00 20.11 C ATOM 0 H VAL A 107 30.863 20.686 -2.943 1.00 19.06 H new ATOM 0 HA VAL A 107 29.146 22.150 -1.407 1.00 19.42 H new ATOM 0 HB VAL A 107 28.611 21.072 -3.944 1.00 20.82 H new ATOM 0 HG11 VAL A 107 26.622 22.341 -3.842 1.00 21.47 H new ATOM 0 HG12 VAL A 107 26.658 21.294 -2.654 1.00 21.47 H new ATOM 0 HG13 VAL A 107 27.006 22.815 -2.380 1.00 21.47 H new ATOM 0 HG21 VAL A 107 28.716 23.290 -4.743 1.00 20.11 H new ATOM 0 HG22 VAL A 107 29.133 23.786 -3.298 1.00 20.11 H new ATOM 0 HG23 VAL A 107 30.115 22.867 -4.133 1.00 20.11 H new ATOM 903 N THR A 108 28.157 20.211 -0.248 1.00 18.08 N ATOM 904 CA THR A 108 27.672 19.027 0.433 1.00 18.58 C ATOM 905 C THR A 108 26.198 18.764 0.139 1.00 18.58 C ATOM 906 O THR A 108 25.489 19.619 -0.384 1.00 17.30 O ATOM 907 CB THR A 108 27.832 19.123 1.965 1.00 19.24 C ATOM 908 OG1 THR A 108 26.874 20.051 2.472 1.00 20.39 O ATOM 909 CG2 THR A 108 29.238 19.606 2.349 1.00 21.02 C ATOM 0 H THR A 108 28.056 20.945 0.188 1.00 18.08 H new ATOM 0 HA THR A 108 28.216 18.299 0.093 1.00 18.58 H new ATOM 0 HB THR A 108 27.695 18.241 2.344 1.00 19.24 H new ATOM 0 HG1 THR A 108 26.953 20.108 3.306 1.00 20.39 H new ATOM 0 HG21 THR A 108 29.310 19.657 3.315 1.00 21.02 H new ATOM 0 HG22 THR A 108 29.899 18.983 2.008 1.00 21.02 H new ATOM 0 HG23 THR A 108 29.394 20.484 1.967 1.00 21.02 H new ATOM 910 N ARG A 109 25.749 17.580 0.539 1.00 19.41 N ATOM 911 CA ARG A 109 24.341 17.186 0.446 1.00 22.06 C ATOM 912 C ARG A 109 23.380 18.204 1.103 1.00 24.23 C ATOM 913 O ARG A 109 22.262 18.399 0.639 1.00 25.11 O ATOM 914 CB ARG A 109 24.210 15.793 1.061 1.00 21.30 C ATOM 915 CG ARG A 109 22.798 15.298 1.295 1.00 20.88 C ATOM 916 CD ARG A 109 22.331 14.538 0.092 1.00 19.30 C ATOM 917 NE ARG A 109 21.099 13.812 0.368 1.00 16.36 N ATOM 918 CZ ARG A 109 20.991 12.495 0.412 1.00 16.25 C ATOM 919 NH1 ARG A 109 22.060 11.701 0.226 1.00 15.40 N ATOM 920 NH2 ARG A 109 19.800 11.973 0.656 1.00 15.28 N ATOM 0 H ARG A 109 26.257 16.973 0.876 1.00 19.41 H new ATOM 0 HA ARG A 109 24.075 17.169 -0.487 1.00 22.06 H new ATOM 0 HB2 ARG A 109 24.663 15.160 0.483 1.00 21.30 H new ATOM 0 HB3 ARG A 109 24.680 15.789 1.910 1.00 21.30 H new ATOM 0 HG2 ARG A 109 22.770 14.729 2.080 1.00 20.88 H new ATOM 0 HG3 ARG A 109 22.206 16.047 1.466 1.00 20.88 H new ATOM 0 HD2 ARG A 109 22.188 15.152 -0.645 1.00 19.30 H new ATOM 0 HD3 ARG A 109 23.020 13.915 -0.187 1.00 19.30 H new ATOM 0 HE ARG A 109 20.389 14.275 0.513 1.00 16.36 H new ATOM 0 HH11 ARG A 109 22.832 12.048 0.075 1.00 15.40 H new ATOM 0 HH12 ARG A 109 21.971 10.846 0.258 1.00 15.40 H new ATOM 0 HH21 ARG A 109 19.122 12.488 0.781 1.00 15.28 H new ATOM 0 HH22 ARG A 109 19.703 11.119 0.690 1.00 15.28 H new ATOM 921 N HIS A 110 23.829 18.893 2.146 1.00 25.84 N ATOM 922 CA HIS A 110 22.976 19.912 2.769 1.00 27.43 C ATOM 923 C HIS A 110 23.099 21.293 2.168 1.00 27.12 C ATOM 924 O HIS A 110 22.637 22.279 2.764 1.00 24.76 O ATOM 925 CB HIS A 110 23.184 19.940 4.276 1.00 32.71 C ATOM 926 CG HIS A 110 23.069 18.580 4.918 1.00 38.10 C ATOM 927 ND1 HIS A 110 22.091 17.702 4.587 1.00 39.15 N ATOM 928 CD2 HIS A 110 23.853 17.954 5.885 1.00 41.71 C ATOM 929 CE1 HIS A 110 22.240 16.574 5.309 1.00 42.84 C ATOM 930 NE2 HIS A 110 23.318 16.729 6.107 1.00 44.78 N ATOM 0 H HIS A 110 24.604 18.794 2.505 1.00 25.84 H new ATOM 0 HA HIS A 110 22.065 19.641 2.577 1.00 27.43 H new ATOM 0 HB2 HIS A 110 24.060 20.309 4.469 1.00 32.71 H new ATOM 0 HB3 HIS A 110 22.531 20.536 4.676 1.00 32.71 H new ATOM 0 HD1 HIS A 110 21.472 17.843 4.007 1.00 39.15 H new ATOM 0 HD2 HIS A 110 24.604 18.311 6.301 1.00 41.71 H new ATOM 0 HE1 HIS A 110 21.696 15.821 5.265 1.00 42.84 H new ATOM 931 N ALA A 111 23.686 21.351 0.970 1.00 25.00 N ATOM 932 CA ALA A 111 23.894 22.576 0.182 1.00 24.89 C ATOM 933 C ALA A 111 24.785 23.606 0.886 1.00 25.15 C ATOM 934 O ALA A 111 24.682 24.808 0.641 1.00 25.62 O ATOM 935 CB ALA A 111 22.567 23.190 -0.246 1.00 26.19 C ATOM 0 H ALA A 111 23.988 20.649 0.576 1.00 25.00 H new ATOM 0 HA ALA A 111 24.376 22.305 -0.615 1.00 24.89 H new ATOM 0 HB1 ALA A 111 22.734 23.994 -0.762 1.00 26.19 H new ATOM 0 HB2 ALA A 111 22.076 22.554 -0.789 1.00 26.19 H new ATOM 0 HB3 ALA A 111 22.045 23.414 0.540 1.00 26.19 H new ATOM 936 N ASP A 112 25.645 23.122 1.767 1.00 23.78 N ATOM 937 CA ASP A 112 26.681 23.947 2.359 1.00 27.02 C ATOM 938 C ASP A 112 27.879 23.930 1.426 1.00 25.55 C ATOM 939 O ASP A 112 28.143 22.933 0.754 1.00 24.32 O ATOM 940 CB ASP A 112 27.071 23.417 3.741 1.00 29.20 C ATOM 941 CG ASP A 112 25.925 23.478 4.732 1.00 33.98 C ATOM 942 OD1 ASP A 112 25.214 24.510 4.786 1.00 35.53 O ATOM 943 OD2 ASP A 112 25.736 22.486 5.469 1.00 39.13 O ATOM 0 H ASP A 112 25.644 22.306 2.038 1.00 23.78 H new ATOM 0 HA ASP A 112 26.358 24.854 2.476 1.00 27.02 H new ATOM 0 HB2 ASP A 112 27.374 22.499 3.658 1.00 29.20 H new ATOM 0 HB3 ASP A 112 27.818 23.933 4.083 1.00 29.20 H new ATOM 944 N VAL A 113 28.574 25.055 1.350 1.00 24.19 N ATOM 945 CA VAL A 113 29.709 25.179 0.472 1.00 23.56 C ATOM 946 C VAL A 113 30.899 25.391 1.404 1.00 24.79 C ATOM 947 O VAL A 113 30.953 26.402 2.113 1.00 24.77 O ATOM 948 CB VAL A 113 29.524 26.366 -0.490 1.00 24.63 C ATOM 949 CG1 VAL A 113 30.766 26.550 -1.334 1.00 25.20 C ATOM 950 CG2 VAL A 113 28.312 26.140 -1.389 1.00 23.86 C ATOM 0 H VAL A 113 28.397 25.762 1.806 1.00 24.19 H new ATOM 0 HA VAL A 113 29.831 24.399 -0.091 1.00 23.56 H new ATOM 0 HB VAL A 113 29.376 27.168 0.035 1.00 24.63 H new ATOM 0 HG11 VAL A 113 30.640 27.300 -1.937 1.00 25.20 H new ATOM 0 HG12 VAL A 113 31.527 26.723 -0.757 1.00 25.20 H new ATOM 0 HG13 VAL A 113 30.929 25.745 -1.850 1.00 25.20 H new ATOM 0 HG21 VAL A 113 28.208 26.895 -1.989 1.00 23.86 H new ATOM 0 HG22 VAL A 113 28.440 25.331 -1.908 1.00 23.86 H new ATOM 0 HG23 VAL A 113 27.516 26.050 -0.842 1.00 23.86 H new ATOM 951 N ILE A 114 31.811 24.421 1.453 1.00 22.21 N ATOM 952 CA ILE A 114 32.880 24.449 2.449 1.00 22.24 C ATOM 953 C ILE A 114 34.260 24.504 1.782 1.00 21.35 C ATOM 954 O ILE A 114 34.490 23.853 0.751 1.00 19.35 O ATOM 955 CB ILE A 114 32.770 23.295 3.491 1.00 24.24 C ATOM 956 CG1 ILE A 114 33.100 21.938 2.878 1.00 24.78 C ATOM 957 CG2 ILE A 114 31.374 23.230 4.124 1.00 26.25 C ATOM 958 CD1 ILE A 114 33.236 20.826 3.911 1.00 24.69 C ATOM 0 H ILE A 114 31.829 23.744 0.923 1.00 22.21 H new ATOM 0 HA ILE A 114 32.769 25.268 2.956 1.00 22.24 H new ATOM 0 HB ILE A 114 33.423 23.496 4.180 1.00 24.24 H new ATOM 0 HG12 ILE A 114 32.405 21.699 2.244 1.00 24.78 H new ATOM 0 HG13 ILE A 114 33.928 22.009 2.378 1.00 24.78 H new ATOM 0 HG21 ILE A 114 31.343 22.503 4.765 1.00 26.25 H new ATOM 0 HG22 ILE A 114 31.184 24.067 4.576 1.00 26.25 H new ATOM 0 HG23 ILE A 114 30.711 23.079 3.432 1.00 26.25 H new ATOM 0 HD11 ILE A 114 33.445 19.992 3.463 1.00 24.69 H new ATOM 0 HD12 ILE A 114 33.948 21.046 4.532 1.00 24.69 H new ATOM 0 HD13 ILE A 114 32.402 20.731 4.397 1.00 24.69 H new ATOM 959 N PRO A 115 35.180 25.303 2.364 1.00 20.62 N ATOM 960 CA PRO A 115 36.510 25.487 1.781 1.00 19.18 C ATOM 961 C PRO A 115 37.383 24.242 1.869 1.00 18.82 C ATOM 962 O PRO A 115 37.462 23.582 2.918 1.00 18.41 O ATOM 963 CB PRO A 115 37.115 26.621 2.618 1.00 19.50 C ATOM 964 CG PRO A 115 36.364 26.606 3.905 1.00 21.31 C ATOM 965 CD PRO A 115 34.973 26.122 3.578 1.00 20.61 C ATOM 0 HA PRO A 115 36.454 25.680 0.832 1.00 19.18 H new ATOM 0 HB2 PRO A 115 38.063 26.480 2.765 1.00 19.50 H new ATOM 0 HB3 PRO A 115 37.022 27.476 2.169 1.00 19.50 H new ATOM 0 HG2 PRO A 115 36.792 26.020 4.549 1.00 21.31 H new ATOM 0 HG3 PRO A 115 36.338 27.491 4.301 1.00 21.31 H new ATOM 0 HD2 PRO A 115 34.595 25.600 4.303 1.00 20.61 H new ATOM 0 HD3 PRO A 115 34.366 26.860 3.414 1.00 20.61 H new ATOM 966 N VAL A 116 38.055 23.958 0.763 1.00 19.49 N ATOM 967 CA VAL A 116 38.999 22.858 0.659 1.00 20.00 C ATOM 968 C VAL A 116 40.269 23.415 0.011 1.00 20.96 C ATOM 969 O VAL A 116 40.216 24.285 -0.878 1.00 21.73 O ATOM 970 CB VAL A 116 38.425 21.702 -0.209 1.00 20.14 C ATOM 971 CG1 VAL A 116 39.491 20.647 -0.522 1.00 21.16 C ATOM 972 CG2 VAL A 116 37.239 21.051 0.476 1.00 21.32 C ATOM 0 H VAL A 116 37.973 24.410 0.036 1.00 19.49 H new ATOM 0 HA VAL A 116 39.182 22.493 1.539 1.00 20.00 H new ATOM 0 HB VAL A 116 38.131 22.092 -1.047 1.00 20.14 H new ATOM 0 HG11 VAL A 116 39.101 19.943 -1.063 1.00 21.16 H new ATOM 0 HG12 VAL A 116 40.222 21.060 -1.008 1.00 21.16 H new ATOM 0 HG13 VAL A 116 39.826 20.270 0.306 1.00 21.16 H new ATOM 0 HG21 VAL A 116 36.897 20.334 -0.081 1.00 21.32 H new ATOM 0 HG22 VAL A 116 37.518 20.690 1.332 1.00 21.32 H new ATOM 0 HG23 VAL A 116 36.543 21.712 0.616 1.00 21.32 H new ATOM 973 N ARG A 117 41.405 22.904 0.459 1.00 21.32 N ATOM 974 CA ARG A 117 42.689 23.255 -0.109 1.00 23.29 C ATOM 975 C ARG A 117 43.199 22.016 -0.843 1.00 22.27 C ATOM 976 O ARG A 117 43.410 20.988 -0.208 1.00 21.33 O ATOM 977 CB ARG A 117 43.651 23.620 1.027 1.00 25.95 C ATOM 978 CG ARG A 117 44.722 24.629 0.657 1.00 32.57 C ATOM 979 CD ARG A 117 45.889 24.010 -0.074 1.00 37.95 C ATOM 980 NE ARG A 117 46.775 25.032 -0.640 1.00 43.17 N ATOM 981 CZ ARG A 117 47.799 24.775 -1.457 1.00 47.08 C ATOM 982 NH1 ARG A 117 48.084 23.525 -1.812 1.00 43.86 N ATOM 983 NH2 ARG A 117 48.540 25.777 -1.931 1.00 49.23 N ATOM 0 H ARG A 117 41.450 22.340 1.106 1.00 21.32 H new ATOM 0 HA ARG A 117 42.620 24.010 -0.714 1.00 23.29 H new ATOM 0 HB2 ARG A 117 43.135 23.972 1.769 1.00 25.95 H new ATOM 0 HB3 ARG A 117 44.083 22.810 1.341 1.00 25.95 H new ATOM 0 HG2 ARG A 117 44.329 25.321 0.102 1.00 32.57 H new ATOM 0 HG3 ARG A 117 45.044 25.061 1.463 1.00 32.57 H new ATOM 0 HD2 ARG A 117 46.391 23.447 0.535 1.00 37.95 H new ATOM 0 HD3 ARG A 117 45.560 23.437 -0.784 1.00 37.95 H new ATOM 0 HE ARG A 117 46.625 25.853 -0.432 1.00 43.17 H new ATOM 0 HH11 ARG A 117 47.607 22.874 -1.515 1.00 43.86 H new ATOM 0 HH12 ARG A 117 48.745 23.368 -2.339 1.00 43.86 H new ATOM 0 HH21 ARG A 117 48.358 26.588 -1.710 1.00 49.23 H new ATOM 0 HH22 ARG A 117 49.200 25.612 -2.457 1.00 49.23 H new ATOM 984 N ARG A 118 43.373 22.099 -2.158 1.00 22.21 N ATOM 985 CA ARG A 118 43.893 20.965 -2.911 1.00 26.12 C ATOM 986 C ARG A 118 45.309 20.627 -2.437 1.00 29.02 C ATOM 987 O ARG A 118 46.118 21.525 -2.215 1.00 26.98 O ATOM 988 CB ARG A 118 43.883 21.243 -4.409 1.00 28.53 C ATOM 989 CG ARG A 118 44.138 20.005 -5.248 1.00 30.25 C ATOM 990 CD ARG A 118 44.060 20.272 -6.736 1.00 31.97 C ATOM 991 NE ARG A 118 43.824 19.015 -7.439 1.00 34.31 N ATOM 992 CZ ARG A 118 43.483 18.912 -8.721 1.00 34.57 C ATOM 993 NH1 ARG A 118 43.342 19.999 -9.463 1.00 36.71 N ATOM 994 NH2 ARG A 118 43.283 17.713 -9.261 1.00 35.54 N ATOM 0 H ARG A 118 43.198 22.797 -2.629 1.00 22.21 H new ATOM 0 HA ARG A 118 43.315 20.203 -2.749 1.00 26.12 H new ATOM 0 HB2 ARG A 118 43.025 21.623 -4.656 1.00 28.53 H new ATOM 0 HB3 ARG A 118 44.558 21.909 -4.613 1.00 28.53 H new ATOM 0 HG2 ARG A 118 45.015 19.650 -5.034 1.00 30.25 H new ATOM 0 HG3 ARG A 118 43.491 19.322 -5.013 1.00 30.25 H new ATOM 0 HD2 ARG A 118 43.345 20.900 -6.926 1.00 31.97 H new ATOM 0 HD3 ARG A 118 44.884 20.678 -7.046 1.00 31.97 H new ATOM 0 HE ARG A 118 43.912 18.286 -6.991 1.00 34.31 H new ATOM 0 HH11 ARG A 118 43.471 20.776 -9.117 1.00 36.71 H new ATOM 0 HH12 ARG A 118 43.122 19.929 -10.291 1.00 36.71 H new ATOM 0 HH21 ARG A 118 43.374 17.005 -8.782 1.00 35.54 H new ATOM 0 HH22 ARG A 118 43.063 17.646 -10.090 1.00 35.54 H new ATOM 995 N ARG A 119 45.587 19.335 -2.284 1.00 30.80 N ATOM 996 CA ARG A 119 46.847 18.861 -1.714 1.00 34.48 C ATOM 997 C ARG A 119 47.542 17.876 -2.644 1.00 36.38 C ATOM 998 O ARG A 119 48.503 17.218 -2.249 1.00 41.60 O ATOM 999 CB ARG A 119 46.592 18.203 -0.352 1.00 36.55 C ATOM 1000 CG ARG A 119 46.247 19.157 0.784 1.00 38.44 C ATOM 1001 CD ARG A 119 47.446 20.023 1.136 1.00 41.82 C ATOM 1002 NE ARG A 119 47.166 20.995 2.188 1.00 43.97 N ATOM 1003 CZ ARG A 119 47.901 22.081 2.403 1.00 44.93 C ATOM 1004 NH1 ARG A 119 48.945 22.349 1.629 1.00 46.30 N ATOM 1005 NH2 ARG A 119 47.587 22.910 3.382 1.00 45.96 N ATOM 0 H ARG A 119 45.047 18.705 -2.509 1.00 30.80 H new ATOM 0 HA ARG A 119 47.430 19.628 -1.599 1.00 34.48 H new ATOM 0 HB2 ARG A 119 45.867 17.565 -0.449 1.00 36.55 H new ATOM 0 HB3 ARG A 119 47.382 17.699 -0.101 1.00 36.55 H new ATOM 0 HG2 ARG A 119 45.500 19.719 0.526 1.00 38.44 H new ATOM 0 HG3 ARG A 119 45.966 18.652 1.563 1.00 38.44 H new ATOM 0 HD2 ARG A 119 48.178 19.452 1.418 1.00 41.82 H new ATOM 0 HD3 ARG A 119 47.743 20.493 0.341 1.00 41.82 H new ATOM 0 HE ARG A 119 46.487 20.857 2.698 1.00 43.97 H new ATOM 0 HH11 ARG A 119 49.149 21.818 0.984 1.00 46.30 H new ATOM 0 HH12 ARG A 119 49.417 23.053 1.773 1.00 46.30 H new ATOM 0 HH21 ARG A 119 46.906 22.747 3.881 1.00 45.96 H new ATOM 0 HH22 ARG A 119 48.064 23.612 3.520 1.00 45.96 H new ATOM 1006 N GLY A 120 47.067 17.794 -3.885 1.00 36.51 N ATOM 1007 CA GLY A 120 47.569 16.822 -4.858 1.00 39.80 C ATOM 1008 C GLY A 120 46.464 16.467 -5.831 1.00 41.73 C ATOM 1009 O GLY A 120 45.381 17.065 -5.790 1.00 42.32 O ATOM 0 H GLY A 120 46.443 18.302 -4.188 1.00 36.51 H new ATOM 0 HA2 GLY A 120 48.328 17.191 -5.336 1.00 39.80 H new ATOM 0 HA3 GLY A 120 47.881 16.025 -4.402 1.00 39.80 H new ATOM 1010 N ASP A 121 46.723 15.480 -6.685 1.00 39.40 N ATOM 1011 CA ASP A 121 45.786 15.070 -7.727 1.00 41.50 C ATOM 1012 C ASP A 121 44.373 14.788 -7.216 1.00 37.11 C ATOM 1013 O ASP A 121 43.395 15.255 -7.797 1.00 35.59 O ATOM 1014 CB ASP A 121 46.313 13.836 -8.479 1.00 46.90 C ATOM 1015 CG ASP A 121 47.278 14.197 -9.597 1.00 54.83 C ATOM 1016 OD1 ASP A 121 47.053 15.223 -10.280 1.00 57.82 O ATOM 1017 OD2 ASP A 121 48.261 13.448 -9.803 1.00 59.03 O ATOM 0 H ASP A 121 47.453 15.026 -6.676 1.00 39.40 H new ATOM 0 HA ASP A 121 45.721 15.829 -8.328 1.00 41.50 H new ATOM 0 HB2 ASP A 121 46.758 13.245 -7.851 1.00 46.90 H new ATOM 0 HB3 ASP A 121 45.564 13.344 -8.850 1.00 46.90 H new ATOM 1018 N SER A 122 44.273 14.037 -6.126 1.00 32.72 N ATOM 1019 CA SER A 122 42.981 13.505 -5.722 1.00 33.13 C ATOM 1020 C SER A 122 42.685 13.669 -4.235 1.00 29.69 C ATOM 1021 O SER A 122 41.907 12.903 -3.671 1.00 28.72 O ATOM 1022 CB SER A 122 42.891 12.033 -6.146 1.00 31.88 C ATOM 1023 OG SER A 122 43.952 11.292 -5.591 1.00 38.17 O ATOM 0 H SER A 122 44.931 13.827 -5.614 1.00 32.72 H new ATOM 0 HA SER A 122 42.299 14.026 -6.174 1.00 33.13 H new ATOM 0 HB2 SER A 122 42.043 11.659 -5.858 1.00 31.88 H new ATOM 0 HB3 SER A 122 42.916 11.968 -7.113 1.00 31.88 H new ATOM 0 HG SER A 122 43.889 10.489 -5.830 1.00 38.17 H new ATOM 1024 N ARG A 123 43.306 14.667 -3.602 1.00 29.25 N ATOM 1025 CA ARG A 123 43.096 14.933 -2.174 1.00 29.69 C ATOM 1026 C ARG A 123 43.034 16.421 -1.890 1.00 28.12 C ATOM 1027 O ARG A 123 43.764 17.217 -2.495 1.00 27.89 O ATOM 1028 CB ARG A 123 44.209 14.311 -1.319 1.00 34.49 C ATOM 1029 CG ARG A 123 44.336 12.808 -1.454 1.00 38.72 C ATOM 1030 CD ARG A 123 43.276 12.102 -0.633 1.00 42.90 C ATOM 1031 NE ARG A 123 43.807 11.760 0.678 1.00 46.86 N ATOM 1032 CZ ARG A 123 44.174 10.536 1.046 1.00 46.97 C ATOM 1033 NH1 ARG A 123 44.046 9.509 0.209 1.00 48.64 N ATOM 1034 NH2 ARG A 123 44.651 10.338 2.265 1.00 47.74 N ATOM 0 H ARG A 123 43.857 15.206 -3.984 1.00 29.25 H new ATOM 0 HA ARG A 123 42.247 14.527 -1.939 1.00 29.69 H new ATOM 0 HB2 ARG A 123 45.055 14.719 -1.562 1.00 34.49 H new ATOM 0 HB3 ARG A 123 44.046 14.528 -0.388 1.00 34.49 H new ATOM 0 HG2 ARG A 123 44.251 12.555 -2.386 1.00 38.72 H new ATOM 0 HG3 ARG A 123 45.217 12.526 -1.163 1.00 38.72 H new ATOM 0 HD2 ARG A 123 42.498 12.673 -0.536 1.00 42.90 H new ATOM 0 HD3 ARG A 123 42.983 11.299 -1.091 1.00 42.90 H new ATOM 0 HE ARG A 123 43.889 12.393 1.254 1.00 46.86 H new ATOM 0 HH11 ARG A 123 43.723 9.634 -0.578 1.00 48.64 H new ATOM 0 HH12 ARG A 123 44.286 8.721 0.456 1.00 48.64 H new ATOM 0 HH21 ARG A 123 44.721 10.998 2.812 1.00 47.74 H new ATOM 0 HH22 ARG A 123 44.890 9.549 2.510 1.00 47.74 H new ATOM 1035 N GLY A 124 42.150 16.797 -0.978 1.00 26.38 N ATOM 1036 CA GLY A 124 42.105 18.172 -0.483 1.00 25.50 C ATOM 1037 C GLY A 124 41.870 18.167 1.012 1.00 25.27 C ATOM 1038 O GLY A 124 41.118 17.337 1.513 1.00 25.18 O ATOM 0 H GLY A 124 41.564 16.273 -0.630 1.00 26.38 H new ATOM 0 HA2 GLY A 124 42.937 18.626 -0.687 1.00 25.50 H new ATOM 0 HA3 GLY A 124 41.397 18.663 -0.929 1.00 25.50 H new ATOM 1039 N SER A 125 42.497 19.080 1.743 1.00 24.41 N ATOM 1040 CA SER A 125 42.239 19.136 3.173 1.00 25.72 C ATOM 1041 C SER A 125 41.040 20.027 3.468 1.00 25.44 C ATOM 1042 O SER A 125 40.818 21.050 2.798 1.00 24.63 O ATOM 1043 CB SER A 125 43.483 19.591 3.953 1.00 29.36 C ATOM 1044 OG SER A 125 44.121 20.668 3.296 1.00 31.85 O ATOM 0 H SER A 125 43.058 19.659 1.442 1.00 24.41 H new ATOM 0 HA SER A 125 42.027 18.239 3.474 1.00 25.72 H new ATOM 0 HB2 SER A 125 43.228 19.859 4.850 1.00 29.36 H new ATOM 0 HB3 SER A 125 44.102 18.850 4.044 1.00 29.36 H new ATOM 0 HG SER A 125 44.711 20.993 3.798 1.00 31.85 H new ATOM 1045 N LEU A 126 40.241 19.634 4.447 1.00 24.52 N ATOM 1046 CA LEU A 126 39.163 20.510 4.876 1.00 26.02 C ATOM 1047 C LEU A 126 39.786 21.594 5.754 1.00 27.34 C ATOM 1048 O LEU A 126 40.463 21.291 6.718 1.00 27.79 O ATOM 1049 CB LEU A 126 38.072 19.739 5.621 1.00 27.05 C ATOM 1050 CG LEU A 126 37.275 18.690 4.836 1.00 27.32 C ATOM 1051 CD1 LEU A 126 36.249 18.064 5.755 1.00 29.62 C ATOM 1052 CD2 LEU A 126 36.557 19.330 3.667 1.00 28.91 C ATOM 0 H LEU A 126 40.301 18.886 4.867 1.00 24.52 H new ATOM 0 HA LEU A 126 38.726 20.908 4.107 1.00 26.02 H new ATOM 0 HB2 LEU A 126 38.485 19.295 6.378 1.00 27.05 H new ATOM 0 HB3 LEU A 126 37.443 20.384 5.980 1.00 27.05 H new ATOM 0 HG LEU A 126 37.888 18.018 4.500 1.00 27.32 H new ATOM 0 HD11 LEU A 126 35.740 17.399 5.266 1.00 29.62 H new ATOM 0 HD12 LEU A 126 36.699 17.641 6.503 1.00 29.62 H new ATOM 0 HD13 LEU A 126 35.649 18.751 6.086 1.00 29.62 H new ATOM 0 HD21 LEU A 126 36.059 18.653 3.183 1.00 28.91 H new ATOM 0 HD22 LEU A 126 35.946 20.008 3.994 1.00 28.91 H new ATOM 0 HD23 LEU A 126 37.206 19.740 3.074 1.00 28.91 H new ATOM 1053 N LEU A 127 39.592 22.855 5.400 1.00 28.34 N ATOM 1054 CA LEU A 127 40.221 23.929 6.172 1.00 30.43 C ATOM 1055 C LEU A 127 39.573 24.078 7.529 1.00 31.88 C ATOM 1056 O LEU A 127 40.208 24.508 8.495 1.00 32.28 O ATOM 1057 CB LEU A 127 40.216 25.239 5.389 1.00 31.04 C ATOM 1058 CG LEU A 127 41.107 25.120 4.152 1.00 31.79 C ATOM 1059 CD1 LEU A 127 41.011 26.390 3.340 1.00 31.89 C ATOM 1060 CD2 LEU A 127 42.557 24.825 4.535 1.00 34.51 C ATOM 0 H LEU A 127 39.113 23.112 4.734 1.00 28.34 H new ATOM 0 HA LEU A 127 41.148 23.688 6.325 1.00 30.43 H new ATOM 0 HB2 LEU A 127 39.310 25.461 5.123 1.00 31.04 H new ATOM 0 HB3 LEU A 127 40.531 25.962 5.954 1.00 31.04 H new ATOM 0 HG LEU A 127 40.796 24.374 3.615 1.00 31.79 H new ATOM 0 HD11 LEU A 127 41.576 26.316 2.555 1.00 31.89 H new ATOM 0 HD12 LEU A 127 40.092 26.529 3.064 1.00 31.89 H new ATOM 0 HD13 LEU A 127 41.304 27.142 3.879 1.00 31.89 H new ATOM 0 HD21 LEU A 127 43.096 24.755 3.732 1.00 34.51 H new ATOM 0 HD22 LEU A 127 42.897 25.543 5.091 1.00 34.51 H new ATOM 0 HD23 LEU A 127 42.599 23.989 5.025 1.00 34.51 H new ATOM 1061 N SER A 128 38.308 23.699 7.595 1.00 32.65 N ATOM 1062 CA SER A 128 37.623 23.554 8.862 1.00 36.00 C ATOM 1063 C SER A 128 37.093 22.123 8.999 1.00 34.66 C ATOM 1064 O SER A 128 36.104 21.766 8.368 1.00 34.71 O ATOM 1065 CB SER A 128 36.504 24.595 8.974 1.00 38.69 C ATOM 1066 OG SER A 128 37.061 25.902 9.060 1.00 42.39 O ATOM 0 H SER A 128 37.824 23.519 6.907 1.00 32.65 H new ATOM 0 HA SER A 128 38.241 23.712 9.593 1.00 36.00 H new ATOM 0 HB2 SER A 128 35.918 24.535 8.203 1.00 38.69 H new ATOM 0 HB3 SER A 128 35.961 24.414 9.757 1.00 38.69 H new ATOM 0 HG SER A 128 36.442 26.467 9.120 1.00 42.39 H new ATOM 1067 N PRO A 129 37.763 21.294 9.817 1.00 34.63 N ATOM 1068 CA PRO A 129 37.311 19.913 10.008 1.00 33.70 C ATOM 1069 C PRO A 129 35.878 19.837 10.540 1.00 31.88 C ATOM 1070 O PRO A 129 35.467 20.660 11.351 1.00 31.55 O ATOM 1071 CB PRO A 129 38.303 19.354 11.036 1.00 34.89 C ATOM 1072 CG PRO A 129 39.489 20.265 10.969 1.00 36.64 C ATOM 1073 CD PRO A 129 38.905 21.619 10.691 1.00 35.73 C ATOM 0 HA PRO A 129 37.293 19.417 9.175 1.00 33.70 H new ATOM 0 HB2 PRO A 129 37.918 19.345 11.926 1.00 34.89 H new ATOM 0 HB3 PRO A 129 38.550 18.440 10.824 1.00 34.89 H new ATOM 0 HG2 PRO A 129 39.987 20.259 11.801 1.00 36.64 H new ATOM 0 HG3 PRO A 129 40.103 19.994 10.269 1.00 36.64 H new ATOM 0 HD2 PRO A 129 38.623 22.066 11.505 1.00 35.73 H new ATOM 0 HD3 PRO A 129 39.542 22.205 10.252 1.00 35.73 H new ATOM 1074 N ARG A 130 35.121 18.871 10.045 1.00 30.58 N ATOM 1075 CA ARG A 130 33.729 18.710 10.434 1.00 29.89 C ATOM 1076 C ARG A 130 33.499 17.254 10.787 1.00 27.45 C ATOM 1077 O ARG A 130 34.245 16.391 10.318 1.00 27.05 O ATOM 1078 CB ARG A 130 32.803 19.131 9.285 1.00 33.12 C ATOM 1079 CG ARG A 130 32.945 20.594 8.879 1.00 35.40 C ATOM 1080 CD ARG A 130 31.629 21.126 8.380 1.00 36.79 C ATOM 1081 NE ARG A 130 31.654 22.557 8.090 1.00 39.15 N ATOM 1082 CZ ARG A 130 30.934 23.466 8.744 1.00 40.90 C ATOM 1083 NH1 ARG A 130 30.129 23.102 9.739 1.00 40.43 N ATOM 1084 NH2 ARG A 130 31.021 24.748 8.405 1.00 42.31 N ATOM 0 H ARG A 130 35.398 18.290 9.475 1.00 30.58 H new ATOM 0 HA ARG A 130 33.532 19.272 11.199 1.00 29.89 H new ATOM 0 HB2 ARG A 130 32.985 18.572 8.514 1.00 33.12 H new ATOM 0 HB3 ARG A 130 31.883 18.965 9.545 1.00 33.12 H new ATOM 0 HG2 ARG A 130 33.247 21.119 9.637 1.00 35.40 H new ATOM 0 HG3 ARG A 130 33.619 20.680 8.187 1.00 35.40 H new ATOM 0 HD2 ARG A 130 31.377 20.644 7.577 1.00 36.79 H new ATOM 0 HD3 ARG A 130 30.944 20.949 9.043 1.00 36.79 H new ATOM 0 HE ARG A 130 32.167 22.830 7.456 1.00 39.15 H new ATOM 0 HH11 ARG A 130 30.071 22.274 9.964 1.00 40.43 H new ATOM 0 HH12 ARG A 130 29.667 23.695 10.157 1.00 40.43 H new ATOM 0 HH21 ARG A 130 31.542 24.989 7.764 1.00 42.31 H new ATOM 0 HH22 ARG A 130 30.557 25.337 8.826 1.00 42.31 H new ATOM 1085 N PRO A 131 32.477 16.965 11.611 1.00 26.03 N ATOM 1086 CA PRO A 131 32.183 15.562 11.854 1.00 27.22 C ATOM 1087 C PRO A 131 31.851 14.899 10.524 1.00 29.25 C ATOM 1088 O PRO A 131 31.258 15.541 9.642 1.00 29.22 O ATOM 1089 CB PRO A 131 30.929 15.598 12.738 1.00 26.57 C ATOM 1090 CG PRO A 131 30.790 16.997 13.203 1.00 28.99 C ATOM 1091 CD PRO A 131 31.438 17.852 12.162 1.00 26.15 C ATOM 0 HA PRO A 131 32.916 15.075 12.263 1.00 27.22 H new ATOM 0 HB2 PRO A 131 30.145 15.320 12.239 1.00 26.57 H new ATOM 0 HB3 PRO A 131 31.017 14.991 13.489 1.00 26.57 H new ATOM 0 HG2 PRO A 131 29.856 17.234 13.313 1.00 28.99 H new ATOM 0 HG3 PRO A 131 31.217 17.119 14.066 1.00 28.99 H new ATOM 0 HD2 PRO A 131 30.806 18.132 11.482 1.00 26.15 H new ATOM 0 HD3 PRO A 131 31.819 18.658 12.544 1.00 26.15 H new ATOM 1092 N VAL A 132 32.241 13.640 10.374 1.00 31.89 N ATOM 1093 CA VAL A 132 31.968 12.888 9.153 1.00 35.13 C ATOM 1094 C VAL A 132 30.467 12.789 8.874 1.00 35.25 C ATOM 1095 O VAL A 132 30.057 12.678 7.722 1.00 34.59 O ATOM 1096 CB VAL A 132 32.645 11.497 9.137 1.00 35.45 C ATOM 1097 CG1 VAL A 132 34.112 11.637 9.446 1.00 38.15 C ATOM 1098 CG2 VAL A 132 32.018 10.530 10.130 1.00 36.26 C ATOM 0 H VAL A 132 32.670 13.197 10.974 1.00 31.89 H new ATOM 0 HA VAL A 132 32.369 13.393 8.428 1.00 35.13 H new ATOM 0 HB VAL A 132 32.517 11.132 8.247 1.00 35.45 H new ATOM 0 HG11 VAL A 132 34.530 10.762 9.434 1.00 38.15 H new ATOM 0 HG12 VAL A 132 34.531 12.204 8.779 1.00 38.15 H new ATOM 0 HG13 VAL A 132 34.221 12.036 10.324 1.00 38.15 H new ATOM 0 HG21 VAL A 132 32.475 9.676 10.083 1.00 36.26 H new ATOM 0 HG22 VAL A 132 32.098 10.890 11.027 1.00 36.26 H new ATOM 0 HG23 VAL A 132 31.080 10.407 9.914 1.00 36.26 H new ATOM 1099 N SER A 133 29.670 12.853 9.939 1.00 35.53 N ATOM 1100 CA SER A 133 28.212 12.838 9.849 1.00 35.29 C ATOM 1101 C SER A 133 27.703 13.954 8.951 1.00 34.62 C ATOM 1102 O SER A 133 26.725 13.790 8.242 1.00 37.29 O ATOM 1103 CB SER A 133 27.603 13.007 11.240 1.00 37.63 C ATOM 1104 OG SER A 133 27.684 14.368 11.658 1.00 40.62 O ATOM 0 H SER A 133 29.966 12.907 10.745 1.00 35.53 H new ATOM 0 HA SER A 133 27.948 11.986 9.469 1.00 35.29 H new ATOM 0 HB2 SER A 133 26.676 12.720 11.230 1.00 37.63 H new ATOM 0 HB3 SER A 133 28.069 12.440 11.874 1.00 37.63 H new ATOM 0 HG SER A 133 27.345 14.447 12.422 1.00 40.62 H new ATOM 1105 N TYR A 134 28.378 15.092 8.998 1.00 32.75 N ATOM 1106 CA TYR A 134 28.034 16.256 8.209 1.00 33.53 C ATOM 1107 C TYR A 134 28.225 16.018 6.705 1.00 31.91 C ATOM 1108 O TYR A 134 27.614 16.712 5.887 1.00 31.97 O ATOM 1109 CB TYR A 134 28.920 17.394 8.672 1.00 35.65 C ATOM 1110 CG TYR A 134 28.751 18.717 7.986 1.00 37.95 C ATOM 1111 CD1 TYR A 134 27.865 19.665 8.485 1.00 40.95 C ATOM 1112 CD2 TYR A 134 29.532 19.053 6.877 1.00 39.91 C ATOM 1113 CE1 TYR A 134 27.727 20.902 7.880 1.00 43.73 C ATOM 1114 CE2 TYR A 134 29.399 20.284 6.256 1.00 41.76 C ATOM 1115 CZ TYR A 134 28.499 21.203 6.762 1.00 44.85 C ATOM 1116 OH TYR A 134 28.373 22.431 6.163 1.00 48.63 O ATOM 0 H TYR A 134 29.065 15.209 9.502 1.00 32.75 H new ATOM 0 HA TYR A 134 27.095 16.462 8.337 1.00 33.53 H new ATOM 0 HB2 TYR A 134 28.769 17.526 9.621 1.00 35.65 H new ATOM 0 HB3 TYR A 134 29.844 17.117 8.568 1.00 35.65 H new ATOM 0 HD1 TYR A 134 27.357 19.465 9.238 1.00 40.95 H new ATOM 0 HD2 TYR A 134 30.151 18.440 6.551 1.00 39.91 H new ATOM 0 HE1 TYR A 134 27.125 21.525 8.217 1.00 43.73 H new ATOM 0 HE2 TYR A 134 29.910 20.490 5.507 1.00 41.76 H new ATOM 0 HH TYR A 134 29.022 22.559 5.646 1.00 48.63 H new ATOM 1117 N LEU A 135 29.078 15.056 6.348 1.00 27.92 N ATOM 1118 CA LEU A 135 29.379 14.772 4.936 1.00 26.37 C ATOM 1119 C LEU A 135 28.655 13.533 4.442 1.00 25.66 C ATOM 1120 O LEU A 135 28.731 13.206 3.265 1.00 22.87 O ATOM 1121 CB LEU A 135 30.876 14.584 4.708 1.00 25.87 C ATOM 1122 CG LEU A 135 31.799 15.718 5.154 1.00 26.10 C ATOM 1123 CD1 LEU A 135 33.251 15.331 4.912 1.00 25.75 C ATOM 1124 CD2 LEU A 135 31.440 16.987 4.414 1.00 27.04 C ATOM 0 H LEU A 135 29.495 14.554 6.907 1.00 27.92 H new ATOM 0 HA LEU A 135 29.070 15.543 4.435 1.00 26.37 H new ATOM 0 HB2 LEU A 135 31.151 13.775 5.167 1.00 25.87 H new ATOM 0 HB3 LEU A 135 31.019 14.435 3.760 1.00 25.87 H new ATOM 0 HG LEU A 135 31.685 15.877 6.104 1.00 26.10 H new ATOM 0 HD11 LEU A 135 33.831 16.055 5.197 1.00 25.75 H new ATOM 0 HD12 LEU A 135 33.461 14.530 5.418 1.00 25.75 H new ATOM 0 HD13 LEU A 135 33.388 15.161 3.967 1.00 25.75 H new ATOM 0 HD21 LEU A 135 32.027 17.705 4.699 1.00 27.04 H new ATOM 0 HD22 LEU A 135 31.542 16.845 3.460 1.00 27.04 H new ATOM 0 HD23 LEU A 135 30.520 17.226 4.608 1.00 27.04 H new ATOM 1125 N LYS A 136 27.994 12.829 5.358 1.00 26.78 N ATOM 1126 CA LYS A 136 27.173 11.680 4.998 1.00 26.81 C ATOM 1127 C LYS A 136 26.145 12.034 3.903 1.00 23.98 C ATOM 1128 O LYS A 136 25.440 13.048 3.962 1.00 25.38 O ATOM 1129 CB LYS A 136 26.483 11.102 6.236 1.00 31.90 C ATOM 1130 CG LYS A 136 26.090 9.639 6.104 1.00 35.47 C ATOM 1131 CD LYS A 136 25.434 9.130 7.378 1.00 37.68 C ATOM 1132 CE LYS A 136 25.216 7.622 7.319 1.00 42.75 C ATOM 1133 NZ LYS A 136 24.444 7.127 8.497 1.00 45.80 N ATOM 0 H LYS A 136 28.009 13.004 6.200 1.00 26.78 H new ATOM 0 HA LYS A 136 27.760 11.001 4.631 1.00 26.81 H new ATOM 0 HB2 LYS A 136 27.074 11.200 6.999 1.00 31.90 H new ATOM 0 HB3 LYS A 136 25.688 11.624 6.424 1.00 31.90 H new ATOM 0 HG2 LYS A 136 25.480 9.531 5.358 1.00 35.47 H new ATOM 0 HG3 LYS A 136 26.876 9.107 5.907 1.00 35.47 H new ATOM 0 HD2 LYS A 136 25.990 9.350 8.142 1.00 37.68 H new ATOM 0 HD3 LYS A 136 24.583 9.578 7.508 1.00 37.68 H new ATOM 0 HE2 LYS A 136 24.742 7.395 6.503 1.00 42.75 H new ATOM 0 HE3 LYS A 136 26.075 7.172 7.283 1.00 42.75 H new ATOM 0 HZ1 LYS A 136 24.335 6.246 8.432 1.00 45.80 H new ATOM 0 HZ2 LYS A 136 24.889 7.316 9.244 1.00 45.80 H new ATOM 0 HZ3 LYS A 136 23.648 7.524 8.518 1.00 45.80 H new ATOM 1134 N GLY A 137 26.077 11.191 2.890 1.00 22.13 N ATOM 1135 CA GLY A 137 25.142 11.431 1.807 1.00 19.47 C ATOM 1136 C GLY A 137 25.704 12.319 0.717 1.00 17.06 C ATOM 1137 O GLY A 137 25.006 12.579 -0.267 1.00 17.55 O ATOM 0 H GLY A 137 26.557 10.482 2.809 1.00 22.13 H new ATOM 0 HA2 GLY A 137 24.880 10.581 1.420 1.00 19.47 H new ATOM 0 HA3 GLY A 137 24.339 11.839 2.166 1.00 19.47 H new ATOM 1138 N SER A 138 26.958 12.760 0.858 1.00 15.11 N ATOM 1139 CA SER A 138 27.533 13.697 -0.124 1.00 14.87 C ATOM 1140 C SER A 138 28.433 13.080 -1.197 1.00 13.95 C ATOM 1141 O SER A 138 28.889 13.789 -2.094 1.00 13.40 O ATOM 1142 CB SER A 138 28.298 14.819 0.586 1.00 16.00 C ATOM 1143 OG SER A 138 27.399 15.585 1.358 1.00 16.34 O ATOM 0 H SER A 138 27.485 12.537 1.500 1.00 15.11 H new ATOM 0 HA SER A 138 26.759 14.037 -0.599 1.00 14.87 H new ATOM 0 HB2 SER A 138 28.989 14.444 1.154 1.00 16.00 H new ATOM 0 HB3 SER A 138 28.742 15.384 -0.066 1.00 16.00 H new ATOM 0 HG SER A 138 27.202 15.165 2.058 1.00 16.34 H new ATOM 1144 N ASER A 139 28.687 11.777 -1.109 0.30 13.81 N ATOM 1145 CA ASER A 139 29.543 11.096 -2.081 0.30 14.00 C ATOM 1146 C ASER A 139 29.028 11.339 -3.501 0.30 13.81 C ATOM 1147 O ASER A 139 27.842 11.136 -3.768 0.30 14.04 O ATOM 1148 CB ASER A 139 29.568 9.596 -1.794 0.30 14.28 C ATOM 1149 OG ASER A 139 30.736 9.000 -2.325 0.30 14.00 O ATOM 1150 N BSER A 139 28.689 11.775 -1.105 0.70 13.95 N ATOM 1151 CA BSER A 139 29.514 11.088 -2.102 0.70 14.75 C ATOM 1152 C BSER A 139 29.008 11.404 -3.497 0.70 14.08 C ATOM 1153 O BSER A 139 27.802 11.309 -3.745 0.70 14.60 O ATOM 1154 CB BSER A 139 29.419 9.578 -1.914 0.70 15.83 C ATOM 1155 OG BSER A 139 29.890 9.222 -0.641 0.70 17.36 O ATOM 0 H ASER A 139 28.373 11.267 -0.492 0.30 13.95 H new ATOM 0 H BSER A 139 28.395 11.269 -0.474 0.70 13.95 H new ATOM 0 HA ASER A 139 30.442 11.452 -2.005 0.30 14.75 H new ATOM 0 HA BSER A 139 30.430 11.387 -1.992 0.70 14.75 H new ATOM 0 HB2ASER A 139 29.530 9.445 -0.837 0.30 15.83 H new ATOM 0 HB2BSER A 139 28.499 9.289 -2.019 0.70 15.83 H new ATOM 0 HB3ASER A 139 28.783 9.176 -2.178 0.30 15.83 H new ATOM 0 HB3BSER A 139 29.938 9.126 -2.597 0.70 15.83 H new ATOM 0 HG ASER A 139 30.784 8.201 -2.070 0.30 17.36 H new ATOM 0 HG BSER A 139 29.936 8.385 -0.583 0.70 17.36 H new ATOM 1156 N GLY A 140 29.906 11.789 -4.397 1.00 13.71 N ATOM 1157 CA GLY A 140 29.504 12.126 -5.770 1.00 13.92 C ATOM 1158 C GLY A 140 29.274 13.610 -6.010 1.00 14.91 C ATOM 1159 O GLY A 140 29.023 14.021 -7.159 1.00 15.26 O ATOM 0 H AGLY A 140 30.742 11.908 -4.232 0.30 13.71 H new ATOM 0 H BGLY A 140 30.748 11.863 -4.240 0.70 13.71 H new ATOM 0 HA2 GLY A 140 30.188 11.813 -6.382 1.00 13.92 H new ATOM 0 HA3 GLY A 140 28.690 11.645 -5.984 1.00 13.92 H new ATOM 1160 N GLY A 141 29.368 14.403 -4.935 1.00 14.57 N ATOM 1161 CA GLY A 141 29.201 15.864 -4.992 1.00 15.62 C ATOM 1162 C GLY A 141 30.421 16.576 -5.561 1.00 16.70 C ATOM 1163 O GLY A 141 31.513 15.988 -5.641 1.00 17.41 O ATOM 0 H GLY A 141 29.532 14.105 -4.145 1.00 14.57 H new ATOM 0 HA2 GLY A 141 28.426 16.076 -5.535 1.00 15.62 H new ATOM 0 HA3 GLY A 141 29.023 16.200 -4.100 1.00 15.62 H new ATOM 1164 N PRO A 142 30.251 17.845 -5.966 1.00 16.68 N ATOM 1165 CA PRO A 142 31.306 18.487 -6.727 1.00 16.82 C ATOM 1166 C PRO A 142 32.313 19.216 -5.834 1.00 16.66 C ATOM 1167 O PRO A 142 31.961 19.709 -4.745 1.00 16.04 O ATOM 1168 CB PRO A 142 30.533 19.490 -7.592 1.00 16.68 C ATOM 1169 CG PRO A 142 29.404 19.910 -6.704 1.00 17.37 C ATOM 1170 CD PRO A 142 29.020 18.659 -5.942 1.00 17.05 C ATOM 0 HA PRO A 142 31.837 17.850 -7.231 1.00 16.82 H new ATOM 0 HB2 PRO A 142 31.087 20.244 -7.848 1.00 16.68 H new ATOM 0 HB3 PRO A 142 30.212 19.083 -8.412 1.00 16.68 H new ATOM 0 HG2 PRO A 142 29.676 20.619 -6.101 1.00 17.37 H new ATOM 0 HG3 PRO A 142 28.657 20.249 -7.222 1.00 17.37 H new ATOM 0 HD2 PRO A 142 28.746 18.864 -5.034 1.00 17.05 H new ATOM 0 HD3 PRO A 142 28.279 18.197 -6.365 1.00 17.05 H new ATOM 1171 N LEU A 143 33.558 19.235 -6.298 1.00 17.61 N ATOM 1172 CA LEU A 143 34.575 20.157 -5.816 1.00 18.50 C ATOM 1173 C LEU A 143 34.713 21.202 -6.885 1.00 18.19 C ATOM 1174 O LEU A 143 34.869 20.858 -8.073 1.00 16.78 O ATOM 1175 CB LEU A 143 35.918 19.463 -5.677 1.00 20.70 C ATOM 1176 CG LEU A 143 36.355 18.662 -4.465 1.00 23.42 C ATOM 1177 CD1 LEU A 143 36.381 19.539 -3.229 1.00 24.71 C ATOM 1178 CD2 LEU A 143 35.512 17.411 -4.262 1.00 24.55 C ATOM 0 H LEU A 143 33.839 18.703 -6.912 1.00 17.61 H new ATOM 0 HA LEU A 143 34.323 20.516 -4.951 1.00 18.50 H new ATOM 0 HB2 LEU A 143 35.988 18.862 -6.435 1.00 20.70 H new ATOM 0 HB3 LEU A 143 36.589 20.152 -5.799 1.00 20.70 H new ATOM 0 HG LEU A 143 37.259 18.350 -4.629 1.00 23.42 H new ATOM 0 HD11 LEU A 143 36.662 19.013 -2.464 1.00 24.71 H new ATOM 0 HD12 LEU A 143 37.004 20.270 -3.364 1.00 24.71 H new ATOM 0 HD13 LEU A 143 35.494 19.896 -3.067 1.00 24.71 H new ATOM 0 HD21 LEU A 143 35.826 16.932 -3.479 1.00 24.55 H new ATOM 0 HD22 LEU A 143 34.584 17.663 -4.136 1.00 24.55 H new ATOM 0 HD23 LEU A 143 35.588 16.839 -5.042 1.00 24.55 H new ATOM 1179 N LEU A 144 34.663 22.468 -6.477 1.00 17.01 N ATOM 1180 CA LEU A 144 34.617 23.578 -7.423 1.00 18.66 C ATOM 1181 C LEU A 144 35.794 24.506 -7.166 1.00 19.72 C ATOM 1182 O LEU A 144 36.277 24.586 -6.039 1.00 19.94 O ATOM 1183 CB LEU A 144 33.308 24.378 -7.285 1.00 18.86 C ATOM 1184 CG LEU A 144 31.985 23.615 -7.478 1.00 19.51 C ATOM 1185 CD1 LEU A 144 30.785 24.486 -7.115 1.00 20.30 C ATOM 1186 CD2 LEU A 144 31.859 23.107 -8.903 1.00 19.12 C ATOM 0 H LEU A 144 34.655 22.706 -5.651 1.00 17.01 H new ATOM 0 HA LEU A 144 34.661 23.213 -8.321 1.00 18.66 H new ATOM 0 HB2 LEU A 144 33.295 24.781 -6.403 1.00 18.86 H new ATOM 0 HB3 LEU A 144 33.332 25.104 -7.928 1.00 18.86 H new ATOM 0 HG LEU A 144 31.995 22.853 -6.878 1.00 19.51 H new ATOM 0 HD11 LEU A 144 29.967 23.981 -7.246 1.00 20.30 H new ATOM 0 HD12 LEU A 144 30.852 24.758 -6.186 1.00 20.30 H new ATOM 0 HD13 LEU A 144 30.773 25.273 -7.682 1.00 20.30 H new ATOM 0 HD21 LEU A 144 31.020 22.630 -9.004 1.00 19.12 H new ATOM 0 HD22 LEU A 144 31.879 23.857 -9.517 1.00 19.12 H new ATOM 0 HD23 LEU A 144 32.597 22.508 -9.100 1.00 19.12 H new ATOM 1187 N CYS A 145 36.255 25.175 -8.215 1.00 21.42 N ATOM 1188 CA CYS A 145 37.291 26.184 -8.077 1.00 23.28 C ATOM 1189 C CYS A 145 36.567 27.519 -7.847 1.00 25.07 C ATOM 1190 O CYS A 145 35.335 27.568 -7.908 1.00 23.32 O ATOM 1191 CB CYS A 145 38.136 26.234 -9.349 1.00 25.15 C ATOM 1192 SG CYS A 145 37.278 27.055 -10.720 1.00 27.78 S ATOM 0 H CYS A 145 35.978 25.057 -9.020 1.00 21.42 H new ATOM 0 HA CYS A 145 37.890 25.987 -7.340 1.00 23.28 H new ATOM 0 HB2 CYS A 145 38.966 26.701 -9.164 1.00 25.15 H new ATOM 0 HB3 CYS A 145 38.372 25.331 -9.613 1.00 25.15 H new ATOM 1193 N PRO A 146 37.322 28.616 -7.603 1.00 28.00 N ATOM 1194 CA PRO A 146 36.663 29.872 -7.254 1.00 29.38 C ATOM 1195 C PRO A 146 35.738 30.447 -8.334 1.00 29.62 C ATOM 1196 O PRO A 146 34.843 31.213 -8.013 1.00 30.79 O ATOM 1197 CB PRO A 146 37.843 30.821 -6.980 1.00 30.66 C ATOM 1198 CG PRO A 146 38.976 29.913 -6.629 1.00 31.75 C ATOM 1199 CD PRO A 146 38.791 28.754 -7.560 1.00 28.66 C ATOM 0 HA PRO A 146 36.061 29.743 -6.505 1.00 29.38 H new ATOM 0 HB2 PRO A 146 38.051 31.361 -7.759 1.00 30.66 H new ATOM 0 HB3 PRO A 146 37.643 31.434 -6.255 1.00 30.66 H new ATOM 0 HG2 PRO A 146 39.835 30.345 -6.761 1.00 31.75 H new ATOM 0 HG3 PRO A 146 38.938 29.636 -5.700 1.00 31.75 H new ATOM 0 HD2 PRO A 146 39.164 28.932 -8.438 1.00 28.66 H new ATOM 0 HD3 PRO A 146 39.220 27.950 -7.227 1.00 28.66 H new ATOM 1200 N ASER A 147 35.961 30.053 -9.585 0.62 29.61 N ATOM 1201 CA ASER A 147 35.127 30.481 -10.710 0.62 30.04 C ATOM 1202 C ASER A 147 33.924 29.559 -10.951 0.62 30.23 C ATOM 1203 O ASER A 147 33.174 29.750 -11.906 0.62 30.63 O ATOM 1204 CB ASER A 147 35.970 30.585 -11.980 0.62 29.43 C ATOM 1205 OG ASER A 147 37.113 31.383 -11.748 0.62 30.33 O ATOM 1206 N BSER A 147 35.943 30.094 -9.595 0.38 29.88 N ATOM 1207 CA BSER A 147 35.038 30.564 -10.643 0.38 30.18 C ATOM 1208 C BSER A 147 33.739 29.750 -10.694 0.38 30.18 C ATOM 1209 O BSER A 147 32.745 30.194 -11.268 0.38 29.30 O ATOM 1210 CB BSER A 147 35.730 30.546 -12.001 0.38 30.40 C ATOM 1211 OG BSER A 147 36.179 29.243 -12.301 0.38 32.14 O ATOM 0 H ASER A 147 36.604 29.527 -9.808 0.62 29.88 H new ATOM 0 H BSER A 147 36.587 29.592 -9.866 0.38 29.88 H new ATOM 0 HA ASER A 147 34.770 31.353 -10.478 0.62 30.18 H new ATOM 0 HA BSER A 147 34.799 31.478 -10.423 0.38 30.18 H new ATOM 0 HB2ASER A 147 36.240 29.699 -12.270 0.62 30.40 H new ATOM 0 HB2BSER A 147 35.117 30.850 -12.688 0.38 30.40 H new ATOM 0 HB3ASER A 147 35.440 30.969 -12.696 0.62 30.40 H new ATOM 0 HB3BSER A 147 36.480 31.161 -11.998 0.38 30.40 H new ATOM 0 HG ASER A 147 37.569 31.432 -12.452 0.62 32.14 H new ATOM 0 HG BSER A 147 35.689 28.907 -12.895 0.38 32.14 H new ATOM 1212 N GLY A 148 33.746 28.569 -10.076 1.00 29.53 N ATOM 1213 CA GLY A 148 32.586 27.689 -10.109 1.00 28.27 C ATOM 1214 C GLY A 148 32.695 26.629 -11.190 1.00 27.67 C ATOM 1215 O GLY A 148 31.685 26.085 -11.627 1.00 29.65 O ATOM 0 H AGLY A 148 34.301 28.391 -9.444 0.62 29.53 H new ATOM 0 H BGLY A 148 34.415 28.261 -9.632 0.38 29.53 H new ATOM 0 HA2 GLY A 148 32.485 27.258 -9.246 1.00 28.27 H new ATOM 0 HA3 GLY A 148 31.786 28.218 -10.257 1.00 28.27 H new ATOM 1216 N HIS A 149 33.917 26.347 -11.636 1.00 26.14 N ATOM 1217 CA HIS A 149 34.151 25.245 -12.569 1.00 25.20 C ATOM 1218 C HIS A 149 34.520 23.976 -11.835 1.00 21.71 C ATOM 1219 O HIS A 149 35.072 24.022 -10.726 1.00 20.98 O ATOM 1220 CB HIS A 149 35.230 25.628 -13.580 1.00 28.14 C ATOM 1221 CG HIS A 149 34.845 26.801 -14.458 1.00 34.48 C ATOM 1222 ND1 HIS A 149 35.535 27.954 -14.476 1.00 38.80 N ATOM 1223 CD2 HIS A 149 33.784 26.970 -15.341 1.00 37.74 C ATOM 1224 CE1 HIS A 149 34.952 28.813 -15.339 1.00 37.29 C ATOM 1225 NE2 HIS A 149 33.885 28.209 -15.866 1.00 37.31 N ATOM 0 H HIS A 149 34.624 26.781 -11.411 1.00 26.14 H new ATOM 0 HA HIS A 149 33.327 25.073 -13.050 1.00 25.20 H new ATOM 0 HB2 HIS A 149 36.047 25.844 -13.104 1.00 28.14 H new ATOM 0 HB3 HIS A 149 35.423 24.862 -14.142 1.00 28.14 H new ATOM 0 HD2 HIS A 149 33.125 26.343 -15.534 1.00 37.74 H new ATOM 0 HE1 HIS A 149 35.243 29.675 -15.532 1.00 37.29 H new ATOM 0 HE2 HIS A 149 33.350 28.553 -16.445 1.00 37.31 H new ATOM 1226 N ALA A 150 34.260 22.835 -12.467 1.00 19.58 N ATOM 1227 CA ALA A 150 34.476 21.512 -11.831 1.00 19.22 C ATOM 1228 C ALA A 150 35.940 21.059 -11.742 1.00 19.15 C ATOM 1229 O ALA A 150 36.633 20.971 -12.759 1.00 19.72 O ATOM 1230 CB ALA A 150 33.666 20.435 -12.561 1.00 17.89 C ATOM 0 H ALA A 150 33.956 22.794 -13.270 1.00 19.58 H new ATOM 0 HA ALA A 150 34.174 21.627 -10.916 1.00 19.22 H new ATOM 0 HB1 ALA A 150 33.815 19.575 -12.137 1.00 17.89 H new ATOM 0 HB2 ALA A 150 32.722 20.656 -12.520 1.00 17.89 H new ATOM 0 HB3 ALA A 150 33.948 20.391 -13.488 1.00 17.89 H new ATOM 1231 N AVAL A 151 36.391 20.772 -10.525 0.88 18.74 N ATOM 1232 CA AVAL A 151 37.723 20.220 -10.280 0.88 19.58 C ATOM 1233 C AVAL A 151 37.676 18.704 -10.089 0.88 19.43 C ATOM 1234 O AVAL A 151 38.564 17.976 -10.524 0.88 18.59 O ATOM 1235 CB AVAL A 151 38.351 20.876 -9.041 0.88 20.27 C ATOM 1236 CG1AVAL A 151 39.688 20.232 -8.701 0.88 21.98 C ATOM 1237 CG2AVAL A 151 38.519 22.370 -9.290 0.88 21.14 C ATOM 1238 N BVAL A 151 36.386 20.736 -10.530 0.12 19.32 N ATOM 1239 CA BVAL A 151 37.741 20.220 -10.321 0.12 19.46 C ATOM 1240 C BVAL A 151 37.780 18.778 -9.795 0.12 19.27 C ATOM 1241 O BVAL A 151 38.851 18.181 -9.700 0.12 19.24 O ATOM 1242 CB BVAL A 151 38.566 21.142 -9.406 0.12 19.77 C ATOM 1243 CG1BVAL A 151 38.061 21.058 -7.981 0.12 19.76 C ATOM 1244 CG2BVAL A 151 40.036 20.769 -9.469 0.12 20.38 C ATOM 0 H AVAL A 151 35.929 20.893 -9.810 0.88 19.32 H new ATOM 0 H BVAL A 151 35.919 20.808 -9.812 0.12 19.32 H new ATOM 0 HA AVAL A 151 38.267 20.411 -11.060 0.88 19.46 H new ATOM 0 HA BVAL A 151 38.144 20.206 -11.203 0.12 19.46 H new ATOM 0 HB AVAL A 151 37.762 20.743 -8.282 0.88 19.77 H new ATOM 0 HB BVAL A 151 38.466 22.056 -9.716 0.12 19.77 H new ATOM 0 HG11AVAL A 151 40.064 20.662 -7.917 0.88 19.76 H new ATOM 0 HG11BVAL A 151 38.589 21.643 -7.415 0.12 19.76 H new ATOM 0 HG12AVAL A 151 39.556 19.288 -8.520 0.88 19.76 H new ATOM 0 HG12BVAL A 151 37.131 21.332 -7.950 0.12 19.76 H new ATOM 0 HG13AVAL A 151 40.297 20.335 -9.449 0.88 19.76 H new ATOM 0 HG13BVAL A 151 38.139 20.145 -7.663 0.12 19.76 H new ATOM 0 HG21AVAL A 151 38.915 22.786 -8.509 0.88 20.38 H new ATOM 0 HG21BVAL A 151 40.544 21.357 -8.889 0.12 20.38 H new ATOM 0 HG22AVAL A 151 39.097 22.507 -10.057 0.88 20.38 H new ATOM 0 HG22BVAL A 151 40.150 19.851 -9.178 0.12 20.38 H new ATOM 0 HG23AVAL A 151 37.652 22.769 -9.463 0.88 20.38 H new ATOM 0 HG23BVAL A 151 40.355 20.861 -10.381 0.12 20.38 H new ATOM 1245 N GLY A 152 36.618 18.227 -9.448 1.00 19.12 N ATOM 1246 CA GLY A 152 36.501 16.806 -9.186 1.00 18.64 C ATOM 1247 C GLY A 152 35.185 16.452 -8.555 1.00 18.89 C ATOM 1248 O GLY A 152 34.355 17.337 -8.294 1.00 17.75 O ATOM 0 H AGLY A 152 35.964 18.706 -9.160 0.88 19.12 H new ATOM 0 H BGLY A 152 35.884 18.667 -9.360 0.12 19.12 H new ATOM 0 HA2 GLY A 152 36.601 16.316 -10.017 1.00 18.64 H new ATOM 0 HA3 GLY A 152 37.223 16.526 -8.602 1.00 18.64 H new ATOM 1249 N ILE A 153 34.984 15.159 -8.343 1.00 18.77 N ATOM 1250 CA ILE A 153 33.859 14.700 -7.547 1.00 20.82 C ATOM 1251 C ILE A 153 34.317 13.976 -6.303 1.00 19.66 C ATOM 1252 O ILE A 153 35.236 13.165 -6.337 1.00 19.24 O ATOM 1253 CB ILE A 153 32.777 13.876 -8.314 1.00 23.38 C ATOM 1254 CG1 ILE A 153 33.276 12.498 -8.734 1.00 23.92 C ATOM 1255 CG2 ILE A 153 32.161 14.672 -9.473 1.00 25.13 C ATOM 1256 CD1 ILE A 153 32.138 11.494 -8.862 1.00 23.29 C ATOM 0 H ILE A 153 35.487 14.533 -8.651 1.00 18.77 H new ATOM 0 HA ILE A 153 33.404 15.518 -7.292 1.00 20.82 H new ATOM 0 HB ILE A 153 32.056 13.710 -7.686 1.00 23.38 H new ATOM 0 HG12 ILE A 153 33.741 12.568 -9.582 1.00 23.92 H new ATOM 0 HG13 ILE A 153 33.919 12.176 -8.083 1.00 23.92 H new ATOM 0 HG21 ILE A 153 31.496 14.127 -9.923 1.00 25.13 H new ATOM 0 HG22 ILE A 153 31.741 15.475 -9.127 1.00 25.13 H new ATOM 0 HG23 ILE A 153 32.857 14.918 -10.103 1.00 25.13 H new ATOM 0 HD11 ILE A 153 32.495 10.633 -9.130 1.00 23.29 H new ATOM 0 HD12 ILE A 153 31.687 11.405 -8.008 1.00 23.29 H new ATOM 0 HD13 ILE A 153 31.507 11.804 -9.530 1.00 23.29 H new ATOM 1257 N PHE A 154 33.643 14.305 -5.211 1.00 20.83 N ATOM 1258 CA PHE A 154 33.900 13.797 -3.875 1.00 21.49 C ATOM 1259 C PHE A 154 33.654 12.283 -3.790 1.00 22.05 C ATOM 1260 O PHE A 154 32.569 11.786 -4.160 1.00 20.34 O ATOM 1261 CB PHE A 154 32.997 14.597 -2.905 1.00 23.94 C ATOM 1262 CG PHE A 154 33.111 14.201 -1.469 1.00 26.81 C ATOM 1263 CD1 PHE A 154 34.341 13.829 -0.918 1.00 29.50 C ATOM 1264 CD2 PHE A 154 31.991 14.238 -0.649 1.00 29.64 C ATOM 1265 CE1 PHE A 154 34.436 13.469 0.416 1.00 31.05 C ATOM 1266 CE2 PHE A 154 32.078 13.883 0.689 1.00 33.59 C ATOM 1267 CZ PHE A 154 33.309 13.502 1.223 1.00 31.63 C ATOM 0 H PHE A 154 32.987 14.861 -5.232 1.00 20.83 H new ATOM 0 HA PHE A 154 34.832 13.917 -3.634 1.00 21.49 H new ATOM 0 HB2 PHE A 154 33.213 15.539 -2.985 1.00 23.94 H new ATOM 0 HB3 PHE A 154 32.074 14.493 -3.183 1.00 23.94 H new ATOM 0 HD1 PHE A 154 35.102 13.823 -1.452 1.00 29.50 H new ATOM 0 HD2 PHE A 154 31.172 14.504 -1.001 1.00 29.64 H new ATOM 0 HE1 PHE A 154 35.255 13.205 0.770 1.00 31.05 H new ATOM 0 HE2 PHE A 154 31.320 13.899 1.227 1.00 33.59 H new ATOM 0 HZ PHE A 154 33.374 13.270 2.121 1.00 31.63 H new ATOM 1268 N ARG A 155 34.666 11.556 -3.308 1.00 21.51 N ATOM 1269 CA ARG A 155 34.642 10.094 -3.288 1.00 25.20 C ATOM 1270 C ARG A 155 34.561 9.554 -1.859 1.00 25.29 C ATOM 1271 O ARG A 155 33.703 8.736 -1.535 1.00 27.02 O ATOM 1272 CB ARG A 155 35.897 9.547 -3.990 1.00 29.32 C ATOM 1273 CG ARG A 155 35.729 8.201 -4.648 1.00 34.22 C ATOM 1274 CD ARG A 155 37.034 7.688 -5.244 1.00 37.67 C ATOM 1275 NE ARG A 155 37.981 7.299 -4.209 1.00 44.96 N ATOM 1276 CZ ARG A 155 37.925 6.169 -3.499 1.00 48.63 C ATOM 1277 NH1 ARG A 155 36.961 5.276 -3.700 1.00 50.39 N ATOM 1278 NH2 ARG A 155 38.841 5.934 -2.569 1.00 51.21 N ATOM 0 H ARG A 155 35.385 11.899 -2.984 1.00 21.51 H new ATOM 0 HA ARG A 155 33.849 9.797 -3.761 1.00 25.20 H new ATOM 0 HB2 ARG A 155 36.179 10.187 -4.662 1.00 29.32 H new ATOM 0 HB3 ARG A 155 36.613 9.486 -3.339 1.00 29.32 H new ATOM 0 HG2 ARG A 155 35.399 7.563 -3.996 1.00 34.22 H new ATOM 0 HG3 ARG A 155 35.059 8.265 -5.346 1.00 34.22 H new ATOM 0 HD2 ARG A 155 36.851 6.928 -5.818 1.00 37.67 H new ATOM 0 HD3 ARG A 155 37.428 8.377 -5.802 1.00 37.67 H new ATOM 0 HE ARG A 155 38.628 7.840 -4.041 1.00 44.96 H new ATOM 0 HH11 ARG A 155 36.358 5.421 -4.296 1.00 50.39 H new ATOM 0 HH12 ARG A 155 36.940 4.554 -3.234 1.00 50.39 H new ATOM 0 HH21 ARG A 155 39.466 6.507 -2.426 1.00 51.21 H new ATOM 0 HH22 ARG A 155 38.810 5.208 -2.109 1.00 51.21 H new ATOM 1279 N ALA A 156 35.448 10.025 -0.990 1.00 22.09 N ATOM 1280 CA ALA A 156 35.563 9.469 0.350 1.00 22.74 C ATOM 1281 C ALA A 156 36.140 10.541 1.254 1.00 21.95 C ATOM 1282 O ALA A 156 36.796 11.466 0.763 1.00 19.92 O ATOM 1283 CB ALA A 156 36.474 8.253 0.332 1.00 22.12 C ATOM 0 H ALA A 156 35.994 10.668 -1.158 1.00 22.09 H new ATOM 0 HA ALA A 156 34.693 9.190 0.675 1.00 22.74 H new ATOM 0 HB1 ALA A 156 36.545 7.889 1.228 1.00 22.12 H new ATOM 0 HB2 ALA A 156 36.105 7.581 -0.262 1.00 22.12 H new ATOM 0 HB3 ALA A 156 37.354 8.513 0.018 1.00 22.12 H new ATOM 1284 N ALA A 157 35.879 10.414 2.552 1.00 21.66 N ATOM 1285 CA ALA A 157 36.448 11.308 3.556 1.00 24.57 C ATOM 1286 C ALA A 157 37.622 10.601 4.208 1.00 25.86 C ATOM 1287 O ALA A 157 37.596 9.381 4.360 1.00 27.98 O ATOM 1288 CB ALA A 157 35.415 11.664 4.615 1.00 23.59 C ATOM 0 H ALA A 157 35.365 9.805 2.876 1.00 21.66 H new ATOM 0 HA ALA A 157 36.735 12.130 3.130 1.00 24.57 H new ATOM 0 HB1 ALA A 157 35.814 12.257 5.270 1.00 23.59 H new ATOM 0 HB2 ALA A 157 34.661 12.107 4.196 1.00 23.59 H new ATOM 0 HB3 ALA A 157 35.111 10.855 5.055 1.00 23.59 H new ATOM 1289 N VAL A 158 38.643 11.371 4.577 1.00 27.35 N ATOM 1290 CA VAL A 158 39.777 10.871 5.355 1.00 30.10 C ATOM 1291 C VAL A 158 39.511 11.321 6.784 1.00 30.75 C ATOM 1292 O VAL A 158 39.475 12.522 7.067 1.00 28.98 O ATOM 1293 CB VAL A 158 41.107 11.459 4.860 1.00 30.46 C ATOM 1294 CG1 VAL A 158 42.276 10.822 5.597 1.00 32.23 C ATOM 1295 CG2 VAL A 158 41.238 11.267 3.354 1.00 32.61 C ATOM 0 H VAL A 158 38.698 12.207 4.381 1.00 27.35 H new ATOM 0 HA VAL A 158 39.856 9.908 5.275 1.00 30.10 H new ATOM 0 HB VAL A 158 41.119 12.411 5.047 1.00 30.46 H new ATOM 0 HG11 VAL A 158 43.108 11.202 5.275 1.00 32.23 H new ATOM 0 HG12 VAL A 158 42.190 10.992 6.548 1.00 32.23 H new ATOM 0 HG13 VAL A 158 42.276 9.865 5.439 1.00 32.23 H new ATOM 0 HG21 VAL A 158 42.080 11.641 3.052 1.00 32.61 H new ATOM 0 HG22 VAL A 158 41.212 10.320 3.145 1.00 32.61 H new ATOM 0 HG23 VAL A 158 40.505 11.717 2.905 1.00 32.61 H new ATOM 1296 N ACYS A 159 39.345 10.350 7.677 0.55 31.24 N ATOM 1297 CA ACYS A 159 38.836 10.618 9.012 0.55 32.66 C ATOM 1298 C ACYS A 159 39.674 10.041 10.147 0.55 34.66 C ATOM 1299 O ACYS A 159 40.272 8.972 10.012 0.55 33.87 O ATOM 1300 CB ACYS A 159 37.413 10.090 9.123 0.55 32.41 C ATOM 1301 SG ACYS A 159 36.317 10.813 7.885 0.55 30.33 S ATOM 1302 N BCYS A 159 39.289 10.363 7.678 0.45 32.95 N ATOM 1303 CA BCYS A 159 38.837 10.695 9.021 0.45 35.50 C ATOM 1304 C BCYS A 159 39.634 10.049 10.146 0.45 36.45 C ATOM 1305 O BCYS A 159 40.159 8.942 10.006 0.45 35.59 O ATOM 1306 CB BCYS A 159 37.361 10.345 9.184 0.45 37.83 C ATOM 1307 SG BCYS A 159 37.037 8.574 9.216 0.45 41.82 S ATOM 0 H ACYS A 159 39.524 9.523 7.525 0.55 32.95 H new ATOM 0 H BCYS A 159 39.393 9.523 7.528 0.45 32.95 H new ATOM 0 HA ACYS A 159 38.873 11.581 9.119 0.55 35.50 H new ATOM 0 HA BCYS A 159 38.982 11.651 9.104 0.45 35.50 H new ATOM 0 HB2ACYS A 159 37.419 9.125 9.023 0.55 37.83 H new ATOM 0 HB2BCYS A 159 37.032 10.741 10.006 0.45 37.83 H new ATOM 0 HB3ACYS A 159 37.067 10.281 10.009 0.55 37.83 H new ATOM 0 HB3BCYS A 159 36.860 10.744 8.456 0.45 37.83 H new ATOM 0 HG ACYS A 159 36.476 10.255 6.835 0.55 41.82 H new ATOM 0 HG BCYS A 159 36.083 8.354 9.909 0.45 41.82 H new ATOM 1308 N THR A 160 39.700 10.770 11.261 1.00 36.24 N ATOM 1309 CA THR A 160 40.299 10.296 12.500 1.00 39.15 C ATOM 1310 C THR A 160 39.263 10.587 13.581 1.00 37.52 C ATOM 1311 O THR A 160 38.845 11.743 13.762 1.00 35.68 O ATOM 1312 CB THR A 160 41.613 11.047 12.848 1.00 43.79 C ATOM 1313 OG1 THR A 160 41.307 12.383 13.277 1.00 51.18 O ATOM 1314 CG2 THR A 160 42.581 11.102 11.647 1.00 44.27 C ATOM 0 H ATHR A 160 39.366 11.561 11.316 0.55 36.24 H new ATOM 0 H BTHR A 160 39.389 11.570 11.317 0.45 36.24 H new ATOM 0 HA THR A 160 40.529 9.357 12.423 1.00 39.15 H new ATOM 0 HB THR A 160 42.051 10.558 13.562 1.00 43.79 H new ATOM 0 HG1 THR A 160 40.476 12.502 13.252 1.00 51.18 H new ATOM 0 HG21 THR A 160 43.387 11.577 11.902 1.00 44.27 H new ATOM 0 HG22 THR A 160 42.810 10.200 11.375 1.00 44.27 H new ATOM 0 HG23 THR A 160 42.154 11.564 10.908 1.00 44.27 H new ATOM 1315 N ARG A 161 38.829 9.541 14.279 1.00 36.27 N ATOM 1316 CA ARG A 161 37.941 9.689 15.437 1.00 36.34 C ATOM 1317 C ARG A 161 36.615 10.371 15.090 1.00 34.49 C ATOM 1318 O ARG A 161 36.076 11.129 15.899 1.00 32.59 O ATOM 1319 CB ARG A 161 38.653 10.458 16.567 1.00 40.20 C ATOM 1320 CG ARG A 161 39.804 9.703 17.218 1.00 44.39 C ATOM 1321 CD ARG A 161 40.563 10.578 18.207 1.00 48.95 C ATOM 1322 NE ARG A 161 41.773 11.166 17.626 1.00 53.31 N ATOM 1323 CZ ARG A 161 41.852 12.384 17.088 1.00 53.33 C ATOM 1324 NH1 ARG A 161 40.790 13.179 17.047 1.00 54.34 N ATOM 1325 NH2 ARG A 161 43.004 12.812 16.592 1.00 53.71 N ATOM 0 H ARG A 161 39.038 8.727 14.098 1.00 36.27 H new ATOM 0 HA ARG A 161 37.727 8.792 15.738 1.00 36.34 H new ATOM 0 HB2 ARG A 161 38.991 11.294 16.210 1.00 40.20 H new ATOM 0 HB3 ARG A 161 38.002 10.683 17.250 1.00 40.20 H new ATOM 0 HG2 ARG A 161 39.460 8.920 17.676 1.00 44.39 H new ATOM 0 HG3 ARG A 161 40.413 9.386 16.532 1.00 44.39 H new ATOM 0 HD2 ARG A 161 39.980 11.288 18.519 1.00 48.95 H new ATOM 0 HD3 ARG A 161 40.805 10.048 18.983 1.00 48.95 H new ATOM 0 HE ARG A 161 42.488 10.688 17.632 1.00 53.31 H new ATOM 0 HH11 ARG A 161 40.039 12.911 17.370 1.00 54.34 H new ATOM 0 HH12 ARG A 161 40.853 13.962 16.698 1.00 54.34 H new ATOM 0 HH21 ARG A 161 43.698 12.305 16.618 1.00 53.71 H new ATOM 0 HH22 ARG A 161 43.057 13.597 16.245 1.00 53.71 H new ATOM 1326 N GLY A 162 36.100 10.101 13.888 1.00 33.36 N ATOM 1327 CA GLY A 162 34.817 10.649 13.451 1.00 31.74 C ATOM 1328 C GLY A 162 34.873 12.074 12.913 1.00 30.55 C ATOM 1329 O GLY A 162 33.839 12.676 12.619 1.00 28.75 O ATOM 0 H GLY A 162 36.484 9.597 13.307 1.00 33.36 H new ATOM 0 HA2 GLY A 162 34.452 10.072 12.762 1.00 31.74 H new ATOM 0 HA3 GLY A 162 34.199 10.624 14.198 1.00 31.74 H new ATOM 1330 N VAL A 163 36.082 12.615 12.787 1.00 30.28 N ATOM 1331 CA VAL A 163 36.272 13.965 12.274 1.00 28.97 C ATOM 1332 C VAL A 163 36.944 13.905 10.909 1.00 29.16 C ATOM 1333 O VAL A 163 38.052 13.370 10.775 1.00 28.61 O ATOM 1334 CB VAL A 163 37.090 14.851 13.244 1.00 29.40 C ATOM 1335 CG1 VAL A 163 37.323 16.226 12.641 1.00 29.82 C ATOM 1336 CG2 VAL A 163 36.363 14.988 14.573 1.00 30.18 C ATOM 0 H VAL A 163 36.811 12.210 12.996 1.00 30.28 H new ATOM 0 HA VAL A 163 35.397 14.375 12.188 1.00 28.97 H new ATOM 0 HB VAL A 163 37.949 14.426 13.395 1.00 29.40 H new ATOM 0 HG11 VAL A 163 37.836 16.768 13.260 1.00 29.82 H new ATOM 0 HG12 VAL A 163 37.813 16.136 11.808 1.00 29.82 H new ATOM 0 HG13 VAL A 163 36.469 16.653 12.469 1.00 29.82 H new ATOM 0 HG21 VAL A 163 36.885 15.545 15.172 1.00 30.18 H new ATOM 0 HG22 VAL A 163 35.495 15.396 14.427 1.00 30.18 H new ATOM 0 HG23 VAL A 163 36.245 14.111 14.969 1.00 30.18 H new ATOM 1337 N ALA A 164 36.257 14.452 9.905 1.00 26.03 N ATOM 1338 CA ALA A 164 36.774 14.509 8.552 1.00 25.93 C ATOM 1339 C ALA A 164 37.790 15.635 8.446 1.00 25.77 C ATOM 1340 O ALA A 164 37.469 16.801 8.703 1.00 25.40 O ATOM 1341 CB ALA A 164 35.645 14.712 7.559 1.00 26.54 C ATOM 0 H ALA A 164 35.476 14.800 9.997 1.00 26.03 H new ATOM 0 HA ALA A 164 37.209 13.668 8.341 1.00 25.93 H new ATOM 0 HB1 ALA A 164 36.007 14.748 6.660 1.00 26.54 H new ATOM 0 HB2 ALA A 164 35.019 13.974 7.626 1.00 26.54 H new ATOM 0 HB3 ALA A 164 35.186 15.544 7.756 1.00 26.54 H new ATOM 1342 N LYS A 165 39.012 15.269 8.076 1.00 25.31 N ATOM 1343 CA LYS A 165 40.109 16.218 7.955 1.00 27.03 C ATOM 1344 C LYS A 165 40.422 16.492 6.507 1.00 25.25 C ATOM 1345 O LYS A 165 40.956 17.539 6.178 1.00 26.31 O ATOM 1346 CB LYS A 165 41.373 15.670 8.625 1.00 29.65 C ATOM 1347 CG LYS A 165 41.297 15.591 10.141 1.00 36.37 C ATOM 1348 CD LYS A 165 41.230 16.972 10.775 1.00 38.95 C ATOM 1349 CE LYS A 165 41.813 16.969 12.188 1.00 41.77 C ATOM 1350 NZ LYS A 165 40.920 16.263 13.156 1.00 44.36 N ATOM 0 H LYS A 165 39.228 14.458 7.887 1.00 25.31 H new ATOM 0 HA LYS A 165 39.832 17.039 8.392 1.00 27.03 H new ATOM 0 HB2 LYS A 165 41.553 14.784 8.275 1.00 29.65 H new ATOM 0 HB3 LYS A 165 42.125 16.231 8.379 1.00 29.65 H new ATOM 0 HG2 LYS A 165 40.515 15.078 10.400 1.00 36.37 H new ATOM 0 HG3 LYS A 165 42.072 15.117 10.480 1.00 36.37 H new ATOM 0 HD2 LYS A 165 41.716 17.606 10.225 1.00 38.95 H new ATOM 0 HD3 LYS A 165 40.308 17.271 10.805 1.00 38.95 H new ATOM 0 HE2 LYS A 165 42.683 16.540 12.178 1.00 41.77 H new ATOM 0 HE3 LYS A 165 41.951 17.883 12.483 1.00 41.77 H new ATOM 0 HZ1 LYS A 165 41.288 16.280 13.966 1.00 44.36 H new ATOM 0 HZ2 LYS A 165 40.129 16.670 13.181 1.00 44.36 H new ATOM 0 HZ3 LYS A 165 40.811 15.418 12.898 1.00 44.36 H new ATOM 1351 N ALA A 166 40.121 15.528 5.642 1.00 24.38 N ATOM 1352 CA ALA A 166 40.428 15.667 4.231 1.00 23.90 C ATOM 1353 C ALA A 166 39.426 14.897 3.401 1.00 23.79 C ATOM 1354 O ALA A 166 38.692 14.038 3.911 1.00 21.57 O ATOM 1355 CB ALA A 166 41.844 15.194 3.932 1.00 24.33 C ATOM 0 H ALA A 166 39.739 14.788 5.856 1.00 24.38 H new ATOM 0 HA ALA A 166 40.371 16.607 3.998 1.00 23.90 H new ATOM 0 HB1 ALA A 166 42.026 15.296 2.985 1.00 24.33 H new ATOM 0 HB2 ALA A 166 42.477 15.724 4.442 1.00 24.33 H new ATOM 0 HB3 ALA A 166 41.932 14.260 4.179 1.00 24.33 H new ATOM 1356 N VAL A 167 39.395 15.216 2.120 1.00 23.06 N ATOM 1357 CA VAL A 167 38.526 14.515 1.201 1.00 23.57 C ATOM 1358 C VAL A 167 39.380 13.890 0.115 1.00 22.08 C ATOM 1359 O VAL A 167 40.390 14.433 -0.280 1.00 23.60 O ATOM 1360 CB VAL A 167 37.442 15.445 0.596 1.00 23.96 C ATOM 1361 CG1 VAL A 167 36.537 15.974 1.701 1.00 26.14 C ATOM 1362 CG2 VAL A 167 38.071 16.601 -0.172 1.00 24.71 C ATOM 0 H VAL A 167 39.871 15.837 1.763 1.00 23.06 H new ATOM 0 HA VAL A 167 38.048 13.824 1.685 1.00 23.57 H new ATOM 0 HB VAL A 167 36.912 14.927 -0.030 1.00 23.96 H new ATOM 0 HG11 VAL A 167 35.862 16.555 1.316 1.00 26.14 H new ATOM 0 HG12 VAL A 167 36.106 15.230 2.150 1.00 26.14 H new ATOM 0 HG13 VAL A 167 37.066 16.475 2.341 1.00 26.14 H new ATOM 0 HG21 VAL A 167 37.372 17.165 -0.538 1.00 24.71 H new ATOM 0 HG22 VAL A 167 38.626 17.124 0.427 1.00 24.71 H new ATOM 0 HG23 VAL A 167 38.616 16.251 -0.894 1.00 24.71 H new ATOM 1363 N ASP A 168 38.955 12.729 -0.335 1.00 22.30 N ATOM 1364 CA ASP A 168 39.505 12.063 -1.490 1.00 22.85 C ATOM 1365 C ASP A 168 38.517 12.324 -2.623 1.00 21.42 C ATOM 1366 O ASP A 168 37.304 12.236 -2.407 1.00 20.21 O ATOM 1367 CB ASP A 168 39.552 10.582 -1.144 1.00 28.02 C ATOM 1368 CG ASP A 168 40.305 9.753 -2.154 1.00 36.55 C ATOM 1369 OD1 ASP A 168 41.567 9.830 -2.204 1.00 41.75 O ATOM 1370 OD2 ASP A 168 39.626 8.977 -2.868 1.00 40.19 O ATOM 0 H ASP A 168 38.315 12.292 0.037 1.00 22.30 H new ATOM 0 HA ASP A 168 40.391 12.365 -1.744 1.00 22.85 H new ATOM 0 HB2 ASP A 168 39.966 10.473 -0.274 1.00 28.02 H new ATOM 0 HB3 ASP A 168 38.645 10.245 -1.071 1.00 28.02 H new ATOM 1371 N PHE A 169 39.009 12.663 -3.812 1.00 19.67 N ATOM 1372 CA PHE A 169 38.124 12.941 -4.940 1.00 21.25 C ATOM 1373 C PHE A 169 38.656 12.388 -6.257 1.00 21.97 C ATOM 1374 O PHE A 169 39.862 12.136 -6.396 1.00 22.35 O ATOM 1375 CB PHE A 169 37.787 14.444 -5.061 1.00 21.80 C ATOM 1376 CG PHE A 169 38.963 15.316 -5.385 1.00 22.35 C ATOM 1377 CD1 PHE A 169 39.723 15.873 -4.362 1.00 24.02 C ATOM 1378 CD2 PHE A 169 39.299 15.596 -6.708 1.00 23.29 C ATOM 1379 CE1 PHE A 169 40.806 16.681 -4.648 1.00 24.15 C ATOM 1380 CE2 PHE A 169 40.388 16.411 -7.007 1.00 25.43 C ATOM 1381 CZ PHE A 169 41.138 16.958 -5.968 1.00 24.40 C ATOM 0 H PHE A 169 39.848 12.737 -3.986 1.00 19.67 H new ATOM 0 HA PHE A 169 37.298 12.470 -4.749 1.00 21.25 H new ATOM 0 HB2 PHE A 169 37.113 14.559 -5.749 1.00 21.80 H new ATOM 0 HB3 PHE A 169 37.395 14.745 -4.226 1.00 21.80 H new ATOM 0 HD1 PHE A 169 39.500 15.700 -3.476 1.00 24.02 H new ATOM 0 HD2 PHE A 169 38.791 15.235 -7.398 1.00 23.29 H new ATOM 0 HE1 PHE A 169 41.313 17.040 -3.956 1.00 24.15 H new ATOM 0 HE2 PHE A 169 40.612 16.588 -7.892 1.00 25.43 H new ATOM 0 HZ PHE A 169 41.862 17.510 -6.159 1.00 24.40 H new ATOM 1382 N VAL A 170 37.745 12.199 -7.207 1.00 21.97 N ATOM 1383 CA VAL A 170 38.084 11.833 -8.568 1.00 22.39 C ATOM 1384 C VAL A 170 38.296 13.117 -9.356 1.00 21.76 C ATOM 1385 O VAL A 170 37.357 13.889 -9.503 1.00 22.33 O ATOM 1386 CB VAL A 170 36.946 11.019 -9.237 1.00 24.23 C ATOM 1387 CG1 VAL A 170 37.378 10.510 -10.611 1.00 25.06 C ATOM 1388 CG2 VAL A 170 36.493 9.862 -8.359 1.00 24.69 C ATOM 0 H VAL A 170 36.900 12.282 -7.072 1.00 21.97 H new ATOM 0 HA VAL A 170 38.882 11.282 -8.558 1.00 22.39 H new ATOM 0 HB VAL A 170 36.191 11.617 -9.352 1.00 24.23 H new ATOM 0 HG11 VAL A 170 36.653 10.004 -11.012 1.00 25.06 H new ATOM 0 HG12 VAL A 170 37.599 11.263 -11.180 1.00 25.06 H new ATOM 0 HG13 VAL A 170 38.156 9.938 -10.515 1.00 25.06 H new ATOM 0 HG21 VAL A 170 35.783 9.375 -8.806 1.00 24.69 H new ATOM 0 HG22 VAL A 170 37.241 9.266 -8.198 1.00 24.69 H new ATOM 0 HG23 VAL A 170 36.166 10.206 -7.513 1.00 24.69 H new ATOM 1389 N PRO A 171 39.530 13.369 -9.852 1.00 22.56 N ATOM 1390 CA PRO A 171 39.806 14.606 -10.582 1.00 22.70 C ATOM 1391 C PRO A 171 39.073 14.650 -11.905 1.00 24.26 C ATOM 1392 O PRO A 171 38.782 13.597 -12.497 1.00 23.17 O ATOM 1393 CB PRO A 171 41.324 14.551 -10.836 1.00 24.13 C ATOM 1394 CG PRO A 171 41.668 13.105 -10.760 1.00 24.43 C ATOM 1395 CD PRO A 171 40.740 12.535 -9.720 1.00 22.97 C ATOM 0 HA PRO A 171 39.519 15.389 -10.086 1.00 22.70 H new ATOM 0 HB2 PRO A 171 41.550 14.922 -11.703 1.00 24.13 H new ATOM 0 HB3 PRO A 171 41.811 15.064 -10.173 1.00 24.13 H new ATOM 0 HG2 PRO A 171 41.544 12.669 -11.618 1.00 24.43 H new ATOM 0 HG3 PRO A 171 42.596 12.978 -10.509 1.00 24.43 H new ATOM 0 HD2 PRO A 171 40.549 11.598 -9.885 1.00 22.97 H new ATOM 0 HD3 PRO A 171 41.120 12.594 -8.830 1.00 22.97 H new ATOM 1396 N VAL A 172 38.771 15.860 -12.366 1.00 24.21 N ATOM 1397 CA VAL A 172 38.034 16.023 -13.611 1.00 28.06 C ATOM 1398 C VAL A 172 38.819 15.438 -14.808 1.00 30.71 C ATOM 1399 O VAL A 172 38.230 15.026 -15.812 1.00 30.59 O ATOM 1400 CB VAL A 172 37.569 17.492 -13.815 1.00 29.61 C ATOM 1401 CG1 VAL A 172 38.739 18.404 -14.192 1.00 29.71 C ATOM 1402 CG2 VAL A 172 36.443 17.562 -14.839 1.00 30.08 C ATOM 0 H VAL A 172 38.983 16.595 -11.974 1.00 24.21 H new ATOM 0 HA VAL A 172 37.217 15.503 -13.554 1.00 28.06 H new ATOM 0 HB VAL A 172 37.221 17.818 -12.970 1.00 29.61 H new ATOM 0 HG11 VAL A 172 38.417 19.311 -14.312 1.00 29.71 H new ATOM 0 HG12 VAL A 172 39.403 18.388 -13.485 1.00 29.71 H new ATOM 0 HG13 VAL A 172 39.140 18.092 -15.018 1.00 29.71 H new ATOM 0 HG21 VAL A 172 36.166 18.485 -14.953 1.00 30.08 H new ATOM 0 HG22 VAL A 172 36.755 17.211 -15.688 1.00 30.08 H new ATOM 0 HG23 VAL A 172 35.690 17.035 -14.529 1.00 30.08 H new ATOM 1403 N GLU A 173 40.143 15.371 -14.664 1.00 34.70 N ATOM 1404 CA GLU A 173 41.036 14.737 -15.647 1.00 38.15 C ATOM 1405 C GLU A 173 40.663 13.271 -15.915 1.00 39.47 C ATOM 1406 O GLU A 173 40.686 12.820 -17.062 1.00 42.32 O ATOM 1407 CB GLU A 173 42.493 14.811 -15.171 1.00 39.24 C ATOM 1408 CG GLU A 173 43.133 16.190 -15.294 1.00 43.44 C ATOM 1409 CD GLU A 173 42.499 17.250 -14.390 1.00 46.58 C ATOM 1410 OE1 GLU A 173 42.146 16.934 -13.228 1.00 41.13 O ATOM 1411 OE2 GLU A 173 42.362 18.415 -14.845 1.00 51.90 O ATOM 0 H GLU A 173 40.557 15.696 -13.984 1.00 34.70 H new ATOM 0 HA GLU A 173 40.933 15.228 -16.477 1.00 38.15 H new ATOM 0 HB2 GLU A 173 42.532 14.531 -14.243 1.00 39.24 H new ATOM 0 HB3 GLU A 173 43.020 14.176 -15.681 1.00 39.24 H new ATOM 0 HG2 GLU A 173 44.077 16.119 -15.082 1.00 43.44 H new ATOM 0 HG3 GLU A 173 43.071 16.485 -16.216 1.00 43.44 H new ATOM 1412 N SER A 174 40.337 12.539 -14.851 1.00 39.70 N ATOM 1413 CA SER A 174 39.930 11.137 -14.952 1.00 38.48 C ATOM 1414 C SER A 174 38.606 10.961 -15.691 1.00 39.20 C ATOM 1415 O SER A 174 38.360 9.913 -16.288 1.00 38.56 O ATOM 1416 CB SER A 174 39.837 10.507 -13.569 1.00 40.19 C ATOM 1417 OG SER A 174 41.105 10.461 -12.953 1.00 43.25 O ATOM 0 H SER A 174 40.346 12.843 -14.046 1.00 39.70 H new ATOM 0 HA SER A 174 40.614 10.686 -15.471 1.00 38.48 H new ATOM 0 HB2 SER A 174 39.223 11.017 -13.017 1.00 40.19 H new ATOM 0 HB3 SER A 174 39.475 9.610 -13.641 1.00 40.19 H new ATOM 0 HG SER A 174 41.035 10.113 -12.192 1.00 43.25 H new ATOM 1418 N MET A 175 37.758 11.984 -15.648 1.00 37.76 N ATOM 1419 CA MET A 175 36.543 12.000 -16.450 1.00 40.13 C ATOM 1420 C MET A 175 36.875 12.148 -17.927 1.00 43.85 C ATOM 1421 O MET A 175 36.247 11.512 -18.773 1.00 43.04 O ATOM 1422 CB MET A 175 35.600 13.113 -15.999 1.00 38.33 C ATOM 1423 CG MET A 175 35.021 12.869 -14.619 1.00 37.51 C ATOM 1424 SD MET A 175 34.271 14.339 -13.916 1.00 43.08 S ATOM 1425 CE MET A 175 34.776 14.119 -12.216 1.00 38.48 C ATOM 0 H MET A 175 37.870 12.681 -15.158 1.00 37.76 H new ATOM 0 HA MET A 175 36.090 11.152 -16.320 1.00 40.13 H new ATOM 0 HB2 MET A 175 36.078 13.957 -16.000 1.00 38.33 H new ATOM 0 HB3 MET A 175 34.876 13.197 -16.639 1.00 38.33 H new ATOM 0 HG2 MET A 175 34.357 12.164 -14.671 1.00 37.51 H new ATOM 0 HG3 MET A 175 35.723 12.554 -14.028 1.00 37.51 H new ATOM 0 HE1 MET A 175 34.609 14.936 -11.720 1.00 38.48 H new ATOM 0 HE2 MET A 175 34.271 13.392 -11.820 1.00 38.48 H new ATOM 0 HE3 MET A 175 35.723 13.910 -12.184 1.00 38.48 H new ATOM 1426 N GLU A 176 37.869 12.979 -18.229 1.00 47.75 N ATOM 1427 CA GLU A 176 38.337 13.161 -19.603 1.00 53.12 C ATOM 1428 C GLU A 176 39.028 11.893 -20.129 1.00 51.87 C ATOM 1429 O GLU A 176 38.749 11.438 -21.242 1.00 53.39 O ATOM 1430 CB GLU A 176 39.245 14.393 -19.702 1.00 58.23 C ATOM 1431 CG GLU A 176 38.530 15.706 -19.378 1.00 63.29 C ATOM 1432 CD GLU A 176 39.477 16.854 -19.034 1.00 70.60 C ATOM 1433 OE1 GLU A 176 40.717 16.689 -19.150 1.00 73.19 O ATOM 1434 OE2 GLU A 176 38.980 17.936 -18.641 1.00 70.07 O ATOM 0 H GLU A 176 38.290 13.452 -17.647 1.00 47.75 H new ATOM 0 HA GLU A 176 37.567 13.317 -20.171 1.00 53.12 H new ATOM 0 HB2 GLU A 176 39.994 14.283 -19.096 1.00 58.23 H new ATOM 0 HB3 GLU A 176 39.611 14.445 -20.599 1.00 58.23 H new ATOM 0 HG2 GLU A 176 37.985 15.964 -20.138 1.00 63.29 H new ATOM 0 HG3 GLU A 176 37.927 15.561 -18.632 1.00 63.29 H new ATOM 1435 N THR A 177 39.906 11.313 -19.314 1.00 53.02 N ATOM 1436 CA THR A 177 40.540 10.028 -19.630 1.00 52.33 C ATOM 1437 C THR A 177 39.516 8.895 -19.792 1.00 52.29 C ATOM 1438 O THR A 177 39.654 8.075 -20.705 1.00 53.60 O ATOM 1439 CB THR A 177 41.606 9.646 -18.578 1.00 54.39 C ATOM 1440 OG1 THR A 177 42.590 10.684 -18.508 1.00 57.81 O ATOM 1441 CG2 THR A 177 42.306 8.323 -18.933 1.00 54.61 C ATOM 0 H THR A 177 40.153 11.651 -18.562 1.00 53.02 H new ATOM 0 HA THR A 177 40.983 10.146 -20.485 1.00 52.33 H new ATOM 0 HB THR A 177 41.158 9.535 -17.725 1.00 54.39 H new ATOM 0 HG1 THR A 177 42.257 11.362 -18.141 1.00 57.81 H new ATOM 0 HG21 THR A 177 42.967 8.114 -18.254 1.00 54.61 H new ATOM 0 HG22 THR A 177 41.649 7.610 -18.975 1.00 54.61 H new ATOM 0 HG23 THR A 177 42.744 8.409 -19.794 1.00 54.61 H new ATOM 1442 N THR A 178 38.503 8.849 -18.918 1.00 49.40 N ATOM 1443 CA THR A 178 37.420 7.853 -19.033 1.00 46.83 C ATOM 1444 C THR A 178 36.658 8.011 -20.362 1.00 46.97 C ATOM 1445 O THR A 178 36.377 7.016 -21.029 1.00 48.12 O ATOM 1446 CB THR A 178 36.447 7.857 -17.813 1.00 45.14 C ATOM 1447 OG1 THR A 178 37.146 7.458 -16.622 1.00 40.49 O ATOM 1448 CG2 THR A 178 35.282 6.887 -18.025 1.00 42.34 C ATOM 0 H THR A 178 38.422 9.385 -18.250 1.00 49.40 H new ATOM 0 HA THR A 178 37.849 6.983 -19.029 1.00 46.83 H new ATOM 0 HB THR A 178 36.103 8.759 -17.722 1.00 45.14 H new ATOM 0 HG1 THR A 178 37.607 8.101 -16.339 1.00 40.49 H new ATOM 0 HG21 THR A 178 34.696 6.911 -17.253 1.00 42.34 H new ATOM 0 HG22 THR A 178 34.784 7.147 -18.816 1.00 42.34 H new ATOM 0 HG23 THR A 178 35.626 5.988 -18.141 1.00 42.34 H new ATOM 1449 N MET A 179 36.363 9.253 -20.752 1.00 47.51 N ATOM 1450 CA MET A 179 35.597 9.546 -21.977 1.00 49.66 C ATOM 1451 C MET A 179 36.330 9.232 -23.286 1.00 55.36 C ATOM 1452 O MET A 179 35.866 8.402 -24.076 1.00 58.95 O ATOM 1453 CB MET A 179 35.115 10.996 -21.987 1.00 48.41 C ATOM 1454 CG MET A 179 34.042 11.292 -20.955 1.00 48.67 C ATOM 1455 SD MET A 179 33.374 12.960 -21.087 1.00 50.08 S ATOM 1456 CE MET A 179 34.758 13.933 -20.481 1.00 53.00 C ATOM 0 H MET A 179 36.601 9.954 -20.315 1.00 47.51 H new ATOM 0 HA MET A 179 34.840 8.941 -21.944 1.00 49.66 H new ATOM 0 HB2 MET A 179 35.873 11.581 -21.830 1.00 48.41 H new ATOM 0 HB3 MET A 179 34.771 11.208 -22.869 1.00 48.41 H new ATOM 0 HG2 MET A 179 33.320 10.652 -21.054 1.00 48.67 H new ATOM 0 HG3 MET A 179 34.412 11.167 -20.067 1.00 48.67 H new ATOM 0 HE1 MET A 179 34.489 14.861 -20.395 1.00 53.00 H new ATOM 0 HE2 MET A 179 35.036 13.596 -19.615 1.00 53.00 H new ATOM 0 HE3 MET A 179 35.498 13.868 -21.105 1.00 53.00 H new ATOM 1457 N ARG A 180 37.455 9.910 -23.518 1.00 57.95 N ATOM 1458 CA ARG A 180 38.258 9.715 -24.730 1.00 60.45 C ATOM 1459 C ARG A 180 39.366 8.687 -24.504 1.00 61.15 C ATOM 1460 O ARG A 180 39.112 7.577 -24.027 1.00 61.11 O ATOM 1461 CB ARG A 180 38.846 11.041 -25.200 1.00 58.74 C ATOM 0 H ARG A 180 37.775 10.497 -22.977 1.00 57.95 H new ATOM 0 HA ARG A 180 37.672 9.372 -25.423 1.00 60.45 H new TER 1462 ARG A 180 ATOM 1463 N GLY B -14 8.975 14.810 -44.410 1.00 29.40 N ATOM 1464 CA GLY B -14 9.348 13.457 -43.905 1.00 25.11 C ATOM 1465 C GLY B -14 10.767 13.442 -43.366 1.00 23.12 C ATOM 1466 O GLY B -14 11.513 14.396 -43.541 1.00 23.26 O ATOM 0 H1 GLY B -14 8.091 14.860 -44.502 1.00 29.40 H new ATOM 0 H2 GLY B -14 9.248 15.429 -43.831 1.00 29.40 H new ATOM 0 H3 GLY B -14 9.363 14.950 -45.199 1.00 29.40 H new ATOM 0 HA2 GLY B -14 8.731 13.189 -43.206 1.00 25.11 H new ATOM 0 HA3 GLY B -14 9.265 12.808 -44.621 1.00 25.11 H new ATOM 1467 N SER B -13 11.143 12.349 -42.718 1.00 19.62 N ATOM 1468 CA SER B -13 12.487 12.222 -42.196 1.00 17.96 C ATOM 1469 C SER B -13 13.479 11.866 -43.305 1.00 16.54 C ATOM 1470 O SER B -13 13.097 11.372 -44.368 1.00 15.50 O ATOM 1471 CB SER B -13 12.528 11.136 -41.113 1.00 18.62 C ATOM 1472 OG SER B -13 11.934 11.622 -39.926 1.00 20.64 O ATOM 0 H SER B -13 10.634 11.672 -42.572 1.00 19.62 H new ATOM 0 HA SER B -13 12.741 13.077 -41.815 1.00 17.96 H new ATOM 0 HB2 SER B -13 12.059 10.344 -41.419 1.00 18.62 H new ATOM 0 HB3 SER B -13 13.446 10.873 -40.941 1.00 18.62 H new ATOM 0 HG SER B -13 11.100 11.536 -39.974 1.00 20.64 H new ATOM 1473 N VAL B -12 14.744 12.144 -43.025 1.00 14.69 N ATOM 1474 CA VAL B -12 15.879 11.654 -43.801 1.00 14.00 C ATOM 1475 C VAL B -12 16.031 10.192 -43.431 1.00 12.80 C ATOM 1476 O VAL B -12 15.948 9.850 -42.248 1.00 12.43 O ATOM 1477 CB VAL B -12 17.154 12.433 -43.411 1.00 14.22 C ATOM 1478 CG1 VAL B -12 18.411 11.780 -44.007 1.00 14.23 C ATOM 1479 CG2 VAL B -12 17.018 13.896 -43.869 1.00 14.47 C ATOM 0 H VAL B -12 14.975 12.637 -42.359 1.00 14.69 H new ATOM 0 HA VAL B -12 15.741 11.769 -44.754 1.00 14.00 H new ATOM 0 HB VAL B -12 17.253 12.411 -42.446 1.00 14.22 H new ATOM 0 HG11 VAL B -12 19.195 12.289 -43.747 1.00 14.23 H new ATOM 0 HG12 VAL B -12 18.491 10.871 -43.677 1.00 14.23 H new ATOM 0 HG13 VAL B -12 18.341 11.767 -44.974 1.00 14.23 H new ATOM 0 HG21 VAL B -12 17.818 14.387 -43.625 1.00 14.47 H new ATOM 0 HG22 VAL B -12 16.903 13.925 -44.832 1.00 14.47 H new ATOM 0 HG23 VAL B -12 16.248 14.300 -43.439 1.00 14.47 H new ATOM 1480 N VAL B -11 16.266 9.337 -44.431 1.00 11.65 N ATOM 1481 CA VAL B -11 16.357 7.895 -44.213 1.00 11.56 C ATOM 1482 C VAL B -11 17.688 7.329 -44.711 1.00 11.13 C ATOM 1483 O VAL B -11 18.104 7.628 -45.829 1.00 10.55 O ATOM 1484 CB VAL B -11 15.207 7.162 -44.942 1.00 11.90 C ATOM 1485 CG1 VAL B -11 15.285 5.641 -44.704 1.00 12.10 C ATOM 1486 CG2 VAL B -11 13.857 7.695 -44.461 1.00 12.63 C ATOM 0 H VAL B -11 16.376 9.578 -45.249 1.00 11.65 H new ATOM 0 HA VAL B -11 16.292 7.751 -43.256 1.00 11.56 H new ATOM 0 HB VAL B -11 15.297 7.328 -45.893 1.00 11.90 H new ATOM 0 HG11 VAL B -11 14.556 5.203 -45.170 1.00 12.10 H new ATOM 0 HG12 VAL B -11 16.131 5.304 -45.039 1.00 12.10 H new ATOM 0 HG13 VAL B -11 15.218 5.458 -43.754 1.00 12.10 H new ATOM 0 HG21 VAL B -11 13.142 7.230 -44.923 1.00 12.63 H new ATOM 0 HG22 VAL B -11 13.773 7.549 -43.506 1.00 12.63 H new ATOM 0 HG23 VAL B -11 13.798 8.645 -44.649 1.00 12.63 H new ATOM 1487 N ILE B -10 18.345 6.510 -43.892 1.00 11.17 N ATOM 1488 CA ILE B -10 19.521 5.788 -44.382 1.00 12.02 C ATOM 1489 C ILE B -10 19.102 4.709 -45.403 1.00 12.41 C ATOM 1490 O ILE B -10 18.283 3.824 -45.104 1.00 13.18 O ATOM 1491 CB ILE B -10 20.316 5.169 -43.232 1.00 12.55 C ATOM 1492 CG1 ILE B -10 20.899 6.294 -42.354 1.00 12.39 C ATOM 1493 CG2 ILE B -10 21.416 4.236 -43.771 1.00 12.54 C ATOM 1494 CD1 ILE B -10 21.520 5.789 -41.071 1.00 12.80 C ATOM 0 H ILE B -10 18.135 6.360 -43.072 1.00 11.17 H new ATOM 0 HA ILE B -10 20.101 6.426 -44.826 1.00 12.02 H new ATOM 0 HB ILE B -10 19.728 4.626 -42.685 1.00 12.55 H new ATOM 0 HG12 ILE B -10 21.569 6.778 -42.862 1.00 12.39 H new ATOM 0 HG13 ILE B -10 20.195 6.926 -42.139 1.00 12.39 H new ATOM 0 HG21 ILE B -10 21.909 3.853 -43.028 1.00 12.54 H new ATOM 0 HG22 ILE B -10 21.011 3.524 -44.291 1.00 12.54 H new ATOM 0 HG23 ILE B -10 22.022 4.742 -44.334 1.00 12.54 H new ATOM 0 HD11 ILE B -10 21.868 6.538 -40.563 1.00 12.80 H new ATOM 0 HD12 ILE B -10 20.848 5.327 -40.546 1.00 12.80 H new ATOM 0 HD13 ILE B -10 22.243 5.177 -41.280 1.00 12.80 H new ATOM 1495 N VAL B -9 19.641 4.788 -46.611 1.00 12.26 N ATOM 1496 CA VAL B -9 19.265 3.822 -47.646 1.00 12.34 C ATOM 1497 C VAL B -9 20.484 3.027 -48.153 1.00 12.49 C ATOM 1498 O VAL B -9 20.340 2.173 -49.032 1.00 13.20 O ATOM 1499 CB VAL B -9 18.563 4.473 -48.849 1.00 11.86 C ATOM 1500 CG1 VAL B -9 17.250 5.183 -48.439 1.00 12.46 C ATOM 1501 CG2 VAL B -9 19.490 5.462 -49.537 1.00 11.86 C ATOM 0 H VAL B -9 20.216 5.380 -46.854 1.00 12.26 H new ATOM 0 HA VAL B -9 18.637 3.220 -47.216 1.00 12.34 H new ATOM 0 HB VAL B -9 18.336 3.760 -49.467 1.00 11.86 H new ATOM 0 HG11 VAL B -9 16.838 5.580 -49.222 1.00 12.46 H new ATOM 0 HG12 VAL B -9 16.642 4.537 -48.046 1.00 12.46 H new ATOM 0 HG13 VAL B -9 17.446 5.877 -47.791 1.00 12.46 H new ATOM 0 HG21 VAL B -9 19.032 5.863 -50.292 1.00 11.86 H new ATOM 0 HG22 VAL B -9 19.747 6.156 -48.909 1.00 11.86 H new ATOM 0 HG23 VAL B -9 20.283 4.999 -49.849 1.00 11.86 H new ATOM 1502 N GLY B -8 21.665 3.320 -47.624 1.00 12.42 N ATOM 1503 CA GLY B -8 22.849 2.504 -47.939 1.00 12.26 C ATOM 1504 C GLY B -8 24.019 3.001 -47.132 1.00 11.88 C ATOM 1505 O GLY B -8 23.878 3.898 -46.300 1.00 11.05 O ATOM 0 H GLY B -8 21.809 3.976 -47.087 1.00 12.42 H new ATOM 0 HA2 GLY B -8 22.676 1.571 -47.737 1.00 12.26 H new ATOM 0 HA3 GLY B -8 23.049 2.557 -48.887 1.00 12.26 H new ATOM 1506 N ARG B -7 25.184 2.423 -47.368 1.00 12.35 N ATOM 1507 CA ARG B -7 26.359 2.805 -46.594 1.00 14.21 C ATOM 1508 C ARG B -7 27.603 2.583 -47.425 1.00 14.70 C ATOM 1509 O ARG B -7 27.611 1.749 -48.326 1.00 15.21 O ATOM 1510 CB ARG B -7 26.440 2.038 -45.260 1.00 15.73 C ATOM 1511 CG ARG B -7 26.802 0.571 -45.380 1.00 18.54 C ATOM 1512 CD ARG B -7 25.583 -0.277 -45.585 1.00 21.18 C ATOM 1513 NE ARG B -7 25.802 -1.660 -45.163 1.00 23.21 N ATOM 1514 CZ ARG B -7 25.310 -2.214 -44.059 1.00 21.68 C ATOM 1515 NH1 ARG B -7 24.557 -1.514 -43.206 1.00 21.72 N ATOM 1516 NH2 ARG B -7 25.578 -3.484 -43.836 1.00 21.16 N ATOM 0 H ARG B -7 25.319 1.816 -47.962 1.00 12.35 H new ATOM 0 HA ARG B -7 26.287 3.746 -46.371 1.00 14.21 H new ATOM 0 HB2 ARG B -7 27.096 2.473 -44.693 1.00 15.73 H new ATOM 0 HB3 ARG B -7 25.584 2.109 -44.810 1.00 15.73 H new ATOM 0 HG2 ARG B -7 27.414 0.447 -46.123 1.00 18.54 H new ATOM 0 HG3 ARG B -7 27.267 0.284 -44.579 1.00 18.54 H new ATOM 0 HD2 ARG B -7 24.841 0.099 -45.087 1.00 21.18 H new ATOM 0 HD3 ARG B -7 25.333 -0.261 -46.522 1.00 21.18 H new ATOM 0 HE ARG B -7 26.289 -2.155 -45.670 1.00 23.21 H new ATOM 0 HH11 ARG B -7 24.382 -0.687 -43.366 1.00 21.72 H new ATOM 0 HH12 ARG B -7 24.248 -1.890 -42.497 1.00 21.72 H new ATOM 0 HH21 ARG B -7 26.057 -3.927 -44.396 1.00 21.16 H new ATOM 0 HH22 ARG B -7 25.274 -3.870 -43.130 1.00 21.16 H new ATOM 1517 N ILE B -6 28.641 3.338 -47.112 1.00 15.51 N ATOM 1518 CA ILE B -6 29.926 3.201 -47.760 1.00 17.18 C ATOM 1519 C ILE B -6 30.860 2.827 -46.620 1.00 18.38 C ATOM 1520 O ILE B -6 30.866 3.469 -45.567 1.00 17.20 O ATOM 1521 CB ILE B -6 30.348 4.496 -48.491 1.00 17.74 C ATOM 1522 CG1 ILE B -6 29.397 4.762 -49.657 1.00 18.85 C ATOM 1523 CG2 ILE B -6 31.782 4.379 -49.023 1.00 19.74 C ATOM 1524 CD1 ILE B -6 29.428 6.176 -50.203 1.00 18.41 C ATOM 0 H ILE B -6 28.617 3.951 -46.510 1.00 15.51 H new ATOM 0 HA ILE B -6 29.928 2.534 -48.464 1.00 17.18 H new ATOM 0 HB ILE B -6 30.309 5.231 -47.859 1.00 17.74 H new ATOM 0 HG12 ILE B -6 29.610 4.148 -50.377 1.00 18.85 H new ATOM 0 HG13 ILE B -6 28.492 4.561 -49.371 1.00 18.85 H new ATOM 0 HG21 ILE B -6 32.027 5.200 -49.477 1.00 19.74 H new ATOM 0 HG22 ILE B -6 32.390 4.226 -48.283 1.00 19.74 H new ATOM 0 HG23 ILE B -6 31.837 3.637 -49.645 1.00 19.74 H new ATOM 0 HD11 ILE B -6 28.797 6.254 -50.936 1.00 18.41 H new ATOM 0 HD12 ILE B -6 29.186 6.800 -49.501 1.00 18.41 H new ATOM 0 HD13 ILE B -6 30.321 6.380 -50.522 1.00 18.41 H new ATOM 1525 N AILE B -5 31.638 1.777 -46.842 0.87 18.93 N ATOM 1526 CA AILE B -5 32.541 1.248 -45.829 0.87 20.43 C ATOM 1527 C AILE B -5 33.977 1.458 -46.301 0.87 21.81 C ATOM 1528 O AILE B -5 34.321 1.082 -47.420 0.87 20.66 O ATOM 1529 CB AILE B -5 32.253 -0.245 -45.565 0.87 20.82 C ATOM 1530 CG1AILE B -5 30.821 -0.398 -45.021 0.87 21.48 C ATOM 1531 CG2AILE B -5 33.268 -0.835 -44.573 0.87 21.68 C ATOM 1532 CD1AILE B -5 30.182 -1.742 -45.290 0.87 22.50 C ATOM 1533 N BILE B -5 31.613 1.750 -46.802 0.13 19.65 N ATOM 1534 CA BILE B -5 32.539 1.302 -45.770 0.13 21.33 C ATOM 1535 C BILE B -5 33.981 1.386 -46.245 0.13 22.86 C ATOM 1536 O BILE B -5 34.335 0.854 -47.297 0.13 22.86 O ATOM 1537 CB BILE B -5 32.195 -0.107 -45.252 0.13 21.38 C ATOM 1538 CG1BILE B -5 33.471 -0.929 -45.044 0.13 21.54 C ATOM 1539 CG2BILE B -5 31.239 -0.801 -46.206 0.13 21.18 C ATOM 1540 CD1BILE B -5 33.309 -2.060 -44.053 0.13 21.63 C ATOM 0 H AILE B -5 31.658 1.349 -47.588 0.87 19.65 H new ATOM 0 H BILE B -5 31.604 1.266 -47.513 0.13 19.65 H new ATOM 0 HA AILE B -5 32.406 1.717 -44.991 0.87 21.33 H new ATOM 0 HA BILE B -5 32.441 1.908 -45.019 0.13 21.33 H new ATOM 0 HB AILE B -5 32.337 -0.733 -46.399 0.87 21.38 H new ATOM 0 HB BILE B -5 31.753 -0.025 -44.393 0.13 21.38 H new ATOM 0 HG12AILE B -5 30.834 -0.246 -44.063 0.87 21.54 H new ATOM 0 HG12BILE B -5 33.754 -1.295 -45.897 0.13 21.54 H new ATOM 0 HG13AILE B -5 30.265 0.295 -45.410 0.87 21.54 H new ATOM 0 HG13BILE B -5 34.179 -0.341 -44.739 0.13 21.54 H new ATOM 0 HG21AILE B -5 33.067 -1.772 -44.423 0.87 21.18 H new ATOM 0 HG21BILE B -5 31.031 -1.686 -45.869 0.13 21.18 H new ATOM 0 HG22AILE B -5 34.163 -0.751 -44.937 0.87 21.18 H new ATOM 0 HG22BILE B -5 30.422 -0.283 -46.280 0.13 21.18 H new ATOM 0 HG23AILE B -5 33.215 -0.355 -43.732 0.87 21.18 H new ATOM 0 HG23BILE B -5 31.653 -0.878 -47.080 0.13 21.18 H new ATOM 0 HD11AILE B -5 29.287 -1.755 -44.917 0.87 21.63 H new ATOM 0 HD11BILE B -5 34.148 -2.538 -43.968 0.13 21.63 H new ATOM 0 HD12AILE B -5 30.135 -1.893 -46.247 0.87 21.63 H new ATOM 0 HD12BILE B -5 33.053 -1.700 -43.189 0.13 21.63 H new ATOM 0 HD13AILE B -5 30.714 -2.441 -44.879 0.87 21.63 H new ATOM 0 HD13BILE B -5 32.621 -2.668 -44.366 0.13 21.63 H new ATOM 1541 N LEU B -4 34.794 2.071 -45.447 1.00 24.32 N ATOM 1542 CA LEU B -4 36.161 2.448 -45.814 1.00 29.02 C ATOM 1543 C LEU B -4 37.210 1.458 -45.338 1.00 33.50 C ATOM 1544 O LEU B -4 36.936 0.612 -44.481 1.00 33.52 O ATOM 1545 CB LEU B -4 36.497 3.842 -45.258 1.00 29.32 C ATOM 1546 CG LEU B -4 35.652 5.036 -45.726 1.00 31.05 C ATOM 1547 CD1 LEU B -4 35.887 6.253 -44.843 1.00 30.80 C ATOM 1548 CD2 LEU B -4 35.918 5.380 -47.183 1.00 30.08 C ATOM 0 H ALEU B -4 34.574 2.280 -44.642 0.87 24.32 H new ATOM 0 H BLEU B -4 34.565 2.336 -44.662 0.13 24.32 H new ATOM 0 HA LEU B -4 36.186 2.451 -46.784 1.00 29.02 H new ATOM 0 HB2 LEU B -4 36.436 3.797 -44.291 1.00 29.32 H new ATOM 0 HB3 LEU B -4 37.423 4.032 -45.475 1.00 29.32 H new ATOM 0 HG LEU B -4 34.722 4.773 -45.648 1.00 31.05 H new ATOM 0 HD11 LEU B -4 35.343 6.992 -45.158 1.00 30.80 H new ATOM 0 HD12 LEU B -4 35.644 6.041 -43.928 1.00 30.80 H new ATOM 0 HD13 LEU B -4 36.824 6.503 -44.879 1.00 30.80 H new ATOM 0 HD21 LEU B -4 35.369 6.136 -47.443 1.00 30.08 H new ATOM 0 HD22 LEU B -4 36.854 5.607 -47.296 1.00 30.08 H new ATOM 0 HD23 LEU B -4 35.701 4.617 -47.741 1.00 30.08 H new ATOM 1549 N SER B -3 38.397 1.584 -45.939 1.00 41.03 N ATOM 1550 CA SER B -3 39.669 0.922 -45.549 1.00 45.83 C ATOM 1551 C SER B -3 40.252 0.082 -46.675 1.00 47.05 C ATOM 1552 O SER B -3 40.852 0.639 -47.591 1.00 51.10 O ATOM 1553 CB SER B -3 39.579 0.117 -44.254 1.00 47.05 C ATOM 1554 OG SER B -3 39.742 0.981 -43.147 1.00 50.55 O ATOM 0 H SER B -3 38.496 2.088 -46.629 1.00 41.03 H new ATOM 0 HA SER B -3 40.282 1.653 -45.370 1.00 45.83 H new ATOM 0 HB2 SER B -3 38.721 -0.333 -44.201 1.00 47.05 H new ATOM 0 HB3 SER B -3 40.262 -0.572 -44.242 1.00 47.05 H new ATOM 0 HG SER B -3 39.691 0.538 -42.435 1.00 50.55 H new ATOM 1555 N GLY B 0 46.126 0.041 -42.794 1.00 61.44 N ATOM 1556 CA GLY B 0 45.260 0.375 -43.915 1.00 63.31 C ATOM 1557 C GLY B 0 45.994 0.365 -45.242 1.00 63.51 C ATOM 1558 O GLY B 0 45.804 -0.539 -46.061 1.00 64.17 O ATOM 0 H1 GLY B 0 45.655 0.059 -42.039 1.00 61.44 H new ATOM 0 H2 GLY B 0 46.465 -0.773 -42.913 1.00 61.44 H new ATOM 0 H3 GLY B 0 46.789 0.633 -42.744 1.00 61.44 H new ATOM 0 HA2 GLY B 0 44.525 -0.257 -43.951 1.00 63.31 H new ATOM 0 HA3 GLY B 0 44.873 1.252 -43.770 1.00 63.31 H new ATOM 1559 N GLY B 1 46.841 1.371 -45.445 1.00 62.00 N ATOM 1560 CA GLY B 1 47.542 1.567 -46.713 1.00 56.19 C ATOM 1561 C GLY B 1 46.797 2.569 -47.582 1.00 53.01 C ATOM 1562 O GLY B 1 46.394 3.634 -47.095 1.00 53.64 O ATOM 0 H GLY B 1 47.026 1.962 -44.849 1.00 62.00 H new ATOM 0 HA2 GLY B 1 48.444 1.883 -46.545 1.00 56.19 H new ATOM 0 HA3 GLY B 1 47.620 0.720 -47.180 1.00 56.19 H new ATOM 1563 N PRO B 2 46.600 2.240 -48.874 1.00 48.81 N ATOM 1564 CA PRO B 2 45.857 3.155 -49.747 1.00 45.88 C ATOM 1565 C PRO B 2 44.374 3.125 -49.370 1.00 42.58 C ATOM 1566 O PRO B 2 43.868 2.082 -48.947 1.00 44.38 O ATOM 1567 CB PRO B 2 46.071 2.577 -51.156 1.00 46.00 C ATOM 1568 CG PRO B 2 47.016 1.423 -50.998 1.00 46.59 C ATOM 1569 CD PRO B 2 46.958 0.992 -49.565 1.00 46.81 C ATOM 0 HA PRO B 2 46.150 4.077 -49.679 1.00 45.88 H new ATOM 0 HB2 PRO B 2 45.230 2.285 -51.542 1.00 46.00 H new ATOM 0 HB3 PRO B 2 46.440 3.247 -51.753 1.00 46.00 H new ATOM 0 HG2 PRO B 2 46.765 0.693 -51.585 1.00 46.59 H new ATOM 0 HG3 PRO B 2 47.918 1.684 -51.240 1.00 46.59 H new ATOM 0 HD2 PRO B 2 46.296 0.297 -49.423 1.00 46.81 H new ATOM 0 HD3 PRO B 2 47.808 0.640 -49.259 1.00 46.81 H new ATOM 1570 N ILE B 3 43.695 4.261 -49.493 1.00 37.15 N ATOM 1571 CA ILE B 3 42.293 4.348 -49.067 1.00 33.63 C ATOM 1572 C ILE B 3 41.356 3.742 -50.109 1.00 28.56 C ATOM 1573 O ILE B 3 41.350 4.155 -51.263 1.00 28.72 O ATOM 1574 CB ILE B 3 41.878 5.801 -48.789 1.00 33.50 C ATOM 1575 CG1 ILE B 3 42.728 6.376 -47.649 1.00 33.44 C ATOM 1576 CG2 ILE B 3 40.396 5.868 -48.447 1.00 32.57 C ATOM 1577 CD1 ILE B 3 42.556 7.866 -47.462 1.00 34.83 C ATOM 0 H ILE B 3 44.020 4.989 -49.817 1.00 37.15 H new ATOM 0 HA ILE B 3 42.219 3.839 -48.244 1.00 33.63 H new ATOM 0 HB ILE B 3 42.029 6.334 -49.585 1.00 33.50 H new ATOM 0 HG12 ILE B 3 42.496 5.924 -46.822 1.00 33.44 H new ATOM 0 HG13 ILE B 3 43.663 6.185 -47.824 1.00 33.44 H new ATOM 0 HG21 ILE B 3 40.145 6.789 -48.274 1.00 32.57 H new ATOM 0 HG22 ILE B 3 39.876 5.526 -49.191 1.00 32.57 H new ATOM 0 HG23 ILE B 3 40.221 5.332 -47.658 1.00 32.57 H new ATOM 0 HD11 ILE B 3 43.117 8.167 -46.730 1.00 34.83 H new ATOM 0 HD12 ILE B 3 42.813 8.326 -48.276 1.00 34.83 H new ATOM 0 HD13 ILE B 3 41.628 8.062 -47.259 1.00 34.83 H new ATOM 1578 N THR B 4 40.560 2.772 -49.693 1.00 26.60 N ATOM 1579 CA THR B 4 39.576 2.152 -50.582 1.00 26.53 C ATOM 1580 C THR B 4 38.197 2.139 -49.907 1.00 23.48 C ATOM 1581 O THR B 4 38.067 2.339 -48.700 1.00 22.09 O ATOM 1582 CB THR B 4 39.950 0.692 -50.962 1.00 29.85 C ATOM 1583 OG1 THR B 4 39.983 -0.116 -49.782 1.00 33.97 O ATOM 1584 CG2 THR B 4 41.313 0.603 -51.701 1.00 30.91 C ATOM 0 H THR B 4 40.569 2.452 -48.895 1.00 26.60 H new ATOM 0 HA THR B 4 39.561 2.682 -51.394 1.00 26.53 H new ATOM 0 HB THR B 4 39.271 0.366 -51.573 1.00 29.85 H new ATOM 0 HG1 THR B 4 40.458 0.258 -49.199 1.00 33.97 H new ATOM 0 HG21 THR B 4 41.504 -0.323 -51.917 1.00 30.91 H new ATOM 0 HG22 THR B 4 41.273 1.124 -52.518 1.00 30.91 H new ATOM 0 HG23 THR B 4 42.015 0.952 -51.130 1.00 30.91 H new ATOM 1585 N ALA B 5 37.170 1.889 -50.698 1.00 21.69 N ATOM 1586 CA ALA B 5 35.819 1.944 -50.188 1.00 20.82 C ATOM 1587 C ALA B 5 34.928 1.087 -51.075 1.00 19.77 C ATOM 1588 O ALA B 5 35.234 0.879 -52.249 1.00 20.04 O ATOM 1589 CB ALA B 5 35.321 3.396 -50.191 1.00 18.74 C ATOM 0 H ALA B 5 37.235 1.686 -51.531 1.00 21.69 H new ATOM 0 HA ALA B 5 35.795 1.610 -49.278 1.00 20.82 H new ATOM 0 HB1 ALA B 5 34.414 3.428 -49.848 1.00 18.74 H new ATOM 0 HB2 ALA B 5 35.898 3.937 -49.630 1.00 18.74 H new ATOM 0 HB3 ALA B 5 35.336 3.742 -51.097 1.00 18.74 H new ATOM 1590 N TYR B 6 33.818 0.633 -50.513 1.00 19.12 N ATOM 1591 CA TYR B 6 32.782 -0.018 -51.294 1.00 18.86 C ATOM 1592 C TYR B 6 31.422 0.352 -50.713 1.00 18.33 C ATOM 1593 O TYR B 6 31.335 0.743 -49.559 1.00 16.47 O ATOM 1594 CB TYR B 6 33.001 -1.543 -51.323 1.00 20.25 C ATOM 1595 CG TYR B 6 32.883 -2.257 -50.001 1.00 20.94 C ATOM 1596 CD1 TYR B 6 31.658 -2.755 -49.571 1.00 20.88 C ATOM 1597 CD2 TYR B 6 34.004 -2.477 -49.199 1.00 21.92 C ATOM 1598 CE1 TYR B 6 31.542 -3.434 -48.376 1.00 22.00 C ATOM 1599 CE2 TYR B 6 33.894 -3.141 -47.988 1.00 22.38 C ATOM 1600 CZ TYR B 6 32.666 -3.624 -47.595 1.00 23.08 C ATOM 1601 OH TYR B 6 32.549 -4.287 -46.407 1.00 26.92 O ATOM 0 H TYR B 6 33.645 0.693 -49.673 1.00 19.12 H new ATOM 0 HA TYR B 6 32.819 0.287 -52.214 1.00 18.86 H new ATOM 0 HB2 TYR B 6 32.359 -1.932 -51.938 1.00 20.25 H new ATOM 0 HB3 TYR B 6 33.883 -1.718 -51.686 1.00 20.25 H new ATOM 0 HD1 TYR B 6 30.903 -2.628 -50.099 1.00 20.88 H new ATOM 0 HD2 TYR B 6 34.836 -2.174 -49.482 1.00 21.92 H new ATOM 0 HE1 TYR B 6 30.716 -3.760 -48.099 1.00 22.00 H new ATOM 0 HE2 TYR B 6 34.641 -3.259 -47.447 1.00 22.38 H new ATOM 0 HH TYR B 6 33.301 -4.333 -46.036 1.00 26.92 H new ATOM 1602 N SER B 7 30.368 0.221 -51.514 1.00 17.82 N ATOM 1603 CA SER B 7 29.035 0.637 -51.067 1.00 17.67 C ATOM 1604 C SER B 7 28.135 -0.599 -50.948 1.00 17.13 C ATOM 1605 O SER B 7 28.358 -1.617 -51.644 1.00 15.22 O ATOM 1606 CB SER B 7 28.446 1.636 -52.081 1.00 19.09 C ATOM 1607 OG SER B 7 27.208 2.177 -51.618 1.00 23.96 O ATOM 0 H SER B 7 30.399 -0.102 -52.311 1.00 17.82 H new ATOM 0 HA SER B 7 29.094 1.069 -50.200 1.00 17.67 H new ATOM 0 HB2 SER B 7 29.078 2.355 -52.234 1.00 19.09 H new ATOM 0 HB3 SER B 7 28.309 1.193 -52.933 1.00 19.09 H new ATOM 0 HG SER B 7 27.150 2.982 -51.850 1.00 23.96 H new ATOM 1608 N GLN B 8 27.119 -0.510 -50.083 1.00 14.74 N ATOM 1609 CA GLN B 8 26.070 -1.528 -50.015 1.00 14.45 C ATOM 1610 C GLN B 8 24.747 -0.813 -49.888 1.00 13.77 C ATOM 1611 O GLN B 8 24.604 0.082 -49.049 1.00 12.47 O ATOM 1612 CB GLN B 8 26.242 -2.442 -48.802 1.00 15.20 C ATOM 1613 CG GLN B 8 27.546 -3.222 -48.757 1.00 16.83 C ATOM 1614 CD GLN B 8 27.658 -4.070 -47.519 1.00 18.31 C ATOM 1615 OE1 GLN B 8 27.250 -3.653 -46.435 1.00 19.15 O ATOM 1616 NE2 GLN B 8 28.229 -5.272 -47.662 1.00 18.78 N ATOM 0 H GLN B 8 27.021 0.137 -49.525 1.00 14.74 H new ATOM 0 HA GLN B 8 26.115 -2.077 -50.813 1.00 14.45 H new ATOM 0 HB2 GLN B 8 26.176 -1.904 -47.998 1.00 15.20 H new ATOM 0 HB3 GLN B 8 25.505 -3.072 -48.783 1.00 15.20 H new ATOM 0 HG2 GLN B 8 27.610 -3.788 -49.542 1.00 16.83 H new ATOM 0 HG3 GLN B 8 28.292 -2.604 -48.792 1.00 16.83 H new ATOM 0 HE21 GLN B 8 28.502 -5.529 -48.436 1.00 18.78 H new ATOM 0 HE22 GLN B 8 28.323 -5.787 -46.980 1.00 18.78 H new ATOM 1617 N GLN B 9 23.789 -1.184 -50.728 1.00 13.24 N ATOM 1618 CA GLN B 9 22.429 -0.723 -50.557 1.00 13.58 C ATOM 1619 C GLN B 9 21.796 -1.403 -49.330 1.00 13.91 C ATOM 1620 O GLN B 9 22.064 -2.584 -49.041 1.00 13.41 O ATOM 1621 CB GLN B 9 21.598 -1.041 -51.794 1.00 13.49 C ATOM 1622 CG GLN B 9 20.124 -0.696 -51.687 1.00 13.52 C ATOM 1623 CD GLN B 9 19.430 -0.869 -53.015 1.00 13.78 C ATOM 1624 OE1 GLN B 9 19.951 -1.565 -53.903 1.00 14.06 O ATOM 1625 NE2 GLN B 9 18.287 -0.200 -53.192 1.00 13.45 N ATOM 0 H GLN B 9 23.911 -1.703 -51.403 1.00 13.24 H new ATOM 0 HA GLN B 9 22.445 0.238 -50.425 1.00 13.58 H new ATOM 0 HB2 GLN B 9 21.973 -0.563 -52.550 1.00 13.49 H new ATOM 0 HB3 GLN B 9 21.681 -1.988 -51.987 1.00 13.49 H new ATOM 0 HG2 GLN B 9 19.703 -1.263 -51.022 1.00 13.52 H new ATOM 0 HG3 GLN B 9 20.024 0.220 -51.383 1.00 13.52 H new ATOM 0 HE21 GLN B 9 17.960 0.271 -52.550 1.00 13.45 H new ATOM 0 HE22 GLN B 9 17.878 -0.240 -53.947 1.00 13.45 H new ATOM 1626 N THR B 10 20.932 -0.674 -48.630 1.00 13.79 N ATOM 1627 CA THR B 10 20.218 -1.291 -47.521 1.00 15.61 C ATOM 1628 C THR B 10 18.708 -1.159 -47.645 1.00 15.65 C ATOM 1629 O THR B 10 17.981 -1.962 -47.055 1.00 16.84 O ATOM 1630 CB THR B 10 20.667 -0.732 -46.134 1.00 17.07 C ATOM 1631 OG1 THR B 10 20.488 0.680 -46.121 1.00 18.93 O ATOM 1632 CG2 THR B 10 22.126 -1.023 -45.865 1.00 17.85 C ATOM 0 H THR B 10 20.749 0.154 -48.775 1.00 13.79 H new ATOM 0 HA THR B 10 20.451 -2.231 -47.570 1.00 15.61 H new ATOM 0 HB THR B 10 20.129 -1.162 -45.451 1.00 17.07 H new ATOM 0 HG1 THR B 10 20.727 0.986 -45.376 1.00 18.93 H new ATOM 0 HG21 THR B 10 22.373 -0.664 -44.998 1.00 17.85 H new ATOM 0 HG22 THR B 10 22.271 -1.982 -45.871 1.00 17.85 H new ATOM 0 HG23 THR B 10 22.671 -0.610 -46.553 1.00 17.85 H new ATOM 1633 N ARG B 11 18.228 -0.159 -48.369 1.00 15.18 N ATOM 1634 CA ARG B 11 16.775 0.036 -48.499 1.00 16.99 C ATOM 1635 C ARG B 11 16.389 0.290 -49.925 1.00 16.70 C ATOM 1636 O ARG B 11 17.140 0.893 -50.690 1.00 16.74 O ATOM 1637 CB ARG B 11 16.279 1.229 -47.678 1.00 17.21 C ATOM 1638 CG ARG B 11 16.302 1.016 -46.179 1.00 18.65 C ATOM 1639 CD ARG B 11 15.389 2.036 -45.493 1.00 20.12 C ATOM 1640 NE ARG B 11 15.228 1.702 -44.079 1.00 21.08 N ATOM 1641 CZ ARG B 11 14.304 0.876 -43.593 1.00 22.41 C ATOM 1642 NH1 ARG B 11 13.427 0.282 -44.401 1.00 23.69 N ATOM 1643 NH2 ARG B 11 14.254 0.644 -42.287 1.00 24.11 N ATOM 0 H ARG B 11 18.711 0.414 -48.790 1.00 15.18 H new ATOM 0 HA ARG B 11 16.369 -0.782 -48.172 1.00 16.99 H new ATOM 0 HB2 ARG B 11 16.824 2.002 -47.891 1.00 17.21 H new ATOM 0 HB3 ARG B 11 15.371 1.438 -47.949 1.00 17.21 H new ATOM 0 HG2 ARG B 11 16.010 0.115 -45.968 1.00 18.65 H new ATOM 0 HG3 ARG B 11 17.208 1.106 -45.846 1.00 18.65 H new ATOM 0 HD2 ARG B 11 15.764 2.926 -45.581 1.00 20.12 H new ATOM 0 HD3 ARG B 11 14.523 2.049 -45.929 1.00 20.12 H new ATOM 0 HE ARG B 11 15.770 2.066 -43.520 1.00 21.08 H new ATOM 0 HH11 ARG B 11 13.453 0.430 -45.248 1.00 23.69 H new ATOM 0 HH12 ARG B 11 12.834 -0.250 -44.076 1.00 23.69 H new ATOM 0 HH21 ARG B 11 14.816 1.026 -41.761 1.00 24.11 H new ATOM 0 HH22 ARG B 11 13.659 0.111 -41.967 1.00 24.11 H new ATOM 1644 N GLY B 12 15.187 -0.147 -50.266 1.00 17.60 N ATOM 1645 CA GLY B 12 14.627 0.187 -51.547 1.00 18.93 C ATOM 1646 C GLY B 12 13.711 1.392 -51.472 1.00 21.42 C ATOM 1647 O GLY B 12 13.390 1.922 -50.385 1.00 19.77 O ATOM 0 H GLY B 12 14.686 -0.636 -49.767 1.00 17.60 H new ATOM 0 HA2 GLY B 12 15.344 0.366 -52.175 1.00 18.93 H new ATOM 0 HA3 GLY B 12 14.132 -0.573 -51.890 1.00 18.93 H new ATOM 1648 N LEU B 13 13.282 1.810 -52.653 1.00 21.62 N ATOM 1649 CA LEU B 13 12.479 3.008 -52.831 1.00 24.10 C ATOM 1650 C LEU B 13 11.184 3.057 -52.007 1.00 23.89 C ATOM 1651 O LEU B 13 10.909 4.066 -51.351 1.00 24.05 O ATOM 1652 CB LEU B 13 12.168 3.188 -54.323 1.00 25.67 C ATOM 1653 CG LEU B 13 11.769 4.603 -54.732 1.00 28.36 C ATOM 1654 CD1 LEU B 13 12.764 5.636 -54.212 1.00 30.63 C ATOM 1655 CD2 LEU B 13 11.637 4.675 -56.249 1.00 29.74 C ATOM 0 H LEU B 13 13.453 1.397 -53.388 1.00 21.62 H new ATOM 0 HA LEU B 13 13.015 3.741 -52.491 1.00 24.10 H new ATOM 0 HB2 LEU B 13 12.948 2.925 -54.836 1.00 25.67 H new ATOM 0 HB3 LEU B 13 11.451 2.581 -54.566 1.00 25.67 H new ATOM 0 HG LEU B 13 10.911 4.813 -54.331 1.00 28.36 H new ATOM 0 HD11 LEU B 13 12.484 6.523 -54.488 1.00 30.63 H new ATOM 0 HD12 LEU B 13 12.798 5.594 -53.243 1.00 30.63 H new ATOM 0 HD13 LEU B 13 13.644 5.449 -54.574 1.00 30.63 H new ATOM 0 HD21 LEU B 13 11.383 5.574 -56.510 1.00 29.74 H new ATOM 0 HD22 LEU B 13 12.486 4.447 -56.659 1.00 29.74 H new ATOM 0 HD23 LEU B 13 10.957 4.049 -56.545 1.00 29.74 H new ATOM 1656 N LEU B 14 10.391 1.990 -52.043 1.00 24.97 N ATOM 1657 CA LEU B 14 9.149 1.980 -51.275 1.00 26.02 C ATOM 1658 C LEU B 14 9.444 2.074 -49.778 1.00 25.80 C ATOM 1659 O LEU B 14 8.839 2.890 -49.082 1.00 24.08 O ATOM 1660 CB LEU B 14 8.291 0.738 -51.579 1.00 28.87 C ATOM 1661 CG LEU B 14 6.879 0.687 -50.958 1.00 31.44 C ATOM 1662 CD1 LEU B 14 6.120 1.991 -51.169 1.00 31.52 C ATOM 1663 CD2 LEU B 14 6.070 -0.500 -51.481 1.00 31.88 C ATOM 0 H LEU B 14 10.548 1.276 -52.495 1.00 24.97 H new ATOM 0 HA LEU B 14 8.636 2.758 -51.545 1.00 26.02 H new ATOM 0 HB2 LEU B 14 8.199 0.665 -52.542 1.00 28.87 H new ATOM 0 HB3 LEU B 14 8.779 -0.045 -51.280 1.00 28.87 H new ATOM 0 HG LEU B 14 7.001 0.565 -50.003 1.00 31.44 H new ATOM 0 HD11 LEU B 14 5.240 1.922 -50.767 1.00 31.52 H new ATOM 0 HD12 LEU B 14 6.608 2.720 -50.755 1.00 31.52 H new ATOM 0 HD13 LEU B 14 6.028 2.162 -52.119 1.00 31.52 H new ATOM 0 HD21 LEU B 14 5.191 -0.499 -51.070 1.00 31.88 H new ATOM 0 HD22 LEU B 14 5.976 -0.429 -52.444 1.00 31.88 H new ATOM 0 HD23 LEU B 14 6.528 -1.326 -51.262 1.00 31.88 H new ATOM 1664 N GLY B 15 10.376 1.246 -49.296 1.00 24.67 N ATOM 1665 CA GLY B 15 10.730 1.229 -47.872 1.00 26.44 C ATOM 1666 C GLY B 15 11.274 2.571 -47.405 1.00 25.35 C ATOM 1667 O GLY B 15 10.987 3.010 -46.284 1.00 26.57 O ATOM 0 H GLY B 15 10.816 0.685 -49.778 1.00 24.67 H new ATOM 0 HA2 GLY B 15 9.947 0.998 -47.348 1.00 26.44 H new ATOM 0 HA3 GLY B 15 11.393 0.539 -47.712 1.00 26.44 H new ATOM 1668 N CYS B 16 12.046 3.220 -48.271 1.00 24.15 N ATOM 1669 CA CYS B 16 12.550 4.563 -48.034 1.00 26.14 C ATOM 1670 C CYS B 16 11.390 5.557 -47.813 1.00 26.07 C ATOM 1671 O CYS B 16 11.377 6.263 -46.806 1.00 23.51 O ATOM 1672 CB CYS B 16 13.452 5.003 -49.199 1.00 29.49 C ATOM 1673 SG CYS B 16 13.958 6.746 -49.196 1.00 38.17 S ATOM 0 H CYS B 16 12.294 2.885 -49.023 1.00 24.15 H new ATOM 0 HA CYS B 16 13.083 4.556 -47.224 1.00 26.14 H new ATOM 0 HB2 CYS B 16 14.251 4.452 -49.193 1.00 29.49 H new ATOM 0 HB3 CYS B 16 12.988 4.820 -50.031 1.00 29.49 H new ATOM 0 HG CYS B 16 14.656 6.962 -50.148 1.00 38.17 H new ATOM 1674 N ILE B 17 10.423 5.588 -48.736 1.00 24.62 N ATOM 1675 CA ILE B 17 9.255 6.484 -48.630 1.00 26.24 C ATOM 1676 C ILE B 17 8.446 6.228 -47.351 1.00 24.24 C ATOM 1677 O ILE B 17 8.118 7.170 -46.618 1.00 24.86 O ATOM 1678 CB ILE B 17 8.306 6.398 -49.862 1.00 28.49 C ATOM 1679 CG1 ILE B 17 9.069 6.541 -51.192 1.00 32.02 C ATOM 1680 CG2 ILE B 17 7.197 7.440 -49.771 1.00 28.45 C ATOM 1681 CD1 ILE B 17 9.859 7.829 -51.363 1.00 34.40 C ATOM 0 H ILE B 17 10.422 5.094 -49.440 1.00 24.62 H new ATOM 0 HA ILE B 17 9.627 7.379 -48.598 1.00 26.24 H new ATOM 0 HB ILE B 17 7.905 5.515 -49.848 1.00 28.49 H new ATOM 0 HG12 ILE B 17 9.680 5.792 -51.278 1.00 32.02 H new ATOM 0 HG13 ILE B 17 8.432 6.472 -51.920 1.00 32.02 H new ATOM 0 HG21 ILE B 17 6.620 7.367 -50.547 1.00 28.45 H new ATOM 0 HG22 ILE B 17 6.676 7.289 -48.967 1.00 28.45 H new ATOM 0 HG23 ILE B 17 7.588 8.327 -49.741 1.00 28.45 H new ATOM 0 HD11 ILE B 17 10.302 7.825 -52.226 1.00 34.40 H new ATOM 0 HD12 ILE B 17 9.257 8.588 -51.312 1.00 34.40 H new ATOM 0 HD13 ILE B 17 10.524 7.897 -50.660 1.00 34.40 H new ATOM 1682 N ILE B 18 8.143 4.962 -47.069 1.00 22.17 N ATOM 1683 CA ILE B 18 7.385 4.609 -45.866 1.00 22.86 C ATOM 1684 C ILE B 18 8.149 5.005 -44.592 1.00 22.70 C ATOM 1685 O ILE B 18 7.586 5.618 -43.676 1.00 22.54 O ATOM 1686 CB ILE B 18 7.058 3.097 -45.841 1.00 24.91 C ATOM 1687 CG1 ILE B 18 6.128 2.760 -47.017 1.00 26.14 C ATOM 1688 CG2 ILE B 18 6.478 2.687 -44.484 1.00 25.28 C ATOM 1689 CD1 ILE B 18 5.788 1.290 -47.157 1.00 29.39 C ATOM 0 H ILE B 18 8.366 4.292 -47.560 1.00 22.17 H new ATOM 0 HA ILE B 18 6.552 5.106 -45.891 1.00 22.86 H new ATOM 0 HB ILE B 18 7.872 2.581 -45.951 1.00 24.91 H new ATOM 0 HG12 ILE B 18 5.304 3.261 -46.915 1.00 26.14 H new ATOM 0 HG13 ILE B 18 6.544 3.062 -47.839 1.00 26.14 H new ATOM 0 HG21 ILE B 18 6.280 1.737 -44.490 1.00 25.28 H new ATOM 0 HG22 ILE B 18 7.123 2.878 -43.785 1.00 25.28 H new ATOM 0 HG23 ILE B 18 5.663 3.185 -44.316 1.00 25.28 H new ATOM 0 HD11 ILE B 18 5.201 1.165 -47.919 1.00 29.39 H new ATOM 0 HD12 ILE B 18 6.603 0.781 -47.290 1.00 29.39 H new ATOM 0 HD13 ILE B 18 5.343 0.983 -46.352 1.00 29.39 H new ATOM 1690 N THR B 19 9.433 4.652 -44.544 1.00 20.32 N ATOM 1691 CA THR B 19 10.292 4.993 -43.415 1.00 20.31 C ATOM 1692 C THR B 19 10.415 6.509 -43.216 1.00 19.81 C ATOM 1693 O THR B 19 10.514 6.981 -42.077 1.00 19.29 O ATOM 1694 CB THR B 19 11.677 4.348 -43.555 1.00 20.53 C ATOM 1695 OG1 THR B 19 11.510 2.928 -43.684 1.00 21.90 O ATOM 1696 CG2 THR B 19 12.549 4.640 -42.325 1.00 20.82 C ATOM 0 H THR B 19 9.829 4.208 -45.165 1.00 20.32 H new ATOM 0 HA THR B 19 9.867 4.632 -42.621 1.00 20.31 H new ATOM 0 HB THR B 19 12.117 4.717 -44.337 1.00 20.53 H new ATOM 0 HG1 THR B 19 11.341 2.737 -44.484 1.00 21.90 H new ATOM 0 HG21 THR B 19 13.417 4.223 -42.437 1.00 20.82 H new ATOM 0 HG22 THR B 19 12.662 5.599 -42.228 1.00 20.82 H new ATOM 0 HG23 THR B 19 12.120 4.284 -41.532 1.00 20.82 H new ATOM 1697 N ASER B 20 10.386 7.265 -44.314 0.55 19.22 N ATOM 1698 CA ASER B 20 10.427 8.722 -44.223 0.55 20.16 C ATOM 1699 C ASER B 20 9.175 9.286 -43.530 0.55 21.16 C ATOM 1700 O ASER B 20 9.244 10.321 -42.859 0.55 22.44 O ATOM 1701 CB ASER B 20 10.635 9.357 -45.600 0.55 19.49 C ATOM 1702 OG ASER B 20 10.835 10.757 -45.494 0.55 18.44 O ATOM 1703 N BSER B 20 10.396 7.270 -44.310 0.45 19.66 N ATOM 1704 CA BSER B 20 10.425 8.724 -44.196 0.45 20.68 C ATOM 1705 C BSER B 20 9.192 9.226 -43.435 0.45 21.38 C ATOM 1706 O BSER B 20 9.286 10.151 -42.624 0.45 22.11 O ATOM 1707 CB BSER B 20 10.526 9.387 -45.571 0.45 20.66 C ATOM 1708 OG BSER B 20 9.249 9.494 -46.176 0.45 20.20 O ATOM 0 H ASER B 20 10.343 6.955 -45.115 0.55 19.66 H new ATOM 0 H BSER B 20 10.367 6.968 -45.115 0.45 19.66 H new ATOM 0 HA ASER B 20 11.190 8.955 -43.671 0.55 20.68 H new ATOM 0 HA BSER B 20 11.217 8.971 -43.694 0.45 20.68 H new ATOM 0 HB2ASER B 20 11.401 8.950 -46.034 0.55 20.66 H new ATOM 0 HB2BSER B 20 10.920 10.269 -45.481 0.45 20.66 H new ATOM 0 HB3ASER B 20 9.864 9.179 -46.161 0.55 20.66 H new ATOM 0 HB3BSER B 20 11.116 8.869 -46.141 0.45 20.66 H new ATOM 0 HG ASER B 20 11.580 10.908 -45.137 0.55 20.20 H new ATOM 0 HG BSER B 20 9.002 8.738 -46.446 0.45 20.20 H new ATOM 1709 N LEU B 21 8.052 8.593 -43.686 1.00 21.39 N ATOM 1710 CA LEU B 21 6.774 8.994 -43.071 1.00 24.63 C ATOM 1711 C LEU B 21 6.646 8.590 -41.611 1.00 24.53 C ATOM 1712 O LEU B 21 6.096 9.334 -40.784 1.00 25.29 O ATOM 1713 CB LEU B 21 5.601 8.415 -43.875 1.00 26.82 C ATOM 1714 CG LEU B 21 5.542 8.871 -45.329 1.00 28.85 C ATOM 1715 CD1 LEU B 21 4.530 8.034 -46.099 1.00 31.59 C ATOM 1716 CD2 LEU B 21 5.209 10.356 -45.418 1.00 32.70 C ATOM 0 H ALEU B 21 8.002 7.872 -44.153 0.55 21.39 H new ATOM 0 H BLEU B 21 7.989 7.919 -44.216 0.45 21.39 H new ATOM 0 HA LEU B 21 6.754 9.964 -43.092 1.00 24.63 H new ATOM 0 HB2 LEU B 21 5.656 7.447 -43.854 1.00 26.82 H new ATOM 0 HB3 LEU B 21 4.771 8.661 -43.437 1.00 26.82 H new ATOM 0 HG LEU B 21 6.415 8.741 -45.731 1.00 28.85 H new ATOM 0 HD11 LEU B 21 4.499 8.331 -47.022 1.00 31.59 H new ATOM 0 HD12 LEU B 21 4.792 7.101 -46.069 1.00 31.59 H new ATOM 0 HD13 LEU B 21 3.653 8.136 -45.698 1.00 31.59 H new ATOM 0 HD21 LEU B 21 5.176 10.625 -46.349 1.00 32.70 H new ATOM 0 HD22 LEU B 21 4.347 10.520 -45.004 1.00 32.70 H new ATOM 0 HD23 LEU B 21 5.891 10.869 -44.957 1.00 32.70 H new ATOM 1717 N THR B 22 7.145 7.409 -41.288 1.00 24.05 N ATOM 1718 CA THR B 22 7.036 6.915 -39.923 1.00 24.24 C ATOM 1719 C THR B 22 8.158 7.447 -39.033 1.00 24.83 C ATOM 1720 O THR B 22 7.958 7.642 -37.827 1.00 25.46 O ATOM 1721 CB THR B 22 6.979 5.379 -39.877 1.00 25.70 C ATOM 1722 OG1 THR B 22 8.260 4.822 -40.217 1.00 24.47 O ATOM 1723 CG2 THR B 22 5.920 4.861 -40.858 1.00 24.01 C ATOM 0 H THR B 22 7.547 6.881 -41.836 1.00 24.05 H new ATOM 0 HA THR B 22 6.198 7.253 -39.570 1.00 24.24 H new ATOM 0 HB THR B 22 6.743 5.107 -38.976 1.00 25.70 H new ATOM 0 HG1 THR B 22 8.194 3.987 -40.284 1.00 24.47 H new ATOM 0 HG21 THR B 22 5.892 3.892 -40.822 1.00 24.01 H new ATOM 0 HG22 THR B 22 5.052 5.219 -40.616 1.00 24.01 H new ATOM 0 HG23 THR B 22 6.146 5.144 -41.758 1.00 24.01 H new ATOM 1724 N GLY B 23 9.325 7.705 -39.629 1.00 23.12 N ATOM 1725 CA GLY B 23 10.498 8.139 -38.870 1.00 21.90 C ATOM 1726 C GLY B 23 11.134 7.004 -38.085 1.00 22.52 C ATOM 1727 O GLY B 23 12.028 7.231 -37.275 1.00 21.04 O ATOM 0 H GLY B 23 9.457 7.634 -40.476 1.00 23.12 H new ATOM 0 HA2 GLY B 23 11.153 8.514 -39.479 1.00 21.90 H new ATOM 0 HA3 GLY B 23 10.241 8.847 -38.259 1.00 21.90 H new ATOM 1728 N ARG B 24 10.687 5.782 -38.356 1.00 22.35 N ATOM 1729 CA ARG B 24 11.108 4.619 -37.598 1.00 25.23 C ATOM 1730 C ARG B 24 11.938 3.699 -38.492 1.00 25.01 C ATOM 1731 O ARG B 24 11.447 3.178 -39.484 1.00 25.93 O ATOM 1732 CB ARG B 24 9.880 3.899 -37.040 1.00 28.74 C ATOM 1733 CG ARG B 24 10.150 2.570 -36.349 1.00 33.58 C ATOM 1734 CD ARG B 24 10.371 2.729 -34.851 1.00 36.90 C ATOM 1735 NE ARG B 24 9.304 3.502 -34.195 1.00 39.40 N ATOM 1736 CZ ARG B 24 9.214 3.678 -32.877 1.00 36.98 C ATOM 1737 NH1 ARG B 24 10.112 3.135 -32.067 1.00 35.42 N ATOM 1738 NH2 ARG B 24 8.229 4.405 -32.368 1.00 38.26 N ATOM 0 H ARG B 24 10.130 5.608 -38.987 1.00 22.35 H new ATOM 0 HA ARG B 24 11.662 4.892 -36.850 1.00 25.23 H new ATOM 0 HB2 ARG B 24 9.439 4.489 -36.409 1.00 28.74 H new ATOM 0 HB3 ARG B 24 9.257 3.746 -37.768 1.00 28.74 H new ATOM 0 HG2 ARG B 24 9.402 1.971 -36.501 1.00 33.58 H new ATOM 0 HG3 ARG B 24 10.931 2.155 -36.746 1.00 33.58 H new ATOM 0 HD2 ARG B 24 10.427 1.851 -34.442 1.00 36.90 H new ATOM 0 HD3 ARG B 24 11.223 3.168 -34.699 1.00 36.90 H new ATOM 0 HE ARG B 24 8.702 3.862 -34.693 1.00 39.40 H new ATOM 0 HH11 ARG B 24 10.756 2.667 -32.391 1.00 35.42 H new ATOM 0 HH12 ARG B 24 10.050 3.251 -31.217 1.00 35.42 H new ATOM 0 HH21 ARG B 24 7.646 4.764 -32.889 1.00 38.26 H new ATOM 0 HH22 ARG B 24 8.173 4.517 -31.517 1.00 38.26 H new ATOM 1739 N ASP B 25 13.202 3.524 -38.145 1.00 23.20 N ATOM 1740 CA ASP B 25 14.102 2.705 -38.959 1.00 24.33 C ATOM 1741 C ASP B 25 14.760 1.669 -38.071 1.00 22.67 C ATOM 1742 O ASP B 25 15.601 2.017 -37.242 1.00 22.34 O ATOM 1743 CB ASP B 25 15.175 3.598 -39.610 1.00 24.78 C ATOM 1744 CG ASP B 25 16.260 2.793 -40.355 1.00 29.60 C ATOM 1745 OD1 ASP B 25 16.128 1.551 -40.558 1.00 30.05 O ATOM 1746 OD2 ASP B 25 17.265 3.419 -40.771 1.00 30.16 O ATOM 0 H ASP B 25 13.564 3.867 -37.444 1.00 23.20 H new ATOM 0 HA ASP B 25 13.599 2.261 -39.660 1.00 24.33 H new ATOM 0 HB2 ASP B 25 14.747 4.207 -40.232 1.00 24.78 H new ATOM 0 HB3 ASP B 25 15.596 4.141 -38.925 1.00 24.78 H new ATOM 1747 N ARG B 26 14.384 0.407 -38.241 1.00 21.97 N ATOM 1748 CA ARG B 26 14.921 -0.672 -37.388 1.00 23.07 C ATOM 1749 C ARG B 26 16.159 -1.376 -37.956 1.00 24.09 C ATOM 1750 O ARG B 26 16.714 -2.275 -37.318 1.00 25.03 O ATOM 1751 CB ARG B 26 13.845 -1.711 -37.117 1.00 25.20 C ATOM 1752 CG ARG B 26 12.586 -1.160 -36.487 1.00 30.16 C ATOM 1753 CD ARG B 26 11.430 -2.094 -36.793 1.00 33.67 C ATOM 1754 NE ARG B 26 10.178 -1.553 -36.295 1.00 37.35 N ATOM 1755 CZ ARG B 26 9.293 -0.903 -37.044 1.00 40.50 C ATOM 1756 NH1 ARG B 26 9.519 -0.714 -38.343 1.00 42.01 N ATOM 1757 NH2 ARG B 26 8.177 -0.441 -36.491 1.00 41.18 N ATOM 0 H ARG B 26 13.823 0.146 -38.838 1.00 21.97 H new ATOM 0 HA ARG B 26 15.202 -0.234 -36.569 1.00 23.07 H new ATOM 0 HB2 ARG B 26 13.612 -2.144 -37.953 1.00 25.20 H new ATOM 0 HB3 ARG B 26 14.211 -2.395 -36.535 1.00 25.20 H new ATOM 0 HG2 ARG B 26 12.702 -1.073 -35.528 1.00 30.16 H new ATOM 0 HG3 ARG B 26 12.400 -0.273 -36.832 1.00 30.16 H new ATOM 0 HD2 ARG B 26 11.368 -2.234 -37.751 1.00 33.67 H new ATOM 0 HD3 ARG B 26 11.595 -2.961 -36.390 1.00 33.67 H new ATOM 0 HE ARG B 26 9.997 -1.660 -35.461 1.00 37.35 H new ATOM 0 HH11 ARG B 26 10.241 -1.013 -38.702 1.00 42.01 H new ATOM 0 HH12 ARG B 26 8.943 -0.293 -38.823 1.00 42.01 H new ATOM 0 HH21 ARG B 26 8.030 -0.563 -35.652 1.00 41.18 H new ATOM 0 HH22 ARG B 26 7.601 -0.020 -36.972 1.00 41.18 H new ATOM 1758 N ASN B 27 16.595 -0.986 -39.143 1.00 23.49 N ATOM 1759 CA ASN B 27 17.800 -1.577 -39.732 1.00 25.20 C ATOM 1760 C ASN B 27 19.073 -1.345 -38.926 1.00 25.13 C ATOM 1761 O ASN B 27 19.249 -0.303 -38.299 1.00 23.95 O ATOM 1762 CB ASN B 27 18.025 -1.054 -41.165 1.00 25.30 C ATOM 1763 CG ASN B 27 17.081 -1.673 -42.170 1.00 27.31 C ATOM 1764 OD1 ASN B 27 16.304 -2.574 -41.836 1.00 27.92 O ATOM 1765 ND2 ASN B 27 17.133 -1.185 -43.417 1.00 25.30 N ATOM 0 H ASN B 27 16.215 -0.385 -39.626 1.00 23.49 H new ATOM 0 HA ASN B 27 17.630 -2.532 -39.733 1.00 25.20 H new ATOM 0 HB2 ASN B 27 17.914 -0.090 -41.174 1.00 25.30 H new ATOM 0 HB3 ASN B 27 18.940 -1.237 -41.432 1.00 25.30 H new ATOM 0 HD21 ASN B 27 16.611 -1.500 -44.024 1.00 25.30 H new ATOM 0 HD22 ASN B 27 17.688 -0.557 -43.610 1.00 25.30 H new ATOM 1766 N GLN B 28 19.972 -2.323 -38.988 1.00 25.20 N ATOM 1767 CA GLN B 28 21.327 -2.193 -38.480 1.00 26.91 C ATOM 1768 C GLN B 28 22.091 -1.162 -39.313 1.00 24.79 C ATOM 1769 O GLN B 28 21.999 -1.153 -40.530 1.00 24.17 O ATOM 1770 CB GLN B 28 22.018 -3.553 -38.602 1.00 31.16 C ATOM 1771 CG GLN B 28 23.441 -3.599 -38.076 1.00 36.65 C ATOM 1772 CD GLN B 28 24.140 -4.904 -38.434 1.00 40.69 C ATOM 1773 OE1 GLN B 28 23.501 -5.886 -38.835 1.00 43.17 O ATOM 1774 NE2 GLN B 28 25.455 -4.927 -38.268 1.00 42.94 N ATOM 0 H GLN B 28 19.806 -3.093 -39.333 1.00 25.20 H new ATOM 0 HA GLN B 28 21.310 -1.904 -37.554 1.00 26.91 H new ATOM 0 HB2 GLN B 28 21.490 -4.213 -38.126 1.00 31.16 H new ATOM 0 HB3 GLN B 28 22.024 -3.815 -39.536 1.00 31.16 H new ATOM 0 HG2 GLN B 28 23.944 -2.853 -38.440 1.00 36.65 H new ATOM 0 HG3 GLN B 28 23.432 -3.492 -37.112 1.00 36.65 H new ATOM 0 HE21 GLN B 28 25.865 -4.225 -37.988 1.00 42.94 H new ATOM 0 HE22 GLN B 28 25.898 -5.644 -38.441 1.00 42.94 H new ATOM 1775 N VAL B 29 22.821 -0.282 -38.645 1.00 24.14 N ATOM 1776 CA VAL B 29 23.682 0.675 -39.315 1.00 22.39 C ATOM 1777 C VAL B 29 25.121 0.165 -39.222 1.00 23.67 C ATOM 1778 O VAL B 29 25.513 -0.364 -38.190 1.00 23.19 O ATOM 1779 CB VAL B 29 23.537 2.060 -38.660 1.00 23.20 C ATOM 1780 CG1 VAL B 29 24.514 3.068 -39.259 1.00 24.11 C ATOM 1781 CG2 VAL B 29 22.093 2.555 -38.797 1.00 23.97 C ATOM 0 H VAL B 29 22.830 -0.224 -37.787 1.00 24.14 H new ATOM 0 HA VAL B 29 23.433 0.766 -40.248 1.00 22.39 H new ATOM 0 HB VAL B 29 23.753 1.973 -37.718 1.00 23.20 H new ATOM 0 HG11 VAL B 29 24.398 3.928 -38.826 1.00 24.11 H new ATOM 0 HG12 VAL B 29 25.423 2.758 -39.123 1.00 24.11 H new ATOM 0 HG13 VAL B 29 24.343 3.159 -40.209 1.00 24.11 H new ATOM 0 HG21 VAL B 29 22.009 3.428 -38.382 1.00 23.97 H new ATOM 0 HG22 VAL B 29 21.861 2.620 -39.737 1.00 23.97 H new ATOM 0 HG23 VAL B 29 21.494 1.931 -38.359 1.00 23.97 H new ATOM 1782 N GLU B 30 25.885 0.312 -40.304 1.00 23.47 N ATOM 1783 CA GLU B 30 27.324 0.035 -40.314 1.00 24.48 C ATOM 1784 C GLU B 30 28.010 1.058 -41.202 1.00 22.07 C ATOM 1785 O GLU B 30 27.365 1.714 -42.005 1.00 20.58 O ATOM 1786 CB GLU B 30 27.633 -1.357 -40.880 1.00 28.18 C ATOM 1787 CG GLU B 30 26.863 -2.505 -40.244 1.00 36.76 C ATOM 1788 CD GLU B 30 27.288 -3.877 -40.761 1.00 42.46 C ATOM 1789 OE1 GLU B 30 28.433 -4.018 -41.269 1.00 44.12 O ATOM 1790 OE2 GLU B 30 26.468 -4.821 -40.647 1.00 45.47 O ATOM 0 H GLU B 30 25.580 0.579 -41.062 1.00 23.47 H new ATOM 0 HA GLU B 30 27.642 0.078 -39.399 1.00 24.48 H new ATOM 0 HB2 GLU B 30 27.447 -1.351 -41.832 1.00 28.18 H new ATOM 0 HB3 GLU B 30 28.582 -1.528 -40.777 1.00 28.18 H new ATOM 0 HG2 GLU B 30 26.987 -2.476 -39.282 1.00 36.76 H new ATOM 0 HG3 GLU B 30 25.915 -2.383 -40.411 1.00 36.76 H new ATOM 1791 N GLY B 31 29.326 1.173 -41.079 1.00 21.28 N ATOM 1792 CA GLY B 31 30.098 2.025 -41.971 1.00 22.31 C ATOM 1793 C GLY B 31 30.242 3.464 -41.512 1.00 22.43 C ATOM 1794 O GLY B 31 29.513 3.929 -40.644 1.00 23.59 O ATOM 0 H GLY B 31 29.792 0.764 -40.483 1.00 21.28 H new ATOM 0 HA2 GLY B 31 30.983 1.643 -42.077 1.00 22.31 H new ATOM 0 HA3 GLY B 31 29.680 2.018 -42.846 1.00 22.31 H new ATOM 1795 N GLU B 32 31.165 4.175 -42.146 1.00 21.72 N ATOM 1796 CA GLU B 32 31.514 5.537 -41.764 1.00 21.78 C ATOM 1797 C GLU B 32 30.679 6.587 -42.492 1.00 19.40 C ATOM 1798 O GLU B 32 30.563 7.728 -42.032 1.00 19.09 O ATOM 1799 CB GLU B 32 32.996 5.781 -42.067 1.00 24.77 C ATOM 1800 CG GLU B 32 33.952 4.924 -41.251 1.00 28.61 C ATOM 1801 CD GLU B 32 34.394 3.639 -41.954 1.00 32.66 C ATOM 1802 OE1 GLU B 32 33.606 3.007 -42.707 1.00 30.37 O ATOM 1803 OE2 GLU B 32 35.559 3.246 -41.728 1.00 37.68 O ATOM 0 H GLU B 32 31.612 3.877 -42.818 1.00 21.72 H new ATOM 0 HA GLU B 32 31.331 5.626 -40.816 1.00 21.78 H new ATOM 0 HB2 GLU B 32 33.154 5.615 -43.010 1.00 24.77 H new ATOM 0 HB3 GLU B 32 33.199 6.716 -41.906 1.00 24.77 H new ATOM 0 HG2 GLU B 32 34.738 5.450 -41.035 1.00 28.61 H new ATOM 0 HG3 GLU B 32 33.526 4.692 -40.411 1.00 28.61 H new ATOM 1804 N VAL B 33 30.149 6.204 -43.654 1.00 16.04 N ATOM 1805 CA VAL B 33 29.407 7.114 -44.530 1.00 15.16 C ATOM 1806 C VAL B 33 28.058 6.477 -44.825 1.00 13.64 C ATOM 1807 O VAL B 33 27.996 5.318 -45.253 1.00 13.35 O ATOM 1808 CB VAL B 33 30.174 7.375 -45.847 1.00 14.88 C ATOM 1809 CG1 VAL B 33 29.376 8.260 -46.806 1.00 14.72 C ATOM 1810 CG2 VAL B 33 31.521 8.015 -45.543 1.00 15.59 C ATOM 0 H VAL B 33 30.210 5.402 -43.959 1.00 16.04 H new ATOM 0 HA VAL B 33 29.293 7.971 -44.090 1.00 15.16 H new ATOM 0 HB VAL B 33 30.311 6.520 -46.284 1.00 14.88 H new ATOM 0 HG11 VAL B 33 29.888 8.401 -47.618 1.00 14.72 H new ATOM 0 HG12 VAL B 33 28.537 7.826 -47.025 1.00 14.72 H new ATOM 0 HG13 VAL B 33 29.197 9.115 -46.384 1.00 14.72 H new ATOM 0 HG21 VAL B 33 31.997 8.176 -46.372 1.00 15.59 H new ATOM 0 HG22 VAL B 33 31.383 8.857 -45.081 1.00 15.59 H new ATOM 0 HG23 VAL B 33 32.043 7.420 -44.981 1.00 15.59 H new ATOM 1811 N GLN B 34 26.985 7.231 -44.623 1.00 12.77 N ATOM 1812 CA GLN B 34 25.647 6.711 -44.906 1.00 12.84 C ATOM 1813 C GLN B 34 25.151 7.363 -46.181 1.00 12.35 C ATOM 1814 O GLN B 34 25.396 8.546 -46.401 1.00 12.10 O ATOM 1815 CB GLN B 34 24.670 7.009 -43.748 1.00 13.46 C ATOM 1816 CG GLN B 34 25.125 6.476 -42.384 1.00 14.41 C ATOM 1817 CD GLN B 34 25.464 4.998 -42.456 1.00 15.34 C ATOM 1818 OE1 GLN B 34 24.655 4.192 -42.925 1.00 15.60 O ATOM 1819 NE2 GLN B 34 26.683 4.638 -42.039 1.00 15.69 N ATOM 0 H GLN B 34 27.005 8.038 -44.326 1.00 12.77 H new ATOM 0 HA GLN B 34 25.692 5.747 -45.007 1.00 12.84 H new ATOM 0 HB2 GLN B 34 24.545 7.969 -43.683 1.00 13.46 H new ATOM 0 HB3 GLN B 34 23.805 6.625 -43.961 1.00 13.46 H new ATOM 0 HG2 GLN B 34 25.901 6.974 -42.082 1.00 14.41 H new ATOM 0 HG3 GLN B 34 24.424 6.618 -41.729 1.00 14.41 H new ATOM 0 HE21 GLN B 34 27.219 5.229 -41.718 1.00 15.69 H new ATOM 0 HE22 GLN B 34 26.930 3.816 -42.092 1.00 15.69 H new ATOM 1820 N VAL B 35 24.458 6.598 -47.019 1.00 11.32 N ATOM 1821 CA VAL B 35 23.756 7.160 -48.158 1.00 11.25 C ATOM 1822 C VAL B 35 22.361 7.416 -47.613 1.00 11.24 C ATOM 1823 O VAL B 35 21.729 6.495 -47.068 1.00 11.97 O ATOM 1824 CB VAL B 35 23.635 6.153 -49.330 1.00 11.93 C ATOM 1825 CG1 VAL B 35 22.900 6.777 -50.515 1.00 12.05 C ATOM 1826 CG2 VAL B 35 25.004 5.654 -49.766 1.00 12.07 C ATOM 0 H VAL B 35 24.384 5.745 -46.941 1.00 11.32 H new ATOM 0 HA VAL B 35 24.216 7.940 -48.506 1.00 11.25 H new ATOM 0 HB VAL B 35 23.119 5.395 -49.012 1.00 11.93 H new ATOM 0 HG11 VAL B 35 22.837 6.129 -51.234 1.00 12.05 H new ATOM 0 HG12 VAL B 35 22.008 7.042 -50.240 1.00 12.05 H new ATOM 0 HG13 VAL B 35 23.387 7.556 -50.824 1.00 12.05 H new ATOM 0 HG21 VAL B 35 24.902 5.027 -50.499 1.00 12.07 H new ATOM 0 HG22 VAL B 35 25.545 6.405 -50.057 1.00 12.07 H new ATOM 0 HG23 VAL B 35 25.440 5.212 -49.021 1.00 12.07 H new ATOM 1827 N VAL B 36 21.885 8.654 -47.722 1.00 11.34 N ATOM 1828 CA VAL B 36 20.614 9.042 -47.100 1.00 12.28 C ATOM 1829 C VAL B 36 19.691 9.646 -48.139 1.00 13.11 C ATOM 1830 O VAL B 36 20.140 10.113 -49.190 1.00 13.44 O ATOM 1831 CB VAL B 36 20.788 10.013 -45.900 1.00 12.74 C ATOM 1832 CG1 VAL B 36 21.646 9.374 -44.795 1.00 12.76 C ATOM 1833 CG2 VAL B 36 21.436 11.327 -46.331 1.00 12.64 C ATOM 0 H VAL B 36 22.280 9.286 -48.151 1.00 11.34 H new ATOM 0 HA VAL B 36 20.220 8.232 -46.740 1.00 12.28 H new ATOM 0 HB VAL B 36 19.900 10.197 -45.557 1.00 12.74 H new ATOM 0 HG11 VAL B 36 21.741 9.997 -44.058 1.00 12.76 H new ATOM 0 HG12 VAL B 36 21.217 8.563 -44.480 1.00 12.76 H new ATOM 0 HG13 VAL B 36 22.522 9.158 -45.150 1.00 12.76 H new ATOM 0 HG21 VAL B 36 21.530 11.909 -45.561 1.00 12.64 H new ATOM 0 HG22 VAL B 36 22.311 11.148 -46.709 1.00 12.64 H new ATOM 0 HG23 VAL B 36 20.879 11.760 -46.997 1.00 12.64 H new ATOM 1834 N SER B 37 18.399 9.608 -47.870 1.00 13.94 N ATOM 1835 CA SER B 37 17.431 10.098 -48.835 1.00 15.29 C ATOM 1836 C SER B 37 16.211 10.622 -48.107 1.00 16.44 C ATOM 1837 O SER B 37 15.853 10.140 -47.014 1.00 14.52 O ATOM 1838 CB SER B 37 17.027 8.974 -49.807 1.00 17.32 C ATOM 1839 OG SER B 37 16.121 9.424 -50.827 1.00 19.95 O ATOM 0 H SER B 37 18.062 9.305 -47.139 1.00 13.94 H new ATOM 0 HA SER B 37 17.831 10.817 -49.348 1.00 15.29 H new ATOM 0 HB2 SER B 37 17.824 8.610 -50.224 1.00 17.32 H new ATOM 0 HB3 SER B 37 16.614 8.252 -49.308 1.00 17.32 H new ATOM 0 HG SER B 37 15.410 9.695 -50.471 1.00 19.95 H new ATOM 1840 N THR B 38 15.599 11.635 -48.709 1.00 18.37 N ATOM 1841 CA THR B 38 14.246 12.014 -48.363 1.00 21.30 C ATOM 1842 C THR B 38 13.367 11.483 -49.480 1.00 23.62 C ATOM 1843 O THR B 38 13.834 10.722 -50.333 1.00 23.85 O ATOM 1844 CB THR B 38 14.104 13.540 -48.274 1.00 22.31 C ATOM 1845 OG1 THR B 38 14.336 14.108 -49.563 1.00 21.96 O ATOM 1846 CG2 THR B 38 15.098 14.115 -47.297 1.00 22.80 C ATOM 0 H THR B 38 15.957 12.116 -49.325 1.00 18.37 H new ATOM 0 HA THR B 38 13.998 11.653 -47.497 1.00 21.30 H new ATOM 0 HB THR B 38 13.208 13.750 -47.967 1.00 22.31 H new ATOM 0 HG1 THR B 38 14.180 14.933 -49.538 1.00 21.96 H new ATOM 0 HG21 THR B 38 14.992 15.078 -47.256 1.00 22.80 H new ATOM 0 HG22 THR B 38 14.944 13.735 -46.418 1.00 22.80 H new ATOM 0 HG23 THR B 38 15.998 13.902 -47.588 1.00 22.80 H new ATOM 1847 N ALA B 39 12.099 11.886 -49.498 1.00 26.10 N ATOM 1848 CA ALA B 39 11.206 11.476 -50.590 1.00 26.00 C ATOM 1849 C ALA B 39 11.569 12.170 -51.894 1.00 26.71 C ATOM 1850 O ALA B 39 11.153 11.723 -52.964 1.00 27.87 O ATOM 1851 CB ALA B 39 9.743 11.745 -50.228 1.00 29.24 C ATOM 0 H ALA B 39 11.737 12.388 -48.901 1.00 26.10 H new ATOM 0 HA ALA B 39 11.320 10.521 -50.718 1.00 26.00 H new ATOM 0 HB1 ALA B 39 9.172 11.468 -50.961 1.00 29.24 H new ATOM 0 HB2 ALA B 39 9.510 11.245 -49.430 1.00 29.24 H new ATOM 0 HB3 ALA B 39 9.619 12.693 -50.063 1.00 29.24 H new ATOM 1852 N THR B 40 12.347 13.252 -51.832 1.00 23.95 N ATOM 1853 CA THR B 40 12.691 13.964 -53.066 1.00 24.76 C ATOM 1854 C THR B 40 14.177 13.988 -53.470 1.00 23.01 C ATOM 1855 O THR B 40 14.482 14.249 -54.633 1.00 22.65 O ATOM 1856 CB THR B 40 12.128 15.404 -53.108 1.00 28.66 C ATOM 1857 OG1 THR B 40 12.844 16.226 -52.181 1.00 33.09 O ATOM 1858 CG2 THR B 40 10.616 15.430 -52.777 1.00 30.83 C ATOM 0 H THR B 40 12.677 13.583 -51.110 1.00 23.95 H new ATOM 0 HA THR B 40 12.251 13.410 -53.730 1.00 24.76 H new ATOM 0 HB THR B 40 12.242 15.748 -54.008 1.00 28.66 H new ATOM 0 HG1 THR B 40 13.110 15.756 -51.537 1.00 33.09 H new ATOM 0 HG21 THR B 40 10.293 16.344 -52.811 1.00 30.83 H new ATOM 0 HG22 THR B 40 10.134 14.892 -53.424 1.00 30.83 H new ATOM 0 HG23 THR B 40 10.473 15.070 -51.888 1.00 30.83 H new ATOM 1859 N GLN B 41 15.108 13.719 -52.550 1.00 20.02 N ATOM 1860 CA GLN B 41 16.524 13.836 -52.945 1.00 18.48 C ATOM 1861 C GLN B 41 17.411 12.925 -52.116 1.00 16.15 C ATOM 1862 O GLN B 41 17.038 12.557 -51.005 1.00 16.81 O ATOM 1863 CB GLN B 41 17.008 15.286 -52.830 1.00 20.04 C ATOM 1864 CG GLN B 41 16.873 15.911 -51.453 1.00 22.59 C ATOM 1865 CD GLN B 41 16.591 17.405 -51.542 1.00 25.56 C ATOM 1866 OE1 GLN B 41 16.090 17.890 -52.557 1.00 26.28 O ATOM 1867 NE2 GLN B 41 16.919 18.137 -50.490 1.00 28.12 N ATOM 0 H GLN B 41 14.959 13.481 -51.737 1.00 20.02 H new ATOM 0 HA GLN B 41 16.587 13.558 -53.872 1.00 18.48 H new ATOM 0 HB2 GLN B 41 17.941 15.321 -53.094 1.00 20.04 H new ATOM 0 HB3 GLN B 41 16.513 15.828 -53.464 1.00 20.04 H new ATOM 0 HG2 GLN B 41 16.156 15.474 -50.967 1.00 22.59 H new ATOM 0 HG3 GLN B 41 17.688 15.764 -50.949 1.00 22.59 H new ATOM 0 HE21 GLN B 41 17.267 17.764 -49.798 1.00 28.12 H new ATOM 0 HE22 GLN B 41 16.784 18.986 -50.498 1.00 28.12 H new ATOM 1868 N SER B 42 18.568 12.581 -52.654 1.00 14.51 N ATOM 1869 CA SER B 42 19.513 11.735 -51.938 1.00 13.61 C ATOM 1870 C SER B 42 20.924 12.331 -51.968 1.00 12.61 C ATOM 1871 O SER B 42 21.254 13.145 -52.846 1.00 12.43 O ATOM 1872 CB SER B 42 19.499 10.315 -52.494 1.00 13.12 C ATOM 1873 OG SER B 42 20.053 10.298 -53.806 1.00 14.25 O ATOM 0 H SER B 42 18.829 12.827 -53.436 1.00 14.51 H new ATOM 0 HA SER B 42 19.234 11.694 -51.010 1.00 13.61 H new ATOM 0 HB2 SER B 42 20.007 9.727 -51.913 1.00 13.12 H new ATOM 0 HB3 SER B 42 18.590 9.977 -52.515 1.00 13.12 H new ATOM 0 HG SER B 42 19.441 10.412 -54.370 1.00 14.25 H new ATOM 1874 N PHE B 43 21.735 11.922 -50.989 1.00 11.65 N ATOM 1875 CA PHE B 43 23.023 12.558 -50.705 1.00 11.89 C ATOM 1876 C PHE B 43 23.724 11.718 -49.625 1.00 11.91 C ATOM 1877 O PHE B 43 23.276 10.597 -49.313 1.00 12.27 O ATOM 1878 CB PHE B 43 22.862 14.056 -50.318 1.00 11.97 C ATOM 1879 CG PHE B 43 21.881 14.302 -49.191 1.00 12.40 C ATOM 1880 CD1 PHE B 43 20.507 14.401 -49.452 1.00 12.54 C ATOM 1881 CD2 PHE B 43 22.324 14.424 -47.883 1.00 12.54 C ATOM 1882 CE1 PHE B 43 19.597 14.613 -48.420 1.00 12.88 C ATOM 1883 CE2 PHE B 43 21.414 14.631 -46.839 1.00 12.48 C ATOM 1884 CZ PHE B 43 20.052 14.716 -47.117 1.00 12.32 C ATOM 0 H PHE B 43 21.551 11.263 -50.468 1.00 11.65 H new ATOM 0 HA PHE B 43 23.577 12.577 -51.501 1.00 11.89 H new ATOM 0 HB2 PHE B 43 23.729 14.409 -50.062 1.00 11.97 H new ATOM 0 HB3 PHE B 43 22.573 14.553 -51.100 1.00 11.97 H new ATOM 0 HD1 PHE B 43 20.199 14.324 -50.326 1.00 12.54 H new ATOM 0 HD2 PHE B 43 23.234 14.368 -47.697 1.00 12.54 H new ATOM 0 HE1 PHE B 43 18.688 14.685 -48.605 1.00 12.88 H new ATOM 0 HE2 PHE B 43 21.718 14.711 -45.964 1.00 12.48 H new ATOM 0 HZ PHE B 43 19.445 14.843 -46.424 1.00 12.32 H new ATOM 1885 N LEU B 44 24.820 12.223 -49.066 1.00 11.56 N ATOM 1886 CA LEU B 44 25.638 11.426 -48.159 1.00 11.76 C ATOM 1887 C LEU B 44 25.693 12.081 -46.796 1.00 12.15 C ATOM 1888 O LEU B 44 25.479 13.283 -46.692 1.00 12.24 O ATOM 1889 CB LEU B 44 27.074 11.250 -48.683 1.00 11.86 C ATOM 1890 CG LEU B 44 27.256 10.476 -50.005 1.00 11.53 C ATOM 1891 CD1 LEU B 44 28.751 10.442 -50.354 1.00 11.64 C ATOM 1892 CD2 LEU B 44 26.688 9.067 -49.908 1.00 11.41 C ATOM 0 H LEU B 44 25.106 13.023 -49.199 1.00 11.56 H new ATOM 0 HA LEU B 44 25.224 10.551 -48.097 1.00 11.76 H new ATOM 0 HB2 LEU B 44 27.462 12.132 -48.796 1.00 11.86 H new ATOM 0 HB3 LEU B 44 27.590 10.798 -47.997 1.00 11.86 H new ATOM 0 HG LEU B 44 26.766 10.929 -50.709 1.00 11.53 H new ATOM 0 HD11 LEU B 44 28.879 9.957 -51.184 1.00 11.64 H new ATOM 0 HD12 LEU B 44 29.081 11.349 -50.455 1.00 11.64 H new ATOM 0 HD13 LEU B 44 29.239 9.998 -49.643 1.00 11.64 H new ATOM 0 HD21 LEU B 44 26.817 8.607 -50.752 1.00 11.41 H new ATOM 0 HD22 LEU B 44 27.144 8.582 -49.203 1.00 11.41 H new ATOM 0 HD23 LEU B 44 25.740 9.113 -49.707 1.00 11.41 H new ATOM 1893 N ALA B 45 25.951 11.281 -45.764 1.00 12.41 N ATOM 1894 CA ALA B 45 26.182 11.806 -44.429 1.00 13.90 C ATOM 1895 C ALA B 45 27.414 11.072 -43.911 1.00 15.57 C ATOM 1896 O ALA B 45 27.607 9.882 -44.206 1.00 16.70 O ATOM 1897 CB ALA B 45 24.961 11.566 -43.531 1.00 13.97 C ATOM 0 H ALA B 45 25.996 10.424 -45.821 1.00 12.41 H new ATOM 0 HA ALA B 45 26.323 12.766 -44.435 1.00 13.90 H new ATOM 0 HB1 ALA B 45 25.135 11.923 -42.646 1.00 13.97 H new ATOM 0 HB2 ALA B 45 24.187 12.009 -43.912 1.00 13.97 H new ATOM 0 HB3 ALA B 45 24.788 10.614 -43.467 1.00 13.97 H new ATOM 1898 N THR B 46 28.263 11.780 -43.180 1.00 15.71 N ATOM 1899 CA THR B 46 29.537 11.234 -42.729 1.00 16.61 C ATOM 1900 C THR B 46 29.604 11.284 -41.193 1.00 17.97 C ATOM 1901 O THR B 46 29.327 12.338 -40.599 1.00 16.46 O ATOM 1902 CB THR B 46 30.673 12.117 -43.293 1.00 18.27 C ATOM 1903 OG1 THR B 46 30.627 12.103 -44.724 1.00 19.38 O ATOM 1904 CG2 THR B 46 32.031 11.632 -42.831 1.00 19.67 C ATOM 0 H THR B 46 28.118 12.590 -42.931 1.00 15.71 H new ATOM 0 HA THR B 46 29.626 10.317 -43.033 1.00 16.61 H new ATOM 0 HB THR B 46 30.543 13.020 -42.963 1.00 18.27 H new ATOM 0 HG1 THR B 46 30.089 12.689 -44.993 1.00 19.38 H new ATOM 0 HG21 THR B 46 32.722 12.204 -43.200 1.00 19.67 H new ATOM 0 HG22 THR B 46 32.072 11.659 -41.862 1.00 19.67 H new ATOM 0 HG23 THR B 46 32.170 10.721 -43.134 1.00 19.67 H new ATOM 1905 N ACYS B 47 29.963 10.169 -40.555 0.58 18.03 N ATOM 1906 CA ACYS B 47 30.068 10.132 -39.097 0.58 19.33 C ATOM 1907 C ACYS B 47 31.473 10.507 -38.618 0.58 19.42 C ATOM 1908 O ACYS B 47 32.456 9.842 -38.963 0.58 19.26 O ATOM 1909 CB ACYS B 47 29.634 8.776 -38.556 0.58 21.31 C ATOM 1910 SG ACYS B 47 27.882 8.455 -38.860 0.58 26.06 S ATOM 1911 N BCYS B 47 29.969 10.162 -40.576 0.42 18.23 N ATOM 1912 CA BCYS B 47 30.125 10.090 -39.134 0.42 19.45 C ATOM 1913 C BCYS B 47 31.511 10.586 -38.721 0.42 19.39 C ATOM 1914 O BCYS B 47 32.525 10.068 -39.203 0.42 19.01 O ATOM 1915 CB BCYS B 47 29.921 8.662 -38.654 0.42 21.32 C ATOM 1916 SG BCYS B 47 29.673 8.554 -36.876 0.42 25.80 S ATOM 0 H ACYS B 47 30.149 9.426 -40.947 0.58 18.23 H new ATOM 0 H BCYS B 47 30.132 9.424 -40.985 0.42 18.23 H new ATOM 0 HA ACYS B 47 29.462 10.801 -38.742 0.58 19.45 H new ATOM 0 HA BCYS B 47 29.455 10.659 -38.724 0.42 19.45 H new ATOM 0 HB2ACYS B 47 30.166 8.078 -38.969 0.58 21.32 H new ATOM 0 HB2BCYS B 47 29.154 8.279 -39.107 0.42 21.32 H new ATOM 0 HB3ACYS B 47 29.808 8.738 -37.603 0.58 21.32 H new ATOM 0 HB3BCYS B 47 30.692 8.128 -38.902 0.42 21.32 H new ATOM 0 HG ACYS B 47 27.447 7.751 -37.991 0.58 25.80 H new ATOM 0 HG BCYS B 47 30.541 9.161 -36.313 0.42 25.80 H new ATOM 1917 N VAL B 48 31.544 11.600 -37.853 1.00 18.91 N ATOM 1918 CA VAL B 48 32.808 12.133 -37.287 1.00 19.66 C ATOM 1919 C VAL B 48 32.593 12.394 -35.786 1.00 20.75 C ATOM 1920 O VAL B 48 31.688 13.126 -35.406 1.00 19.37 O ATOM 1921 CB VAL B 48 33.295 13.420 -38.003 1.00 20.50 C ATOM 1922 CG1 VAL B 48 34.690 13.819 -37.518 1.00 20.72 C ATOM 1923 CG2 VAL B 48 33.320 13.238 -39.524 1.00 20.41 C ATOM 0 H AVAL B 48 30.853 12.065 -37.641 0.58 18.91 H new ATOM 0 H BVAL B 48 30.839 12.004 -37.571 0.42 18.91 H new ATOM 0 HA VAL B 48 33.506 11.473 -37.424 1.00 19.66 H new ATOM 0 HB VAL B 48 32.666 14.125 -37.784 1.00 20.50 H new ATOM 0 HG11 VAL B 48 34.975 14.624 -37.978 1.00 20.72 H new ATOM 0 HG12 VAL B 48 34.666 13.984 -36.562 1.00 20.72 H new ATOM 0 HG13 VAL B 48 35.316 13.102 -37.706 1.00 20.72 H new ATOM 0 HG21 VAL B 48 33.628 14.057 -39.943 1.00 20.41 H new ATOM 0 HG22 VAL B 48 33.921 12.512 -39.753 1.00 20.41 H new ATOM 0 HG23 VAL B 48 32.427 13.030 -39.840 1.00 20.41 H new ATOM 1924 N ASN B 49 33.390 11.744 -34.940 1.00 23.75 N ATOM 1925 CA ASN B 49 33.268 11.878 -33.475 1.00 24.74 C ATOM 1926 C ASN B 49 31.850 11.696 -32.917 1.00 24.21 C ATOM 1927 O ASN B 49 31.373 12.516 -32.133 1.00 25.00 O ATOM 1928 CB ASN B 49 33.867 13.212 -33.014 1.00 28.84 C ATOM 1929 CG ASN B 49 35.389 13.186 -32.983 1.00 32.47 C ATOM 1930 OD1 ASN B 49 36.016 12.142 -33.214 1.00 33.90 O ATOM 1931 ND2 ASN B 49 35.991 14.332 -32.691 1.00 34.60 N ATOM 0 H ASN B 49 34.017 11.212 -35.192 1.00 23.75 H new ATOM 0 HA ASN B 49 33.774 11.137 -33.107 1.00 24.74 H new ATOM 0 HB2 ASN B 49 33.570 13.919 -33.608 1.00 28.84 H new ATOM 0 HB3 ASN B 49 33.532 13.425 -32.129 1.00 28.84 H new ATOM 0 HD21 ASN B 49 36.849 14.370 -32.656 1.00 34.60 H new ATOM 0 HD22 ASN B 49 35.523 15.037 -32.536 1.00 34.60 H new ATOM 1932 N GLY B 50 31.177 10.631 -33.348 1.00 22.51 N ATOM 1933 CA GLY B 50 29.867 10.266 -32.810 1.00 21.50 C ATOM 1934 C GLY B 50 28.730 11.148 -33.289 1.00 20.48 C ATOM 1935 O GLY B 50 27.625 11.089 -32.752 1.00 21.94 O ATOM 0 H GLY B 50 31.466 10.100 -33.960 1.00 22.51 H new ATOM 0 HA2 GLY B 50 29.674 9.347 -33.052 1.00 21.50 H new ATOM 0 HA3 GLY B 50 29.905 10.302 -31.841 1.00 21.50 H new ATOM 1936 N VAL B 51 28.992 11.960 -34.306 1.00 18.83 N ATOM 1937 CA VAL B 51 27.945 12.767 -34.932 1.00 18.51 C ATOM 1938 C VAL B 51 27.894 12.427 -36.420 1.00 18.03 C ATOM 1939 O VAL B 51 28.908 12.337 -37.060 1.00 18.48 O ATOM 1940 CB VAL B 51 28.184 14.283 -34.749 1.00 18.04 C ATOM 1941 CG1 VAL B 51 27.137 15.101 -35.505 1.00 16.99 C ATOM 1942 CG2 VAL B 51 28.136 14.658 -33.265 1.00 20.29 C ATOM 0 H VAL B 51 29.773 12.060 -34.652 1.00 18.83 H new ATOM 0 HA VAL B 51 27.101 12.559 -34.501 1.00 18.51 H new ATOM 0 HB VAL B 51 29.062 14.486 -35.108 1.00 18.04 H new ATOM 0 HG11 VAL B 51 27.309 16.047 -35.374 1.00 16.99 H new ATOM 0 HG12 VAL B 51 27.184 14.892 -36.451 1.00 16.99 H new ATOM 0 HG13 VAL B 51 26.253 14.884 -35.170 1.00 16.99 H new ATOM 0 HG21 VAL B 51 28.288 15.611 -33.167 1.00 20.29 H new ATOM 0 HG22 VAL B 51 27.266 14.430 -32.901 1.00 20.29 H new ATOM 0 HG23 VAL B 51 28.824 14.171 -32.785 1.00 20.29 H new ATOM 1943 N BCYS B 52 26.690 12.183 -36.941 0.34 18.04 N ATOM 1944 CA BCYS B 52 26.476 12.043 -38.382 0.34 17.35 C ATOM 1945 C BCYS B 52 26.199 13.407 -38.987 0.34 16.76 C ATOM 1946 O BCYS B 52 25.152 14.007 -38.732 0.34 16.16 O ATOM 1947 CB BCYS B 52 25.303 11.110 -38.681 0.34 18.37 C ATOM 1948 SG BCYS B 52 25.735 9.362 -38.681 0.34 19.30 S ATOM 1949 N CCYS B 52 26.689 12.263 -36.931 0.66 19.18 N ATOM 1950 CA CCYS B 52 26.465 12.039 -38.325 0.66 18.61 C ATOM 1951 C CCYS B 52 26.190 13.400 -38.987 0.66 17.58 C ATOM 1952 O CCYS B 52 25.133 14.000 -38.756 0.66 16.38 O ATOM 1953 CB CCYS B 52 25.269 11.108 -38.421 0.66 21.51 C ATOM 1954 SG CCYS B 52 24.788 10.757 -40.091 0.66 25.03 S ATOM 0 H BCYS B 52 25.976 12.094 -36.470 0.34 19.18 H new ATOM 0 H CCYS B 52 25.969 12.281 -36.461 0.66 19.18 H new ATOM 0 HA BCYS B 52 27.278 11.660 -38.771 0.34 18.61 H new ATOM 0 HA CCYS B 52 27.224 11.637 -38.776 0.66 18.61 H new ATOM 0 HB2BCYS B 52 24.606 11.261 -38.023 0.34 21.51 H new ATOM 0 HB2CCYS B 52 25.478 10.275 -37.969 0.66 21.51 H new ATOM 0 HB3BCYS B 52 24.931 11.341 -39.546 0.34 21.51 H new ATOM 0 HB3CCYS B 52 24.519 11.505 -37.951 0.66 21.51 H new ATOM 0 HG BCYS B 52 24.815 8.722 -39.110 0.34 25.03 H new ATOM 0 HG CCYS B 52 23.843 10.018 -40.089 0.66 25.03 H new ATOM 1955 N TRP B 53 27.134 13.874 -39.807 1.00 15.79 N ATOM 1956 CA TRP B 53 27.067 15.215 -40.408 1.00 15.73 C ATOM 1957 C TRP B 53 26.649 15.189 -41.839 1.00 14.93 C ATOM 1958 O TRP B 53 27.069 14.317 -42.602 1.00 14.70 O ATOM 1959 CB TRP B 53 28.440 15.861 -40.388 1.00 16.22 C ATOM 1960 CG TRP B 53 29.016 16.053 -39.017 1.00 17.98 C ATOM 1961 CD1 TRP B 53 29.906 15.227 -38.350 1.00 18.37 C ATOM 1962 CD2 TRP B 53 28.762 17.171 -38.089 1.00 18.51 C ATOM 1963 NE1 TRP B 53 30.206 15.743 -37.103 1.00 18.70 N ATOM 1964 CE2 TRP B 53 29.567 16.907 -36.898 1.00 19.04 C ATOM 1965 CE3 TRP B 53 27.960 18.311 -38.124 1.00 18.87 C ATOM 1966 CZ2 TRP B 53 29.552 17.763 -35.786 1.00 20.74 C ATOM 1967 CZ3 TRP B 53 27.963 19.170 -37.009 1.00 19.52 C ATOM 1968 CH2 TRP B 53 28.749 18.903 -35.875 1.00 19.99 C ATOM 0 H BTRP B 53 27.831 13.424 -40.035 0.34 15.79 H new ATOM 0 H CTRP B 53 27.833 13.427 -40.032 0.66 15.79 H new ATOM 0 HA TRP B 53 26.414 15.705 -39.884 1.00 15.73 H new ATOM 0 HB2 TRP B 53 29.049 15.315 -40.909 1.00 16.22 H new ATOM 0 HB3 TRP B 53 28.386 16.724 -40.827 1.00 16.22 H new ATOM 0 HD1 TRP B 53 30.253 14.436 -38.693 1.00 18.37 H new ATOM 0 HE1 TRP B 53 30.732 15.369 -36.534 1.00 18.70 H new ATOM 0 HE3 TRP B 53 27.435 18.500 -38.868 1.00 18.87 H new ATOM 0 HZ2 TRP B 53 30.054 17.580 -35.025 1.00 20.74 H new ATOM 0 HZ3 TRP B 53 27.432 19.933 -37.023 1.00 19.52 H new ATOM 0 HH2 TRP B 53 28.734 19.502 -35.164 1.00 19.99 H new ATOM 1969 N THR B 54 25.849 16.167 -42.241 1.00 14.29 N ATOM 1970 CA THR B 54 25.533 16.299 -43.653 1.00 13.93 C ATOM 1971 C THR B 54 25.286 17.752 -44.025 1.00 13.83 C ATOM 1972 O THR B 54 25.455 18.672 -43.196 1.00 13.73 O ATOM 1973 CB THR B 54 24.355 15.362 -44.065 1.00 13.96 C ATOM 1974 OG1 THR B 54 24.279 15.306 -45.490 1.00 14.58 O ATOM 1975 CG2 THR B 54 23.031 15.877 -43.530 1.00 13.85 C ATOM 0 H THR B 54 25.486 16.752 -41.725 1.00 14.29 H new ATOM 0 HA THR B 54 26.304 16.007 -44.163 1.00 13.93 H new ATOM 0 HB THR B 54 24.522 14.482 -43.692 1.00 13.96 H new ATOM 0 HG1 THR B 54 24.544 14.555 -45.756 1.00 14.58 H new ATOM 0 HG21 THR B 54 22.318 15.278 -43.800 1.00 13.85 H new ATOM 0 HG22 THR B 54 23.068 15.920 -42.562 1.00 13.85 H new ATOM 0 HG23 THR B 54 22.860 16.763 -43.886 1.00 13.85 H new ATOM 1976 N VAL B 55 24.907 17.962 -45.276 1.00 14.30 N ATOM 1977 CA VAL B 55 24.636 19.305 -45.768 1.00 14.30 C ATOM 1978 C VAL B 55 23.215 19.740 -45.466 1.00 14.13 C ATOM 1979 O VAL B 55 22.262 18.990 -45.663 1.00 12.54 O ATOM 1980 CB VAL B 55 24.842 19.403 -47.303 1.00 14.61 C ATOM 1981 CG1 VAL B 55 26.334 19.449 -47.625 1.00 14.97 C ATOM 1982 CG2 VAL B 55 24.174 18.232 -48.013 1.00 14.47 C ATOM 0 H VAL B 55 24.800 17.339 -45.859 1.00 14.30 H new ATOM 0 HA VAL B 55 25.263 19.886 -45.309 1.00 14.30 H new ATOM 0 HB VAL B 55 24.428 20.220 -47.621 1.00 14.61 H new ATOM 0 HG11 VAL B 55 26.456 19.510 -48.585 1.00 14.97 H new ATOM 0 HG12 VAL B 55 26.734 20.223 -47.199 1.00 14.97 H new ATOM 0 HG13 VAL B 55 26.761 18.643 -47.296 1.00 14.97 H new ATOM 0 HG21 VAL B 55 24.314 18.311 -48.970 1.00 14.47 H new ATOM 0 HG22 VAL B 55 24.560 17.400 -47.698 1.00 14.47 H new ATOM 0 HG23 VAL B 55 23.223 18.239 -47.824 1.00 14.47 H new ATOM 1983 N TYR B 56 23.090 20.996 -45.048 1.00 14.84 N ATOM 1984 CA TYR B 56 21.777 21.612 -44.847 1.00 16.92 C ATOM 1985 C TYR B 56 20.961 21.677 -46.152 1.00 17.52 C ATOM 1986 O TYR B 56 19.743 21.477 -46.136 1.00 16.66 O ATOM 1987 CB TYR B 56 21.942 22.997 -44.181 1.00 18.62 C ATOM 1988 CG TYR B 56 20.620 23.685 -43.952 1.00 20.78 C ATOM 1989 CD1 TYR B 56 19.823 23.349 -42.861 1.00 21.79 C ATOM 1990 CD2 TYR B 56 20.156 24.651 -44.842 1.00 23.39 C ATOM 1991 CE1 TYR B 56 18.599 23.973 -42.650 1.00 23.91 C ATOM 1992 CE2 TYR B 56 18.930 25.274 -44.643 1.00 26.01 C ATOM 1993 CZ TYR B 56 18.160 24.922 -43.546 1.00 26.10 C ATOM 1994 OH TYR B 56 16.937 25.532 -43.342 1.00 30.79 O ATOM 0 H TYR B 56 23.755 21.513 -44.874 1.00 14.84 H new ATOM 0 HA TYR B 56 21.263 21.050 -44.246 1.00 16.92 H new ATOM 0 HB2 TYR B 56 22.401 22.893 -43.333 1.00 18.62 H new ATOM 0 HB3 TYR B 56 22.503 23.557 -44.740 1.00 18.62 H new ATOM 0 HD1 TYR B 56 20.114 22.697 -42.265 1.00 21.79 H new ATOM 0 HD2 TYR B 56 20.674 24.882 -45.579 1.00 23.39 H new ATOM 0 HE1 TYR B 56 18.081 23.751 -41.910 1.00 23.91 H new ATOM 0 HE2 TYR B 56 18.629 25.921 -45.240 1.00 26.01 H new ATOM 0 HH TYR B 56 16.794 26.086 -43.957 1.00 30.79 H new ATOM 1995 N HIS B 57 21.606 21.898 -47.303 1.00 17.16 N ATOM 1996 CA HIS B 57 20.827 21.938 -48.544 1.00 18.45 C ATOM 1997 C HIS B 57 20.238 20.603 -48.923 1.00 17.76 C ATOM 1998 O HIS B 57 19.349 20.527 -49.752 1.00 16.82 O ATOM 1999 CB HIS B 57 21.581 22.621 -49.712 1.00 20.55 C ATOM 2000 CG HIS B 57 22.717 21.804 -50.285 1.00 21.18 C ATOM 2001 ND1 HIS B 57 23.980 21.901 -49.825 1.00 22.97 N ATOM 2002 CD2 HIS B 57 22.743 20.864 -51.316 1.00 22.51 C ATOM 2003 CE1 HIS B 57 24.780 21.057 -50.514 1.00 23.32 C ATOM 2004 NE2 HIS B 57 24.023 20.417 -51.423 1.00 23.27 N ATOM 0 H HIS B 57 22.453 22.022 -47.386 1.00 17.16 H new ATOM 0 HA HIS B 57 20.067 22.509 -48.352 1.00 18.45 H new ATOM 0 HB2 HIS B 57 20.948 22.816 -50.421 1.00 20.55 H new ATOM 0 HB3 HIS B 57 21.932 23.471 -49.403 1.00 20.55 H new ATOM 0 HD1 HIS B 57 24.238 22.421 -49.190 1.00 22.97 H new ATOM 0 HD2 HIS B 57 22.019 20.593 -51.834 1.00 22.51 H new ATOM 0 HE1 HIS B 57 25.693 20.940 -50.383 1.00 23.32 H new ATOM 2005 N GLY B 58 20.721 19.535 -48.298 1.00 16.50 N ATOM 2006 CA GLY B 58 20.170 18.214 -48.513 1.00 16.00 C ATOM 2007 C GLY B 58 19.128 17.870 -47.452 1.00 15.52 C ATOM 2008 O GLY B 58 18.013 17.466 -47.779 1.00 16.61 O ATOM 0 H GLY B 58 21.375 19.560 -47.740 1.00 16.50 H new ATOM 0 HA2 GLY B 58 19.765 18.169 -49.393 1.00 16.00 H new ATOM 0 HA3 GLY B 58 20.883 17.557 -48.495 1.00 16.00 H new ATOM 2009 N ALA B 59 19.488 18.043 -46.182 1.00 15.54 N ATOM 2010 CA ALA B 59 18.656 17.557 -45.071 1.00 14.46 C ATOM 2011 C ALA B 59 17.663 18.610 -44.570 1.00 15.65 C ATOM 2012 O ALA B 59 16.673 18.265 -43.909 1.00 15.47 O ATOM 2013 CB ALA B 59 19.539 17.084 -43.933 1.00 14.96 C ATOM 0 H ALA B 59 20.211 18.440 -45.938 1.00 15.54 H new ATOM 0 HA ALA B 59 18.131 16.815 -45.410 1.00 14.46 H new ATOM 0 HB1 ALA B 59 18.984 16.765 -43.204 1.00 14.96 H new ATOM 0 HB2 ALA B 59 20.110 16.364 -44.244 1.00 14.96 H new ATOM 0 HB3 ALA B 59 20.089 17.820 -43.622 1.00 14.96 H new ATOM 2014 N GLY B 60 17.917 19.883 -44.870 1.00 15.10 N ATOM 2015 CA GLY B 60 17.133 20.966 -44.260 1.00 15.65 C ATOM 2016 C GLY B 60 17.134 20.805 -42.731 1.00 15.13 C ATOM 2017 O GLY B 60 18.178 20.526 -42.120 1.00 15.00 O ATOM 0 H GLY B 60 18.529 20.142 -45.416 1.00 15.10 H new ATOM 0 HA2 GLY B 60 17.508 21.827 -44.504 1.00 15.65 H new ATOM 0 HA3 GLY B 60 16.223 20.948 -44.596 1.00 15.65 H new ATOM 2018 N ASER B 61 15.955 20.973 -42.127 0.51 14.74 N ATOM 2019 CA ASER B 61 15.771 20.880 -40.672 0.51 13.67 C ATOM 2020 C ASER B 61 15.300 19.501 -40.208 0.51 14.08 C ATOM 2021 O ASER B 61 14.960 19.321 -39.029 0.51 13.62 O ATOM 2022 CB ASER B 61 14.712 21.896 -40.239 0.51 13.86 C ATOM 2023 OG ASER B 61 15.068 23.190 -40.662 0.51 13.05 O ATOM 2024 N BSER B 61 15.960 20.984 -42.129 0.49 14.89 N ATOM 2025 CA BSER B 61 15.789 20.891 -40.681 0.49 13.93 C ATOM 2026 C BSER B 61 15.222 19.538 -40.241 0.49 14.24 C ATOM 2027 O BSER B 61 14.740 19.411 -39.106 0.49 13.73 O ATOM 2028 CB BSER B 61 14.819 21.984 -40.230 0.49 14.41 C ATOM 2029 OG BSER B 61 13.593 21.864 -40.925 0.49 14.04 O ATOM 0 H ASER B 61 15.229 21.146 -42.555 0.51 14.89 H new ATOM 0 H BSER B 61 15.234 21.164 -42.554 0.49 14.89 H new ATOM 0 HA ASER B 61 16.638 21.053 -40.272 0.51 13.93 H new ATOM 0 HA BSER B 61 16.665 20.995 -40.277 0.49 13.93 H new ATOM 0 HB2ASER B 61 13.851 21.653 -40.613 0.51 14.41 H new ATOM 0 HB2BSER B 61 14.665 21.916 -39.275 0.49 14.41 H new ATOM 0 HB3ASER B 61 14.616 21.880 -39.274 0.51 14.41 H new ATOM 0 HB3BSER B 61 15.207 22.858 -40.393 0.49 14.41 H new ATOM 0 HG ASER B 61 14.478 23.737 -40.419 0.51 14.04 H new ATOM 0 HG BSER B 61 13.736 21.890 -41.752 0.49 14.04 H new ATOM 2030 N LYS B 62 15.268 18.543 -41.132 1.00 13.04 N ATOM 2031 CA LYS B 62 14.620 17.247 -40.886 1.00 12.90 C ATOM 2032 C LYS B 62 15.245 16.359 -39.832 1.00 12.02 C ATOM 2033 O LYS B 62 16.455 16.406 -39.571 1.00 11.56 O ATOM 2034 CB LYS B 62 14.550 16.441 -42.168 1.00 13.49 C ATOM 2035 CG LYS B 62 13.779 17.141 -43.271 1.00 15.17 C ATOM 2036 CD LYS B 62 13.958 16.352 -44.559 1.00 17.19 C ATOM 2037 CE LYS B 62 12.981 16.817 -45.624 1.00 19.64 C ATOM 2038 NZ LYS B 62 13.248 18.254 -45.903 1.00 20.90 N ATOM 0 H ALYS B 62 15.617 18.621 -41.914 0.51 13.04 H new ATOM 0 H BLYS B 62 15.671 18.598 -41.889 0.49 13.04 H new ATOM 0 HA LYS B 62 13.749 17.502 -40.545 1.00 12.90 H new ATOM 0 HB2 LYS B 62 15.451 16.257 -42.477 1.00 13.49 H new ATOM 0 HB3 LYS B 62 14.133 15.585 -41.983 1.00 13.49 H new ATOM 0 HG2 LYS B 62 12.839 17.201 -43.040 1.00 15.17 H new ATOM 0 HG3 LYS B 62 14.101 18.049 -43.384 1.00 15.17 H new ATOM 0 HD2 LYS B 62 14.867 16.456 -44.882 1.00 17.19 H new ATOM 0 HD3 LYS B 62 13.825 15.407 -44.384 1.00 17.19 H new ATOM 0 HE2 LYS B 62 13.085 16.290 -46.432 1.00 19.64 H new ATOM 0 HE3 LYS B 62 12.067 16.695 -45.322 1.00 19.64 H new ATOM 0 HZ1 LYS B 62 12.734 18.526 -46.576 1.00 20.90 H new ATOM 0 HZ2 LYS B 62 13.066 18.736 -45.177 1.00 20.90 H new ATOM 0 HZ3 LYS B 62 14.104 18.360 -46.122 1.00 20.90 H new ATOM 2039 N THR B 63 14.395 15.510 -39.266 1.00 11.28 N ATOM 2040 CA THR B 63 14.816 14.446 -38.379 1.00 11.67 C ATOM 2041 C THR B 63 15.404 13.308 -39.205 1.00 11.93 C ATOM 2042 O THR B 63 15.205 13.248 -40.427 1.00 11.98 O ATOM 2043 CB THR B 63 13.619 13.877 -37.592 1.00 11.93 C ATOM 2044 OG1 THR B 63 12.483 13.769 -38.458 1.00 12.52 O ATOM 2045 CG2 THR B 63 13.257 14.774 -36.452 1.00 11.67 C ATOM 0 H THR B 63 13.545 15.540 -39.391 1.00 11.28 H new ATOM 0 HA THR B 63 15.469 14.811 -37.762 1.00 11.67 H new ATOM 0 HB THR B 63 13.871 13.006 -37.248 1.00 11.93 H new ATOM 0 HG1 THR B 63 12.487 13.018 -38.834 1.00 12.52 H new ATOM 0 HG21 THR B 63 12.503 14.398 -35.971 1.00 11.67 H new ATOM 0 HG22 THR B 63 14.014 14.856 -35.852 1.00 11.67 H new ATOM 0 HG23 THR B 63 13.018 15.650 -36.793 1.00 11.67 H new ATOM 2046 N LEU B 64 16.133 12.430 -38.532 1.00 11.68 N ATOM 2047 CA LEU B 64 16.726 11.245 -39.159 1.00 12.08 C ATOM 2048 C LEU B 64 15.958 10.068 -38.613 1.00 12.39 C ATOM 2049 O LEU B 64 15.773 9.978 -37.378 1.00 12.21 O ATOM 2050 CB LEU B 64 18.193 11.129 -38.749 1.00 12.78 C ATOM 2051 CG LEU B 64 18.990 9.890 -39.163 1.00 13.13 C ATOM 2052 CD1 LEU B 64 19.061 9.786 -40.685 1.00 13.07 C ATOM 2053 CD2 LEU B 64 20.383 10.002 -38.566 1.00 13.48 C ATOM 0 H LEU B 64 16.302 12.501 -37.692 1.00 11.68 H new ATOM 0 HA LEU B 64 16.684 11.289 -40.127 1.00 12.08 H new ATOM 0 HB2 LEU B 64 18.656 11.905 -39.101 1.00 12.78 H new ATOM 0 HB3 LEU B 64 18.231 11.191 -37.782 1.00 12.78 H new ATOM 0 HG LEU B 64 18.555 9.088 -38.835 1.00 13.13 H new ATOM 0 HD11 LEU B 64 19.568 8.997 -40.932 1.00 13.07 H new ATOM 0 HD12 LEU B 64 18.164 9.719 -41.047 1.00 13.07 H new ATOM 0 HD13 LEU B 64 19.496 10.575 -41.044 1.00 13.07 H new ATOM 0 HD21 LEU B 64 20.906 9.225 -38.817 1.00 13.48 H new ATOM 0 HD22 LEU B 64 20.815 10.804 -38.900 1.00 13.48 H new ATOM 0 HD23 LEU B 64 20.318 10.049 -37.599 1.00 13.48 H new ATOM 2054 N ALA B 65 15.470 9.193 -39.497 1.00 12.62 N ATOM 2055 CA ALA B 65 14.723 8.016 -39.042 1.00 13.35 C ATOM 2056 C ALA B 65 15.627 7.111 -38.205 1.00 13.97 C ATOM 2057 O ALA B 65 16.748 6.836 -38.589 1.00 13.89 O ATOM 2058 CB ALA B 65 14.139 7.246 -40.211 1.00 13.83 C ATOM 0 H ALA B 65 15.558 9.260 -40.350 1.00 12.62 H new ATOM 0 HA ALA B 65 13.985 8.322 -38.492 1.00 13.35 H new ATOM 0 HB1 ALA B 65 13.652 6.475 -39.880 1.00 13.83 H new ATOM 0 HB2 ALA B 65 13.536 7.820 -40.708 1.00 13.83 H new ATOM 0 HB3 ALA B 65 14.856 6.949 -40.794 1.00 13.83 H new ATOM 2059 N GLY B 66 15.128 6.643 -37.061 1.00 14.91 N ATOM 2060 CA GLY B 66 15.948 5.854 -36.124 1.00 15.37 C ATOM 2061 C GLY B 66 15.160 4.737 -35.447 1.00 16.13 C ATOM 2062 O GLY B 66 13.935 4.656 -35.573 1.00 14.56 O ATOM 0 H GLY B 66 14.317 6.769 -36.804 1.00 14.91 H new ATOM 0 HA2 GLY B 66 16.700 5.470 -36.602 1.00 15.37 H new ATOM 0 HA3 GLY B 66 16.314 6.443 -35.446 1.00 15.37 H new ATOM 2063 N PRO B 67 15.867 3.856 -34.720 1.00 18.36 N ATOM 2064 CA PRO B 67 15.250 2.672 -34.108 1.00 20.07 C ATOM 2065 C PRO B 67 14.196 3.019 -33.054 1.00 22.16 C ATOM 2066 O PRO B 67 13.215 2.287 -32.890 1.00 23.01 O ATOM 2067 CB PRO B 67 16.436 1.900 -33.516 1.00 20.64 C ATOM 2068 CG PRO B 67 17.553 2.868 -33.429 1.00 20.73 C ATOM 2069 CD PRO B 67 17.306 3.976 -34.421 1.00 20.01 C ATOM 0 HA PRO B 67 14.753 2.150 -34.757 1.00 20.07 H new ATOM 0 HB2 PRO B 67 16.216 1.544 -32.641 1.00 20.64 H new ATOM 0 HB3 PRO B 67 16.674 1.145 -34.077 1.00 20.64 H new ATOM 0 HG2 PRO B 67 17.617 3.228 -32.531 1.00 20.73 H new ATOM 0 HG3 PRO B 67 18.396 2.428 -33.619 1.00 20.73 H new ATOM 0 HD2 PRO B 67 17.522 4.845 -34.047 1.00 20.01 H new ATOM 0 HD3 PRO B 67 17.847 3.868 -35.219 1.00 20.01 H new ATOM 2070 N LYS B 68 14.348 4.168 -32.399 1.00 22.70 N ATOM 2071 CA LYS B 68 13.328 4.585 -31.434 1.00 24.44 C ATOM 2072 C LYS B 68 12.441 5.691 -31.989 1.00 24.43 C ATOM 2073 O LYS B 68 11.700 6.332 -31.261 1.00 26.06 O ATOM 2074 CB LYS B 68 13.972 4.955 -30.096 1.00 26.88 C ATOM 2075 CG LYS B 68 14.726 3.767 -29.512 1.00 29.76 C ATOM 2076 CD LYS B 68 15.358 4.050 -28.162 1.00 31.91 C ATOM 2077 CE LYS B 68 16.083 2.798 -27.678 1.00 34.13 C ATOM 2078 NZ LYS B 68 15.970 2.630 -26.202 1.00 34.07 N ATOM 0 H LYS B 68 15.012 4.707 -32.492 1.00 22.70 H new ATOM 0 HA LYS B 68 12.739 3.832 -31.270 1.00 24.44 H new ATOM 0 HB2 LYS B 68 14.580 5.700 -30.220 1.00 26.88 H new ATOM 0 HB3 LYS B 68 13.288 5.248 -29.473 1.00 26.88 H new ATOM 0 HG2 LYS B 68 14.116 3.018 -29.424 1.00 29.76 H new ATOM 0 HG3 LYS B 68 15.419 3.496 -30.134 1.00 29.76 H new ATOM 0 HD2 LYS B 68 15.980 4.791 -28.233 1.00 31.91 H new ATOM 0 HD3 LYS B 68 14.677 4.311 -27.522 1.00 31.91 H new ATOM 0 HE2 LYS B 68 15.714 2.018 -28.122 1.00 34.13 H new ATOM 0 HE3 LYS B 68 17.019 2.849 -27.927 1.00 34.13 H new ATOM 0 HZ1 LYS B 68 16.402 1.893 -25.953 1.00 34.07 H new ATOM 0 HZ2 LYS B 68 16.328 3.335 -25.794 1.00 34.07 H new ATOM 0 HZ3 LYS B 68 15.112 2.561 -25.976 1.00 34.07 H new ATOM 2079 N GLY B 69 12.493 5.888 -33.302 1.00 22.10 N ATOM 2080 CA GLY B 69 11.752 6.982 -33.924 1.00 19.71 C ATOM 2081 C GLY B 69 12.676 8.111 -34.363 1.00 18.26 C ATOM 2082 O GLY B 69 13.910 7.982 -34.306 1.00 19.62 O ATOM 0 H GLY B 69 12.948 5.404 -33.848 1.00 22.10 H new ATOM 0 HA2 GLY B 69 11.263 6.647 -34.692 1.00 19.71 H new ATOM 0 HA3 GLY B 69 11.096 7.326 -33.298 1.00 19.71 H new ATOM 2083 N PRO B 70 12.080 9.216 -34.833 1.00 17.66 N ATOM 2084 CA PRO B 70 12.840 10.291 -35.476 1.00 17.15 C ATOM 2085 C PRO B 70 13.857 10.895 -34.517 1.00 16.77 C ATOM 2086 O PRO B 70 13.576 11.099 -33.316 1.00 16.17 O ATOM 2087 CB PRO B 70 11.770 11.336 -35.815 1.00 17.34 C ATOM 2088 CG PRO B 70 10.477 10.620 -35.785 1.00 18.59 C ATOM 2089 CD PRO B 70 10.625 9.446 -34.873 1.00 16.75 C ATOM 0 HA PRO B 70 13.339 9.978 -36.247 1.00 17.15 H new ATOM 0 HB2 PRO B 70 11.779 12.063 -35.173 1.00 17.34 H new ATOM 0 HB3 PRO B 70 11.930 11.727 -36.688 1.00 17.34 H new ATOM 0 HG2 PRO B 70 9.771 11.207 -35.472 1.00 18.59 H new ATOM 0 HG3 PRO B 70 10.229 10.329 -36.676 1.00 18.59 H new ATOM 0 HD2 PRO B 70 10.269 9.634 -33.990 1.00 16.75 H new ATOM 0 HD3 PRO B 70 10.151 8.670 -35.211 1.00 16.75 H new ATOM 2090 N ILE B 71 15.033 11.182 -35.045 1.00 15.47 N ATOM 2091 CA ILE B 71 16.105 11.759 -34.247 1.00 15.03 C ATOM 2092 C ILE B 71 16.202 13.226 -34.625 1.00 14.68 C ATOM 2093 O ILE B 71 16.444 13.554 -35.781 1.00 13.17 O ATOM 2094 CB ILE B 71 17.437 11.074 -34.585 1.00 15.29 C ATOM 2095 CG1 ILE B 71 17.379 9.592 -34.195 1.00 15.79 C ATOM 2096 CG2 ILE B 71 18.636 11.817 -33.962 1.00 16.04 C ATOM 2097 CD1 ILE B 71 18.442 8.754 -34.911 1.00 16.73 C ATOM 0 H ILE B 71 15.235 11.050 -35.871 1.00 15.47 H new ATOM 0 HA ILE B 71 15.924 11.644 -33.301 1.00 15.03 H new ATOM 0 HB ILE B 71 17.576 11.116 -35.544 1.00 15.29 H new ATOM 0 HG12 ILE B 71 17.498 9.508 -33.236 1.00 15.79 H new ATOM 0 HG13 ILE B 71 16.500 9.240 -34.404 1.00 15.79 H new ATOM 0 HG21 ILE B 71 19.458 11.358 -34.195 1.00 16.04 H new ATOM 0 HG22 ILE B 71 18.666 12.725 -34.301 1.00 16.04 H new ATOM 0 HG23 ILE B 71 18.539 11.836 -32.997 1.00 16.04 H new ATOM 0 HD11 ILE B 71 18.366 7.828 -34.633 1.00 16.73 H new ATOM 0 HD12 ILE B 71 18.311 8.815 -35.870 1.00 16.73 H new ATOM 0 HD13 ILE B 71 19.324 9.087 -34.684 1.00 16.73 H new ATOM 2098 N THR B 72 16.011 14.105 -33.652 1.00 14.40 N ATOM 2099 CA THR B 72 16.119 15.539 -33.884 1.00 15.25 C ATOM 2100 C THR B 72 17.587 15.906 -34.120 1.00 14.88 C ATOM 2101 O THR B 72 18.470 15.329 -33.501 1.00 14.94 O ATOM 2102 CB THR B 72 15.623 16.303 -32.634 1.00 16.09 C ATOM 2103 OG1 THR B 72 14.257 15.943 -32.396 1.00 17.22 O ATOM 2104 CG2 THR B 72 15.737 17.801 -32.836 1.00 16.08 C ATOM 0 H THR B 72 15.816 13.890 -32.842 1.00 14.40 H new ATOM 0 HA THR B 72 15.583 15.777 -34.657 1.00 15.25 H new ATOM 0 HB THR B 72 16.172 16.064 -31.871 1.00 16.09 H new ATOM 0 HG1 THR B 72 13.974 16.350 -31.718 1.00 17.22 H new ATOM 0 HG21 THR B 72 15.421 18.260 -32.042 1.00 16.08 H new ATOM 0 HG22 THR B 72 16.664 18.036 -32.998 1.00 16.08 H new ATOM 0 HG23 THR B 72 15.199 18.067 -33.598 1.00 16.08 H new ATOM 2105 N GLN B 73 17.828 16.848 -35.021 1.00 14.58 N ATOM 2106 CA GLN B 73 19.165 17.384 -35.253 1.00 15.78 C ATOM 2107 C GLN B 73 19.767 17.892 -33.948 1.00 18.00 C ATOM 2108 O GLN B 73 19.095 18.577 -33.172 1.00 17.32 O ATOM 2109 CB GLN B 73 19.120 18.514 -36.287 1.00 14.90 C ATOM 2110 CG GLN B 73 18.915 17.984 -37.707 1.00 14.64 C ATOM 2111 CD GLN B 73 18.846 19.078 -38.755 1.00 15.19 C ATOM 2112 OE1 GLN B 73 19.225 20.227 -38.503 1.00 15.84 O ATOM 2113 NE2 GLN B 73 18.369 18.722 -39.943 1.00 14.10 N ATOM 0 H GLN B 73 17.219 17.197 -35.518 1.00 14.58 H new ATOM 0 HA GLN B 73 19.724 16.670 -35.598 1.00 15.78 H new ATOM 0 HB2 GLN B 73 18.401 19.126 -36.064 1.00 14.90 H new ATOM 0 HB3 GLN B 73 19.947 19.020 -36.248 1.00 14.90 H new ATOM 0 HG2 GLN B 73 19.641 17.380 -37.927 1.00 14.64 H new ATOM 0 HG3 GLN B 73 18.096 17.465 -37.736 1.00 14.64 H new ATOM 0 HE21 GLN B 73 18.115 17.912 -40.079 1.00 14.10 H new ATOM 0 HE22 GLN B 73 18.314 19.302 -40.576 1.00 14.10 H new ATOM 2114 N MET B 74 21.021 17.523 -33.725 1.00 19.49 N ATOM 2115 CA MET B 74 21.799 17.968 -32.585 1.00 23.19 C ATOM 2116 C MET B 74 22.413 19.330 -32.924 1.00 23.49 C ATOM 2117 O MET B 74 22.614 20.171 -32.043 1.00 23.49 O ATOM 2118 CB MET B 74 22.910 16.953 -32.324 1.00 28.10 C ATOM 2119 CG MET B 74 23.441 16.907 -30.903 1.00 36.19 C ATOM 2120 SD MET B 74 24.664 15.570 -30.765 1.00 47.52 S ATOM 2121 CE MET B 74 25.481 16.040 -29.242 1.00 45.55 C ATOM 0 H MET B 74 21.452 16.993 -34.248 1.00 19.49 H new ATOM 0 HA MET B 74 21.241 18.046 -31.796 1.00 23.19 H new ATOM 0 HB2 MET B 74 22.581 16.071 -32.557 1.00 28.10 H new ATOM 0 HB3 MET B 74 23.649 17.147 -32.922 1.00 28.10 H new ATOM 0 HG2 MET B 74 23.847 17.757 -30.670 1.00 36.19 H new ATOM 0 HG3 MET B 74 22.713 16.760 -30.279 1.00 36.19 H new ATOM 0 HE1 MET B 74 26.405 15.745 -29.266 1.00 45.55 H new ATOM 0 HE2 MET B 74 25.452 17.005 -29.144 1.00 45.55 H new ATOM 0 HE3 MET B 74 25.029 15.625 -28.491 1.00 45.55 H new ATOM 2122 N TYR B 75 22.723 19.536 -34.200 1.00 21.61 N ATOM 2123 CA TYR B 75 23.373 20.765 -34.660 1.00 22.76 C ATOM 2124 C TYR B 75 22.763 21.206 -35.971 1.00 22.16 C ATOM 2125 O TYR B 75 22.545 20.394 -36.873 1.00 20.30 O ATOM 2126 CB TYR B 75 24.887 20.543 -34.837 1.00 24.46 C ATOM 2127 CG TYR B 75 25.567 20.022 -33.591 1.00 27.92 C ATOM 2128 CD1 TYR B 75 25.728 20.838 -32.466 1.00 30.22 C ATOM 2129 CD2 TYR B 75 26.031 18.704 -33.524 1.00 30.85 C ATOM 2130 CE1 TYR B 75 26.344 20.359 -31.313 1.00 32.49 C ATOM 2131 CE2 TYR B 75 26.641 18.215 -32.374 1.00 33.36 C ATOM 2132 CZ TYR B 75 26.798 19.048 -31.276 1.00 35.12 C ATOM 2133 OH TYR B 75 27.413 18.565 -30.140 1.00 38.82 O ATOM 0 H TYR B 75 22.563 18.968 -34.826 1.00 21.61 H new ATOM 0 HA TYR B 75 23.238 21.456 -33.993 1.00 22.76 H new ATOM 0 HB2 TYR B 75 25.033 19.916 -35.563 1.00 24.46 H new ATOM 0 HB3 TYR B 75 25.302 21.380 -35.098 1.00 24.46 H new ATOM 0 HD1 TYR B 75 25.418 21.715 -32.489 1.00 30.22 H new ATOM 0 HD2 TYR B 75 25.930 18.146 -34.261 1.00 30.85 H new ATOM 0 HE1 TYR B 75 26.450 20.913 -30.574 1.00 32.49 H new ATOM 0 HE2 TYR B 75 26.942 17.336 -32.341 1.00 33.36 H new ATOM 0 HH TYR B 75 27.633 17.763 -30.260 1.00 38.82 H new ATOM 2134 N THR B 76 22.469 22.494 -36.077 1.00 22.86 N ATOM 2135 CA THR B 76 21.848 23.034 -37.284 1.00 24.02 C ATOM 2136 C THR B 76 22.530 24.365 -37.603 1.00 26.54 C ATOM 2137 O THR B 76 22.199 25.390 -37.013 1.00 29.59 O ATOM 2138 CB THR B 76 20.316 23.220 -37.091 1.00 23.93 C ATOM 2139 OG1 THR B 76 19.743 22.018 -36.543 1.00 22.78 O ATOM 2140 CG2 THR B 76 19.621 23.542 -38.403 1.00 23.16 C ATOM 0 H THR B 76 22.620 23.076 -35.462 1.00 22.86 H new ATOM 0 HA THR B 76 21.962 22.416 -38.023 1.00 24.02 H new ATOM 0 HB THR B 76 20.186 23.964 -36.482 1.00 23.93 H new ATOM 0 HG1 THR B 76 19.588 21.473 -37.163 1.00 22.78 H new ATOM 0 HG21 THR B 76 18.670 23.651 -38.247 1.00 23.16 H new ATOM 0 HG22 THR B 76 19.985 24.363 -38.769 1.00 23.16 H new ATOM 0 HG23 THR B 76 19.764 22.817 -39.032 1.00 23.16 H new ATOM 2141 N ASN B 77 23.496 24.347 -38.514 1.00 26.90 N ATOM 2142 CA ASN B 77 24.252 25.556 -38.864 1.00 26.84 C ATOM 2143 C ASN B 77 24.021 25.947 -40.308 1.00 26.78 C ATOM 2144 O ASN B 77 24.739 25.519 -41.223 1.00 25.64 O ATOM 2145 CB ASN B 77 25.747 25.377 -38.567 1.00 29.85 C ATOM 2146 CG ASN B 77 26.500 26.707 -38.474 1.00 31.36 C ATOM 2147 OD1 ASN B 77 26.135 27.709 -39.102 1.00 32.24 O ATOM 2148 ND2 ASN B 77 27.576 26.709 -37.698 1.00 33.90 N ATOM 0 H ASN B 77 23.734 23.643 -38.946 1.00 26.90 H new ATOM 0 HA ASN B 77 23.926 26.281 -38.309 1.00 26.84 H new ATOM 0 HB2 ASN B 77 25.851 24.893 -37.733 1.00 29.85 H new ATOM 0 HB3 ASN B 77 26.147 24.832 -39.263 1.00 29.85 H new ATOM 0 HD21 ASN B 77 28.047 27.424 -37.618 1.00 33.90 H new ATOM 0 HD22 ASN B 77 27.802 25.995 -37.275 1.00 33.90 H new ATOM 2149 N VAL B 78 22.995 26.759 -40.512 1.00 26.64 N ATOM 2150 CA VAL B 78 22.557 27.134 -41.853 1.00 29.23 C ATOM 2151 C VAL B 78 23.643 27.918 -42.611 1.00 30.49 C ATOM 2152 O VAL B 78 23.828 27.700 -43.815 1.00 29.90 O ATOM 2153 CB VAL B 78 21.217 27.906 -41.809 1.00 29.20 C ATOM 2154 CG1 VAL B 78 20.709 28.205 -43.213 1.00 29.64 C ATOM 2155 CG2 VAL B 78 20.177 27.102 -41.031 1.00 28.95 C ATOM 0 H VAL B 78 22.531 27.110 -39.879 1.00 26.64 H new ATOM 0 HA VAL B 78 22.405 26.314 -42.349 1.00 29.23 H new ATOM 0 HB VAL B 78 21.368 28.752 -41.359 1.00 29.20 H new ATOM 0 HG11 VAL B 78 19.870 28.688 -43.158 1.00 29.64 H new ATOM 0 HG12 VAL B 78 21.362 28.745 -43.685 1.00 29.64 H new ATOM 0 HG13 VAL B 78 20.571 27.373 -43.692 1.00 29.64 H new ATOM 0 HG21 VAL B 78 19.340 27.592 -41.008 1.00 28.95 H new ATOM 0 HG22 VAL B 78 20.038 26.246 -41.466 1.00 28.95 H new ATOM 0 HG23 VAL B 78 20.491 26.957 -40.125 1.00 28.95 H new ATOM 2156 N ASP B 79 24.362 28.795 -41.903 1.00 32.25 N ATOM 2157 CA ASP B 79 25.417 29.629 -42.519 1.00 37.45 C ATOM 2158 C ASP B 79 26.545 28.776 -43.094 1.00 35.07 C ATOM 2159 O ASP B 79 27.108 29.108 -44.142 1.00 35.46 O ATOM 2160 CB ASP B 79 26.035 30.613 -41.509 1.00 41.75 C ATOM 2161 CG ASP B 79 25.112 31.770 -41.141 1.00 48.10 C ATOM 2162 OD1 ASP B 79 24.113 32.046 -41.852 1.00 50.37 O ATOM 2163 OD2 ASP B 79 25.412 32.423 -40.116 1.00 52.87 O ATOM 0 H ASP B 79 24.257 28.926 -41.060 1.00 32.25 H new ATOM 0 HA ASP B 79 24.980 30.123 -43.230 1.00 37.45 H new ATOM 0 HB2 ASP B 79 26.273 30.130 -40.702 1.00 41.75 H new ATOM 0 HB3 ASP B 79 26.858 30.970 -41.879 1.00 41.75 H new ATOM 2164 N GLN B 80 26.871 27.688 -42.396 1.00 32.88 N ATOM 2165 CA GLN B 80 27.936 26.780 -42.817 1.00 32.47 C ATOM 2166 C GLN B 80 27.414 25.633 -43.687 1.00 29.96 C ATOM 2167 O GLN B 80 28.193 24.775 -44.106 1.00 28.01 O ATOM 2168 CB GLN B 80 28.689 26.207 -41.607 1.00 35.35 C ATOM 2169 CG GLN B 80 29.277 27.232 -40.638 1.00 43.70 C ATOM 2170 CD GLN B 80 30.479 27.998 -41.183 1.00 48.16 C ATOM 2171 OE1 GLN B 80 30.499 28.432 -42.341 1.00 51.54 O ATOM 2172 NE2 GLN B 80 31.483 28.192 -40.330 1.00 52.87 N ATOM 0 H GLN B 80 26.481 27.456 -41.666 1.00 32.88 H new ATOM 0 HA GLN B 80 28.548 27.309 -43.353 1.00 32.47 H new ATOM 0 HB2 GLN B 80 28.083 25.632 -41.114 1.00 35.35 H new ATOM 0 HB3 GLN B 80 29.410 25.646 -41.933 1.00 35.35 H new ATOM 0 HG2 GLN B 80 28.585 27.867 -40.397 1.00 43.70 H new ATOM 0 HG3 GLN B 80 29.540 26.777 -39.823 1.00 43.70 H new ATOM 0 HE21 GLN B 80 31.436 27.876 -39.532 1.00 52.87 H new ATOM 0 HE22 GLN B 80 32.178 28.633 -40.578 1.00 52.87 H new ATOM 2173 N ASP B 81 26.103 25.619 -43.941 1.00 26.14 N ATOM 2174 CA ASP B 81 25.440 24.563 -44.719 1.00 25.32 C ATOM 2175 C ASP B 81 25.660 23.204 -44.067 1.00 22.64 C ATOM 2176 O ASP B 81 25.932 22.224 -44.746 1.00 22.85 O ATOM 2177 CB ASP B 81 25.903 24.565 -46.202 1.00 26.56 C ATOM 2178 CG ASP B 81 24.993 23.723 -47.124 1.00 29.45 C ATOM 2179 OD1 ASP B 81 23.823 23.470 -46.771 1.00 26.64 O ATOM 2180 OD2 ASP B 81 25.444 23.316 -48.226 1.00 30.94 O ATOM 0 H ASP B 81 25.565 26.230 -43.663 1.00 26.14 H new ATOM 0 HA ASP B 81 24.488 24.747 -44.722 1.00 25.32 H new ATOM 0 HB2 ASP B 81 25.926 25.479 -46.527 1.00 26.56 H new ATOM 0 HB3 ASP B 81 26.809 24.223 -46.252 1.00 26.56 H new ATOM 2181 N LEU B 82 25.554 23.165 -42.742 1.00 19.83 N ATOM 2182 CA LEU B 82 25.930 21.987 -41.973 1.00 19.81 C ATOM 2183 C LEU B 82 24.870 21.595 -40.963 1.00 17.84 C ATOM 2184 O LEU B 82 24.414 22.455 -40.193 1.00 19.17 O ATOM 2185 CB LEU B 82 27.243 22.260 -41.209 1.00 20.66 C ATOM 2186 CG LEU B 82 27.810 21.139 -40.351 1.00 21.74 C ATOM 2187 CD1 LEU B 82 28.210 19.980 -41.252 1.00 22.65 C ATOM 2188 CD2 LEU B 82 29.009 21.600 -39.536 1.00 23.02 C ATOM 0 H LEU B 82 25.263 23.819 -42.266 1.00 19.83 H new ATOM 0 HA LEU B 82 26.037 21.260 -42.606 1.00 19.81 H new ATOM 0 HB2 LEU B 82 27.919 22.510 -41.858 1.00 20.66 H new ATOM 0 HB3 LEU B 82 27.100 23.030 -40.637 1.00 20.66 H new ATOM 0 HG LEU B 82 27.125 20.858 -39.724 1.00 21.74 H new ATOM 0 HD11 LEU B 82 28.573 19.260 -40.712 1.00 22.65 H new ATOM 0 HD12 LEU B 82 27.431 19.661 -41.734 1.00 22.65 H new ATOM 0 HD13 LEU B 82 28.881 20.279 -41.885 1.00 22.65 H new ATOM 0 HD21 LEU B 82 29.342 20.861 -39.003 1.00 23.02 H new ATOM 0 HD22 LEU B 82 29.708 21.908 -40.134 1.00 23.02 H new ATOM 0 HD23 LEU B 82 28.743 22.326 -38.950 1.00 23.02 H new ATOM 2189 N VAL B 83 24.515 20.311 -40.935 1.00 16.83 N ATOM 2190 CA VAL B 83 23.645 19.767 -39.889 1.00 16.19 C ATOM 2191 C VAL B 83 24.234 18.468 -39.347 1.00 15.41 C ATOM 2192 O VAL B 83 24.974 17.785 -40.038 1.00 14.69 O ATOM 2193 CB VAL B 83 22.167 19.543 -40.332 1.00 17.13 C ATOM 2194 CG1 VAL B 83 21.568 20.760 -41.000 1.00 16.38 C ATOM 2195 CG2 VAL B 83 21.999 18.316 -41.219 1.00 16.29 C ATOM 0 H VAL B 83 24.770 19.732 -41.518 1.00 16.83 H new ATOM 0 HA VAL B 83 23.611 20.442 -39.193 1.00 16.19 H new ATOM 0 HB VAL B 83 21.677 19.384 -39.510 1.00 17.13 H new ATOM 0 HG11 VAL B 83 20.652 20.571 -41.256 1.00 16.38 H new ATOM 0 HG12 VAL B 83 21.583 21.508 -40.383 1.00 16.38 H new ATOM 0 HG13 VAL B 83 22.084 20.983 -41.790 1.00 16.38 H new ATOM 0 HG21 VAL B 83 21.066 18.221 -41.467 1.00 16.29 H new ATOM 0 HG22 VAL B 83 22.537 18.419 -42.020 1.00 16.29 H new ATOM 0 HG23 VAL B 83 22.287 17.526 -40.736 1.00 16.29 H new ATOM 2196 N GLY B 84 23.924 18.138 -38.098 1.00 14.72 N ATOM 2197 CA GLY B 84 24.369 16.885 -37.547 1.00 15.38 C ATOM 2198 C GLY B 84 23.334 16.245 -36.638 1.00 16.19 C ATOM 2199 O GLY B 84 22.606 16.958 -35.931 1.00 15.44 O ATOM 0 H GLY B 84 23.460 18.627 -37.564 1.00 14.72 H new ATOM 0 HA2 GLY B 84 24.580 16.275 -38.271 1.00 15.38 H new ATOM 0 HA3 GLY B 84 25.188 17.028 -37.048 1.00 15.38 H new ATOM 2200 N TRP B 85 23.282 14.910 -36.657 1.00 15.68 N ATOM 2201 CA TRP B 85 22.458 14.152 -35.702 1.00 17.00 C ATOM 2202 C TRP B 85 23.364 13.284 -34.884 1.00 18.86 C ATOM 2203 O TRP B 85 24.435 12.873 -35.355 1.00 19.39 O ATOM 2204 CB TRP B 85 21.463 13.242 -36.410 1.00 15.19 C ATOM 2205 CG TRP B 85 20.526 13.855 -37.435 1.00 14.50 C ATOM 2206 CD1 TRP B 85 19.242 14.371 -37.232 1.00 14.17 C ATOM 2207 CD2 TRP B 85 20.739 13.929 -38.880 1.00 15.34 C ATOM 2208 NE1 TRP B 85 18.683 14.783 -38.426 1.00 14.31 N ATOM 2209 CE2 TRP B 85 19.531 14.544 -39.450 1.00 14.57 C ATOM 2210 CE3 TRP B 85 21.780 13.562 -39.730 1.00 15.05 C ATOM 2211 CZ2 TRP B 85 19.390 14.761 -40.811 1.00 15.72 C ATOM 2212 CZ3 TRP B 85 21.624 13.791 -41.104 1.00 16.62 C ATOM 2213 CH2 TRP B 85 20.448 14.365 -41.631 1.00 15.12 C ATOM 0 H TRP B 85 23.717 14.421 -37.216 1.00 15.68 H new ATOM 0 HA TRP B 85 21.967 14.787 -35.157 1.00 17.00 H new ATOM 0 HB2 TRP B 85 21.967 12.541 -36.852 1.00 15.19 H new ATOM 0 HB3 TRP B 85 20.919 12.814 -35.731 1.00 15.19 H new ATOM 0 HD1 TRP B 85 18.821 14.429 -36.405 1.00 14.17 H new ATOM 0 HE1 TRP B 85 17.905 15.141 -38.506 1.00 14.31 H new ATOM 0 HE3 TRP B 85 22.557 13.176 -39.395 1.00 15.05 H new ATOM 0 HZ2 TRP B 85 18.624 15.153 -41.163 1.00 15.72 H new ATOM 0 HZ3 TRP B 85 22.314 13.559 -41.683 1.00 16.62 H new ATOM 0 HH2 TRP B 85 20.376 14.483 -42.551 1.00 15.12 H new ATOM 2214 N GLN B 86 22.967 12.959 -33.656 1.00 21.25 N ATOM 2215 CA GLN B 86 23.727 11.925 -32.944 1.00 24.84 C ATOM 2216 C GLN B 86 23.768 10.662 -33.813 1.00 25.28 C ATOM 2217 O GLN B 86 22.745 10.218 -34.346 1.00 25.23 O ATOM 2218 CB GLN B 86 23.165 11.627 -31.551 1.00 29.74 C ATOM 2219 CG GLN B 86 23.972 10.577 -30.788 1.00 34.94 C ATOM 2220 CD GLN B 86 23.586 10.458 -29.324 1.00 40.29 C ATOM 2221 OE1 GLN B 86 22.884 11.311 -28.776 1.00 45.12 O ATOM 2222 NE2 GLN B 86 24.059 9.396 -28.676 1.00 44.32 N ATOM 0 H GLN B 86 22.300 13.300 -33.234 1.00 21.25 H new ATOM 0 HA GLN B 86 24.627 12.254 -32.795 1.00 24.84 H new ATOM 0 HB2 GLN B 86 23.144 12.448 -31.035 1.00 29.74 H new ATOM 0 HB3 GLN B 86 22.248 11.322 -31.637 1.00 29.74 H new ATOM 0 HG2 GLN B 86 23.854 9.715 -31.217 1.00 34.94 H new ATOM 0 HG3 GLN B 86 24.915 10.797 -30.849 1.00 34.94 H new ATOM 0 HE21 GLN B 86 24.546 8.821 -29.091 1.00 44.32 H new ATOM 0 HE22 GLN B 86 23.878 9.285 -27.843 1.00 44.32 H new ATOM 2223 N ALA B 87 24.965 10.124 -33.994 1.00 25.31 N ATOM 2224 CA ALA B 87 25.168 8.984 -34.885 1.00 29.13 C ATOM 2225 C ALA B 87 24.431 7.752 -34.360 1.00 31.35 C ATOM 2226 O ALA B 87 24.413 7.507 -33.149 1.00 30.41 O ATOM 2227 CB ALA B 87 26.655 8.684 -35.048 1.00 28.67 C ATOM 0 H ALA B 87 25.680 10.405 -33.608 1.00 25.31 H new ATOM 0 HA ALA B 87 24.805 9.212 -35.755 1.00 29.13 H new ATOM 0 HB1 ALA B 87 26.769 7.926 -35.642 1.00 28.67 H new ATOM 0 HB2 ALA B 87 27.102 9.458 -35.424 1.00 28.67 H new ATOM 0 HB3 ALA B 87 27.040 8.477 -34.182 1.00 28.67 H new ATOM 2228 N PRO B 88 23.793 6.989 -35.268 1.00 33.92 N ATOM 2229 CA PRO B 88 23.254 5.680 -34.911 1.00 35.22 C ATOM 2230 C PRO B 88 24.327 4.794 -34.286 1.00 34.68 C ATOM 2231 O PRO B 88 25.497 4.886 -34.680 1.00 35.28 O ATOM 2232 CB PRO B 88 22.845 5.108 -36.267 1.00 36.25 C ATOM 2233 CG PRO B 88 22.435 6.318 -37.038 1.00 36.65 C ATOM 2234 CD PRO B 88 23.465 7.346 -36.661 1.00 35.91 C ATOM 0 HA PRO B 88 22.533 5.733 -34.264 1.00 35.22 H new ATOM 0 HB2 PRO B 88 23.580 4.642 -36.696 1.00 36.25 H new ATOM 0 HB3 PRO B 88 22.117 4.473 -36.183 1.00 36.25 H new ATOM 0 HG2 PRO B 88 22.434 6.148 -37.993 1.00 36.65 H new ATOM 0 HG3 PRO B 88 21.540 6.606 -36.800 1.00 36.65 H new ATOM 0 HD2 PRO B 88 24.245 7.302 -37.237 1.00 35.91 H new ATOM 0 HD3 PRO B 88 23.114 8.248 -36.728 1.00 35.91 H new ATOM 2235 N APRO B 89 23.958 3.909 -33.333 0.52 34.90 N ATOM 2236 CA APRO B 89 24.973 3.159 -32.561 0.52 33.74 C ATOM 2237 C APRO B 89 25.992 2.341 -33.371 0.52 32.36 C ATOM 2238 O APRO B 89 27.171 2.303 -33.011 0.52 32.27 O ATOM 2239 CB APRO B 89 24.128 2.217 -31.694 0.52 34.64 C ATOM 2240 CG APRO B 89 22.812 2.127 -32.390 0.52 34.35 C ATOM 2241 CD APRO B 89 22.592 3.488 -32.977 0.52 34.42 C ATOM 2242 N BPRO B 89 23.921 3.973 -33.298 0.48 35.80 N ATOM 2243 CA BPRO B 89 24.741 2.899 -32.765 0.48 34.92 C ATOM 2244 C BPRO B 89 24.967 1.909 -33.888 0.48 33.56 C ATOM 2245 O BPRO B 89 24.006 1.475 -34.526 0.48 33.77 O ATOM 2246 CB BPRO B 89 23.846 2.273 -31.693 0.48 36.06 C ATOM 2247 CG BPRO B 89 22.858 3.337 -31.344 0.48 36.44 C ATOM 2248 CD BPRO B 89 22.608 4.042 -32.633 0.48 35.88 C ATOM 0 HA APRO B 89 25.538 3.788 -32.085 0.52 34.92 H new ATOM 0 HA BPRO B 89 25.601 3.177 -32.414 0.48 34.92 H new ATOM 0 HB2APRO B 89 24.544 1.344 -31.616 0.52 36.06 H new ATOM 0 HB2BPRO B 89 23.402 1.478 -32.027 0.48 36.06 H new ATOM 0 HB3APRO B 89 24.026 2.565 -30.794 0.52 36.06 H new ATOM 0 HB3BPRO B 89 24.363 2.005 -30.917 0.48 36.06 H new ATOM 0 HG2APRO B 89 22.825 1.445 -33.079 0.52 36.44 H new ATOM 0 HG2BPRO B 89 22.041 2.958 -30.984 0.48 36.44 H new ATOM 0 HG3APRO B 89 22.103 1.892 -31.772 0.52 36.44 H new ATOM 0 HG3BPRO B 89 23.211 3.941 -30.672 0.48 36.44 H new ATOM 0 HD2APRO B 89 22.011 3.457 -33.753 0.52 35.88 H new ATOM 0 HD2BPRO B 89 21.916 3.606 -33.154 0.48 35.88 H new ATOM 0 HD3APRO B 89 22.182 4.094 -32.340 0.52 35.88 H new ATOM 0 HD3BPRO B 89 22.322 4.958 -32.493 0.48 35.88 H new ATOM 2249 N AGLY B 90 25.542 1.692 -34.442 0.52 31.29 N ATOM 2250 CA AGLY B 90 26.404 0.820 -35.249 0.52 30.50 C ATOM 2251 C AGLY B 90 27.393 1.542 -36.153 0.52 30.36 C ATOM 2252 O AGLY B 90 28.401 0.965 -36.561 0.52 29.82 O ATOM 2253 N BGLY B 90 26.225 1.582 -34.148 0.48 31.97 N ATOM 2254 CA BGLY B 90 26.563 0.742 -35.285 0.48 30.93 C ATOM 2255 C BGLY B 90 27.374 1.508 -36.313 0.48 30.44 C ATOM 2256 O BGLY B 90 28.238 0.933 -36.972 0.48 30.34 O ATOM 0 H AGLY B 90 24.731 1.742 -34.724 0.52 31.97 H new ATOM 0 H BGLY B 90 26.898 1.837 -33.677 0.48 31.97 H new ATOM 0 HA2AGLY B 90 26.899 0.237 -34.652 0.52 30.93 H new ATOM 0 HA2BGLY B 90 27.067 -0.029 -34.982 0.48 30.93 H new ATOM 0 HA3AGLY B 90 25.841 0.252 -35.798 0.52 30.93 H new ATOM 0 HA3BGLY B 90 25.750 0.407 -35.695 0.48 30.93 H new ATOM 2257 N ALA B 91 27.101 2.805 -36.458 1.00 29.04 N ATOM 2258 CA ALA B 91 27.912 3.630 -37.356 1.00 30.19 C ATOM 2259 C ALA B 91 29.332 3.763 -36.817 1.00 30.80 C ATOM 2260 O ALA B 91 29.532 3.863 -35.602 1.00 31.04 O ATOM 2261 CB ALA B 91 27.281 4.996 -37.545 1.00 29.17 C ATOM 0 H AALA B 91 26.414 3.215 -36.144 0.52 29.04 H new ATOM 0 H BALA B 91 26.465 3.220 -36.055 0.48 29.04 H new ATOM 0 HA ALA B 91 27.952 3.194 -38.221 1.00 30.19 H new ATOM 0 HB1 ALA B 91 27.831 5.527 -38.142 1.00 29.17 H new ATOM 0 HB2 ALA B 91 26.396 4.894 -37.928 1.00 29.17 H new ATOM 0 HB3 ALA B 91 27.212 5.442 -36.687 1.00 29.17 H new ATOM 2262 N ARG B 92 30.310 3.729 -37.714 1.00 31.38 N ATOM 2263 CA ARG B 92 31.718 3.866 -37.324 1.00 34.79 C ATOM 2264 C ARG B 92 32.178 5.296 -37.548 1.00 33.01 C ATOM 2265 O ARG B 92 32.062 5.814 -38.667 1.00 33.37 O ATOM 2266 CB ARG B 92 32.610 2.914 -38.127 1.00 38.02 C ATOM 2267 CG ARG B 92 34.055 2.896 -37.640 1.00 44.11 C ATOM 2268 CD ARG B 92 34.905 1.861 -38.366 1.00 50.75 C ATOM 2269 NE ARG B 92 34.254 0.550 -38.428 1.00 56.76 N ATOM 2270 CZ ARG B 92 34.362 -0.401 -37.502 1.00 59.08 C ATOM 2271 NH1 ARG B 92 35.101 -0.206 -36.415 1.00 60.70 N ATOM 2272 NH2 ARG B 92 33.721 -1.554 -37.665 1.00 58.66 N ATOM 0 H ARG B 92 30.184 3.627 -38.559 1.00 31.38 H new ATOM 0 HA ARG B 92 31.793 3.639 -36.384 1.00 34.79 H new ATOM 0 HB2 ARG B 92 32.246 2.017 -38.075 1.00 38.02 H new ATOM 0 HB3 ARG B 92 32.592 3.174 -39.061 1.00 38.02 H new ATOM 0 HG2 ARG B 92 34.446 3.775 -37.764 1.00 44.11 H new ATOM 0 HG3 ARG B 92 34.070 2.711 -36.688 1.00 44.11 H new ATOM 0 HD2 ARG B 92 35.089 2.171 -39.266 1.00 50.75 H new ATOM 0 HD3 ARG B 92 35.760 1.774 -37.916 1.00 50.75 H new ATOM 0 HE ARG B 92 33.765 0.382 -39.115 1.00 56.76 H new ATOM 0 HH11 ARG B 92 35.515 0.540 -36.305 1.00 60.70 H new ATOM 0 HH12 ARG B 92 35.165 -0.825 -35.822 1.00 60.70 H new ATOM 0 HH21 ARG B 92 33.240 -1.683 -38.366 1.00 58.66 H new ATOM 0 HH22 ARG B 92 33.788 -2.171 -37.070 1.00 58.66 H new ATOM 2273 N SER B 93 32.708 5.927 -36.500 1.00 28.93 N ATOM 2274 CA SER B 93 33.106 7.324 -36.594 1.00 28.28 C ATOM 2275 C SER B 93 34.516 7.506 -37.136 1.00 27.04 C ATOM 2276 O SER B 93 35.430 6.781 -36.768 1.00 26.82 O ATOM 2277 CB SER B 93 32.985 8.019 -35.236 1.00 30.00 C ATOM 2278 OG SER B 93 31.718 8.627 -35.108 1.00 31.87 O ATOM 0 H SER B 93 32.843 5.564 -35.732 1.00 28.93 H new ATOM 0 HA SER B 93 32.496 7.734 -37.227 1.00 28.28 H new ATOM 0 HB2 SER B 93 33.115 7.374 -34.523 1.00 30.00 H new ATOM 0 HB3 SER B 93 33.682 8.687 -35.144 1.00 30.00 H new ATOM 0 HG SER B 93 31.128 8.113 -35.413 1.00 31.87 H new ATOM 2279 N LEU B 94 34.681 8.477 -38.019 1.00 24.54 N ATOM 2280 CA LEU B 94 36.009 8.939 -38.395 1.00 25.01 C ATOM 2281 C LEU B 94 36.510 9.845 -37.266 1.00 25.69 C ATOM 2282 O LEU B 94 35.716 10.413 -36.533 1.00 24.96 O ATOM 2283 CB LEU B 94 35.927 9.731 -39.698 1.00 23.27 C ATOM 2284 CG LEU B 94 35.485 8.939 -40.934 1.00 23.79 C ATOM 2285 CD1 LEU B 94 35.040 9.878 -42.045 1.00 24.16 C ATOM 2286 CD2 LEU B 94 36.627 8.046 -41.406 1.00 24.77 C ATOM 0 H LEU B 94 34.035 8.884 -38.415 1.00 24.54 H new ATOM 0 HA LEU B 94 36.612 8.191 -38.529 1.00 25.01 H new ATOM 0 HB2 LEU B 94 35.310 10.469 -39.570 1.00 23.27 H new ATOM 0 HB3 LEU B 94 36.798 10.118 -39.877 1.00 23.27 H new ATOM 0 HG LEU B 94 34.728 8.382 -40.696 1.00 23.79 H new ATOM 0 HD11 LEU B 94 34.765 9.359 -42.817 1.00 24.16 H new ATOM 0 HD12 LEU B 94 34.295 10.416 -41.735 1.00 24.16 H new ATOM 0 HD13 LEU B 94 35.776 10.459 -42.292 1.00 24.16 H new ATOM 0 HD21 LEU B 94 36.345 7.546 -42.188 1.00 24.77 H new ATOM 0 HD22 LEU B 94 37.394 8.594 -41.633 1.00 24.77 H new ATOM 0 HD23 LEU B 94 36.869 7.429 -40.698 1.00 24.77 H new ATOM 2287 N THR B 95 37.817 9.985 -37.117 1.00 27.52 N ATOM 2288 CA THR B 95 38.328 10.996 -36.199 1.00 30.30 C ATOM 2289 C THR B 95 38.905 12.162 -37.009 1.00 30.07 C ATOM 2290 O THR B 95 39.386 11.958 -38.133 1.00 28.85 O ATOM 2291 CB THR B 95 39.346 10.417 -35.197 1.00 32.74 C ATOM 2292 OG1 THR B 95 40.210 9.503 -35.870 1.00 36.65 O ATOM 2293 CG2 THR B 95 38.625 9.661 -34.092 1.00 35.90 C ATOM 0 H THR B 95 38.414 9.520 -37.525 1.00 27.52 H new ATOM 0 HA THR B 95 37.595 11.325 -35.656 1.00 30.30 H new ATOM 0 HB THR B 95 39.855 11.150 -34.817 1.00 32.74 H new ATOM 0 HG1 THR B 95 40.766 9.189 -35.324 1.00 36.65 H new ATOM 0 HG21 THR B 95 39.275 9.302 -33.468 1.00 35.90 H new ATOM 0 HG22 THR B 95 38.027 10.264 -33.624 1.00 35.90 H new ATOM 0 HG23 THR B 95 38.112 8.934 -34.478 1.00 35.90 H new ATOM 2294 N PRO B 96 38.821 13.396 -36.468 1.00 30.24 N ATOM 2295 CA PRO B 96 39.317 14.563 -37.194 1.00 31.55 C ATOM 2296 C PRO B 96 40.804 14.475 -37.504 1.00 35.07 C ATOM 2297 O PRO B 96 41.575 13.931 -36.710 1.00 35.50 O ATOM 2298 CB PRO B 96 39.047 15.712 -36.219 1.00 31.14 C ATOM 2299 CG PRO B 96 37.883 15.238 -35.420 1.00 29.56 C ATOM 2300 CD PRO B 96 38.202 13.792 -35.190 1.00 29.34 C ATOM 0 HA PRO B 96 38.888 14.662 -38.058 1.00 31.55 H new ATOM 0 HB2 PRO B 96 39.817 15.888 -35.656 1.00 31.14 H new ATOM 0 HB3 PRO B 96 38.844 16.536 -36.688 1.00 31.14 H new ATOM 0 HG2 PRO B 96 37.798 15.725 -34.585 1.00 29.56 H new ATOM 0 HG3 PRO B 96 37.048 15.350 -35.900 1.00 29.56 H new ATOM 0 HD2 PRO B 96 38.808 13.670 -34.442 1.00 29.34 H new ATOM 0 HD3 PRO B 96 37.406 13.272 -34.998 1.00 29.34 H new ATOM 2301 N CYS B 97 41.188 14.978 -38.675 1.00 37.15 N ATOM 2302 CA CYS B 97 42.583 14.981 -39.092 1.00 40.00 C ATOM 2303 C CYS B 97 43.337 16.074 -38.339 1.00 41.77 C ATOM 2304 O CYS B 97 42.841 17.188 -38.191 1.00 41.89 O ATOM 2305 CB CYS B 97 42.681 15.188 -40.607 1.00 38.84 C ATOM 2306 SG CYS B 97 44.304 15.699 -41.226 1.00 43.42 S ATOM 0 H CYS B 97 40.648 15.325 -39.247 1.00 37.15 H new ATOM 0 HA CYS B 97 42.987 14.125 -38.881 1.00 40.00 H new ATOM 0 HB2 CYS B 97 42.431 14.360 -41.047 1.00 38.84 H new ATOM 0 HB3 CYS B 97 42.028 15.856 -40.868 1.00 38.84 H new ATOM 2307 N THR B 98 44.538 15.738 -37.881 1.00 45.95 N ATOM 2308 CA THR B 98 45.380 16.664 -37.133 1.00 49.55 C ATOM 2309 C THR B 98 46.711 16.946 -37.846 1.00 50.84 C ATOM 2310 O THR B 98 47.421 17.883 -37.484 1.00 53.06 O ATOM 2311 CB THR B 98 45.672 16.126 -35.711 1.00 51.21 C ATOM 2312 OG1 THR B 98 46.327 14.853 -35.805 1.00 53.74 O ATOM 2313 CG2 THR B 98 44.377 15.973 -34.891 1.00 50.59 C ATOM 0 H THR B 98 44.889 14.962 -37.996 1.00 45.95 H new ATOM 0 HA THR B 98 44.883 17.495 -37.072 1.00 49.55 H new ATOM 0 HB THR B 98 46.245 16.765 -35.259 1.00 51.21 H new ATOM 0 HG1 THR B 98 46.487 14.562 -35.033 1.00 53.74 H new ATOM 0 HG21 THR B 98 44.591 15.635 -34.007 1.00 50.59 H new ATOM 0 HG22 THR B 98 43.941 16.836 -34.810 1.00 50.59 H new ATOM 0 HG23 THR B 98 43.782 15.352 -35.339 1.00 50.59 H new ATOM 2314 N CYS B 99 47.034 16.143 -38.861 1.00 50.89 N ATOM 2315 CA CYS B 99 48.335 16.209 -39.549 1.00 51.68 C ATOM 2316 C CYS B 99 48.475 17.387 -40.524 1.00 52.59 C ATOM 2317 O CYS B 99 49.588 17.714 -40.953 1.00 52.35 O ATOM 2318 CB CYS B 99 48.632 14.887 -40.281 1.00 52.27 C ATOM 2319 SG CYS B 99 47.839 14.700 -41.909 1.00 54.83 S ATOM 0 H CYS B 99 46.505 15.541 -39.174 1.00 50.89 H new ATOM 0 HA CYS B 99 48.988 16.357 -38.848 1.00 51.68 H new ATOM 0 HB2 CYS B 99 49.592 14.807 -40.395 1.00 52.27 H new ATOM 0 HB3 CYS B 99 48.351 14.151 -39.715 1.00 52.27 H new ATOM 2320 N GLY B 100 47.346 17.999 -40.885 1.00 51.39 N ATOM 2321 CA GLY B 100 47.324 19.141 -41.798 1.00 50.42 C ATOM 2322 C GLY B 100 47.835 18.858 -43.207 1.00 47.94 C ATOM 2323 O GLY B 100 48.326 19.769 -43.879 1.00 47.11 O ATOM 0 H GLY B 100 46.568 17.761 -40.605 1.00 51.39 H new ATOM 0 HA2 GLY B 100 46.413 19.469 -41.860 1.00 50.42 H new ATOM 0 HA3 GLY B 100 47.857 19.854 -41.413 1.00 50.42 H new ATOM 2324 N SER B 101 47.716 17.603 -43.654 1.00 43.74 N ATOM 2325 CA SER B 101 48.151 17.199 -44.998 1.00 42.19 C ATOM 2326 C SER B 101 47.386 17.960 -46.071 1.00 41.38 C ATOM 2327 O SER B 101 46.234 18.345 -45.858 1.00 40.55 O ATOM 2328 CB SER B 101 47.953 15.697 -45.207 1.00 41.48 C ATOM 2329 OG SER B 101 48.392 15.307 -46.498 1.00 41.76 O ATOM 0 H SER B 101 47.381 16.963 -43.187 1.00 43.74 H new ATOM 0 HA SER B 101 49.095 17.410 -45.072 1.00 42.19 H new ATOM 0 HB2 SER B 101 48.444 15.204 -44.531 1.00 41.48 H new ATOM 0 HB3 SER B 101 47.016 15.471 -45.097 1.00 41.48 H new ATOM 0 HG SER B 101 48.278 14.481 -46.595 1.00 41.76 H new ATOM 2330 N SER B 102 48.027 18.192 -47.216 1.00 38.83 N ATOM 2331 CA SER B 102 47.367 18.899 -48.306 1.00 36.91 C ATOM 2332 C SER B 102 46.930 17.970 -49.436 1.00 34.17 C ATOM 2333 O SER B 102 46.204 18.390 -50.329 1.00 33.66 O ATOM 2334 CB SER B 102 48.228 20.055 -48.835 1.00 40.58 C ATOM 2335 OG SER B 102 48.323 21.103 -47.876 1.00 42.29 O ATOM 0 H SER B 102 48.836 17.950 -47.379 1.00 38.83 H new ATOM 0 HA SER B 102 46.557 19.278 -47.931 1.00 36.91 H new ATOM 0 HB2 SER B 102 49.116 19.729 -49.051 1.00 40.58 H new ATOM 0 HB3 SER B 102 47.844 20.398 -49.657 1.00 40.58 H new ATOM 0 HG SER B 102 48.846 20.873 -47.260 1.00 42.29 H new ATOM 2336 N ASP B 103 47.368 16.717 -49.402 1.00 35.43 N ATOM 2337 CA ASP B 103 46.856 15.735 -50.351 1.00 37.88 C ATOM 2338 C ASP B 103 45.730 14.949 -49.692 1.00 35.15 C ATOM 2339 O ASP B 103 45.939 14.203 -48.729 1.00 37.47 O ATOM 2340 CB ASP B 103 47.954 14.839 -50.936 1.00 41.96 C ATOM 2341 CG ASP B 103 48.705 15.505 -52.111 1.00 48.93 C ATOM 2342 OD1 ASP B 103 48.120 16.365 -52.831 1.00 48.13 O ATOM 2343 OD2 ASP B 103 49.889 15.148 -52.326 1.00 52.96 O ATOM 0 H ASP B 103 47.952 16.418 -48.847 1.00 35.43 H new ATOM 0 HA ASP B 103 46.496 16.203 -51.121 1.00 37.88 H new ATOM 0 HB2 ASP B 103 48.589 14.614 -50.238 1.00 41.96 H new ATOM 0 HB3 ASP B 103 47.559 14.007 -51.240 1.00 41.96 H new ATOM 2344 N LEU B 104 44.527 15.180 -50.209 1.00 31.05 N ATOM 2345 CA LEU B 104 43.295 14.643 -49.648 1.00 27.47 C ATOM 2346 C LEU B 104 42.616 13.708 -50.634 1.00 26.60 C ATOM 2347 O LEU B 104 43.010 13.609 -51.813 1.00 25.30 O ATOM 2348 CB LEU B 104 42.316 15.778 -49.317 1.00 27.37 C ATOM 2349 CG LEU B 104 42.864 17.011 -48.619 1.00 28.46 C ATOM 2350 CD1 LEU B 104 41.823 18.123 -48.640 1.00 28.51 C ATOM 2351 CD2 LEU B 104 43.294 16.651 -47.206 1.00 28.07 C ATOM 0 H LEU B 104 44.403 15.663 -50.910 1.00 31.05 H new ATOM 0 HA LEU B 104 43.530 14.158 -48.842 1.00 27.47 H new ATOM 0 HB2 LEU B 104 41.902 16.065 -50.146 1.00 27.37 H new ATOM 0 HB3 LEU B 104 41.611 15.410 -48.761 1.00 27.37 H new ATOM 0 HG LEU B 104 43.647 17.339 -49.088 1.00 28.46 H new ATOM 0 HD11 LEU B 104 42.178 18.907 -48.193 1.00 28.51 H new ATOM 0 HD12 LEU B 104 41.605 18.345 -49.559 1.00 28.51 H new ATOM 0 HD13 LEU B 104 41.022 17.825 -48.181 1.00 28.51 H new ATOM 0 HD21 LEU B 104 43.643 17.440 -46.763 1.00 28.07 H new ATOM 0 HD22 LEU B 104 42.531 16.314 -46.711 1.00 28.07 H new ATOM 0 HD23 LEU B 104 43.983 15.969 -47.241 1.00 28.07 H new ATOM 2352 N TYR B 105 41.572 13.050 -50.146 1.00 24.25 N ATOM 2353 CA TYR B 105 40.849 12.053 -50.912 1.00 24.88 C ATOM 2354 C TYR B 105 39.373 12.241 -50.652 1.00 23.14 C ATOM 2355 O TYR B 105 38.952 12.262 -49.514 1.00 22.16 O ATOM 2356 CB TYR B 105 41.280 10.652 -50.496 1.00 28.71 C ATOM 2357 CG TYR B 105 42.720 10.408 -50.830 1.00 30.76 C ATOM 2358 CD1 TYR B 105 43.084 9.953 -52.094 1.00 33.57 C ATOM 2359 CD2 TYR B 105 43.724 10.691 -49.908 1.00 32.92 C ATOM 2360 CE1 TYR B 105 44.414 9.760 -52.429 1.00 36.79 C ATOM 2361 CE2 TYR B 105 45.061 10.504 -50.233 1.00 37.08 C ATOM 2362 CZ TYR B 105 45.397 10.035 -51.494 1.00 38.38 C ATOM 2363 OH TYR B 105 46.722 9.838 -51.828 1.00 41.42 O ATOM 0 H TYR B 105 41.263 13.173 -49.353 1.00 24.25 H new ATOM 0 HA TYR B 105 41.039 12.158 -51.857 1.00 24.88 H new ATOM 0 HB2 TYR B 105 41.142 10.538 -49.543 1.00 28.71 H new ATOM 0 HB3 TYR B 105 40.725 9.994 -50.943 1.00 28.71 H new ATOM 0 HD1 TYR B 105 42.423 9.776 -52.724 1.00 33.57 H new ATOM 0 HD2 TYR B 105 43.496 11.009 -49.064 1.00 32.92 H new ATOM 0 HE1 TYR B 105 44.645 9.448 -53.274 1.00 36.79 H new ATOM 0 HE2 TYR B 105 45.726 10.692 -49.610 1.00 37.08 H new ATOM 0 HH TYR B 105 47.209 10.043 -51.175 1.00 41.42 H new ATOM 2364 N LEU B 106 38.616 12.421 -51.720 1.00 22.33 N ATOM 2365 CA LEU B 106 37.174 12.533 -51.635 1.00 23.20 C ATOM 2366 C LEU B 106 36.549 11.151 -51.891 1.00 21.63 C ATOM 2367 O LEU B 106 36.899 10.472 -52.866 1.00 20.92 O ATOM 2368 CB LEU B 106 36.682 13.561 -52.665 1.00 24.93 C ATOM 2369 CG LEU B 106 35.176 13.705 -52.888 1.00 28.51 C ATOM 2370 CD1 LEU B 106 34.507 14.268 -51.646 1.00 28.97 C ATOM 2371 CD2 LEU B 106 34.884 14.585 -54.100 1.00 31.76 C ATOM 0 H LEU B 106 38.927 12.482 -52.520 1.00 22.33 H new ATOM 0 HA LEU B 106 36.909 12.835 -50.752 1.00 23.20 H new ATOM 0 HB2 LEU B 106 37.026 14.429 -52.403 1.00 24.93 H new ATOM 0 HB3 LEU B 106 37.087 13.341 -53.518 1.00 24.93 H new ATOM 0 HG LEU B 106 34.811 12.823 -53.063 1.00 28.51 H new ATOM 0 HD11 LEU B 106 33.554 14.354 -51.802 1.00 28.97 H new ATOM 0 HD12 LEU B 106 34.659 13.670 -50.897 1.00 28.97 H new ATOM 0 HD13 LEU B 106 34.881 15.140 -51.444 1.00 28.97 H new ATOM 0 HD21 LEU B 106 33.925 14.661 -54.221 1.00 31.76 H new ATOM 0 HD22 LEU B 106 35.263 15.467 -53.959 1.00 31.76 H new ATOM 0 HD23 LEU B 106 35.279 14.187 -54.892 1.00 31.76 H new ATOM 2372 N VAL B 107 35.644 10.729 -51.015 1.00 21.06 N ATOM 2373 CA VAL B 107 34.935 9.470 -51.223 1.00 21.21 C ATOM 2374 C VAL B 107 33.574 9.824 -51.816 1.00 21.38 C ATOM 2375 O VAL B 107 32.805 10.582 -51.217 1.00 21.80 O ATOM 2376 CB VAL B 107 34.778 8.647 -49.934 1.00 22.35 C ATOM 2377 CG1 VAL B 107 34.143 7.295 -50.252 1.00 21.98 C ATOM 2378 CG2 VAL B 107 36.138 8.424 -49.287 1.00 22.77 C ATOM 0 H VAL B 107 35.426 11.152 -50.299 1.00 21.06 H new ATOM 0 HA VAL B 107 35.448 8.905 -51.822 1.00 21.21 H new ATOM 0 HB VAL B 107 34.207 9.136 -49.321 1.00 22.35 H new ATOM 0 HG11 VAL B 107 34.047 6.782 -49.434 1.00 21.98 H new ATOM 0 HG12 VAL B 107 33.270 7.433 -50.651 1.00 21.98 H new ATOM 0 HG13 VAL B 107 34.708 6.810 -50.873 1.00 21.98 H new ATOM 0 HG21 VAL B 107 36.029 7.904 -48.475 1.00 22.77 H new ATOM 0 HG22 VAL B 107 36.715 7.945 -49.902 1.00 22.77 H new ATOM 0 HG23 VAL B 107 36.538 9.281 -49.071 1.00 22.77 H new ATOM 2379 N THR B 108 33.300 9.325 -53.014 1.00 20.29 N ATOM 2380 CA THR B 108 32.048 9.669 -53.685 1.00 20.23 C ATOM 2381 C THR B 108 30.965 8.648 -53.410 1.00 20.10 C ATOM 2382 O THR B 108 31.209 7.576 -52.866 1.00 18.97 O ATOM 2383 CB THR B 108 32.200 9.763 -55.214 1.00 20.67 C ATOM 2384 OG1 THR B 108 32.269 8.438 -55.740 1.00 21.88 O ATOM 2385 CG2 THR B 108 33.440 10.568 -55.604 1.00 20.50 C ATOM 0 H THR B 108 33.815 8.793 -53.452 1.00 20.29 H new ATOM 0 HA THR B 108 31.803 10.536 -53.325 1.00 20.23 H new ATOM 0 HB THR B 108 31.435 10.229 -55.586 1.00 20.67 H new ATOM 0 HG1 THR B 108 32.040 8.445 -56.548 1.00 21.88 H new ATOM 0 HG21 THR B 108 33.508 10.609 -56.571 1.00 20.50 H new ATOM 0 HG22 THR B 108 33.368 11.467 -55.247 1.00 20.50 H new ATOM 0 HG23 THR B 108 34.231 10.139 -55.242 1.00 20.50 H new ATOM 2386 N ARG B 109 29.762 9.004 -53.826 1.00 21.30 N ATOM 2387 CA ARG B 109 28.591 8.152 -53.736 1.00 23.47 C ATOM 2388 C ARG B 109 28.805 6.775 -54.392 1.00 25.30 C ATOM 2389 O ARG B 109 28.332 5.755 -53.891 1.00 25.24 O ATOM 2390 CB ARG B 109 27.440 8.908 -54.394 1.00 22.44 C ATOM 2391 CG ARG B 109 26.173 8.117 -54.587 1.00 22.75 C ATOM 2392 CD ARG B 109 25.262 8.317 -53.411 1.00 20.32 C ATOM 2393 NE ARG B 109 23.926 7.810 -53.687 1.00 18.07 N ATOM 2394 CZ ARG B 109 22.835 8.551 -53.741 1.00 17.84 C ATOM 2395 NH1 ARG B 109 22.891 9.873 -53.547 1.00 17.43 N ATOM 2396 NH2 ARG B 109 21.678 7.952 -53.983 1.00 16.96 N ATOM 0 H ARG B 109 29.599 9.771 -54.179 1.00 21.30 H new ATOM 0 HA ARG B 109 28.397 7.961 -52.805 1.00 23.47 H new ATOM 0 HB2 ARG B 109 27.237 9.689 -53.856 1.00 22.44 H new ATOM 0 HB3 ARG B 109 27.737 9.230 -55.259 1.00 22.44 H new ATOM 0 HG2 ARG B 109 25.728 8.397 -55.402 1.00 22.75 H new ATOM 0 HG3 ARG B 109 26.382 7.175 -54.688 1.00 22.75 H new ATOM 0 HD2 ARG B 109 25.628 7.865 -52.635 1.00 20.32 H new ATOM 0 HD3 ARG B 109 25.214 9.261 -53.193 1.00 20.32 H new ATOM 0 HE ARG B 109 23.841 6.965 -53.825 1.00 18.07 H new ATOM 0 HH11 ARG B 109 23.646 10.252 -53.384 1.00 17.43 H new ATOM 0 HH12 ARG B 109 22.172 10.344 -53.585 1.00 17.43 H new ATOM 0 HH21 ARG B 109 21.651 7.100 -54.100 1.00 16.96 H new ATOM 0 HH22 ARG B 109 20.954 8.415 -54.023 1.00 16.96 H new ATOM 2397 N HIS B 110 29.538 6.730 -55.494 1.00 28.40 N ATOM 2398 CA HIS B 110 29.835 5.428 -56.106 1.00 30.58 C ATOM 2399 C HIS B 110 31.005 4.721 -55.465 1.00 29.94 C ATOM 2400 O HIS B 110 31.505 3.737 -55.995 1.00 31.24 O ATOM 2401 CB HIS B 110 30.013 5.570 -57.606 1.00 35.26 C ATOM 2402 CG HIS B 110 28.913 6.362 -58.268 1.00 40.65 C ATOM 2403 ND1 HIS B 110 29.159 7.307 -59.198 1.00 44.78 N ATOM 2404 CD2 HIS B 110 27.525 6.337 -58.082 1.00 42.94 C ATOM 2405 CE1 HIS B 110 27.991 7.851 -59.603 1.00 47.36 C ATOM 2406 NE2 HIS B 110 26.993 7.261 -58.912 1.00 48.01 N ATOM 0 H HIS B 110 29.867 7.414 -55.898 1.00 28.40 H new ATOM 0 HA HIS B 110 29.067 4.859 -55.942 1.00 30.58 H new ATOM 0 HB2 HIS B 110 30.864 6.000 -57.785 1.00 35.26 H new ATOM 0 HB3 HIS B 110 30.052 4.687 -58.005 1.00 35.26 H new ATOM 0 HD2 HIS B 110 27.057 5.787 -57.496 1.00 42.94 H new ATOM 0 HE1 HIS B 110 27.892 8.516 -60.246 1.00 47.36 H new ATOM 0 HE2 HIS B 110 26.156 7.443 -58.988 1.00 48.01 H new ATOM 2407 N ALA B 111 31.425 5.207 -54.299 1.00 27.66 N ATOM 2408 CA ALA B 111 32.531 4.626 -53.526 1.00 27.79 C ATOM 2409 C ALA B 111 33.892 4.692 -54.248 1.00 27.22 C ATOM 2410 O ALA B 111 34.788 3.916 -53.965 1.00 26.29 O ATOM 2411 CB ALA B 111 32.208 3.204 -53.086 1.00 27.29 C ATOM 0 H ALA B 111 31.071 5.896 -53.925 1.00 27.66 H new ATOM 0 HA ALA B 111 32.623 5.181 -52.736 1.00 27.79 H new ATOM 0 HB1 ALA B 111 32.953 2.845 -52.579 1.00 27.29 H new ATOM 0 HB2 ALA B 111 31.412 3.210 -52.531 1.00 27.29 H new ATOM 0 HB3 ALA B 111 32.053 2.651 -53.867 1.00 27.29 H new ATOM 2412 N ASP B 112 34.035 5.629 -55.173 1.00 26.81 N ATOM 2413 CA ASP B 112 35.339 5.928 -55.741 1.00 29.27 C ATOM 2414 C ASP B 112 36.058 6.893 -54.806 1.00 27.95 C ATOM 2415 O ASP B 112 35.433 7.739 -54.150 1.00 26.50 O ATOM 2416 CB ASP B 112 35.205 6.561 -57.124 1.00 30.95 C ATOM 2417 CG ASP B 112 34.374 5.721 -58.067 1.00 35.09 C ATOM 2418 OD1 ASP B 112 34.612 4.490 -58.169 1.00 35.59 O ATOM 2419 OD2 ASP B 112 33.481 6.301 -58.716 1.00 40.13 O ATOM 0 H ASP B 112 33.389 6.103 -55.486 1.00 26.81 H new ATOM 0 HA ASP B 112 35.841 5.104 -55.837 1.00 29.27 H new ATOM 0 HB2 ASP B 112 34.802 7.439 -57.037 1.00 30.95 H new ATOM 0 HB3 ASP B 112 36.088 6.691 -57.504 1.00 30.95 H new ATOM 2420 N VAL B 113 37.368 6.726 -54.716 1.00 27.25 N ATOM 2421 CA VAL B 113 38.187 7.584 -53.894 1.00 26.48 C ATOM 2422 C VAL B 113 39.005 8.426 -54.850 1.00 27.60 C ATOM 2423 O VAL B 113 39.804 7.883 -55.620 1.00 28.24 O ATOM 2424 CB VAL B 113 39.103 6.744 -52.993 1.00 27.77 C ATOM 2425 CG1 VAL B 113 39.952 7.639 -52.106 1.00 27.23 C ATOM 2426 CG2 VAL B 113 38.276 5.804 -52.137 1.00 27.19 C ATOM 0 H VAL B 113 37.803 6.111 -55.131 1.00 27.25 H new ATOM 0 HA VAL B 113 37.646 8.140 -53.311 1.00 26.48 H new ATOM 0 HB VAL B 113 39.692 6.222 -53.560 1.00 27.77 H new ATOM 0 HG11 VAL B 113 40.523 7.091 -51.545 1.00 27.23 H new ATOM 0 HG12 VAL B 113 40.501 8.216 -52.659 1.00 27.23 H new ATOM 0 HG13 VAL B 113 39.375 8.182 -51.546 1.00 27.23 H new ATOM 0 HG21 VAL B 113 38.864 5.279 -51.572 1.00 27.19 H new ATOM 0 HG22 VAL B 113 37.671 6.320 -51.582 1.00 27.19 H new ATOM 0 HG23 VAL B 113 37.763 5.212 -52.709 1.00 27.19 H new ATOM 2427 N ILE B 114 38.788 9.739 -54.839 1.00 25.34 N ATOM 2428 CA ILE B 114 39.463 10.600 -55.801 1.00 25.46 C ATOM 2429 C ILE B 114 40.401 11.618 -55.149 1.00 25.23 C ATOM 2430 O ILE B 114 40.065 12.223 -54.120 1.00 23.87 O ATOM 2431 CB ILE B 114 38.498 11.266 -56.813 1.00 27.12 C ATOM 2432 CG1 ILE B 114 37.578 12.280 -56.150 1.00 27.59 C ATOM 2433 CG2 ILE B 114 37.661 10.220 -57.558 1.00 27.79 C ATOM 2434 CD1 ILE B 114 36.899 13.170 -57.173 1.00 29.90 C ATOM 0 H ILE B 114 38.263 10.144 -54.292 1.00 25.34 H new ATOM 0 HA ILE B 114 40.026 10.001 -56.316 1.00 25.46 H new ATOM 0 HB ILE B 114 39.056 11.738 -57.451 1.00 27.12 H new ATOM 0 HG12 ILE B 114 36.906 11.815 -55.628 1.00 27.59 H new ATOM 0 HG13 ILE B 114 38.089 12.827 -55.533 1.00 27.59 H new ATOM 0 HG21 ILE B 114 37.068 10.665 -58.183 1.00 27.79 H new ATOM 0 HG22 ILE B 114 38.249 9.620 -58.043 1.00 27.79 H new ATOM 0 HG23 ILE B 114 37.136 9.712 -56.920 1.00 27.79 H new ATOM 0 HD11 ILE B 114 36.321 13.803 -56.719 1.00 29.90 H new ATOM 0 HD12 ILE B 114 37.571 13.652 -57.680 1.00 29.90 H new ATOM 0 HD13 ILE B 114 36.370 12.625 -57.776 1.00 29.90 H new ATOM 2435 N PRO B 115 41.590 11.814 -55.752 1.00 24.00 N ATOM 2436 CA PRO B 115 42.562 12.724 -55.155 1.00 23.03 C ATOM 2437 C PRO B 115 42.168 14.195 -55.269 1.00 22.26 C ATOM 2438 O PRO B 115 41.738 14.657 -56.326 1.00 21.08 O ATOM 2439 CB PRO B 115 43.846 12.438 -55.955 1.00 23.84 C ATOM 2440 CG PRO B 115 43.370 11.876 -57.250 1.00 24.73 C ATOM 2441 CD PRO B 115 42.171 11.049 -56.874 1.00 25.16 C ATOM 0 HA PRO B 115 42.648 12.578 -54.200 1.00 23.03 H new ATOM 0 HB2 PRO B 115 44.363 13.247 -56.091 1.00 23.84 H new ATOM 0 HB3 PRO B 115 44.419 11.810 -55.488 1.00 23.84 H new ATOM 0 HG2 PRO B 115 43.134 12.578 -57.876 1.00 24.73 H new ATOM 0 HG3 PRO B 115 44.054 11.336 -57.675 1.00 24.73 H new ATOM 0 HD2 PRO B 115 41.548 10.962 -57.612 1.00 25.16 H new ATOM 0 HD3 PRO B 115 42.422 10.151 -56.607 1.00 25.16 H new ATOM 2442 N VAL B 116 42.352 14.922 -54.170 1.00 21.20 N ATOM 2443 CA VAL B 116 42.063 16.343 -54.095 1.00 21.01 C ATOM 2444 C VAL B 116 43.257 17.076 -53.475 1.00 20.95 C ATOM 2445 O VAL B 116 43.865 16.586 -52.522 1.00 21.73 O ATOM 2446 CB VAL B 116 40.825 16.578 -53.194 1.00 21.73 C ATOM 2447 CG1 VAL B 116 40.648 18.054 -52.842 1.00 21.34 C ATOM 2448 CG2 VAL B 116 39.570 16.008 -53.842 1.00 22.67 C ATOM 0 H VAL B 116 42.654 14.593 -53.435 1.00 21.20 H new ATOM 0 HA VAL B 116 41.892 16.677 -54.990 1.00 21.01 H new ATOM 0 HB VAL B 116 40.976 16.106 -52.360 1.00 21.73 H new ATOM 0 HG11 VAL B 116 39.865 18.161 -52.279 1.00 21.34 H new ATOM 0 HG12 VAL B 116 41.433 18.370 -52.368 1.00 21.34 H new ATOM 0 HG13 VAL B 116 40.533 18.569 -53.656 1.00 21.34 H new ATOM 0 HG21 VAL B 116 38.807 16.165 -53.264 1.00 22.67 H new ATOM 0 HG22 VAL B 116 39.422 16.442 -54.697 1.00 22.67 H new ATOM 0 HG23 VAL B 116 39.681 15.054 -53.979 1.00 22.67 H new ATOM 2449 N ARG B 117 43.547 18.270 -53.981 1.00 20.77 N ATOM 2450 CA ARG B 117 44.633 19.088 -53.460 1.00 22.23 C ATOM 2451 C ARG B 117 44.026 20.237 -52.695 1.00 22.15 C ATOM 2452 O ARG B 117 43.318 21.056 -53.272 1.00 22.42 O ATOM 2453 CB ARG B 117 45.494 19.628 -54.612 1.00 21.92 C ATOM 2454 CG ARG B 117 46.486 20.736 -54.238 1.00 23.67 C ATOM 2455 CD ARG B 117 47.692 20.227 -53.457 1.00 22.71 C ATOM 2456 NE ARG B 117 48.461 19.195 -54.157 1.00 23.32 N ATOM 2457 CZ ARG B 117 49.521 19.413 -54.945 1.00 24.22 C ATOM 2458 NH1 ARG B 117 49.970 20.641 -55.181 1.00 22.62 N ATOM 2459 NH2 ARG B 117 50.143 18.378 -55.499 1.00 23.49 N ATOM 0 H ARG B 117 43.119 18.628 -54.636 1.00 20.77 H new ATOM 0 HA ARG B 117 45.200 18.556 -52.881 1.00 22.23 H new ATOM 0 HB2 ARG B 117 45.990 18.889 -54.997 1.00 21.92 H new ATOM 0 HB3 ARG B 117 44.904 19.965 -55.304 1.00 21.92 H new ATOM 0 HG2 ARG B 117 46.794 21.173 -55.048 1.00 23.67 H new ATOM 0 HG3 ARG B 117 46.027 21.408 -53.710 1.00 23.67 H new ATOM 0 HD2 ARG B 117 48.277 20.975 -53.259 1.00 22.71 H new ATOM 0 HD3 ARG B 117 47.389 19.871 -52.607 1.00 22.71 H new ATOM 0 HE ARG B 117 48.210 18.379 -54.053 1.00 23.32 H new ATOM 0 HH11 ARG B 117 49.578 21.318 -54.824 1.00 22.62 H new ATOM 0 HH12 ARG B 117 50.653 20.759 -55.690 1.00 22.62 H new ATOM 0 HH21 ARG B 117 49.864 17.578 -55.350 1.00 23.49 H new ATOM 0 HH22 ARG B 117 50.825 18.508 -56.007 1.00 23.49 H new ATOM 2460 N ARG B 118 44.300 20.308 -51.401 1.00 23.14 N ATOM 2461 CA ARG B 118 43.778 21.411 -50.599 1.00 26.93 C ATOM 2462 C ARG B 118 44.331 22.768 -51.040 1.00 28.68 C ATOM 2463 O ARG B 118 45.544 22.927 -51.216 1.00 28.41 O ATOM 2464 CB ARG B 118 44.053 21.178 -49.115 1.00 28.75 C ATOM 2465 CG ARG B 118 43.296 22.133 -48.211 1.00 30.09 C ATOM 2466 CD ARG B 118 43.392 21.721 -46.753 1.00 31.08 C ATOM 2467 NE ARG B 118 42.343 22.374 -45.974 1.00 32.97 N ATOM 2468 CZ ARG B 118 42.038 22.070 -44.717 1.00 34.97 C ATOM 2469 NH1 ARG B 118 42.696 21.103 -44.086 1.00 34.90 N ATOM 2470 NH2 ARG B 118 41.065 22.730 -44.093 1.00 37.31 N ATOM 0 H ARG B 118 44.779 19.738 -50.970 1.00 23.14 H new ATOM 0 HA ARG B 118 42.819 21.434 -50.742 1.00 26.93 H new ATOM 0 HB2 ARG B 118 43.813 20.266 -48.887 1.00 28.75 H new ATOM 0 HB3 ARG B 118 45.004 21.271 -48.950 1.00 28.75 H new ATOM 0 HG2 ARG B 118 43.650 23.030 -48.318 1.00 30.09 H new ATOM 0 HG3 ARG B 118 42.364 22.162 -48.479 1.00 30.09 H new ATOM 0 HD2 ARG B 118 43.309 20.758 -46.676 1.00 31.08 H new ATOM 0 HD3 ARG B 118 44.263 21.960 -46.399 1.00 31.08 H new ATOM 0 HE ARG B 118 41.891 22.999 -46.355 1.00 32.97 H new ATOM 0 HH11 ARG B 118 43.321 20.673 -44.491 1.00 34.90 H new ATOM 0 HH12 ARG B 118 42.497 20.908 -43.272 1.00 34.90 H new ATOM 0 HH21 ARG B 118 40.635 23.352 -44.503 1.00 37.31 H new ATOM 0 HH22 ARG B 118 40.866 22.535 -43.279 1.00 37.31 H new ATOM 2471 N ARG B 119 43.425 23.728 -51.224 1.00 30.15 N ATOM 2472 CA ARG B 119 43.764 25.096 -51.581 1.00 35.16 C ATOM 2473 C ARG B 119 43.047 26.035 -50.623 1.00 37.97 C ATOM 2474 O ARG B 119 42.107 26.729 -51.019 1.00 44.97 O ATOM 2475 CB ARG B 119 43.288 25.416 -52.996 1.00 37.55 C ATOM 2476 CG ARG B 119 43.426 24.298 -54.021 1.00 43.97 C ATOM 2477 CD ARG B 119 44.621 24.515 -54.932 1.00 47.80 C ATOM 2478 NE ARG B 119 44.729 25.907 -55.384 1.00 54.63 N ATOM 2479 CZ ARG B 119 43.923 26.479 -56.276 1.00 55.66 C ATOM 2480 NH1 ARG B 119 42.923 25.796 -56.822 1.00 62.23 N ATOM 2481 NH2 ARG B 119 44.111 27.744 -56.615 1.00 58.16 N ATOM 0 H ARG B 119 42.579 23.595 -51.142 1.00 30.15 H new ATOM 0 HA ARG B 119 44.727 25.204 -51.532 1.00 35.16 H new ATOM 0 HB2 ARG B 119 42.354 25.676 -52.952 1.00 37.55 H new ATOM 0 HB3 ARG B 119 43.782 26.187 -53.317 1.00 37.55 H new ATOM 0 HG2 ARG B 119 43.518 23.448 -53.563 1.00 43.97 H new ATOM 0 HG3 ARG B 119 42.617 24.246 -54.554 1.00 43.97 H new ATOM 0 HD2 ARG B 119 45.433 24.265 -54.463 1.00 47.80 H new ATOM 0 HD3 ARG B 119 44.548 23.931 -55.703 1.00 47.80 H new ATOM 0 HE ARG B 119 45.358 26.388 -55.049 1.00 54.63 H new ATOM 0 HH11 ARG B 119 42.791 24.976 -56.600 1.00 62.23 H new ATOM 0 HH12 ARG B 119 42.408 26.174 -57.397 1.00 62.23 H new ATOM 0 HH21 ARG B 119 44.752 28.194 -56.259 1.00 58.16 H new ATOM 0 HH22 ARG B 119 43.592 28.117 -57.191 1.00 58.16 H new ATOM 2482 N GLY B 120 43.454 26.041 -49.362 1.00 38.95 N ATOM 2483 CA GLY B 120 42.802 26.894 -48.365 1.00 38.91 C ATOM 2484 C GLY B 120 41.901 26.130 -47.413 1.00 39.81 C ATOM 2485 O GLY B 120 41.777 24.899 -47.496 1.00 38.12 O ATOM 0 H GLY B 120 44.102 25.563 -49.059 1.00 38.95 H new ATOM 0 HA2 GLY B 120 43.482 27.359 -47.853 1.00 38.91 H new ATOM 0 HA3 GLY B 120 42.279 27.571 -48.821 1.00 38.91 H new ATOM 2486 N ASP B 121 41.260 26.866 -46.509 1.00 39.24 N ATOM 2487 CA ASP B 121 40.458 26.253 -45.456 1.00 41.19 C ATOM 2488 C ASP B 121 39.340 25.354 -45.997 1.00 38.52 C ATOM 2489 O ASP B 121 39.150 24.249 -45.488 1.00 39.58 O ATOM 2490 CB ASP B 121 39.877 27.322 -44.513 1.00 45.23 C ATOM 2491 CG ASP B 121 40.946 27.992 -43.644 1.00 49.96 C ATOM 2492 OD1 ASP B 121 41.987 27.360 -43.344 1.00 50.84 O ATOM 2493 OD2 ASP B 121 40.734 29.161 -43.251 1.00 53.24 O ATOM 0 H ASP B 121 41.277 27.726 -46.489 1.00 39.24 H new ATOM 0 HA ASP B 121 41.061 25.681 -44.956 1.00 41.19 H new ATOM 0 HB2 ASP B 121 39.423 27.999 -45.039 1.00 45.23 H new ATOM 0 HB3 ASP B 121 39.210 26.913 -43.940 1.00 45.23 H new ATOM 2494 N SER B 122 38.639 25.813 -47.036 1.00 34.42 N ATOM 2495 CA SER B 122 37.422 25.144 -47.502 1.00 33.68 C ATOM 2496 C SER B 122 37.334 24.823 -49.007 1.00 30.49 C ATOM 2497 O SER B 122 36.239 24.597 -49.518 1.00 26.43 O ATOM 2498 CB SER B 122 36.192 25.955 -47.061 1.00 33.43 C ATOM 2499 OG SER B 122 36.342 27.320 -47.387 1.00 37.60 O ATOM 0 H SER B 122 38.853 26.514 -47.486 1.00 34.42 H new ATOM 0 HA SER B 122 37.451 24.270 -47.083 1.00 33.68 H new ATOM 0 HB2 SER B 122 35.397 25.602 -47.490 1.00 33.43 H new ATOM 0 HB3 SER B 122 36.064 25.860 -46.104 1.00 33.43 H new ATOM 0 HG SER B 122 35.660 27.744 -47.140 1.00 37.60 H new ATOM 2500 N ARG B 123 38.472 24.806 -49.706 1.00 29.32 N ATOM 2501 CA ARG B 123 38.499 24.489 -51.133 1.00 31.12 C ATOM 2502 C ARG B 123 39.600 23.499 -51.444 1.00 29.13 C ATOM 2503 O ARG B 123 40.651 23.496 -50.796 1.00 30.26 O ATOM 2504 CB ARG B 123 38.704 25.745 -51.988 1.00 33.76 C ATOM 2505 CG ARG B 123 37.531 26.703 -51.989 1.00 41.09 C ATOM 2506 CD ARG B 123 36.385 26.182 -52.835 1.00 43.71 C ATOM 2507 NE ARG B 123 36.255 26.922 -54.085 1.00 48.38 N ATOM 2508 CZ ARG B 123 35.352 27.875 -54.305 1.00 47.70 C ATOM 2509 NH1 ARG B 123 34.488 28.216 -53.358 1.00 50.23 N ATOM 2510 NH2 ARG B 123 35.314 28.489 -55.478 1.00 49.28 N ATOM 0 H ARG B 123 39.244 24.977 -49.367 1.00 29.32 H new ATOM 0 HA ARG B 123 37.638 24.099 -51.350 1.00 31.12 H new ATOM 0 HB2 ARG B 123 39.490 26.215 -51.669 1.00 33.76 H new ATOM 0 HB3 ARG B 123 38.887 25.474 -52.901 1.00 33.76 H new ATOM 0 HG2 ARG B 123 37.225 26.842 -51.079 1.00 41.09 H new ATOM 0 HG3 ARG B 123 37.817 27.566 -52.327 1.00 41.09 H new ATOM 0 HD2 ARG B 123 36.527 25.242 -53.029 1.00 43.71 H new ATOM 0 HD3 ARG B 123 35.557 26.246 -52.333 1.00 43.71 H new ATOM 0 HE ARG B 123 36.798 26.730 -54.723 1.00 48.38 H new ATOM 0 HH11 ARG B 123 34.508 27.820 -52.595 1.00 50.23 H new ATOM 0 HH12 ARG B 123 33.907 28.833 -53.507 1.00 50.23 H new ATOM 0 HH21 ARG B 123 35.872 28.272 -56.095 1.00 49.28 H new ATOM 0 HH22 ARG B 123 34.731 29.105 -55.622 1.00 49.28 H new ATOM 2511 N GLY B 124 39.346 22.651 -52.427 1.00 27.49 N ATOM 2512 CA GLY B 124 40.358 21.743 -52.957 1.00 27.73 C ATOM 2513 C GLY B 124 40.123 21.531 -54.438 1.00 29.27 C ATOM 2514 O GLY B 124 38.979 21.441 -54.874 1.00 29.87 O ATOM 0 H GLY B 124 38.579 22.583 -52.810 1.00 27.49 H new ATOM 0 HA2 GLY B 124 41.244 22.110 -52.810 1.00 27.73 H new ATOM 0 HA3 GLY B 124 40.321 20.894 -52.489 1.00 27.73 H new ATOM 2515 N SER B 125 41.193 21.461 -55.226 1.00 27.51 N ATOM 2516 CA SER B 125 41.038 21.260 -56.660 1.00 25.45 C ATOM 2517 C SER B 125 41.122 19.771 -56.943 1.00 24.28 C ATOM 2518 O SER B 125 41.796 19.023 -56.237 1.00 21.51 O ATOM 2519 CB SER B 125 42.115 22.019 -57.437 1.00 28.81 C ATOM 2520 OG SER B 125 43.383 21.709 -56.897 1.00 31.13 O ATOM 0 H SER B 125 42.006 21.527 -54.953 1.00 27.51 H new ATOM 0 HA SER B 125 40.178 21.604 -56.948 1.00 25.45 H new ATOM 0 HB2 SER B 125 42.083 21.777 -58.376 1.00 28.81 H new ATOM 0 HB3 SER B 125 41.954 22.974 -57.385 1.00 28.81 H new ATOM 0 HG SER B 125 43.978 22.123 -57.322 1.00 31.13 H new ATOM 2521 N LEU B 126 40.402 19.333 -57.962 1.00 23.74 N ATOM 2522 CA LEU B 126 40.490 17.953 -58.386 1.00 25.51 C ATOM 2523 C LEU B 126 41.775 17.764 -59.202 1.00 27.90 C ATOM 2524 O LEU B 126 41.986 18.439 -60.199 1.00 28.34 O ATOM 2525 CB LEU B 126 39.254 17.579 -59.206 1.00 25.85 C ATOM 2526 CG LEU B 126 37.898 17.633 -58.500 1.00 25.18 C ATOM 2527 CD1 LEU B 126 36.913 16.851 -59.355 1.00 28.10 C ATOM 2528 CD2 LEU B 126 37.986 16.987 -57.140 1.00 27.04 C ATOM 0 H LEU B 126 39.859 19.818 -58.419 1.00 23.74 H new ATOM 0 HA LEU B 126 40.521 17.368 -57.613 1.00 25.51 H new ATOM 0 HB2 LEU B 126 39.215 18.169 -59.975 1.00 25.85 H new ATOM 0 HB3 LEU B 126 39.380 16.679 -59.545 1.00 25.85 H new ATOM 0 HG LEU B 126 37.618 18.555 -58.385 1.00 25.18 H new ATOM 0 HD11 LEU B 126 36.038 16.864 -58.936 1.00 28.10 H new ATOM 0 HD12 LEU B 126 36.855 17.256 -60.235 1.00 28.10 H new ATOM 0 HD13 LEU B 126 37.216 15.934 -59.441 1.00 28.10 H new ATOM 0 HD21 LEU B 126 37.120 17.029 -56.705 1.00 27.04 H new ATOM 0 HD22 LEU B 126 38.253 16.060 -57.239 1.00 27.04 H new ATOM 0 HD23 LEU B 126 38.641 17.456 -56.600 1.00 27.04 H new ATOM 2529 N LEU B 127 42.628 16.848 -58.772 1.00 29.94 N ATOM 2530 CA LEU B 127 43.881 16.593 -59.495 1.00 32.93 C ATOM 2531 C LEU B 127 43.625 15.938 -60.845 1.00 34.66 C ATOM 2532 O LEU B 127 44.376 16.142 -61.809 1.00 37.29 O ATOM 2533 CB LEU B 127 44.842 15.777 -58.628 1.00 34.44 C ATOM 2534 CG LEU B 127 45.332 16.604 -57.432 1.00 34.31 C ATOM 2535 CD1 LEU B 127 45.872 15.718 -56.324 1.00 34.21 C ATOM 2536 CD2 LEU B 127 46.355 17.656 -57.868 1.00 35.33 C ATOM 0 H LEU B 127 42.509 16.363 -58.072 1.00 29.94 H new ATOM 0 HA LEU B 127 44.305 17.445 -59.681 1.00 32.93 H new ATOM 0 HB2 LEU B 127 44.397 14.975 -58.312 1.00 34.44 H new ATOM 0 HB3 LEU B 127 45.600 15.490 -59.160 1.00 34.44 H new ATOM 0 HG LEU B 127 44.567 17.077 -57.069 1.00 34.31 H new ATOM 0 HD11 LEU B 127 46.173 16.270 -55.585 1.00 34.21 H new ATOM 0 HD12 LEU B 127 45.172 15.121 -56.017 1.00 34.21 H new ATOM 0 HD13 LEU B 127 46.617 15.196 -56.661 1.00 34.21 H new ATOM 0 HD21 LEU B 127 46.647 18.163 -57.095 1.00 35.33 H new ATOM 0 HD22 LEU B 127 47.119 17.216 -58.274 1.00 35.33 H new ATOM 0 HD23 LEU B 127 45.948 18.256 -58.513 1.00 35.33 H new ATOM 2537 N SER B 128 42.532 15.187 -60.920 1.00 34.01 N ATOM 2538 CA SER B 128 42.096 14.595 -62.171 1.00 35.30 C ATOM 2539 C SER B 128 40.641 14.994 -62.437 1.00 32.73 C ATOM 2540 O SER B 128 39.728 14.378 -61.899 1.00 32.12 O ATOM 2541 CB SER B 128 42.251 13.074 -62.092 1.00 38.39 C ATOM 2542 OG SER B 128 43.545 12.720 -61.611 1.00 40.63 O ATOM 0 H SER B 128 42.026 15.009 -60.248 1.00 34.01 H new ATOM 0 HA SER B 128 42.640 14.918 -62.906 1.00 35.30 H new ATOM 0 HB2 SER B 128 41.572 12.706 -61.506 1.00 38.39 H new ATOM 0 HB3 SER B 128 42.110 12.685 -62.969 1.00 38.39 H new ATOM 0 HG SER B 128 43.611 11.883 -61.573 1.00 40.63 H new ATOM 2543 N PRO B 129 40.423 16.039 -63.251 1.00 32.00 N ATOM 2544 CA PRO B 129 39.050 16.541 -63.432 1.00 32.45 C ATOM 2545 C PRO B 129 38.114 15.440 -63.910 1.00 30.54 C ATOM 2546 O PRO B 129 38.532 14.542 -64.628 1.00 28.96 O ATOM 2547 CB PRO B 129 39.205 17.619 -64.511 1.00 32.05 C ATOM 2548 CG PRO B 129 40.639 18.034 -64.421 1.00 34.63 C ATOM 2549 CD PRO B 129 41.376 16.760 -64.113 1.00 33.50 C ATOM 0 HA PRO B 129 38.664 16.874 -62.607 1.00 32.45 H new ATOM 0 HB2 PRO B 129 38.992 17.271 -65.391 1.00 32.05 H new ATOM 0 HB3 PRO B 129 38.610 18.368 -64.351 1.00 32.05 H new ATOM 0 HG2 PRO B 129 40.946 18.429 -65.252 1.00 34.63 H new ATOM 0 HG3 PRO B 129 40.773 18.697 -63.726 1.00 34.63 H new ATOM 0 HD2 PRO B 129 41.584 16.260 -64.918 1.00 33.50 H new ATOM 0 HD3 PRO B 129 42.216 16.930 -63.659 1.00 33.50 H new ATOM 2550 N ARG B 130 36.878 15.490 -63.455 1.00 29.20 N ATOM 2551 CA ARG B 130 35.872 14.507 -63.835 1.00 29.60 C ATOM 2552 C ARG B 130 34.601 15.270 -64.181 1.00 27.20 C ATOM 2553 O ARG B 130 34.460 16.414 -63.777 1.00 27.64 O ATOM 2554 CB ARG B 130 35.630 13.526 -62.680 1.00 31.12 C ATOM 2555 CG ARG B 130 36.819 12.610 -62.433 1.00 33.15 C ATOM 2556 CD ARG B 130 36.379 11.287 -61.866 1.00 34.95 C ATOM 2557 NE ARG B 130 37.492 10.381 -61.619 1.00 35.24 N ATOM 2558 CZ ARG B 130 37.712 9.254 -62.290 1.00 37.19 C ATOM 2559 NH1 ARG B 130 36.899 8.873 -63.270 1.00 37.32 N ATOM 2560 NH2 ARG B 130 38.759 8.501 -61.980 1.00 38.66 N ATOM 0 H ARG B 130 36.593 16.095 -62.915 1.00 29.20 H new ATOM 0 HA ARG B 130 36.165 13.986 -64.599 1.00 29.60 H new ATOM 0 HB2 ARG B 130 35.437 14.025 -61.871 1.00 31.12 H new ATOM 0 HB3 ARG B 130 34.847 12.988 -62.875 1.00 31.12 H new ATOM 0 HG2 ARG B 130 37.297 12.465 -63.264 1.00 33.15 H new ATOM 0 HG3 ARG B 130 37.438 13.037 -61.820 1.00 33.15 H new ATOM 0 HD2 ARG B 130 35.900 11.439 -61.036 1.00 34.95 H new ATOM 0 HD3 ARG B 130 35.756 10.868 -62.480 1.00 34.95 H new ATOM 0 HE ARG B 130 38.046 10.589 -60.995 1.00 35.24 H new ATOM 0 HH11 ARG B 130 36.220 9.358 -63.478 1.00 37.32 H new ATOM 0 HH12 ARG B 130 37.052 8.142 -63.696 1.00 37.32 H new ATOM 0 HH21 ARG B 130 39.291 8.743 -61.349 1.00 38.66 H new ATOM 0 HH22 ARG B 130 38.906 7.771 -62.410 1.00 38.66 H new ATOM 2561 N PRO B 131 33.672 14.646 -64.933 1.00 27.17 N ATOM 2562 CA PRO B 131 32.417 15.349 -65.194 1.00 27.40 C ATOM 2563 C PRO B 131 31.684 15.564 -63.868 1.00 29.72 C ATOM 2564 O PRO B 131 31.779 14.714 -62.985 1.00 28.97 O ATOM 2565 CB PRO B 131 31.634 14.369 -66.072 1.00 27.66 C ATOM 2566 CG PRO B 131 32.641 13.408 -66.606 1.00 29.76 C ATOM 2567 CD PRO B 131 33.723 13.319 -65.573 1.00 26.66 C ATOM 0 HA PRO B 131 32.534 16.217 -65.611 1.00 27.40 H new ATOM 0 HB2 PRO B 131 30.953 13.909 -65.557 1.00 27.66 H new ATOM 0 HB3 PRO B 131 31.180 14.834 -66.792 1.00 27.66 H new ATOM 0 HG2 PRO B 131 32.241 12.539 -66.764 1.00 29.76 H new ATOM 0 HG3 PRO B 131 32.997 13.715 -67.455 1.00 29.76 H new ATOM 0 HD2 PRO B 131 33.556 12.606 -64.937 1.00 26.66 H new ATOM 0 HD3 PRO B 131 34.589 13.145 -65.973 1.00 26.66 H new ATOM 2568 N VAL B 132 30.969 16.677 -63.721 1.00 31.44 N ATOM 2569 CA VAL B 132 30.233 16.938 -62.479 1.00 33.35 C ATOM 2570 C VAL B 132 29.172 15.878 -62.206 1.00 33.71 C ATOM 2571 O VAL B 132 28.774 15.683 -61.057 1.00 32.70 O ATOM 2572 CB VAL B 132 29.613 18.351 -62.418 1.00 33.86 C ATOM 2573 CG1 VAL B 132 30.611 19.375 -62.907 1.00 36.08 C ATOM 2574 CG2 VAL B 132 28.347 18.449 -63.248 1.00 37.15 C ATOM 0 H VAL B 132 30.895 17.290 -64.320 1.00 31.44 H new ATOM 0 HA VAL B 132 30.900 16.891 -61.776 1.00 33.35 H new ATOM 0 HB VAL B 132 29.382 18.527 -61.492 1.00 33.86 H new ATOM 0 HG11 VAL B 132 30.214 20.259 -62.866 1.00 36.08 H new ATOM 0 HG12 VAL B 132 31.402 19.349 -62.346 1.00 36.08 H new ATOM 0 HG13 VAL B 132 30.858 19.175 -63.823 1.00 36.08 H new ATOM 0 HG21 VAL B 132 27.988 19.348 -63.185 1.00 37.15 H new ATOM 0 HG22 VAL B 132 28.551 18.247 -64.174 1.00 37.15 H new ATOM 0 HG23 VAL B 132 27.692 17.815 -62.916 1.00 37.15 H new ATOM 2575 N SER B 133 28.739 15.180 -63.255 1.00 32.80 N ATOM 2576 CA SER B 133 27.800 14.072 -63.104 1.00 34.23 C ATOM 2577 C SER B 133 28.394 12.930 -62.266 1.00 33.75 C ATOM 2578 O SER B 133 27.670 12.190 -61.622 1.00 35.77 O ATOM 2579 CB SER B 133 27.369 13.546 -64.475 1.00 35.99 C ATOM 2580 OG SER B 133 28.324 12.626 -64.985 1.00 38.50 O ATOM 0 H SER B 133 28.979 15.334 -64.066 1.00 32.80 H new ATOM 0 HA SER B 133 27.023 14.413 -62.633 1.00 34.23 H new ATOM 0 HB2 SER B 133 26.504 13.114 -64.403 1.00 35.99 H new ATOM 0 HB3 SER B 133 27.265 14.287 -65.092 1.00 35.99 H new ATOM 0 HG SER B 133 28.499 12.817 -65.784 1.00 38.50 H new ATOM 2581 N TYR B 134 29.712 12.774 -62.302 1.00 31.65 N ATOM 2582 CA TYR B 134 30.397 11.774 -61.489 1.00 31.79 C ATOM 2583 C TYR B 134 30.199 12.035 -59.995 1.00 29.19 C ATOM 2584 O TYR B 134 30.259 11.105 -59.201 1.00 28.98 O ATOM 2585 CB TYR B 134 31.875 11.829 -61.802 1.00 33.61 C ATOM 2586 CG TYR B 134 32.740 10.707 -61.293 1.00 36.37 C ATOM 2587 CD1 TYR B 134 32.894 9.538 -62.033 1.00 37.91 C ATOM 2588 CD2 TYR B 134 33.484 10.851 -60.116 1.00 37.20 C ATOM 2589 CE1 TYR B 134 33.729 8.521 -61.603 1.00 40.08 C ATOM 2590 CE2 TYR B 134 34.318 9.836 -59.669 1.00 39.57 C ATOM 2591 CZ TYR B 134 34.440 8.676 -60.421 1.00 42.17 C ATOM 2592 OH TYR B 134 35.269 7.661 -60.008 1.00 43.35 O ATOM 0 H TYR B 134 30.235 13.244 -62.797 1.00 31.65 H new ATOM 0 HA TYR B 134 30.027 10.902 -61.697 1.00 31.79 H new ATOM 0 HB2 TYR B 134 31.975 11.869 -62.766 1.00 33.61 H new ATOM 0 HB3 TYR B 134 32.225 12.661 -61.446 1.00 33.61 H new ATOM 0 HD1 TYR B 134 32.427 9.438 -62.831 1.00 37.91 H new ATOM 0 HD2 TYR B 134 33.418 11.639 -59.626 1.00 37.20 H new ATOM 0 HE1 TYR B 134 33.813 7.741 -62.102 1.00 40.08 H new ATOM 0 HE2 TYR B 134 34.790 9.932 -58.874 1.00 39.57 H new ATOM 0 HH TYR B 134 34.918 6.920 -60.191 1.00 43.35 H new ATOM 2593 N LEU B 135 29.975 13.295 -59.628 1.00 26.17 N ATOM 2594 CA LEU B 135 29.888 13.688 -58.217 1.00 25.87 C ATOM 2595 C LEU B 135 28.447 13.849 -57.757 1.00 26.11 C ATOM 2596 O LEU B 135 28.203 14.231 -56.616 1.00 24.09 O ATOM 2597 CB LEU B 135 30.648 14.983 -57.960 1.00 24.71 C ATOM 2598 CG LEU B 135 32.110 15.055 -58.400 1.00 25.02 C ATOM 2599 CD1 LEU B 135 32.617 16.478 -58.241 1.00 24.01 C ATOM 2600 CD2 LEU B 135 32.954 14.061 -57.619 1.00 26.01 C ATOM 0 H LEU B 135 29.870 13.944 -60.183 1.00 26.17 H new ATOM 0 HA LEU B 135 30.294 12.971 -57.706 1.00 25.87 H new ATOM 0 HB2 LEU B 135 30.169 15.702 -58.401 1.00 24.71 H new ATOM 0 HB3 LEU B 135 30.615 15.163 -57.007 1.00 24.71 H new ATOM 0 HG LEU B 135 32.180 14.811 -59.336 1.00 25.02 H new ATOM 0 HD11 LEU B 135 33.545 16.524 -58.520 1.00 24.01 H new ATOM 0 HD12 LEU B 135 32.085 17.075 -58.790 1.00 24.01 H new ATOM 0 HD13 LEU B 135 32.546 16.745 -57.311 1.00 24.01 H new ATOM 0 HD21 LEU B 135 33.877 14.120 -57.911 1.00 26.01 H new ATOM 0 HD22 LEU B 135 32.901 14.265 -56.672 1.00 26.01 H new ATOM 0 HD23 LEU B 135 32.623 13.163 -57.775 1.00 26.01 H new ATOM 2601 N LYS B 136 27.505 13.568 -58.654 1.00 27.02 N ATOM 2602 CA LYS B 136 26.090 13.709 -58.349 1.00 26.90 C ATOM 2603 C LYS B 136 25.712 12.757 -57.215 1.00 24.58 C ATOM 2604 O LYS B 136 26.017 11.558 -57.245 1.00 24.48 O ATOM 2605 CB LYS B 136 25.238 13.444 -59.595 1.00 33.66 C ATOM 2606 CG LYS B 136 23.829 14.010 -59.496 1.00 37.50 C ATOM 2607 CD LYS B 136 23.118 14.085 -60.837 1.00 39.94 C ATOM 2608 CE LYS B 136 21.628 14.279 -60.600 1.00 44.77 C ATOM 2609 NZ LYS B 136 20.856 14.633 -61.826 1.00 50.12 N ATOM 0 H LYS B 136 27.670 13.292 -59.452 1.00 27.02 H new ATOM 0 HA LYS B 136 25.917 14.620 -58.063 1.00 26.90 H new ATOM 0 HB2 LYS B 136 25.680 13.828 -60.368 1.00 33.66 H new ATOM 0 HB3 LYS B 136 25.185 12.487 -59.745 1.00 33.66 H new ATOM 0 HG2 LYS B 136 23.308 13.460 -58.891 1.00 37.50 H new ATOM 0 HG3 LYS B 136 23.870 14.898 -59.108 1.00 37.50 H new ATOM 0 HD2 LYS B 136 23.472 14.820 -61.363 1.00 39.94 H new ATOM 0 HD3 LYS B 136 23.273 13.273 -61.344 1.00 39.94 H new ATOM 0 HE2 LYS B 136 21.262 13.464 -60.223 1.00 44.77 H new ATOM 0 HE3 LYS B 136 21.504 14.978 -59.939 1.00 44.77 H new ATOM 0 HZ1 LYS B 136 19.996 14.731 -61.618 1.00 50.12 H new ATOM 0 HZ2 LYS B 136 21.168 15.395 -62.164 1.00 50.12 H new ATOM 0 HZ3 LYS B 136 20.942 13.984 -62.429 1.00 50.12 H new ATOM 2610 N GLY B 137 25.046 13.298 -56.211 1.00 21.61 N ATOM 2611 CA GLY B 137 24.608 12.475 -55.096 1.00 19.35 C ATOM 2612 C GLY B 137 25.655 12.315 -54.016 1.00 17.59 C ATOM 2613 O GLY B 137 25.413 11.582 -53.053 1.00 17.44 O ATOM 0 H GLY B 137 24.838 14.131 -56.154 1.00 21.61 H new ATOM 0 HA2 GLY B 137 23.810 12.867 -54.708 1.00 19.35 H new ATOM 0 HA3 GLY B 137 24.360 11.598 -55.428 1.00 19.35 H new ATOM 2614 N SER B 138 26.802 13.001 -54.149 1.00 15.94 N ATOM 2615 CA SER B 138 27.888 12.868 -53.174 1.00 15.57 C ATOM 2616 C SER B 138 27.962 13.960 -52.102 1.00 15.15 C ATOM 2617 O SER B 138 28.819 13.893 -51.208 1.00 14.53 O ATOM 2618 CB SER B 138 29.254 12.767 -53.878 1.00 17.36 C ATOM 2619 OG SER B 138 29.317 11.579 -54.633 1.00 19.31 O ATOM 0 H SER B 138 26.966 13.545 -54.795 1.00 15.94 H new ATOM 0 HA SER B 138 27.672 12.047 -52.704 1.00 15.57 H new ATOM 0 HB2 SER B 138 29.386 13.535 -54.456 1.00 17.36 H new ATOM 0 HB3 SER B 138 29.967 12.780 -53.221 1.00 17.36 H new ATOM 0 HG SER B 138 28.949 11.701 -55.378 1.00 19.31 H new ATOM 2620 N ASER B 139 27.089 14.958 -52.199 0.50 15.14 N ATOM 2621 CA ASER B 139 27.074 16.060 -51.241 0.50 16.00 C ATOM 2622 C ASER B 139 26.952 15.507 -49.814 0.50 15.53 C ATOM 2623 O ASER B 139 26.079 14.679 -49.542 0.50 15.37 O ATOM 2624 CB ASER B 139 25.892 16.969 -51.540 0.50 17.01 C ATOM 2625 OG ASER B 139 26.167 18.276 -51.089 0.50 18.23 O ATOM 2626 N BSER B 139 27.101 14.971 -52.211 0.50 14.98 N ATOM 2627 CA BSER B 139 27.037 16.044 -51.217 0.50 15.76 C ATOM 2628 C BSER B 139 27.017 15.424 -49.826 0.50 15.40 C ATOM 2629 O BSER B 139 26.284 14.465 -49.589 0.50 15.35 O ATOM 2630 CB BSER B 139 25.756 16.842 -51.415 0.50 16.27 C ATOM 2631 OG BSER B 139 25.860 17.651 -52.561 0.50 17.30 O ATOM 0 H ASER B 139 26.493 15.016 -52.816 0.50 14.98 H new ATOM 0 H BSER B 139 26.541 15.055 -52.858 0.50 14.98 H new ATOM 0 HA ASER B 139 27.899 16.564 -51.316 0.50 15.76 H new ATOM 0 HA BSER B 139 27.806 16.627 -51.316 0.50 15.76 H new ATOM 0 HB2ASER B 139 25.714 16.978 -52.493 0.50 16.27 H new ATOM 0 HB2BSER B 139 25.002 16.239 -51.504 0.50 16.27 H new ATOM 0 HB3ASER B 139 25.094 16.629 -51.105 0.50 16.27 H new ATOM 0 HB3BSER B 139 25.587 17.394 -50.635 0.50 16.27 H new ATOM 0 HG ASER B 139 26.007 18.825 -51.705 0.50 17.30 H new ATOM 0 HG BSER B 139 25.108 17.980 -52.741 0.50 17.30 H new ATOM 2632 N GLY B 140 27.822 15.959 -48.915 1.00 15.44 N ATOM 2633 CA GLY B 140 27.846 15.449 -47.549 1.00 15.92 C ATOM 2634 C GLY B 140 28.862 14.350 -47.311 1.00 16.52 C ATOM 2635 O GLY B 140 29.017 13.895 -46.168 1.00 17.08 O ATOM 0 H AGLY B 140 28.410 16.565 -49.078 0.50 15.44 H new ATOM 0 H BGLY B 140 28.359 16.614 -49.066 0.50 15.44 H new ATOM 0 HA2 GLY B 140 28.032 16.184 -46.944 1.00 15.92 H new ATOM 0 HA3 GLY B 140 26.964 15.114 -47.325 1.00 15.92 H new ATOM 2636 N GLY B 141 29.561 13.928 -48.373 1.00 16.90 N ATOM 2637 CA GLY B 141 30.588 12.870 -48.274 1.00 17.42 C ATOM 2638 C GLY B 141 31.902 13.398 -47.719 1.00 18.44 C ATOM 2639 O GLY B 141 32.096 14.615 -47.672 1.00 18.23 O ATOM 0 H GLY B 141 29.457 14.242 -49.167 1.00 16.90 H new ATOM 0 HA2 GLY B 141 30.261 12.156 -47.704 1.00 17.42 H new ATOM 0 HA3 GLY B 141 30.740 12.486 -49.151 1.00 17.42 H new ATOM 2640 N PRO B 142 32.805 12.488 -47.278 1.00 18.25 N ATOM 2641 CA PRO B 142 34.006 12.904 -46.573 1.00 18.85 C ATOM 2642 C PRO B 142 35.179 13.267 -47.480 1.00 20.66 C ATOM 2643 O PRO B 142 35.358 12.685 -48.571 1.00 20.32 O ATOM 2644 CB PRO B 142 34.369 11.651 -45.760 1.00 19.66 C ATOM 2645 CG PRO B 142 33.940 10.534 -46.634 1.00 19.04 C ATOM 2646 CD PRO B 142 32.709 11.017 -47.361 1.00 18.37 C ATOM 0 HA PRO B 142 33.840 13.710 -46.059 1.00 18.85 H new ATOM 0 HB2 PRO B 142 35.319 11.611 -45.571 1.00 19.66 H new ATOM 0 HB3 PRO B 142 33.909 11.634 -44.906 1.00 19.66 H new ATOM 0 HG2 PRO B 142 34.641 10.295 -47.261 1.00 19.04 H new ATOM 0 HG3 PRO B 142 33.745 9.741 -46.111 1.00 19.04 H new ATOM 0 HD2 PRO B 142 32.697 10.712 -48.282 1.00 18.37 H new ATOM 0 HD3 PRO B 142 31.897 10.689 -46.943 1.00 18.37 H new ATOM 2647 N LEU B 143 35.957 14.240 -47.012 1.00 21.35 N ATOM 2648 CA LEU B 143 37.312 14.445 -47.467 1.00 22.43 C ATOM 2649 C LEU B 143 38.228 13.881 -46.398 1.00 21.77 C ATOM 2650 O LEU B 143 38.096 14.222 -45.210 1.00 20.62 O ATOM 2651 CB LEU B 143 37.602 15.927 -47.628 1.00 24.66 C ATOM 2652 CG LEU B 143 37.218 16.736 -48.857 1.00 28.32 C ATOM 2653 CD1 LEU B 143 38.066 16.323 -50.057 1.00 29.78 C ATOM 2654 CD2 LEU B 143 35.725 16.689 -49.148 1.00 29.79 C ATOM 0 H LEU B 143 35.702 14.803 -46.414 1.00 21.35 H new ATOM 0 HA LEU B 143 37.447 14.012 -48.324 1.00 22.43 H new ATOM 0 HB2 LEU B 143 37.186 16.369 -46.871 1.00 24.66 H new ATOM 0 HB3 LEU B 143 38.561 16.029 -47.524 1.00 24.66 H new ATOM 0 HG LEU B 143 37.411 17.668 -48.668 1.00 28.32 H new ATOM 0 HD11 LEU B 143 37.809 16.848 -50.831 1.00 29.78 H new ATOM 0 HD12 LEU B 143 39.003 16.477 -49.860 1.00 29.78 H new ATOM 0 HD13 LEU B 143 37.926 15.382 -50.244 1.00 29.78 H new ATOM 0 HD21 LEU B 143 35.532 17.218 -49.938 1.00 29.79 H new ATOM 0 HD22 LEU B 143 35.454 15.770 -49.301 1.00 29.79 H new ATOM 0 HD23 LEU B 143 35.236 17.049 -48.391 1.00 29.79 H new ATOM 2655 N LEU B 144 39.133 13.002 -46.814 1.00 20.98 N ATOM 2656 CA LEU B 144 40.038 12.330 -45.887 1.00 21.75 C ATOM 2657 C LEU B 144 41.487 12.697 -46.180 1.00 21.34 C ATOM 2658 O LEU B 144 41.832 13.048 -47.303 1.00 19.38 O ATOM 2659 CB LEU B 144 39.876 10.809 -45.972 1.00 23.02 C ATOM 2660 CG LEU B 144 38.439 10.296 -45.856 1.00 23.38 C ATOM 2661 CD1 LEU B 144 38.354 8.847 -46.312 1.00 24.27 C ATOM 2662 CD2 LEU B 144 37.923 10.470 -44.430 1.00 22.87 C ATOM 0 H LEU B 144 39.240 12.779 -47.638 1.00 20.98 H new ATOM 0 HA LEU B 144 39.809 12.625 -44.992 1.00 21.75 H new ATOM 0 HB2 LEU B 144 40.244 10.506 -46.817 1.00 23.02 H new ATOM 0 HB3 LEU B 144 40.406 10.402 -45.269 1.00 23.02 H new ATOM 0 HG LEU B 144 37.870 10.822 -46.440 1.00 23.38 H new ATOM 0 HD11 LEU B 144 37.439 8.536 -46.233 1.00 24.27 H new ATOM 0 HD12 LEU B 144 38.639 8.781 -47.237 1.00 24.27 H new ATOM 0 HD13 LEU B 144 38.930 8.299 -45.757 1.00 24.27 H new ATOM 0 HD21 LEU B 144 37.012 10.141 -44.373 1.00 22.87 H new ATOM 0 HD22 LEU B 144 38.486 9.970 -43.819 1.00 22.87 H new ATOM 0 HD23 LEU B 144 37.942 11.410 -44.191 1.00 22.87 H new ATOM 2663 N CYS B 145 42.322 12.637 -45.151 1.00 24.55 N ATOM 2664 CA CYS B 145 43.768 12.766 -45.328 1.00 26.34 C ATOM 2665 C CYS B 145 44.293 11.372 -45.631 1.00 28.06 C ATOM 2666 O CYS B 145 43.533 10.404 -45.547 1.00 27.41 O ATOM 2667 CB CYS B 145 44.402 13.277 -44.042 1.00 28.23 C ATOM 2668 SG CYS B 145 44.375 12.018 -42.758 1.00 32.76 S ATOM 0 H CYS B 145 42.073 12.521 -44.336 1.00 24.55 H new ATOM 0 HA CYS B 145 43.979 13.389 -46.041 1.00 26.34 H new ATOM 0 HB2 CYS B 145 45.318 13.547 -44.215 1.00 28.23 H new ATOM 0 HB3 CYS B 145 43.927 14.065 -43.735 1.00 28.23 H new ATOM 2669 N PRO B 146 45.606 11.240 -45.930 1.00 30.25 N ATOM 2670 CA PRO B 146 46.111 9.919 -46.301 1.00 31.17 C ATOM 2671 C PRO B 146 45.964 8.828 -45.230 1.00 32.00 C ATOM 2672 O PRO B 146 45.848 7.659 -45.578 1.00 33.31 O ATOM 2673 CB PRO B 146 47.579 10.199 -46.652 1.00 31.14 C ATOM 2674 CG PRO B 146 47.551 11.621 -47.131 1.00 31.53 C ATOM 2675 CD PRO B 146 46.638 12.275 -46.129 1.00 30.00 C ATOM 0 HA PRO B 146 45.592 9.541 -47.028 1.00 31.17 H new ATOM 0 HB2 PRO B 146 48.159 10.092 -45.882 1.00 31.14 H new ATOM 0 HB3 PRO B 146 47.905 9.596 -47.338 1.00 31.14 H new ATOM 0 HG2 PRO B 146 48.435 12.021 -47.131 1.00 31.53 H new ATOM 0 HG3 PRO B 146 47.207 11.692 -48.035 1.00 31.53 H new ATOM 0 HD2 PRO B 146 47.100 12.490 -45.304 1.00 30.00 H new ATOM 0 HD3 PRO B 146 46.261 13.102 -46.467 1.00 30.00 H new ATOM 2676 N ASER B 147 45.949 9.217 -43.958 0.35 32.01 N ATOM 2677 CA ASER B 147 45.746 8.266 -42.867 0.35 32.29 C ATOM 2678 C ASER B 147 44.265 8.004 -42.576 0.35 32.50 C ATOM 2679 O ASER B 147 43.927 7.439 -41.536 0.35 32.41 O ATOM 2680 CB ASER B 147 46.462 8.739 -41.601 0.35 32.81 C ATOM 2681 OG ASER B 147 47.862 8.807 -41.809 0.35 32.78 O ATOM 2682 N BSER B 147 45.944 9.201 -43.953 0.65 32.21 N ATOM 2683 CA BSER B 147 45.748 8.218 -42.883 0.65 32.84 C ATOM 2684 C BSER B 147 44.280 7.794 -42.727 0.65 33.25 C ATOM 2685 O BSER B 147 43.961 6.909 -41.931 0.65 32.29 O ATOM 2686 CB BSER B 147 46.293 8.748 -41.555 0.65 34.23 C ATOM 2687 OG BSER B 147 45.530 9.847 -41.090 0.65 34.54 O ATOM 0 H ASER B 147 46.055 10.032 -43.704 0.35 32.21 H new ATOM 0 H BSER B 147 46.041 10.012 -43.683 0.65 32.21 H new ATOM 0 HA ASER B 147 46.130 7.424 -43.157 0.35 32.84 H new ATOM 0 HA BSER B 147 46.246 7.426 -43.139 0.65 32.84 H new ATOM 0 HB2ASER B 147 46.127 9.612 -41.342 0.35 34.23 H new ATOM 0 HB2BSER B 147 46.282 8.040 -40.892 0.65 34.23 H new ATOM 0 HB3ASER B 147 46.269 8.132 -40.869 0.35 34.23 H new ATOM 0 HB3BSER B 147 47.218 9.017 -41.667 0.65 34.23 H new ATOM 0 HG ASER B 147 48.238 9.069 -41.105 0.35 34.54 H new ATOM 0 HG BSER B 147 45.323 10.339 -41.739 0.65 34.54 H new ATOM 2688 N GLY B 148 43.393 8.420 -43.494 1.00 32.12 N ATOM 2689 CA GLY B 148 41.961 8.126 -43.406 1.00 31.72 C ATOM 2690 C GLY B 148 41.201 8.888 -42.335 1.00 30.95 C ATOM 2691 O GLY B 148 40.111 8.474 -41.931 1.00 32.43 O ATOM 0 H AGLY B 148 43.614 8.881 -44.186 0.35 32.12 H new ATOM 0 H BGLY B 148 43.598 9.021 -44.074 0.65 32.12 H new ATOM 0 HA2 GLY B 148 41.554 8.316 -44.266 1.00 31.72 H new ATOM 0 HA3 GLY B 148 41.851 7.176 -43.244 1.00 31.72 H new ATOM 2692 N HIS B 149 41.768 9.994 -41.863 1.00 29.39 N ATOM 2693 CA HIS B 149 41.084 10.841 -40.890 1.00 27.32 C ATOM 2694 C HIS B 149 40.325 11.927 -41.594 1.00 24.39 C ATOM 2695 O HIS B 149 40.691 12.328 -42.704 1.00 23.18 O ATOM 2696 CB HIS B 149 42.076 11.404 -39.863 1.00 31.30 C ATOM 2697 CG HIS B 149 42.716 10.341 -38.999 1.00 36.12 C ATOM 2698 ND1 HIS B 149 43.972 9.900 -39.201 1.00 40.39 N ATOM 2699 CD2 HIS B 149 42.213 9.610 -37.932 1.00 38.22 C ATOM 2700 CE1 HIS B 149 44.267 8.951 -38.297 1.00 39.18 C ATOM 2701 NE2 HIS B 149 43.190 8.772 -37.521 1.00 40.23 N ATOM 0 H HIS B 149 42.549 10.272 -42.093 1.00 29.39 H new ATOM 0 HA HIS B 149 40.443 10.304 -40.399 1.00 27.32 H new ATOM 0 HB2 HIS B 149 42.771 11.893 -40.330 1.00 31.30 H new ATOM 0 HB3 HIS B 149 41.615 12.040 -39.293 1.00 31.30 H new ATOM 0 HD1 HIS B 149 44.504 10.183 -39.815 1.00 40.39 H new ATOM 0 HD2 HIS B 149 41.361 9.683 -37.567 1.00 38.22 H new ATOM 0 HE1 HIS B 149 45.076 8.498 -38.223 1.00 39.18 H new ATOM 2702 N ALA B 150 39.255 12.415 -40.966 1.00 22.43 N ATOM 2703 CA ALA B 150 38.352 13.384 -41.602 1.00 22.12 C ATOM 2704 C ALA B 150 38.910 14.822 -41.689 1.00 22.05 C ATOM 2705 O ALA B 150 39.316 15.395 -40.674 1.00 22.84 O ATOM 2706 CB ALA B 150 37.015 13.395 -40.859 1.00 22.38 C ATOM 0 H ALA B 150 39.031 12.197 -40.165 1.00 22.43 H new ATOM 0 HA ALA B 150 38.244 13.088 -42.519 1.00 22.12 H new ATOM 0 HB1 ALA B 150 36.417 14.034 -41.277 1.00 22.38 H new ATOM 0 HB2 ALA B 150 36.618 12.511 -40.894 1.00 22.38 H new ATOM 0 HB3 ALA B 150 37.161 13.647 -39.934 1.00 22.38 H new ATOM 2707 N AVAL B 151 38.896 15.415 -42.884 0.89 20.24 N ATOM 2708 CA AVAL B 151 39.321 16.804 -43.060 0.89 20.17 C ATOM 2709 C AVAL B 151 38.109 17.694 -43.242 0.89 19.96 C ATOM 2710 O AVAL B 151 38.105 18.875 -42.899 0.89 19.64 O ATOM 2711 CB AVAL B 151 40.256 16.935 -44.289 0.89 20.39 C ATOM 2712 CG1AVAL B 151 40.531 18.394 -44.618 0.89 21.99 C ATOM 2713 CG2AVAL B 151 41.566 16.218 -44.027 0.89 21.58 C ATOM 2714 N BVAL B 151 38.902 15.392 -42.891 0.11 21.47 N ATOM 2715 CA BVAL B 151 39.364 16.762 -43.089 0.11 21.05 C ATOM 2716 C BVAL B 151 38.225 17.696 -43.503 0.11 20.56 C ATOM 2717 O BVAL B 151 38.403 18.913 -43.549 0.11 20.53 O ATOM 2718 CB BVAL B 151 40.508 16.830 -44.120 0.11 21.25 C ATOM 2719 CG1BVAL B 151 39.955 17.121 -45.502 0.11 21.53 C ATOM 2720 CG2BVAL B 151 41.521 17.892 -43.725 0.11 21.55 C ATOM 0 H AVAL B 151 38.642 15.027 -43.609 0.89 21.47 H new ATOM 0 H BVAL B 151 38.632 15.000 -43.607 0.11 21.47 H new ATOM 0 HA AVAL B 151 39.808 17.081 -42.268 0.89 21.05 H new ATOM 0 HA BVAL B 151 39.704 17.065 -42.232 0.11 21.05 H new ATOM 0 HB AVAL B 151 39.809 16.528 -45.048 0.89 21.25 H new ATOM 0 HB BVAL B 151 40.955 15.970 -44.138 0.11 21.25 H new ATOM 0 HG11AVAL B 151 41.117 18.447 -45.389 0.89 21.53 H new ATOM 0 HG11BVAL B 151 40.684 17.161 -46.141 0.11 21.53 H new ATOM 0 HG12AVAL B 151 39.695 18.844 -44.816 0.89 21.53 H new ATOM 0 HG12BVAL B 151 39.339 16.417 -45.759 0.11 21.53 H new ATOM 0 HG13AVAL B 151 40.956 18.822 -43.859 0.89 21.53 H new ATOM 0 HG13BVAL B 151 39.488 17.971 -45.491 0.11 21.53 H new ATOM 0 HG21AVAL B 151 42.144 16.306 -44.801 0.89 21.55 H new ATOM 0 HG21BVAL B 151 42.233 17.921 -44.383 0.11 21.55 H new ATOM 0 HG22AVAL B 151 42.001 16.610 -43.254 0.89 21.55 H new ATOM 0 HG22BVAL B 151 41.084 18.757 -43.683 0.11 21.55 H new ATOM 0 HG23AVAL B 151 41.393 15.279 -43.858 0.89 21.55 H new ATOM 0 HG23BVAL B 151 41.894 17.676 -42.856 0.11 21.55 H new ATOM 2721 N GLY B 152 37.059 17.128 -43.810 1.00 19.65 N ATOM 2722 CA GLY B 152 35.880 17.927 -44.089 1.00 19.85 C ATOM 2723 C GLY B 152 34.763 17.142 -44.727 1.00 18.80 C ATOM 2724 O GLY B 152 34.877 15.942 -44.933 1.00 17.88 O ATOM 0 H AGLY B 152 37.007 16.300 -44.038 0.89 19.65 H new ATOM 0 H BGLY B 152 36.935 16.278 -43.861 0.11 19.65 H new ATOM 0 HA2 GLY B 152 35.560 18.319 -43.261 1.00 19.85 H new ATOM 0 HA3 GLY B 152 36.126 18.661 -44.674 1.00 19.85 H new ATOM 2725 N ILE B 153 33.668 17.826 -45.014 1.00 19.09 N ATOM 2726 CA ILE B 153 32.633 17.217 -45.819 1.00 20.62 C ATOM 2727 C ILE B 153 32.311 18.043 -47.045 1.00 20.44 C ATOM 2728 O ILE B 153 32.189 19.272 -46.991 1.00 20.31 O ATOM 2729 CB ILE B 153 31.334 16.852 -45.032 1.00 23.75 C ATOM 2730 CG1 ILE B 153 30.639 18.093 -44.506 1.00 24.09 C ATOM 2731 CG2 ILE B 153 31.618 15.827 -43.916 1.00 24.03 C ATOM 2732 CD1 ILE B 153 29.143 17.888 -44.343 1.00 25.70 C ATOM 0 H ILE B 153 33.508 18.631 -44.756 1.00 19.09 H new ATOM 0 HA ILE B 153 33.012 16.372 -46.107 1.00 20.62 H new ATOM 0 HB ILE B 153 30.722 16.427 -45.654 1.00 23.75 H new ATOM 0 HG12 ILE B 153 31.025 18.340 -43.651 1.00 24.09 H new ATOM 0 HG13 ILE B 153 30.798 18.833 -45.113 1.00 24.09 H new ATOM 0 HG21 ILE B 153 30.794 15.622 -43.447 1.00 24.03 H new ATOM 0 HG22 ILE B 153 31.978 15.015 -44.306 1.00 24.03 H new ATOM 0 HG23 ILE B 153 32.261 16.198 -43.291 1.00 24.03 H new ATOM 0 HD11 ILE B 153 28.739 18.703 -44.006 1.00 25.70 H new ATOM 0 HD12 ILE B 153 28.751 17.665 -45.202 1.00 25.70 H new ATOM 0 HD13 ILE B 153 28.982 17.165 -43.717 1.00 25.70 H new ATOM 2733 N PHE B 154 32.136 17.322 -48.137 1.00 20.39 N ATOM 2734 CA PHE B 154 31.904 17.869 -49.452 1.00 21.40 C ATOM 2735 C PHE B 154 30.557 18.585 -49.539 1.00 22.43 C ATOM 2736 O PHE B 154 29.506 17.993 -49.255 1.00 21.43 O ATOM 2737 CB PHE B 154 32.000 16.692 -50.440 1.00 24.29 C ATOM 2738 CG PHE B 154 31.718 17.048 -51.856 1.00 26.08 C ATOM 2739 CD1 PHE B 154 32.189 18.235 -52.408 1.00 27.95 C ATOM 2740 CD2 PHE B 154 30.999 16.174 -52.655 1.00 29.61 C ATOM 2741 CE1 PHE B 154 31.916 18.554 -53.726 1.00 30.94 C ATOM 2742 CE2 PHE B 154 30.718 16.485 -53.974 1.00 32.28 C ATOM 2743 CZ PHE B 154 31.185 17.677 -54.514 1.00 32.06 C ATOM 0 H PHE B 154 32.150 16.462 -48.129 1.00 20.39 H new ATOM 0 HA PHE B 154 32.565 18.546 -49.665 1.00 21.40 H new ATOM 0 HB2 PHE B 154 32.891 16.311 -50.386 1.00 24.29 H new ATOM 0 HB3 PHE B 154 31.379 16.001 -50.163 1.00 24.29 H new ATOM 0 HD1 PHE B 154 32.691 18.819 -51.887 1.00 27.95 H new ATOM 0 HD2 PHE B 154 30.701 15.368 -52.300 1.00 29.61 H new ATOM 0 HE1 PHE B 154 32.222 19.356 -54.084 1.00 30.94 H new ATOM 0 HE2 PHE B 154 30.219 15.899 -54.496 1.00 32.28 H new ATOM 0 HZ PHE B 154 31.008 17.887 -55.403 1.00 32.06 H new ATOM 2744 N ARG B 155 30.575 19.861 -49.925 1.00 22.26 N ATOM 2745 CA ARG B 155 29.308 20.589 -50.040 1.00 25.88 C ATOM 2746 C ARG B 155 28.908 21.006 -51.448 1.00 26.13 C ATOM 2747 O ARG B 155 27.722 20.989 -51.772 1.00 26.77 O ATOM 2748 CB ARG B 155 29.186 21.733 -49.023 1.00 31.22 C ATOM 2749 CG ARG B 155 30.137 22.887 -49.201 1.00 35.86 C ATOM 2750 CD ARG B 155 29.667 24.069 -48.362 1.00 40.21 C ATOM 2751 NE ARG B 155 28.327 24.482 -48.765 1.00 44.32 N ATOM 2752 CZ ARG B 155 28.056 25.447 -49.646 1.00 47.87 C ATOM 2753 NH1 ARG B 155 29.039 26.130 -50.232 1.00 48.15 N ATOM 2754 NH2 ARG B 155 26.794 25.731 -49.944 1.00 49.14 N ATOM 0 H ARG B 155 31.282 20.311 -50.119 1.00 22.26 H new ATOM 0 HA ARG B 155 28.643 19.923 -49.805 1.00 25.88 H new ATOM 0 HB2 ARG B 155 28.280 22.077 -49.059 1.00 31.22 H new ATOM 0 HB3 ARG B 155 29.315 21.366 -48.135 1.00 31.22 H new ATOM 0 HG2 ARG B 155 31.032 22.625 -48.935 1.00 35.86 H new ATOM 0 HG3 ARG B 155 30.182 23.140 -50.136 1.00 35.86 H new ATOM 0 HD2 ARG B 155 29.668 23.826 -47.423 1.00 40.21 H new ATOM 0 HD3 ARG B 155 30.284 24.810 -48.464 1.00 40.21 H new ATOM 0 HE ARG B 155 27.661 24.072 -48.407 1.00 44.32 H new ATOM 0 HH11 ARG B 155 29.859 25.951 -50.044 1.00 48.15 H new ATOM 0 HH12 ARG B 155 28.854 26.750 -50.798 1.00 48.15 H new ATOM 0 HH21 ARG B 155 26.155 25.294 -49.570 1.00 49.14 H new ATOM 0 HH22 ARG B 155 26.615 26.352 -50.511 1.00 49.14 H new ATOM 2755 N ALA B 156 29.877 21.342 -52.305 1.00 23.85 N ATOM 2756 CA ALA B 156 29.543 21.821 -53.645 1.00 24.65 C ATOM 2757 C ALA B 156 30.722 21.611 -54.565 1.00 24.96 C ATOM 2758 O ALA B 156 31.844 21.454 -54.092 1.00 23.33 O ATOM 2759 CB ALA B 156 29.165 23.295 -53.615 1.00 24.89 C ATOM 0 H ALA B 156 30.718 21.300 -52.132 1.00 23.85 H new ATOM 0 HA ALA B 156 28.781 21.318 -53.973 1.00 24.65 H new ATOM 0 HB1 ALA B 156 28.948 23.592 -54.512 1.00 24.89 H new ATOM 0 HB2 ALA B 156 28.395 23.420 -53.038 1.00 24.89 H new ATOM 0 HB3 ALA B 156 29.911 23.814 -53.275 1.00 24.89 H new ATOM 2760 N ALA B 157 30.459 21.575 -55.865 1.00 25.59 N ATOM 2761 CA ALA B 157 31.524 21.466 -56.835 1.00 28.31 C ATOM 2762 C ALA B 157 31.703 22.787 -57.558 1.00 30.41 C ATOM 2763 O ALA B 157 30.767 23.584 -57.674 1.00 33.54 O ATOM 2764 CB ALA B 157 31.267 20.333 -57.812 1.00 28.48 C ATOM 0 H ALA B 157 29.668 21.613 -56.201 1.00 25.59 H new ATOM 0 HA ALA B 157 32.347 21.257 -56.366 1.00 28.31 H new ATOM 0 HB1 ALA B 157 31.996 20.284 -58.450 1.00 28.48 H new ATOM 0 HB2 ALA B 157 31.205 19.495 -57.327 1.00 28.48 H new ATOM 0 HB3 ALA B 157 30.435 20.495 -58.284 1.00 28.48 H new ATOM 2765 N VAL B 158 32.922 23.032 -58.019 1.00 31.90 N ATOM 2766 CA VAL B 158 33.201 24.211 -58.824 1.00 34.78 C ATOM 2767 C VAL B 158 33.366 23.695 -60.241 1.00 34.86 C ATOM 2768 O VAL B 158 34.215 22.843 -60.517 1.00 31.74 O ATOM 2769 CB VAL B 158 34.454 24.961 -58.335 1.00 36.58 C ATOM 2770 CG1 VAL B 158 34.629 26.257 -59.108 1.00 37.54 C ATOM 2771 CG2 VAL B 158 34.342 25.248 -56.844 1.00 38.13 C ATOM 0 H VAL B 158 33.603 22.526 -57.876 1.00 31.90 H new ATOM 0 HA VAL B 158 32.484 24.862 -58.762 1.00 34.78 H new ATOM 0 HB VAL B 158 35.232 24.402 -58.489 1.00 36.58 H new ATOM 0 HG11 VAL B 158 35.421 26.719 -58.791 1.00 37.54 H new ATOM 0 HG12 VAL B 158 34.727 26.060 -60.053 1.00 37.54 H new ATOM 0 HG13 VAL B 158 33.851 26.821 -58.975 1.00 37.54 H new ATOM 0 HG21 VAL B 158 35.135 25.720 -56.545 1.00 38.13 H new ATOM 0 HG22 VAL B 158 33.558 25.795 -56.677 1.00 38.13 H new ATOM 0 HG23 VAL B 158 34.262 24.412 -56.359 1.00 38.13 H new ATOM 2772 N CYS B 159 32.517 24.197 -61.125 1.00 37.82 N ATOM 2773 CA CYS B 159 32.344 23.618 -62.441 1.00 42.60 C ATOM 2774 C CYS B 159 32.500 24.635 -63.549 1.00 43.48 C ATOM 2775 O CYS B 159 32.110 25.789 -63.411 1.00 42.13 O ATOM 2776 CB CYS B 159 30.962 22.994 -62.542 1.00 48.27 C ATOM 2777 SG CYS B 159 30.633 21.871 -61.171 1.00 61.84 S ATOM 0 H CYS B 159 32.024 24.886 -60.976 1.00 37.82 H new ATOM 0 HA CYS B 159 33.038 22.949 -62.552 1.00 42.60 H new ATOM 0 HB2 CYS B 159 30.291 23.694 -62.555 1.00 48.27 H new ATOM 0 HB3 CYS B 159 30.885 22.512 -63.380 1.00 48.27 H new ATOM 0 HG CYS B 159 29.534 21.405 -61.290 1.00 61.84 H new ATOM 2778 N THR B 160 33.085 24.183 -64.648 1.00 44.23 N ATOM 2779 CA THR B 160 33.186 24.980 -65.853 1.00 43.76 C ATOM 2780 C THR B 160 32.895 24.016 -66.984 1.00 40.32 C ATOM 2781 O THR B 160 33.618 23.033 -67.170 1.00 37.87 O ATOM 2782 CB THR B 160 34.587 25.619 -66.016 1.00 45.22 C ATOM 2783 OG1 THR B 160 35.589 24.596 -65.962 1.00 50.80 O ATOM 2784 CG2 THR B 160 34.864 26.634 -64.908 1.00 45.21 C ATOM 0 H THR B 160 33.436 23.401 -64.714 1.00 44.23 H new ATOM 0 HA THR B 160 32.566 25.726 -65.834 1.00 43.76 H new ATOM 0 HB THR B 160 34.611 26.075 -66.872 1.00 45.22 H new ATOM 0 HG1 THR B 160 35.266 23.872 -66.241 1.00 50.80 H new ATOM 0 HG21 THR B 160 35.746 27.018 -65.034 1.00 45.21 H new ATOM 0 HG22 THR B 160 34.198 27.338 -64.940 1.00 45.21 H new ATOM 0 HG23 THR B 160 34.825 26.191 -64.046 1.00 45.21 H new ATOM 2785 N ARG B 161 31.801 24.280 -67.697 1.00 40.05 N ATOM 2786 CA ARG B 161 31.391 23.500 -68.865 1.00 38.15 C ATOM 2787 C ARG B 161 31.140 22.012 -68.588 1.00 36.33 C ATOM 2788 O ARG B 161 31.470 21.151 -69.413 1.00 34.75 O ATOM 2789 CB ARG B 161 32.383 23.705 -70.021 1.00 42.53 C ATOM 2790 CG ARG B 161 32.312 25.094 -70.639 1.00 48.89 C ATOM 2791 CD ARG B 161 33.452 25.343 -71.616 1.00 52.73 C ATOM 2792 NE ARG B 161 34.531 26.131 -71.015 1.00 58.74 N ATOM 2793 CZ ARG B 161 35.599 25.625 -70.395 1.00 61.30 C ATOM 2794 NH1 ARG B 161 35.768 24.307 -70.279 1.00 57.98 N ATOM 2795 NH2 ARG B 161 36.510 26.451 -69.890 1.00 63.58 N ATOM 0 H ARG B 161 31.267 24.928 -67.513 1.00 40.05 H new ATOM 0 HA ARG B 161 30.522 23.846 -69.123 1.00 38.15 H new ATOM 0 HB2 ARG B 161 33.284 23.548 -69.697 1.00 42.53 H new ATOM 0 HB3 ARG B 161 32.209 23.043 -70.709 1.00 42.53 H new ATOM 0 HG2 ARG B 161 31.464 25.199 -71.099 1.00 48.89 H new ATOM 0 HG3 ARG B 161 32.338 25.762 -69.936 1.00 48.89 H new ATOM 0 HD2 ARG B 161 33.806 24.493 -71.922 1.00 52.73 H new ATOM 0 HD3 ARG B 161 33.111 25.806 -72.397 1.00 52.73 H new ATOM 0 HE ARG B 161 34.471 26.987 -71.066 1.00 58.74 H new ATOM 0 HH11 ARG B 161 35.183 23.768 -70.607 1.00 57.98 H new ATOM 0 HH12 ARG B 161 36.462 23.996 -69.877 1.00 57.98 H new ATOM 0 HH21 ARG B 161 36.408 27.302 -69.965 1.00 63.58 H new ATOM 0 HH22 ARG B 161 37.202 26.135 -69.489 1.00 63.58 H new ATOM 2796 N GLY B 162 30.537 21.716 -67.435 1.00 33.99 N ATOM 2797 CA GLY B 162 30.143 20.355 -67.086 1.00 31.80 C ATOM 2798 C GLY B 162 31.277 19.569 -66.459 1.00 30.43 C ATOM 2799 O GLY B 162 31.127 18.390 -66.122 1.00 30.22 O ATOM 0 H GLY B 162 30.346 22.301 -66.834 1.00 33.99 H new ATOM 0 HA2 GLY B 162 29.394 20.385 -66.470 1.00 31.80 H new ATOM 0 HA3 GLY B 162 29.836 19.895 -67.883 1.00 31.80 H new ATOM 2800 N VAL B 163 32.423 20.213 -66.295 1.00 29.87 N ATOM 2801 CA VAL B 163 33.562 19.533 -65.711 1.00 28.51 C ATOM 2802 C VAL B 163 33.864 20.099 -64.331 1.00 28.10 C ATOM 2803 O VAL B 163 34.020 21.306 -64.163 1.00 27.65 O ATOM 2804 CB VAL B 163 34.806 19.567 -66.631 1.00 29.65 C ATOM 2805 CG1 VAL B 163 35.978 18.887 -65.950 1.00 27.89 C ATOM 2806 CG2 VAL B 163 34.509 18.850 -67.941 1.00 28.99 C ATOM 0 H VAL B 163 32.560 21.034 -66.513 1.00 29.87 H new ATOM 0 HA VAL B 163 33.327 18.597 -65.613 1.00 28.51 H new ATOM 0 HB VAL B 163 35.029 20.494 -66.811 1.00 29.65 H new ATOM 0 HG11 VAL B 163 36.752 18.914 -66.534 1.00 27.89 H new ATOM 0 HG12 VAL B 163 36.183 19.348 -65.121 1.00 27.89 H new ATOM 0 HG13 VAL B 163 35.750 17.964 -65.758 1.00 27.89 H new ATOM 0 HG21 VAL B 163 35.294 18.877 -68.510 1.00 28.99 H new ATOM 0 HG22 VAL B 163 34.274 17.927 -67.759 1.00 28.99 H new ATOM 0 HG23 VAL B 163 33.770 19.289 -68.390 1.00 28.99 H new ATOM 2807 N ALA B 164 33.945 19.204 -63.349 1.00 26.04 N ATOM 2808 CA ALA B 164 34.280 19.587 -61.993 1.00 26.37 C ATOM 2809 C ALA B 164 35.779 19.763 -61.856 1.00 24.84 C ATOM 2810 O ALA B 164 36.551 18.854 -62.148 1.00 25.67 O ATOM 2811 CB ALA B 164 33.760 18.551 -60.997 1.00 25.49 C ATOM 0 H ALA B 164 33.807 18.362 -63.455 1.00 26.04 H new ATOM 0 HA ALA B 164 33.852 20.434 -61.794 1.00 26.37 H new ATOM 0 HB1 ALA B 164 33.993 18.823 -60.096 1.00 25.49 H new ATOM 0 HB2 ALA B 164 32.796 18.483 -61.075 1.00 25.49 H new ATOM 0 HB3 ALA B 164 34.161 17.689 -61.188 1.00 25.49 H new ATOM 2812 N LYS B 165 36.169 20.947 -61.415 1.00 25.78 N ATOM 2813 CA LYS B 165 37.577 21.333 -61.302 1.00 28.63 C ATOM 2814 C LYS B 165 38.016 21.426 -59.860 1.00 27.03 C ATOM 2815 O LYS B 165 39.190 21.221 -59.547 1.00 27.00 O ATOM 2816 CB LYS B 165 37.810 22.696 -61.975 1.00 30.02 C ATOM 2817 CG LYS B 165 37.782 22.654 -63.501 1.00 35.48 C ATOM 2818 CD LYS B 165 38.646 21.516 -64.043 1.00 38.16 C ATOM 2819 CE LYS B 165 39.163 21.801 -65.450 1.00 42.65 C ATOM 2820 NZ LYS B 165 38.059 21.951 -66.441 1.00 44.92 N ATOM 0 H LYS B 165 35.621 21.562 -61.168 1.00 25.78 H new ATOM 0 HA LYS B 165 38.099 20.645 -61.744 1.00 28.63 H new ATOM 0 HB2 LYS B 165 37.133 23.318 -61.666 1.00 30.02 H new ATOM 0 HB3 LYS B 165 38.668 23.045 -61.687 1.00 30.02 H new ATOM 0 HG2 LYS B 165 36.868 22.542 -63.807 1.00 35.48 H new ATOM 0 HG3 LYS B 165 38.098 23.500 -63.855 1.00 35.48 H new ATOM 0 HD2 LYS B 165 39.398 21.372 -63.447 1.00 38.16 H new ATOM 0 HD3 LYS B 165 38.129 20.695 -64.051 1.00 38.16 H new ATOM 0 HE2 LYS B 165 39.696 22.611 -65.438 1.00 42.65 H new ATOM 0 HE3 LYS B 165 39.749 21.080 -65.729 1.00 42.65 H new ATOM 0 HZ1 LYS B 165 38.403 22.072 -67.253 1.00 44.92 H new ATOM 0 HZ2 LYS B 165 37.556 21.217 -66.439 1.00 44.92 H new ATOM 0 HZ3 LYS B 165 37.558 22.654 -66.224 1.00 44.92 H new ATOM 2821 N ALA B 166 37.073 21.789 -58.995 1.00 26.45 N ATOM 2822 CA ALA B 166 37.359 22.012 -57.587 1.00 26.41 C ATOM 2823 C ALA B 166 36.143 21.628 -56.751 1.00 26.29 C ATOM 2824 O ALA B 166 35.036 21.472 -57.273 1.00 24.46 O ATOM 2825 CB ALA B 166 37.731 23.468 -57.342 1.00 26.48 C ATOM 0 H ALA B 166 36.250 21.912 -59.211 1.00 26.45 H new ATOM 0 HA ALA B 166 38.112 21.459 -57.327 1.00 26.41 H new ATOM 0 HB1 ALA B 166 37.919 23.600 -56.400 1.00 26.48 H new ATOM 0 HB2 ALA B 166 38.518 23.693 -57.862 1.00 26.48 H new ATOM 0 HB3 ALA B 166 36.994 24.040 -57.608 1.00 26.48 H new ATOM 2826 N VAL B 167 36.362 21.458 -55.456 1.00 25.69 N ATOM 2827 CA VAL B 167 35.276 21.147 -54.545 1.00 25.36 C ATOM 2828 C VAL B 167 35.346 22.127 -53.391 1.00 25.99 C ATOM 2829 O VAL B 167 36.429 22.539 -52.981 1.00 25.33 O ATOM 2830 CB VAL B 167 35.316 19.683 -54.056 1.00 26.18 C ATOM 2831 CG1 VAL B 167 35.141 18.733 -55.240 1.00 26.48 C ATOM 2832 CG2 VAL B 167 36.610 19.380 -53.312 1.00 25.39 C ATOM 0 H VAL B 167 37.135 21.519 -55.085 1.00 25.69 H new ATOM 0 HA VAL B 167 34.429 21.237 -55.010 1.00 25.36 H new ATOM 0 HB VAL B 167 34.584 19.551 -53.433 1.00 26.18 H new ATOM 0 HG11 VAL B 167 35.167 17.816 -54.926 1.00 26.48 H new ATOM 0 HG12 VAL B 167 34.288 18.903 -55.668 1.00 26.48 H new ATOM 0 HG13 VAL B 167 35.857 18.876 -55.878 1.00 26.48 H new ATOM 0 HG21 VAL B 167 36.606 18.456 -53.018 1.00 25.39 H new ATOM 0 HG22 VAL B 167 37.365 19.527 -53.903 1.00 25.39 H new ATOM 0 HG23 VAL B 167 36.684 19.964 -52.541 1.00 25.39 H new ATOM 2833 N ASP B 168 34.175 22.553 -52.945 1.00 25.16 N ATOM 2834 CA ASP B 168 34.022 23.363 -51.758 1.00 25.44 C ATOM 2835 C ASP B 168 33.627 22.399 -50.628 1.00 22.85 C ATOM 2836 O ASP B 168 32.813 21.484 -50.826 1.00 20.04 O ATOM 2837 CB ASP B 168 32.925 24.390 -52.033 1.00 29.54 C ATOM 2838 CG ASP B 168 32.834 25.472 -50.971 1.00 38.93 C ATOM 2839 OD1 ASP B 168 33.842 26.183 -50.706 1.00 45.03 O ATOM 2840 OD2 ASP B 168 31.719 25.636 -50.420 1.00 44.94 O ATOM 0 H ASP B 168 33.431 22.373 -53.336 1.00 25.16 H new ATOM 0 HA ASP B 168 34.829 23.841 -51.511 1.00 25.44 H new ATOM 0 HB2 ASP B 168 33.088 24.804 -52.895 1.00 29.54 H new ATOM 0 HB3 ASP B 168 32.071 23.933 -52.094 1.00 29.54 H new ATOM 2841 N PHE B 169 34.194 22.597 -49.447 1.00 22.03 N ATOM 2842 CA PHE B 169 33.903 21.697 -48.334 1.00 22.74 C ATOM 2843 C PHE B 169 33.778 22.410 -47.006 1.00 22.47 C ATOM 2844 O PHE B 169 34.262 23.535 -46.852 1.00 24.07 O ATOM 2845 CB PHE B 169 34.902 20.524 -48.250 1.00 23.03 C ATOM 2846 CG PHE B 169 36.321 20.925 -47.938 1.00 23.31 C ATOM 2847 CD1 PHE B 169 37.190 21.311 -48.962 1.00 24.68 C ATOM 2848 CD2 PHE B 169 36.805 20.882 -46.626 1.00 23.98 C ATOM 2849 CE1 PHE B 169 38.507 21.664 -48.683 1.00 24.73 C ATOM 2850 CE2 PHE B 169 38.121 21.235 -46.339 1.00 25.41 C ATOM 2851 CZ PHE B 169 38.976 21.628 -47.375 1.00 24.42 C ATOM 0 H PHE B 169 34.742 23.235 -49.267 1.00 22.03 H new ATOM 0 HA PHE B 169 33.030 21.323 -48.529 1.00 22.74 H new ATOM 0 HB2 PHE B 169 34.597 19.904 -47.569 1.00 23.03 H new ATOM 0 HB3 PHE B 169 34.892 20.046 -49.094 1.00 23.03 H new ATOM 0 HD1 PHE B 169 36.885 21.332 -49.840 1.00 24.68 H new ATOM 0 HD2 PHE B 169 36.241 20.614 -45.937 1.00 23.98 H new ATOM 0 HE1 PHE B 169 39.074 21.924 -49.373 1.00 24.73 H new ATOM 0 HE2 PHE B 169 38.431 21.210 -45.462 1.00 25.41 H new ATOM 0 HZ PHE B 169 39.856 21.865 -47.189 1.00 24.42 H new ATOM 2852 N VAL B 170 33.112 21.758 -46.063 1.00 22.07 N ATOM 2853 CA VAL B 170 33.041 22.236 -44.683 1.00 22.30 C ATOM 2854 C VAL B 170 34.193 21.622 -43.904 1.00 21.96 C ATOM 2855 O VAL B 170 34.257 20.395 -43.752 1.00 20.77 O ATOM 2856 CB VAL B 170 31.697 21.862 -43.998 1.00 22.69 C ATOM 2857 CG1 VAL B 170 31.582 22.568 -42.647 1.00 23.76 C ATOM 2858 CG2 VAL B 170 30.515 22.219 -44.880 1.00 22.78 C ATOM 0 H VAL B 170 32.686 21.024 -46.202 1.00 22.07 H new ATOM 0 HA VAL B 170 33.099 23.204 -44.692 1.00 22.30 H new ATOM 0 HB VAL B 170 31.686 20.902 -43.857 1.00 22.69 H new ATOM 0 HG11 VAL B 170 30.741 22.329 -42.227 1.00 23.76 H new ATOM 0 HG12 VAL B 170 32.317 22.295 -42.076 1.00 23.76 H new ATOM 0 HG13 VAL B 170 31.615 23.528 -42.780 1.00 23.76 H new ATOM 0 HG21 VAL B 170 29.691 21.976 -44.430 1.00 22.78 H new ATOM 0 HG22 VAL B 170 30.518 23.173 -45.055 1.00 22.78 H new ATOM 0 HG23 VAL B 170 30.580 21.736 -45.719 1.00 22.78 H new ATOM 2859 N PRO B 171 35.121 22.463 -43.404 1.00 23.11 N ATOM 2860 CA PRO B 171 36.238 21.856 -42.702 1.00 24.68 C ATOM 2861 C PRO B 171 35.813 21.289 -41.361 1.00 25.87 C ATOM 2862 O PRO B 171 34.875 21.790 -40.735 1.00 26.90 O ATOM 2863 CB PRO B 171 37.240 23.017 -42.526 1.00 26.27 C ATOM 2864 CG PRO B 171 36.450 24.250 -42.670 1.00 25.55 C ATOM 2865 CD PRO B 171 35.246 23.929 -43.513 1.00 25.31 C ATOM 0 HA PRO B 171 36.615 21.106 -43.187 1.00 24.68 H new ATOM 0 HB2 PRO B 171 37.669 22.978 -41.657 1.00 26.27 H new ATOM 0 HB3 PRO B 171 37.944 22.974 -43.192 1.00 26.27 H new ATOM 0 HG2 PRO B 171 36.177 24.582 -41.801 1.00 25.55 H new ATOM 0 HG3 PRO B 171 36.981 24.947 -43.087 1.00 25.55 H new ATOM 0 HD2 PRO B 171 34.452 24.379 -43.185 1.00 25.31 H new ATOM 0 HD3 PRO B 171 35.371 24.208 -44.433 1.00 25.31 H new ATOM 2866 N VAL B 172 36.503 20.247 -40.928 1.00 26.81 N ATOM 2867 CA VAL B 172 36.199 19.602 -39.663 1.00 29.16 C ATOM 2868 C VAL B 172 36.265 20.595 -38.483 1.00 32.62 C ATOM 2869 O VAL B 172 35.536 20.455 -37.487 1.00 32.28 O ATOM 2870 CB VAL B 172 37.085 18.348 -39.466 1.00 29.56 C ATOM 2871 CG1 VAL B 172 38.531 18.719 -39.151 1.00 31.05 C ATOM 2872 CG2 VAL B 172 36.504 17.422 -38.411 1.00 30.89 C ATOM 0 H VAL B 172 37.159 19.894 -41.358 1.00 26.81 H new ATOM 0 HA VAL B 172 35.280 19.293 -39.686 1.00 29.16 H new ATOM 0 HB VAL B 172 37.093 17.865 -40.307 1.00 29.56 H new ATOM 0 HG11 VAL B 172 39.055 17.911 -39.034 1.00 31.05 H new ATOM 0 HG12 VAL B 172 38.899 19.239 -39.883 1.00 31.05 H new ATOM 0 HG13 VAL B 172 38.560 19.243 -38.335 1.00 31.05 H new ATOM 0 HG21 VAL B 172 37.078 16.647 -38.309 1.00 30.89 H new ATOM 0 HG22 VAL B 172 36.443 17.893 -37.565 1.00 30.89 H new ATOM 0 HG23 VAL B 172 35.619 17.134 -38.685 1.00 30.89 H new ATOM 2873 N GLU B 173 37.103 21.621 -38.621 1.00 35.05 N ATOM 2874 CA GLU B 173 37.179 22.710 -37.630 1.00 38.55 C ATOM 2875 C GLU B 173 35.816 23.365 -37.378 1.00 39.82 C ATOM 2876 O GLU B 173 35.456 23.632 -36.234 1.00 40.28 O ATOM 2877 CB GLU B 173 38.182 23.776 -38.077 1.00 41.45 C ATOM 2878 CG GLU B 173 39.644 23.372 -37.927 1.00 42.74 C ATOM 2879 CD GLU B 173 40.162 22.455 -39.033 1.00 45.80 C ATOM 2880 OE1 GLU B 173 39.536 22.359 -40.127 1.00 40.95 O ATOM 2881 OE2 GLU B 173 41.224 21.829 -38.798 1.00 46.74 O ATOM 0 H GLU B 173 37.642 21.711 -39.285 1.00 35.05 H new ATOM 0 HA GLU B 173 37.476 22.309 -36.798 1.00 38.55 H new ATOM 0 HB2 GLU B 173 38.012 23.994 -39.007 1.00 41.45 H new ATOM 0 HB3 GLU B 173 38.028 24.584 -37.564 1.00 41.45 H new ATOM 0 HG2 GLU B 173 40.189 24.174 -37.905 1.00 42.74 H new ATOM 0 HG3 GLU B 173 39.759 22.927 -37.073 1.00 42.74 H new ATOM 2882 N SER B 174 35.064 23.612 -38.453 1.00 40.58 N ATOM 2883 CA SER B 174 33.717 24.186 -38.356 1.00 40.43 C ATOM 2884 C SER B 174 32.702 23.265 -37.671 1.00 41.66 C ATOM 2885 O SER B 174 31.683 23.726 -37.162 1.00 41.89 O ATOM 2886 CB SER B 174 33.206 24.585 -39.730 1.00 41.25 C ATOM 2887 OG SER B 174 34.089 25.501 -40.345 1.00 45.54 O ATOM 0 H SER B 174 35.319 23.452 -39.258 1.00 40.58 H new ATOM 0 HA SER B 174 33.804 24.971 -37.793 1.00 40.43 H new ATOM 0 HB2 SER B 174 33.112 23.796 -40.287 1.00 41.25 H new ATOM 0 HB3 SER B 174 32.325 24.982 -39.650 1.00 41.25 H new ATOM 0 HG SER B 174 33.793 25.710 -41.103 1.00 45.54 H new ATOM 2888 N MET B 175 32.969 21.965 -37.672 1.00 42.69 N ATOM 2889 CA MET B 175 32.155 21.027 -36.909 1.00 42.81 C ATOM 2890 C MET B 175 32.465 21.197 -35.426 1.00 46.09 C ATOM 2891 O MET B 175 31.550 21.246 -34.600 1.00 42.40 O ATOM 2892 CB MET B 175 32.403 19.589 -37.370 1.00 43.01 C ATOM 2893 CG MET B 175 32.074 19.369 -38.845 1.00 45.28 C ATOM 2894 SD MET B 175 32.553 17.757 -39.495 1.00 48.02 S ATOM 2895 CE MET B 175 32.652 18.154 -41.238 1.00 45.84 C ATOM 0 H MET B 175 33.617 21.605 -38.108 1.00 42.69 H new ATOM 0 HA MET B 175 31.215 21.215 -37.060 1.00 42.81 H new ATOM 0 HB2 MET B 175 33.333 19.361 -37.214 1.00 43.01 H new ATOM 0 HB3 MET B 175 31.868 18.985 -36.831 1.00 43.01 H new ATOM 0 HG2 MET B 175 31.119 19.484 -38.971 1.00 45.28 H new ATOM 0 HG3 MET B 175 32.514 20.058 -39.368 1.00 45.28 H new ATOM 0 HE1 MET B 175 33.370 17.645 -41.646 1.00 45.84 H new ATOM 0 HE2 MET B 175 31.813 17.930 -41.669 1.00 45.84 H new ATOM 0 HE3 MET B 175 32.827 19.102 -41.345 1.00 45.84 H new ATOM 2896 N GLU B 176 33.756 21.308 -35.106 1.00 47.90 N ATOM 2897 CA GLU B 176 34.223 21.590 -33.740 1.00 52.77 C ATOM 2898 C GLU B 176 33.675 22.927 -33.203 1.00 54.11 C ATOM 2899 O GLU B 176 33.197 22.995 -32.066 1.00 57.47 O ATOM 2900 CB GLU B 176 35.760 21.558 -33.677 1.00 55.78 C ATOM 2901 CG GLU B 176 36.385 20.212 -34.055 1.00 59.49 C ATOM 2902 CD GLU B 176 37.884 20.289 -34.366 1.00 64.33 C ATOM 2903 OE1 GLU B 176 38.473 21.398 -34.306 1.00 64.16 O ATOM 2904 OE2 GLU B 176 38.482 19.229 -34.677 1.00 61.62 O ATOM 0 H GLU B 176 34.392 21.222 -35.678 1.00 47.90 H new ATOM 0 HA GLU B 176 33.875 20.891 -33.164 1.00 52.77 H new ATOM 0 HB2 GLU B 176 36.111 22.242 -34.269 1.00 55.78 H new ATOM 0 HB3 GLU B 176 36.040 21.790 -32.778 1.00 55.78 H new ATOM 0 HG2 GLU B 176 36.246 19.585 -33.328 1.00 59.49 H new ATOM 0 HG3 GLU B 176 35.921 19.856 -34.829 1.00 59.49 H new ATOM 2905 N THR B 177 33.730 23.972 -34.031 1.00 54.17 N ATOM 2906 CA THR B 177 33.201 25.305 -33.694 1.00 54.39 C ATOM 2907 C THR B 177 31.667 25.326 -33.600 1.00 54.93 C ATOM 2908 O THR B 177 31.099 26.126 -32.846 1.00 54.48 O ATOM 2909 CB THR B 177 33.711 26.372 -34.696 1.00 55.66 C ATOM 2910 OG1 THR B 177 35.096 26.627 -34.442 1.00 58.37 O ATOM 2911 CG2 THR B 177 32.930 27.696 -34.591 1.00 56.41 C ATOM 0 H THR B 177 34.080 23.930 -34.816 1.00 54.17 H new ATOM 0 HA THR B 177 33.537 25.525 -32.811 1.00 54.39 H new ATOM 0 HB THR B 177 33.579 26.022 -35.591 1.00 55.66 H new ATOM 0 HG1 THR B 177 35.379 27.204 -34.983 1.00 58.37 H new ATOM 0 HG21 THR B 177 33.282 28.331 -35.234 1.00 56.41 H new ATOM 0 HG22 THR B 177 31.992 27.534 -34.777 1.00 56.41 H new ATOM 0 HG23 THR B 177 33.024 28.057 -33.696 1.00 56.41 H new ATOM 2912 N THR B 178 31.010 24.464 -34.380 1.00 50.19 N ATOM 2913 CA THR B 178 29.564 24.249 -34.265 1.00 48.64 C ATOM 2914 C THR B 178 29.253 23.540 -32.939 1.00 48.40 C ATOM 2915 O THR B 178 28.295 23.895 -32.252 1.00 51.54 O ATOM 2916 CB THR B 178 28.996 23.455 -35.479 1.00 45.52 C ATOM 2917 OG1 THR B 178 29.135 24.236 -36.676 1.00 42.44 O ATOM 2918 CG2 THR B 178 27.510 23.108 -35.292 1.00 43.98 C ATOM 0 H THR B 178 31.388 23.989 -34.989 1.00 50.19 H new ATOM 0 HA THR B 178 29.125 25.114 -34.271 1.00 48.64 H new ATOM 0 HB THR B 178 29.500 22.629 -35.546 1.00 45.52 H new ATOM 0 HG1 THR B 178 29.875 24.068 -37.036 1.00 42.44 H new ATOM 0 HG21 THR B 178 27.193 22.616 -36.065 1.00 43.98 H new ATOM 0 HG22 THR B 178 27.402 22.564 -34.496 1.00 43.98 H new ATOM 0 HG23 THR B 178 26.996 23.925 -35.197 1.00 43.98 H new ATOM 2919 N MET B 179 30.079 22.557 -32.584 1.00 50.24 N ATOM 2920 CA MET B 179 29.896 21.764 -31.364 1.00 53.24 C ATOM 2921 C MET B 179 30.229 22.510 -30.069 1.00 58.58 C ATOM 2922 O MET B 179 29.667 22.197 -29.015 1.00 60.90 O ATOM 2923 CB MET B 179 30.721 20.476 -31.426 1.00 52.55 C ATOM 2924 CG MET B 179 30.213 19.451 -32.424 1.00 53.04 C ATOM 2925 SD MET B 179 31.006 17.839 -32.288 1.00 55.00 S ATOM 2926 CE MET B 179 32.686 18.190 -32.815 1.00 56.15 C ATOM 0 H MET B 179 30.767 22.328 -33.047 1.00 50.24 H new ATOM 0 HA MET B 179 28.947 21.563 -31.335 1.00 53.24 H new ATOM 0 HB2 MET B 179 31.637 20.703 -31.650 1.00 52.55 H new ATOM 0 HB3 MET B 179 30.736 20.072 -30.544 1.00 52.55 H new ATOM 0 HG2 MET B 179 29.257 19.342 -32.303 1.00 53.04 H new ATOM 0 HG3 MET B 179 30.348 19.793 -33.322 1.00 53.04 H new ATOM 0 HE1 MET B 179 33.192 17.363 -32.856 1.00 56.15 H new ATOM 0 HE2 MET B 179 32.670 18.603 -33.692 1.00 56.15 H new ATOM 0 HE3 MET B 179 33.105 18.793 -32.181 1.00 56.15 H new ATOM 2927 N ARG B 180 31.143 23.481 -30.152 1.00 62.32 N ATOM 2928 CA ARG B 180 31.611 24.246 -28.978 1.00 66.12 C ATOM 2929 C ARG B 180 30.499 24.916 -28.142 1.00 65.55 C ATOM 2930 O ARG B 180 30.404 24.643 -26.947 1.00 67.25 O ATOM 2931 CB ARG B 180 32.709 25.255 -29.364 1.00 66.04 C ATOM 2932 CG ARG B 180 34.135 24.813 -29.049 1.00 68.49 C ATOM 2933 CD ARG B 180 35.169 25.568 -29.886 1.00 70.80 C ATOM 2934 NE ARG B 180 34.866 26.998 -30.018 1.00 71.13 N ATOM 2935 CZ ARG B 180 35.289 27.782 -31.010 1.00 69.21 C ATOM 2936 NH1 ARG B 180 36.050 27.294 -31.984 1.00 67.83 N ATOM 2937 NH2 ARG B 180 34.944 29.063 -31.033 1.00 65.53 N ATOM 0 H ARG B 180 31.513 23.719 -30.891 1.00 62.32 H new ATOM 0 HA ARG B 180 31.991 23.577 -28.388 1.00 66.12 H new ATOM 0 HB2 ARG B 180 32.644 25.435 -30.315 1.00 66.04 H new ATOM 0 HB3 ARG B 180 32.536 26.092 -28.905 1.00 66.04 H new ATOM 0 HG2 ARG B 180 34.316 24.956 -28.107 1.00 68.49 H new ATOM 0 HG3 ARG B 180 34.221 23.861 -29.213 1.00 68.49 H new ATOM 0 HD2 ARG B 180 36.044 25.464 -29.481 1.00 70.80 H new ATOM 0 HD3 ARG B 180 35.216 25.170 -30.769 1.00 70.80 H new ATOM 0 HE ARG B 180 34.378 27.358 -29.408 1.00 71.13 H new ATOM 0 HH11 ARG B 180 36.275 26.464 -31.979 1.00 67.83 H new ATOM 0 HH12 ARG B 180 36.318 27.808 -32.619 1.00 67.83 H new ATOM 0 HH21 ARG B 180 34.448 29.386 -30.409 1.00 65.53 H new ATOM 0 HH22 ARG B 180 35.216 29.570 -31.672 1.00 65.53 H new ATOM 2938 N GLY B 181 29.657 25.771 -28.733 1.00 65.96 N ATOM 2939 CA GLY B 181 29.697 26.147 -30.147 1.00 64.31 C ATOM 2940 C GLY B 181 28.845 27.363 -30.465 1.00 65.61 C ATOM 2941 O GLY B 181 27.942 27.710 -29.701 1.00 67.60 O ATOM 0 H GLY B 181 29.023 26.162 -28.302 1.00 65.96 H new ATOM 0 HA2 GLY B 181 30.615 26.327 -30.402 1.00 64.31 H new ATOM 0 HA3 GLY B 181 29.395 25.398 -30.684 1.00 64.31 H new TER 2942 GLY B 181 ATOM 2943 N GLY C 4 44.949 8.641 9.483 1.00 54.73 N ATOM 2944 CA GLY C 4 43.607 8.814 8.853 1.00 53.20 C ATOM 2945 C GLY C 4 43.220 7.677 7.921 1.00 54.78 C ATOM 2946 O GLY C 4 44.060 7.151 7.185 1.00 53.73 O ATOM 0 HA2 GLY C 4 42.938 8.892 9.551 1.00 53.20 H new ATOM 0 HA3 GLY C 4 43.596 9.647 8.356 1.00 53.20 H new ATOM 2947 N ARG C 5 41.939 7.311 7.949 1.00 53.40 N ATOM 2948 CA ARG C 5 41.412 6.233 7.108 1.00 55.32 C ATOM 2949 C ARG C 5 40.191 6.664 6.284 1.00 52.28 C ATOM 2950 O ARG C 5 39.453 7.572 6.675 1.00 49.49 O ATOM 2951 CB ARG C 5 41.064 5.011 7.961 1.00 59.05 C ATOM 2952 CG ARG C 5 40.120 5.303 9.114 1.00 62.39 C ATOM 2953 CD ARG C 5 39.723 4.022 9.822 1.00 66.13 C ATOM 2954 NE ARG C 5 38.428 4.169 10.482 1.00 69.04 N ATOM 2955 CZ ARG C 5 37.251 4.036 9.874 1.00 69.49 C ATOM 2956 NH1 ARG C 5 37.187 3.746 8.579 1.00 69.50 N ATOM 2957 NH2 ARG C 5 36.131 4.195 10.567 1.00 68.76 N ATOM 0 H ARG C 5 41.350 7.680 8.456 1.00 53.40 H new ATOM 0 HA ARG C 5 42.114 6.002 6.479 1.00 55.32 H new ATOM 0 HB2 ARG C 5 40.663 4.336 7.392 1.00 59.05 H new ATOM 0 HB3 ARG C 5 41.884 4.633 8.316 1.00 59.05 H new ATOM 0 HG2 ARG C 5 40.547 5.906 9.742 1.00 62.39 H new ATOM 0 HG3 ARG C 5 39.327 5.753 8.783 1.00 62.39 H new ATOM 0 HD2 ARG C 5 39.683 3.294 9.182 1.00 66.13 H new ATOM 0 HD3 ARG C 5 40.399 3.788 10.477 1.00 66.13 H new ATOM 0 HE ARG C 5 38.426 4.354 11.322 1.00 69.04 H new ATOM 0 HH11 ARG C 5 37.910 3.642 8.125 1.00 69.50 H new ATOM 0 HH12 ARG C 5 36.422 3.662 8.194 1.00 69.50 H new ATOM 0 HH21 ARG C 5 36.167 4.383 11.405 1.00 68.76 H new ATOM 0 HH22 ARG C 5 35.369 4.110 10.178 1.00 68.76 H new ATOM 2958 N LEU C 6 39.980 5.988 5.157 1.00 50.38 N ATOM 2959 CA LEU C 6 38.911 6.332 4.218 1.00 47.87 C ATOM 2960 C LEU C 6 37.524 5.897 4.691 1.00 47.13 C ATOM 2961 O LEU C 6 37.269 4.720 4.929 1.00 49.33 O ATOM 2962 CB LEU C 6 39.203 5.768 2.823 1.00 48.96 C ATOM 2963 CG LEU C 6 40.315 6.352 1.932 1.00 52.01 C ATOM 2964 CD1 LEU C 6 40.192 7.863 1.759 1.00 50.71 C ATOM 2965 CD2 LEU C 6 41.710 5.965 2.418 1.00 52.12 C ATOM 0 H LEU C 6 40.455 5.313 4.913 1.00 50.38 H new ATOM 0 HA LEU C 6 38.896 7.301 4.173 1.00 47.87 H new ATOM 0 HB2 LEU C 6 39.400 4.825 2.936 1.00 48.96 H new ATOM 0 HB3 LEU C 6 38.377 5.827 2.317 1.00 48.96 H new ATOM 0 HG LEU C 6 40.191 5.953 1.057 1.00 52.01 H new ATOM 0 HD11 LEU C 6 40.911 8.184 1.193 1.00 50.71 H new ATOM 0 HD12 LEU C 6 39.339 8.073 1.348 1.00 50.71 H new ATOM 0 HD13 LEU C 6 40.248 8.294 2.626 1.00 50.71 H new ATOM 0 HD21 LEU C 6 42.377 6.353 1.830 1.00 52.12 H new ATOM 0 HD22 LEU C 6 41.842 6.297 3.320 1.00 52.12 H new ATOM 0 HD23 LEU C 6 41.798 4.999 2.413 1.00 52.12 H new ATOM 2966 N VAL C 7 36.636 6.869 4.836 1.00 43.19 N ATOM 2967 CA VAL C 7 35.245 6.612 5.150 1.00 41.92 C ATOM 2968 C VAL C 7 34.380 6.935 3.923 1.00 44.05 C ATOM 2969 O VAL C 7 34.588 7.948 3.244 1.00 40.73 O ATOM 2970 CB VAL C 7 34.804 7.406 6.394 1.00 40.90 C ATOM 2971 CG1 VAL C 7 33.291 7.557 6.459 1.00 42.50 C ATOM 2972 CG2 VAL C 7 35.316 6.720 7.648 1.00 42.07 C ATOM 0 H VAL C 7 36.828 7.703 4.754 1.00 43.19 H new ATOM 0 HA VAL C 7 35.130 5.673 5.366 1.00 41.92 H new ATOM 0 HB VAL C 7 35.184 8.296 6.331 1.00 40.90 H new ATOM 0 HG11 VAL C 7 33.050 8.060 7.252 1.00 42.50 H new ATOM 0 HG12 VAL C 7 32.978 8.027 5.670 1.00 42.50 H new ATOM 0 HG13 VAL C 7 32.879 6.679 6.496 1.00 42.50 H new ATOM 0 HG21 VAL C 7 35.036 7.223 8.429 1.00 42.07 H new ATOM 0 HG22 VAL C 7 34.954 5.821 7.696 1.00 42.07 H new ATOM 0 HG23 VAL C 7 36.285 6.677 7.621 1.00 42.07 H new ATOM 2973 N TYR C 8 33.428 6.054 3.635 1.00 44.22 N ATOM 2974 CA TYR C 8 32.498 6.249 2.531 1.00 42.37 C ATOM 2975 C TYR C 8 31.204 6.859 3.051 1.00 43.06 C ATOM 2976 O TYR C 8 30.747 6.545 4.149 1.00 46.42 O ATOM 2977 CB TYR C 8 32.299 4.941 1.767 1.00 43.47 C ATOM 2978 CG TYR C 8 33.609 4.499 1.153 1.00 44.87 C ATOM 2979 CD1 TYR C 8 34.015 4.994 -0.078 1.00 43.55 C ATOM 2980 CD2 TYR C 8 34.476 3.637 1.839 1.00 48.57 C ATOM 2981 CE1 TYR C 8 35.222 4.617 -0.639 1.00 46.23 C ATOM 2982 CE2 TYR C 8 35.696 3.255 1.288 1.00 47.51 C ATOM 2983 CZ TYR C 8 36.061 3.750 0.045 1.00 48.07 C ATOM 2984 OH TYR C 8 37.263 3.390 -0.528 1.00 52.43 O ATOM 0 H TYR C 8 33.304 5.326 4.075 1.00 44.22 H new ATOM 0 HA TYR C 8 32.863 6.879 1.890 1.00 42.37 H new ATOM 0 HB2 TYR C 8 31.966 4.255 2.366 1.00 43.47 H new ATOM 0 HB3 TYR C 8 31.632 5.061 1.073 1.00 43.47 H new ATOM 0 HD1 TYR C 8 33.466 5.590 -0.534 1.00 43.55 H new ATOM 0 HD2 TYR C 8 34.232 3.315 2.677 1.00 48.57 H new ATOM 0 HE1 TYR C 8 35.470 4.944 -1.473 1.00 46.23 H new ATOM 0 HE2 TYR C 8 36.259 2.675 1.748 1.00 47.51 H new ATOM 0 HH TYR C 8 37.673 2.866 -0.015 1.00 52.43 H new ATOM 2985 N LEU C 9 30.643 7.760 2.263 1.00 39.15 N ATOM 2986 CA LEU C 9 29.614 8.670 2.735 1.00 36.09 C ATOM 2987 C LEU C 9 28.279 8.489 1.998 1.00 33.98 C ATOM 2988 O LEU C 9 27.686 9.449 1.475 1.00 33.15 O ATOM 2989 CB LEU C 9 30.136 10.103 2.635 1.00 38.70 C ATOM 2990 CG LEU C 9 31.417 10.300 3.464 1.00 40.85 C ATOM 2991 CD1 LEU C 9 32.199 11.469 2.925 1.00 41.97 C ATOM 2992 CD2 LEU C 9 31.131 10.477 4.947 1.00 39.39 C ATOM 0 H LEU C 9 30.849 7.862 1.434 1.00 39.15 H new ATOM 0 HA LEU C 9 29.421 8.464 3.663 1.00 36.09 H new ATOM 0 HB2 LEU C 9 30.315 10.319 1.706 1.00 38.70 H new ATOM 0 HB3 LEU C 9 29.453 10.719 2.943 1.00 38.70 H new ATOM 0 HG LEU C 9 31.947 9.492 3.381 1.00 40.85 H new ATOM 0 HD11 LEU C 9 33.005 11.589 3.451 1.00 41.97 H new ATOM 0 HD12 LEU C 9 32.439 11.300 2.000 1.00 41.97 H new ATOM 0 HD13 LEU C 9 31.657 12.272 2.976 1.00 41.97 H new ATOM 0 HD21 LEU C 9 31.966 10.597 5.426 1.00 39.39 H new ATOM 0 HD22 LEU C 9 30.569 11.257 5.078 1.00 39.39 H new ATOM 0 HD23 LEU C 9 30.675 9.690 5.285 1.00 39.39 H new ATOM 2993 N LEU C 10 27.842 7.234 1.943 1.00 29.83 N ATOM 2994 CA LEU C 10 26.489 6.903 1.521 1.00 28.11 C ATOM 2995 C LEU C 10 25.539 7.127 2.688 1.00 27.36 C ATOM 2996 O LEU C 10 25.899 6.889 3.840 1.00 28.13 O ATOM 2997 CB LEU C 10 26.403 5.441 1.050 1.00 27.24 C ATOM 2998 CG LEU C 10 27.320 5.046 -0.119 1.00 27.22 C ATOM 2999 CD1 LEU C 10 27.052 3.601 -0.504 1.00 26.65 C ATOM 3000 CD2 LEU C 10 27.096 5.953 -1.319 1.00 25.28 C ATOM 0 H LEU C 10 28.323 6.552 2.150 1.00 29.83 H new ATOM 0 HA LEU C 10 26.242 7.474 0.777 1.00 28.11 H new ATOM 0 HB2 LEU C 10 26.607 4.866 1.804 1.00 27.24 H new ATOM 0 HB3 LEU C 10 25.486 5.258 0.793 1.00 27.24 H new ATOM 0 HG LEU C 10 28.243 5.144 0.164 1.00 27.22 H new ATOM 0 HD11 LEU C 10 27.630 3.350 -1.242 1.00 26.65 H new ATOM 0 HD12 LEU C 10 27.230 3.025 0.256 1.00 26.65 H new ATOM 0 HD13 LEU C 10 26.125 3.504 -0.773 1.00 26.65 H new ATOM 0 HD21 LEU C 10 27.684 5.685 -2.042 1.00 25.28 H new ATOM 0 HD22 LEU C 10 26.174 5.883 -1.610 1.00 25.28 H new ATOM 0 HD23 LEU C 10 27.287 6.871 -1.071 1.00 25.28 H new ATOM 3001 N ASP C 11 24.339 7.611 2.397 1.00 24.00 N ATOM 3002 CA ASP C 11 23.307 7.654 3.406 1.00 24.19 C ATOM 3003 C ASP C 11 22.241 6.629 3.018 1.00 22.30 C ATOM 3004 O ASP C 11 22.361 5.980 1.968 1.00 19.96 O ATOM 3005 CB ASP C 11 22.734 9.069 3.559 1.00 26.46 C ATOM 3006 CG ASP C 11 22.186 9.343 4.982 1.00 30.47 C ATOM 3007 OD1 ASP C 11 21.913 8.388 5.766 1.00 30.48 O ATOM 3008 OD2 ASP C 11 22.031 10.537 5.322 1.00 34.35 O ATOM 0 H ASP C 11 24.108 7.916 1.627 1.00 24.00 H new ATOM 0 HA ASP C 11 23.670 7.427 4.276 1.00 24.19 H new ATOM 0 HB2 ASP C 11 23.425 9.718 3.352 1.00 26.46 H new ATOM 0 HB3 ASP C 11 22.022 9.197 2.912 1.00 26.46 H new ATOM 3009 N GLY C 12 21.215 6.472 3.856 1.00 21.24 N ATOM 3010 CA GLY C 12 20.097 5.590 3.547 1.00 19.56 C ATOM 3011 C GLY C 12 19.249 6.139 2.400 1.00 19.90 C ATOM 3012 O GLY C 12 19.546 7.229 1.850 1.00 18.73 O ATOM 0 H GLY C 12 21.151 6.873 4.614 1.00 21.24 H new ATOM 0 HA2 GLY C 12 20.433 4.711 3.311 1.00 19.56 H new ATOM 0 HA3 GLY C 12 19.543 5.479 4.336 1.00 19.56 H new ATOM 3013 N PRO C 13 18.193 5.405 2.021 1.00 19.33 N ATOM 3014 CA PRO C 13 17.414 5.802 0.833 1.00 18.77 C ATOM 3015 C PRO C 13 16.561 7.051 1.030 1.00 17.82 C ATOM 3016 O PRO C 13 16.175 7.386 2.156 1.00 17.67 O ATOM 3017 CB PRO C 13 16.512 4.590 0.585 1.00 20.37 C ATOM 3018 CG PRO C 13 16.346 3.949 1.929 1.00 19.88 C ATOM 3019 CD PRO C 13 17.609 4.230 2.706 1.00 20.08 C ATOM 0 HA PRO C 13 18.004 6.032 0.098 1.00 18.77 H new ATOM 0 HB2 PRO C 13 15.656 4.859 0.216 1.00 20.37 H new ATOM 0 HB3 PRO C 13 16.915 3.977 -0.049 1.00 20.37 H new ATOM 0 HG2 PRO C 13 15.572 4.310 2.389 1.00 19.88 H new ATOM 0 HG3 PRO C 13 16.203 2.994 1.839 1.00 19.88 H new ATOM 0 HD2 PRO C 13 17.418 4.420 3.638 1.00 20.08 H new ATOM 0 HD3 PRO C 13 18.213 3.471 2.689 1.00 20.08 H new ATOM 3020 N GLY C 14 16.288 7.745 -0.066 1.00 16.53 N ATOM 3021 CA GLY C 14 15.422 8.902 -0.036 1.00 16.10 C ATOM 3022 C GLY C 14 16.174 10.218 0.040 1.00 15.42 C ATOM 3023 O GLY C 14 17.380 10.265 0.346 1.00 14.75 O ATOM 0 H GLY C 14 16.601 7.556 -0.844 1.00 16.53 H new ATOM 0 HA2 GLY C 14 14.865 8.901 -0.830 1.00 16.10 H new ATOM 0 HA3 GLY C 14 14.828 8.833 0.727 1.00 16.10 H new ATOM 3024 N TYR C 15 15.440 11.302 -0.213 1.00 15.77 N ATOM 3025 CA TYR C 15 16.003 12.654 -0.141 1.00 16.31 C ATOM 3026 C TYR C 15 16.440 12.995 1.290 1.00 18.47 C ATOM 3027 O TYR C 15 17.510 13.581 1.497 1.00 18.35 O ATOM 3028 CB TYR C 15 14.953 13.655 -0.609 1.00 15.24 C ATOM 3029 CG TYR C 15 15.415 15.078 -0.511 1.00 14.83 C ATOM 3030 CD1 TYR C 15 16.266 15.626 -1.477 1.00 13.33 C ATOM 3031 CD2 TYR C 15 15.025 15.871 0.561 1.00 14.34 C ATOM 3032 CE1 TYR C 15 16.677 16.933 -1.380 1.00 14.55 C ATOM 3033 CE2 TYR C 15 15.438 17.187 0.661 1.00 15.64 C ATOM 3034 CZ TYR C 15 16.257 17.712 -0.305 1.00 15.32 C ATOM 3035 OH TYR C 15 16.689 19.017 -0.191 1.00 16.85 O ATOM 0 H TYR C 15 14.608 11.277 -0.430 1.00 15.77 H new ATOM 0 HA TYR C 15 16.785 12.697 -0.713 1.00 16.31 H new ATOM 0 HB2 TYR C 15 14.715 13.460 -1.529 1.00 15.24 H new ATOM 0 HB3 TYR C 15 14.149 13.544 -0.078 1.00 15.24 H new ATOM 0 HD1 TYR C 15 16.555 15.102 -2.189 1.00 13.33 H new ATOM 0 HD2 TYR C 15 14.478 15.511 1.221 1.00 14.34 H new ATOM 0 HE1 TYR C 15 17.234 17.296 -2.030 1.00 14.55 H new ATOM 0 HE2 TYR C 15 15.162 17.712 1.378 1.00 15.64 H new ATOM 0 HH TYR C 15 17.408 19.112 -0.614 1.00 16.85 H new ATOM 3036 N ASP C 16 15.607 12.626 2.260 1.00 21.45 N ATOM 3037 CA ASP C 16 15.920 12.840 3.684 1.00 27.50 C ATOM 3038 C ASP C 16 15.802 11.502 4.424 1.00 28.13 C ATOM 3039 O ASP C 16 14.731 11.135 4.945 1.00 28.65 O ATOM 3040 CB ASP C 16 15.009 13.907 4.312 1.00 32.23 C ATOM 3041 CG ASP C 16 15.366 14.208 5.776 1.00 36.83 C ATOM 3042 OD1 ASP C 16 16.408 13.720 6.276 1.00 39.35 O ATOM 3043 OD2 ASP C 16 14.595 14.943 6.431 1.00 43.36 O ATOM 0 H ASP C 16 14.848 12.247 2.119 1.00 21.45 H new ATOM 0 HA ASP C 16 16.828 13.173 3.761 1.00 27.50 H new ATOM 0 HB2 ASP C 16 15.071 14.725 3.794 1.00 32.23 H new ATOM 0 HB3 ASP C 16 14.087 13.609 4.263 1.00 32.23 H new ATOM 3044 N PRO C 17 16.900 10.747 4.442 1.00 28.14 N ATOM 3045 CA PRO C 17 16.853 9.372 4.910 1.00 29.12 C ATOM 3046 C PRO C 17 16.360 9.272 6.362 1.00 32.04 C ATOM 3047 O PRO C 17 16.687 10.121 7.185 1.00 32.42 O ATOM 3048 CB PRO C 17 18.313 8.916 4.780 1.00 27.45 C ATOM 3049 CG PRO C 17 18.882 9.791 3.706 1.00 27.75 C ATOM 3050 CD PRO C 17 18.246 11.128 3.962 1.00 27.68 C ATOM 0 HA PRO C 17 16.232 8.824 4.405 1.00 29.12 H new ATOM 0 HB2 PRO C 17 18.793 9.024 5.616 1.00 27.45 H new ATOM 0 HB3 PRO C 17 18.370 7.978 4.539 1.00 27.45 H new ATOM 0 HG2 PRO C 17 19.849 9.840 3.761 1.00 27.75 H new ATOM 0 HG3 PRO C 17 18.665 9.457 2.822 1.00 27.75 H new ATOM 0 HD2 PRO C 17 18.735 11.641 4.624 1.00 27.68 H new ATOM 0 HD3 PRO C 17 18.204 11.669 3.158 1.00 27.68 H new ATOM 3051 N ILE C 18 15.549 8.257 6.640 1.00 36.00 N ATOM 3052 CA ILE C 18 15.019 8.017 7.983 1.00 43.83 C ATOM 3053 C ILE C 18 16.041 7.270 8.867 1.00 47.38 C ATOM 3054 O ILE C 18 16.557 6.218 8.481 1.00 45.28 O ATOM 3055 CB ILE C 18 13.641 7.298 7.902 1.00 44.75 C ATOM 3056 CG1 ILE C 18 12.532 8.335 7.650 1.00 45.54 C ATOM 3057 CG2 ILE C 18 13.341 6.499 9.162 1.00 46.87 C ATOM 3058 CD1 ILE C 18 11.382 7.847 6.787 1.00 45.85 C ATOM 0 H ILE C 18 15.288 7.684 6.054 1.00 36.00 H new ATOM 0 HA ILE C 18 14.867 8.871 8.417 1.00 43.83 H new ATOM 0 HB ILE C 18 13.674 6.669 7.164 1.00 44.75 H new ATOM 0 HG12 ILE C 18 12.177 8.623 8.505 1.00 45.54 H new ATOM 0 HG13 ILE C 18 12.926 9.115 7.229 1.00 45.54 H new ATOM 0 HG21 ILE C 18 12.477 6.067 9.074 1.00 46.87 H new ATOM 0 HG22 ILE C 18 14.027 5.825 9.289 1.00 46.87 H new ATOM 0 HG23 ILE C 18 13.327 7.095 9.928 1.00 46.87 H new ATOM 0 HD11 ILE C 18 10.733 8.559 6.680 1.00 45.85 H new ATOM 0 HD12 ILE C 18 11.719 7.584 5.916 1.00 45.85 H new ATOM 0 HD13 ILE C 18 10.958 7.085 7.213 1.00 45.85 H new ATOM 3059 N HIS C 19 16.336 7.846 10.035 1.00 55.23 N ATOM 3060 CA HIS C 19 17.246 7.254 11.023 1.00 62.49 C ATOM 3061 C HIS C 19 16.556 7.006 12.336 1.00 67.69 C ATOM 3062 O HIS C 19 15.858 7.884 12.850 1.00 69.74 O ATOM 3063 CB HIS C 19 18.440 8.168 11.266 1.00 65.74 C ATOM 3064 CG HIS C 19 19.338 8.334 10.068 1.00 68.19 C ATOM 3065 ND1 HIS C 19 19.650 9.541 9.560 1.00 66.77 N ATOM 3066 CD2 HIS C 19 19.997 7.391 9.278 1.00 67.79 C ATOM 3067 CE1 HIS C 19 20.465 9.383 8.502 1.00 67.79 C ATOM 3068 NE2 HIS C 19 20.675 8.065 8.330 1.00 69.64 N ATOM 0 H HIS C 19 16.009 8.603 10.280 1.00 55.23 H new ATOM 0 HA HIS C 19 17.544 6.406 10.659 1.00 62.49 H new ATOM 0 HB2 HIS C 19 18.117 9.041 11.540 1.00 65.74 H new ATOM 0 HB3 HIS C 19 18.962 7.814 12.003 1.00 65.74 H new ATOM 0 HD2 HIS C 19 19.972 6.468 9.386 1.00 67.79 H new ATOM 0 HE1 HIS C 19 20.821 10.065 7.980 1.00 67.79 H new ATOM 0 HE2 HIS C 19 21.162 7.711 7.716 1.00 69.64 H new ATOM 3069 N CYS C 20 16.748 5.811 12.893 1.00 69.84 N ATOM 3070 CA CYS C 20 16.204 5.456 14.206 1.00 70.14 C ATOM 3071 C CYS C 20 16.956 4.282 14.821 1.00 68.01 C ATOM 3072 O CYS C 20 18.042 4.455 15.373 1.00 65.21 O ATOM 3073 CB CYS C 20 14.706 5.145 14.124 1.00 73.21 C ATOM 3074 SG CYS C 20 14.260 3.910 12.882 1.00 82.85 S ATOM 0 H CYS C 20 17.199 5.181 12.520 1.00 69.84 H new ATOM 0 HA CYS C 20 16.323 6.227 14.782 1.00 70.14 H new ATOM 0 HB2 CYS C 20 14.404 4.837 14.993 1.00 73.21 H new ATOM 0 HB3 CYS C 20 14.227 5.967 13.932 1.00 73.21 H new ATOM 0 HG CYS C 20 13.073 3.737 12.898 1.00 82.85 H new TER 3075 CYS C 20 ATOM 3076 N LEU D 6 29.617 27.569 -58.328 1.00 50.42 N ATOM 3077 CA LEU D 6 29.215 26.484 -57.383 1.00 50.33 C ATOM 3078 C LEU D 6 28.011 25.701 -57.890 1.00 49.43 C ATOM 3079 O LEU D 6 26.955 26.273 -58.147 1.00 53.08 O ATOM 3080 CB LEU D 6 28.899 27.047 -55.992 1.00 51.92 C ATOM 3081 CG LEU D 6 29.933 27.752 -55.100 1.00 53.57 C ATOM 3082 CD1 LEU D 6 31.198 26.920 -54.906 1.00 52.75 C ATOM 3083 CD2 LEU D 6 30.259 29.151 -55.612 1.00 54.26 C ATOM 0 HA LEU D 6 29.972 25.881 -57.322 1.00 50.33 H new ATOM 0 HB2 LEU D 6 28.170 27.676 -56.112 1.00 51.92 H new ATOM 0 HB3 LEU D 6 28.551 26.306 -55.471 1.00 51.92 H new ATOM 0 HG LEU D 6 29.523 27.848 -54.226 1.00 53.57 H new ATOM 0 HD11 LEU D 6 31.819 27.403 -54.339 1.00 52.75 H new ATOM 0 HD12 LEU D 6 30.969 26.075 -54.488 1.00 52.75 H new ATOM 0 HD13 LEU D 6 31.611 26.753 -55.768 1.00 52.75 H new ATOM 0 HD21 LEU D 6 30.913 29.566 -55.027 1.00 54.26 H new ATOM 0 HD22 LEU D 6 30.621 29.091 -56.510 1.00 54.26 H new ATOM 0 HD23 LEU D 6 29.451 29.688 -55.625 1.00 54.26 H new ATOM 3084 N VAL D 7 28.182 24.389 -58.022 1.00 46.23 N ATOM 3085 CA VAL D 7 27.100 23.474 -58.374 1.00 43.19 C ATOM 3086 C VAL D 7 26.807 22.523 -57.196 1.00 42.76 C ATOM 3087 O VAL D 7 27.728 21.992 -56.555 1.00 36.12 O ATOM 3088 CB VAL D 7 27.419 22.693 -59.670 1.00 46.26 C ATOM 3089 CG1 VAL D 7 26.540 21.454 -59.815 1.00 46.63 C ATOM 3090 CG2 VAL D 7 27.274 23.599 -60.890 1.00 44.66 C ATOM 0 H VAL D 7 28.940 24.000 -57.908 1.00 46.23 H new ATOM 0 HA VAL D 7 26.302 23.996 -58.550 1.00 43.19 H new ATOM 0 HB VAL D 7 28.339 22.392 -59.611 1.00 46.26 H new ATOM 0 HG11 VAL D 7 26.767 20.990 -60.636 1.00 46.63 H new ATOM 0 HG12 VAL D 7 26.686 20.863 -59.060 1.00 46.63 H new ATOM 0 HG13 VAL D 7 25.608 21.720 -59.841 1.00 46.63 H new ATOM 0 HG21 VAL D 7 27.477 23.095 -61.694 1.00 44.66 H new ATOM 0 HG22 VAL D 7 26.364 23.933 -60.939 1.00 44.66 H new ATOM 0 HG23 VAL D 7 27.888 24.346 -60.813 1.00 44.66 H new ATOM 3091 N TYR D 8 25.517 22.338 -56.921 1.00 42.19 N ATOM 3092 CA TYR D 8 25.034 21.495 -55.829 1.00 41.91 C ATOM 3093 C TYR D 8 24.688 20.107 -56.343 1.00 42.15 C ATOM 3094 O TYR D 8 24.123 19.946 -57.429 1.00 46.56 O ATOM 3095 CB TYR D 8 23.866 22.179 -55.118 1.00 43.35 C ATOM 3096 CG TYR D 8 24.320 23.491 -54.526 1.00 45.11 C ATOM 3097 CD1 TYR D 8 24.951 23.530 -53.287 1.00 45.14 C ATOM 3098 CD2 TYR D 8 24.183 24.691 -55.238 1.00 46.93 C ATOM 3099 CE1 TYR D 8 25.407 24.722 -52.751 1.00 46.06 C ATOM 3100 CE2 TYR D 8 24.635 25.894 -54.708 1.00 47.24 C ATOM 3101 CZ TYR D 8 25.248 25.899 -53.466 1.00 48.26 C ATOM 3102 OH TYR D 8 25.704 27.082 -52.923 1.00 54.16 O ATOM 0 H TYR D 8 24.885 22.707 -57.374 1.00 42.19 H new ATOM 0 HA TYR D 8 25.736 21.377 -55.170 1.00 41.91 H new ATOM 0 HB2 TYR D 8 23.141 22.332 -55.744 1.00 43.35 H new ATOM 0 HB3 TYR D 8 23.520 21.602 -54.419 1.00 43.35 H new ATOM 0 HD1 TYR D 8 25.069 22.740 -52.810 1.00 45.14 H new ATOM 0 HD2 TYR D 8 23.784 24.682 -56.078 1.00 46.93 H new ATOM 0 HE1 TYR D 8 25.817 24.733 -51.917 1.00 46.06 H new ATOM 0 HE2 TYR D 8 24.527 26.687 -55.182 1.00 47.24 H new ATOM 0 HH TYR D 8 25.547 27.713 -53.455 1.00 54.16 H new ATOM 3103 N LEU D 9 25.058 19.107 -55.563 1.00 37.03 N ATOM 3104 CA LEU D 9 25.169 17.752 -56.055 1.00 35.23 C ATOM 3105 C LEU D 9 24.200 16.808 -55.354 1.00 34.16 C ATOM 3106 O LEU D 9 24.591 15.732 -54.873 1.00 36.99 O ATOM 3107 CB LEU D 9 26.598 17.268 -55.862 1.00 35.63 C ATOM 3108 CG LEU D 9 27.617 18.158 -56.576 1.00 37.82 C ATOM 3109 CD1 LEU D 9 28.834 18.320 -55.697 1.00 38.07 C ATOM 3110 CD2 LEU D 9 27.987 17.634 -57.953 1.00 35.48 C ATOM 0 H LEU D 9 25.252 19.197 -54.730 1.00 37.03 H new ATOM 0 HA LEU D 9 24.939 17.753 -56.997 1.00 35.23 H new ATOM 0 HB2 LEU D 9 26.803 17.242 -54.914 1.00 35.63 H new ATOM 0 HB3 LEU D 9 26.677 16.360 -56.194 1.00 35.63 H new ATOM 0 HG LEU D 9 27.211 19.026 -56.727 1.00 37.82 H new ATOM 0 HD11 LEU D 9 29.484 18.884 -56.145 1.00 38.07 H new ATOM 0 HD12 LEU D 9 28.575 18.730 -54.857 1.00 38.07 H new ATOM 0 HD13 LEU D 9 29.226 17.450 -55.523 1.00 38.07 H new ATOM 0 HD21 LEU D 9 28.633 18.230 -58.363 1.00 35.48 H new ATOM 0 HD22 LEU D 9 28.373 16.748 -57.869 1.00 35.48 H new ATOM 0 HD23 LEU D 9 27.192 17.589 -58.507 1.00 35.48 H new ATOM 3111 N LEU D 10 22.942 17.225 -55.280 1.00 29.29 N ATOM 3112 CA LEU D 10 21.888 16.340 -54.812 1.00 26.03 C ATOM 3113 C LEU D 10 21.466 15.436 -55.963 1.00 25.65 C ATOM 3114 O LEU D 10 21.497 15.856 -57.125 1.00 24.77 O ATOM 3115 CB LEU D 10 20.690 17.158 -54.308 1.00 25.09 C ATOM 3116 CG LEU D 10 21.018 18.149 -53.178 1.00 24.40 C ATOM 3117 CD1 LEU D 10 19.808 19.006 -52.791 1.00 24.85 C ATOM 3118 CD2 LEU D 10 21.581 17.408 -51.972 1.00 22.92 C ATOM 0 H LEU D 10 22.680 18.015 -55.496 1.00 29.29 H new ATOM 0 HA LEU D 10 22.215 15.801 -54.075 1.00 26.03 H new ATOM 0 HB2 LEU D 10 20.313 17.650 -55.054 1.00 25.09 H new ATOM 0 HB3 LEU D 10 20.004 16.546 -53.996 1.00 25.09 H new ATOM 0 HG LEU D 10 21.695 18.760 -53.509 1.00 24.40 H new ATOM 0 HD11 LEU D 10 20.057 19.615 -52.078 1.00 24.85 H new ATOM 0 HD12 LEU D 10 19.512 19.515 -53.562 1.00 24.85 H new ATOM 0 HD13 LEU D 10 19.088 18.431 -52.488 1.00 24.85 H new ATOM 0 HD21 LEU D 10 21.784 18.043 -51.267 1.00 22.92 H new ATOM 0 HD22 LEU D 10 20.927 16.767 -51.651 1.00 22.92 H new ATOM 0 HD23 LEU D 10 22.392 16.941 -52.228 1.00 22.92 H new ATOM 3119 N ASP D 11 21.080 14.203 -55.651 1.00 23.46 N ATOM 3120 CA ASP D 11 20.467 13.361 -56.660 1.00 24.26 C ATOM 3121 C ASP D 11 18.993 13.153 -56.291 1.00 22.04 C ATOM 3122 O ASP D 11 18.530 13.639 -55.257 1.00 18.37 O ATOM 3123 CB ASP D 11 21.235 12.034 -56.833 1.00 26.98 C ATOM 3124 CG ASP D 11 21.029 11.397 -58.241 1.00 33.16 C ATOM 3125 OD1 ASP D 11 20.099 11.803 -58.989 1.00 34.19 O ATOM 3126 OD2 ASP D 11 21.802 10.472 -58.599 1.00 37.95 O ATOM 0 H ASP D 11 21.163 13.843 -54.874 1.00 23.46 H new ATOM 0 HA ASP D 11 20.510 13.797 -57.526 1.00 24.26 H new ATOM 0 HB2 ASP D 11 22.181 12.191 -56.689 1.00 26.98 H new ATOM 0 HB3 ASP D 11 20.945 11.406 -56.153 1.00 26.98 H new ATOM 3127 N GLY D 12 18.260 12.440 -57.139 1.00 21.57 N ATOM 3128 CA GLY D 12 16.869 12.106 -56.857 1.00 21.04 C ATOM 3129 C GLY D 12 16.776 11.112 -55.714 1.00 20.68 C ATOM 3130 O GLY D 12 17.807 10.685 -55.169 1.00 20.80 O ATOM 0 H GLY D 12 18.552 12.138 -57.889 1.00 21.57 H new ATOM 0 HA2 GLY D 12 16.378 12.911 -56.632 1.00 21.04 H new ATOM 0 HA3 GLY D 12 16.454 11.733 -57.650 1.00 21.04 H new ATOM 3131 N PRO D 13 15.552 10.748 -55.320 1.00 20.57 N ATOM 3132 CA PRO D 13 15.419 9.938 -54.108 1.00 20.10 C ATOM 3133 C PRO D 13 15.864 8.484 -54.291 1.00 19.73 C ATOM 3134 O PRO D 13 15.867 7.955 -55.402 1.00 19.17 O ATOM 3135 CB PRO D 13 13.921 10.004 -53.806 1.00 21.79 C ATOM 3136 CG PRO D 13 13.274 10.245 -55.140 1.00 21.59 C ATOM 3137 CD PRO D 13 14.238 11.124 -55.888 1.00 21.05 C ATOM 0 HA PRO D 13 15.986 10.273 -53.396 1.00 20.10 H new ATOM 0 HB2 PRO D 13 13.606 9.179 -53.405 1.00 21.79 H new ATOM 0 HB3 PRO D 13 13.718 10.718 -53.182 1.00 21.79 H new ATOM 0 HG2 PRO D 13 13.121 9.411 -55.612 1.00 21.59 H new ATOM 0 HG3 PRO D 13 12.411 10.677 -55.039 1.00 21.59 H new ATOM 0 HD2 PRO D 13 14.202 10.963 -56.844 1.00 21.05 H new ATOM 0 HD3 PRO D 13 14.045 12.065 -55.751 1.00 21.05 H new ATOM 3138 N GLY D 14 16.272 7.866 -53.193 1.00 18.56 N ATOM 3139 CA GLY D 14 16.569 6.442 -53.174 1.00 17.94 C ATOM 3140 C GLY D 14 18.056 6.183 -53.255 1.00 17.28 C ATOM 3141 O GLY D 14 18.841 7.090 -53.572 1.00 15.98 O ATOM 0 H GLY D 14 16.385 8.260 -52.437 1.00 18.56 H new ATOM 0 HA2 GLY D 14 16.215 6.048 -52.362 1.00 17.94 H new ATOM 0 HA3 GLY D 14 16.123 6.008 -53.918 1.00 17.94 H new ATOM 3142 N TYR D 15 18.448 4.931 -53.027 1.00 16.80 N ATOM 3143 CA TYR D 15 19.867 4.562 -53.128 1.00 17.18 C ATOM 3144 C TYR D 15 20.387 4.677 -54.572 1.00 19.03 C ATOM 3145 O TYR D 15 21.513 5.131 -54.806 1.00 18.60 O ATOM 3146 CB TYR D 15 20.052 3.127 -52.614 1.00 16.14 C ATOM 3147 CG TYR D 15 21.450 2.610 -52.727 1.00 15.84 C ATOM 3148 CD1 TYR D 15 22.400 2.921 -51.758 1.00 15.95 C ATOM 3149 CD2 TYR D 15 21.837 1.827 -53.806 1.00 15.71 C ATOM 3150 CE1 TYR D 15 23.682 2.430 -51.835 1.00 16.19 C ATOM 3151 CE2 TYR D 15 23.128 1.327 -53.895 1.00 17.04 C ATOM 3152 CZ TYR D 15 24.043 1.632 -52.917 1.00 16.71 C ATOM 3153 OH TYR D 15 25.334 1.152 -52.992 1.00 17.84 O ATOM 0 H TYR D 15 17.920 4.286 -52.815 1.00 16.80 H new ATOM 0 HA TYR D 15 20.382 5.180 -52.585 1.00 17.18 H new ATOM 0 HB2 TYR D 15 19.778 3.090 -51.684 1.00 16.14 H new ATOM 0 HB3 TYR D 15 19.460 2.539 -53.108 1.00 16.14 H new ATOM 0 HD1 TYR D 15 22.163 3.471 -51.046 1.00 15.95 H new ATOM 0 HD2 TYR D 15 21.223 1.635 -54.478 1.00 15.71 H new ATOM 0 HE1 TYR D 15 24.302 2.629 -51.171 1.00 16.19 H new ATOM 0 HE2 TYR D 15 23.373 0.788 -54.613 1.00 17.04 H new ATOM 0 HH TYR D 15 25.816 1.557 -52.436 1.00 17.84 H new ATOM 3154 N ASP D 16 19.556 4.264 -55.525 1.00 22.34 N ATOM 3155 CA ASP D 16 19.895 4.372 -56.954 1.00 28.52 C ATOM 3156 C ASP D 16 18.773 5.098 -57.692 1.00 28.85 C ATOM 3157 O ASP D 16 17.796 4.473 -58.136 1.00 28.09 O ATOM 3158 CB ASP D 16 20.139 2.987 -57.565 1.00 34.76 C ATOM 3159 CG ASP D 16 20.777 3.060 -58.943 1.00 40.62 C ATOM 3160 OD1 ASP D 16 21.331 4.129 -59.312 1.00 41.77 O ATOM 3161 OD2 ASP D 16 20.731 2.031 -59.653 1.00 46.83 O ATOM 0 H ASP D 16 18.785 3.916 -55.370 1.00 22.34 H new ATOM 0 HA ASP D 16 20.715 4.882 -57.044 1.00 28.52 H new ATOM 0 HB2 ASP D 16 20.711 2.473 -56.974 1.00 34.76 H new ATOM 0 HB3 ASP D 16 19.296 2.512 -57.628 1.00 34.76 H new ATOM 3162 N PRO D 17 18.887 6.430 -57.786 1.00 28.00 N ATOM 3163 CA PRO D 17 17.763 7.213 -58.266 1.00 30.12 C ATOM 3164 C PRO D 17 17.418 6.905 -59.736 1.00 32.74 C ATOM 3165 O PRO D 17 18.309 6.659 -60.550 1.00 32.57 O ATOM 3166 CB PRO D 17 18.234 8.662 -58.076 1.00 29.11 C ATOM 3167 CG PRO D 17 19.289 8.590 -57.014 1.00 28.53 C ATOM 3168 CD PRO D 17 19.963 7.267 -57.218 1.00 28.18 C ATOM 0 HA PRO D 17 16.942 7.017 -57.788 1.00 30.12 H new ATOM 0 HB2 PRO D 17 18.590 9.027 -58.901 1.00 29.11 H new ATOM 0 HB3 PRO D 17 17.501 9.237 -57.805 1.00 29.11 H new ATOM 0 HG2 PRO D 17 19.921 9.321 -57.097 1.00 28.53 H new ATOM 0 HG3 PRO D 17 18.899 8.652 -56.128 1.00 28.53 H new ATOM 0 HD2 PRO D 17 20.719 7.338 -57.822 1.00 28.18 H new ATOM 0 HD3 PRO D 17 20.299 6.903 -56.384 1.00 28.18 H new ATOM 3169 N ILE D 18 16.121 6.871 -60.027 1.00 37.77 N ATOM 3170 CA ILE D 18 15.589 6.627 -61.367 1.00 42.47 C ATOM 3171 C ILE D 18 15.678 7.930 -62.157 1.00 47.04 C ATOM 3172 O ILE D 18 15.231 8.981 -61.685 1.00 46.30 O ATOM 3173 CB ILE D 18 14.110 6.165 -61.303 1.00 41.82 C ATOM 3174 CG1 ILE D 18 13.964 4.941 -60.391 1.00 41.83 C ATOM 3175 CG2 ILE D 18 13.571 5.845 -62.697 1.00 44.35 C ATOM 3176 CD1 ILE D 18 12.596 4.801 -59.760 1.00 42.49 C ATOM 0 H ILE D 18 15.509 6.992 -59.435 1.00 37.77 H new ATOM 0 HA ILE D 18 16.105 5.926 -61.794 1.00 42.47 H new ATOM 0 HB ILE D 18 13.589 6.895 -60.934 1.00 41.82 H new ATOM 0 HG12 ILE D 18 14.156 4.141 -60.906 1.00 41.83 H new ATOM 0 HG13 ILE D 18 14.630 4.992 -59.688 1.00 41.83 H new ATOM 0 HG21 ILE D 18 12.647 5.559 -62.629 1.00 44.35 H new ATOM 0 HG22 ILE D 18 13.624 6.637 -63.254 1.00 44.35 H new ATOM 0 HG23 ILE D 18 14.100 5.135 -63.094 1.00 44.35 H new ATOM 0 HD11 ILE D 18 12.577 4.009 -59.200 1.00 42.49 H new ATOM 0 HD12 ILE D 18 12.407 5.584 -59.219 1.00 42.49 H new ATOM 0 HD13 ILE D 18 11.925 4.720 -60.456 1.00 42.49 H new ATOM 3177 N HIS D 19 16.249 7.853 -63.355 1.00 54.64 N ATOM 3178 CA HIS D 19 16.424 9.024 -64.209 1.00 61.30 C ATOM 3179 C HIS D 19 15.711 8.895 -65.525 1.00 67.98 C ATOM 3180 O HIS D 19 15.989 7.978 -66.302 1.00 70.21 O ATOM 3181 CB HIS D 19 17.905 9.298 -64.440 1.00 62.03 C ATOM 3182 CG HIS D 19 18.652 9.687 -63.189 1.00 64.60 C ATOM 3183 ND1 HIS D 19 19.713 8.995 -62.736 1.00 65.19 N ATOM 3184 CD2 HIS D 19 18.442 10.730 -62.285 1.00 64.51 C ATOM 3185 CE1 HIS D 19 20.169 9.569 -61.604 1.00 66.69 C ATOM 3186 NE2 HIS D 19 19.388 10.630 -61.330 1.00 65.58 N ATOM 0 H HIS D 19 16.546 7.121 -63.696 1.00 54.64 H new ATOM 0 HA HIS D 19 16.024 9.774 -63.741 1.00 61.30 H new ATOM 0 HB2 HIS D 19 18.317 8.506 -64.820 1.00 62.03 H new ATOM 0 HB3 HIS D 19 17.996 10.007 -65.095 1.00 62.03 H new ATOM 0 HD2 HIS D 19 17.773 11.374 -62.333 1.00 64.51 H new ATOM 0 HE1 HIS D 19 20.896 9.282 -61.101 1.00 66.69 H new ATOM 0 HE2 HIS D 19 19.478 11.157 -60.657 1.00 65.58 H new ATOM 3187 N CYS D 20 14.772 9.814 -65.764 1.00 71.63 N ATOM 3188 CA CYS D 20 14.100 9.996 -67.058 1.00 73.90 C ATOM 3189 C CYS D 20 13.536 8.714 -67.682 1.00 74.27 C ATOM 3190 O CYS D 20 13.079 7.811 -66.981 1.00 75.89 O ATOM 3191 CB CYS D 20 15.040 10.705 -68.039 1.00 74.53 C ATOM 3192 SG CYS D 20 14.311 11.079 -69.647 1.00 85.84 S ATOM 0 H CYS D 20 14.500 10.365 -65.162 1.00 71.63 H new ATOM 0 HA CYS D 20 13.323 10.546 -66.874 1.00 73.90 H new ATOM 0 HB2 CYS D 20 15.344 11.533 -67.635 1.00 74.53 H new ATOM 0 HB3 CYS D 20 15.824 10.150 -68.174 1.00 74.53 H new ATOM 0 HG CYS D 20 15.123 11.632 -70.336 1.00 85.84 H new TER 3193 CYS D 20 HETATM 3194 ZN ZN A1181 39.145 26.986 -12.181 1.00 42.78 ZN HETATM 3195 CL CL A1182 21.836 0.327 -3.674 1.00 55.06 CL HETATM 3196 CL CL A1183 7.612 11.084 -5.735 1.00 24.04 CL HETATM 3197 CL CL A1184 10.115 11.813 1.735 1.00 31.99 CL HETATM 3198 CL CL A1185 4.999 7.189 -19.820 1.00 52.83 CL HETATM 3199 CL CL A1186 24.974 -2.720 -9.407 1.00 32.90 CL HETATM 3200 CL CL A1187 7.167 9.894 -12.882 1.00 45.49 CL HETATM 3201 CL CL A1188 30.932 11.838 12.828 1.00 57.36 CL HETATM 3202 ZN ZN B1182 45.619 13.665 -41.143 1.00 62.53 ZN HETATM 3203 CL CL B1183 13.451 21.136 -43.845 1.00 33.67 CL HETATM 3204 CL CL B1184 28.681 16.569 -65.973 1.00 52.23 CL HETATM 3205 CL CL B1185 10.791 14.406 -47.379 1.00 51.14 CL HETATM 3206 CL CL B1186 7.332 13.720 -41.217 1.00 33.45 CL HETATM 3207 CL CL B1187 19.150 -4.830 -40.442 1.00 55.35 CL HETATM 3208 CL CL B1188 13.399 -1.057 -47.470 1.00 26.58 CL HETATM 3209 O HOH A2001 20.895 30.304 -7.835 1.00 46.09 O HETATM 3210 O HOH A2002 22.267 28.808 -5.581 1.00 31.91 O HETATM 3211 O HOH A2003 14.533 14.272 -18.079 1.00 39.55 O HETATM 3212 O HOH A2004 16.212 17.707 -10.605 1.00 19.39 O HETATM 3213 O HOH A2005 15.499 9.793 -12.022 1.00 15.88 O HETATM 3214 O HOH A2006 12.853 14.163 -9.500 1.00 32.16 O HETATM 3215 O HOH A2007 12.896 11.544 -10.324 1.00 34.33 O HETATM 3216 O HOH A2008 14.509 0.113 -13.096 1.00 25.11 O HETATM 3217 O HOH A2009 18.089 -0.685 -5.851 1.00 28.54 O HETATM 3218 O HOH A2010 27.994 29.959 0.507 1.00 41.97 O HETATM 3219 O HOH A2011 25.234 28.703 0.221 1.00 30.98 O HETATM 3220 O HOH A2012 21.091 26.214 1.869 1.00 31.04 O HETATM 3221 O HOH A2013 23.602 26.954 1.363 1.00 17.33 O HETATM 3222 O HOH A2014 18.136 29.934 -8.522 1.00 38.87 O HETATM 3223 O HOH A2015 19.812 18.022 -0.308 1.00 29.74 O HETATM 3224 O HOH A2016 10.991 21.038 -3.015 1.00 13.08 O HETATM 3225 O HOH A2017 12.111 15.557 2.968 1.00 18.14 O HETATM 3226 O HOH A2018 7.544 13.464 -7.880 1.00 33.57 O HETATM 3227 O HOH A2019 7.958 16.793 -7.451 1.00 13.50 O HETATM 3228 O HOH A2020 12.747 10.883 -1.171 1.00 23.12 O HETATM 3229 O HOH A2021 6.167 12.145 -10.838 1.00 39.09 O HETATM 3230 O HOH A2022 7.734 7.561 -11.509 1.00 24.42 O HETATM 3231 O HOH A2023 6.537 9.906 -3.016 1.00 28.49 O HETATM 3232 O HOH A2024 18.649 6.376 -22.878 1.00 37.87 O HETATM 3233 O HOH A2025 22.139 7.659 -22.981 1.00 35.41 O HETATM 3234 O HOH A2026 7.044 5.160 -12.698 1.00 38.14 O HETATM 3235 O HOH A2027 9.354 5.770 -23.884 1.00 39.00 O HETATM 3236 O HOH A2028 11.115 1.082 -20.167 1.00 33.83 O HETATM 3237 O HOH A2029 12.521 13.203 -16.233 1.00 35.80 O HETATM 3238 O HOH A2030 13.847 13.551 -12.624 1.00 36.15 O HETATM 3239 O HOH A2031 7.749 17.112 -16.372 1.00 39.61 O HETATM 3240 O HOH A2032 7.469 17.343 -10.124 1.00 41.72 O HETATM 3241 O HOH A2033 8.099 17.995 -12.827 1.00 34.38 O HETATM 3242 O HOH A2034 13.993 15.968 -10.786 1.00 29.94 O HETATM 3243 O HOH A2035 14.763 17.329 -17.537 0.50 22.90 O HETATM 3244 O HOH A2036 18.843 24.494 -13.975 1.00 38.27 O HETATM 3245 O HOH A2037 19.691 1.226 3.975 1.00 40.50 O HETATM 3246 O HOH A2038 23.929 0.640 -6.033 1.00 27.60 O HETATM 3247 O HOH A2039 26.330 -0.141 -3.773 1.00 49.57 O HETATM 3248 O HOH A2040 23.985 19.362 -19.183 1.00 37.98 O HETATM 3249 O HOH A2041 32.118 14.914 -18.684 1.00 39.77 O HETATM 3250 O HOH A2042 28.167 -0.476 -5.902 1.00 33.19 O HETATM 3251 O HOH A2043 30.786 -4.194 -12.723 1.00 19.59 O HETATM 3252 O HOH A2044 28.033 -3.688 -10.209 1.00 37.21 O HETATM 3253 O HOH A2045 27.972 -2.886 -7.481 1.00 42.03 O HETATM 3254 O HOH A2046 32.696 -4.557 -8.924 1.00 41.64 O HETATM 3255 O HOH A2047 28.821 0.306 -1.729 1.00 33.01 O HETATM 3256 O HOH A2048 31.107 7.484 0.033 1.00 36.68 O HETATM 3257 O HOH A2049 25.975 -5.575 -11.394 1.00 43.92 O HETATM 3258 O HOH A2050 14.971 8.104 -20.444 1.00 22.74 O HETATM 3259 O HOH A2051 8.473 11.854 -19.957 1.00 47.17 O HETATM 3260 O HOH A2052 15.316 3.102 -21.911 1.00 36.91 O HETATM 3261 O HOH A2053 20.247 4.361 -22.398 1.00 23.64 O HETATM 3262 O HOH A2054 23.868 7.406 -20.810 1.00 19.39 O HETATM 3263 O HOH A2055 20.997 0.382 -23.640 1.00 34.26 O HETATM 3264 O HOH A2056 27.112 2.180 -22.460 1.00 36.36 O HETATM 3265 O HOH A2057 32.985 2.452 -19.687 1.00 33.80 O HETATM 3266 O HOH A2058 35.579 -0.391 -15.497 1.00 33.36 O HETATM 3267 O HOH A2059 38.129 0.186 -14.147 1.00 48.41 O HETATM 3268 O HOH A2060 39.223 7.747 -7.997 1.00 48.68 O HETATM 3269 O HOH A2061 34.640 1.474 -5.978 1.00 37.03 O HETATM 3270 O HOH A2062 20.059 9.086 -22.712 1.00 43.26 O HETATM 3271 O HOH A2063 21.668 18.439 -20.034 1.00 48.18 O HETATM 3272 O HOH A2064 23.922 23.400 -19.216 1.00 37.26 O HETATM 3273 O HOH A2065 31.025 25.528 -14.503 1.00 26.29 O HETATM 3274 O HOH A2066 41.777 23.413 -10.148 1.00 40.89 O HETATM 3275 O HOH A2067 38.396 27.798 -14.216 1.00 23.36 O HETATM 3276 O HOH A2068 42.484 27.009 0.035 1.00 24.48 O HETATM 3277 O HOH A2069 19.123 15.697 0.933 1.00 21.35 O HETATM 3278 O HOH A2070 22.125 12.472 3.553 1.00 34.20 O HETATM 3279 O HOH A2071 24.462 14.224 6.703 1.00 35.85 O HETATM 3280 O HOH A2072 18.740 17.723 4.078 1.00 50.01 O HETATM 3281 O HOH A2073 27.411 27.408 2.313 1.00 30.46 O HETATM 3282 O HOH A2074 31.538 27.262 4.687 1.00 44.68 O HETATM 3283 O HOH A2075 36.450 23.405 5.567 1.00 32.65 O HETATM 3284 O HOH A2076 41.215 18.321 -11.061 1.00 34.05 O HETATM 3285 O HOH A2077 46.562 13.002 -4.323 1.00 40.65 O HETATM 3286 O HOH A2078 44.773 13.080 2.849 1.00 44.10 O HETATM 3287 O HOH A2079 44.849 8.167 3.755 1.00 50.90 O HETATM 3288 O HOH A2080 42.231 19.453 7.783 1.00 34.97 O HETATM 3289 O HOH A2081 34.035 23.005 7.019 1.00 36.08 O HETATM 3290 O HOH A2082 36.758 27.572 7.108 1.00 46.93 O HETATM 3291 O HOH A2083 29.286 25.732 5.833 1.00 41.76 O HETATM 3292 O HOH A2084 33.090 26.110 6.780 1.00 37.98 O HETATM 3293 O HOH A2085 26.268 15.479 3.679 1.00 28.23 O HETATM 3294 O HOH A2086 28.976 26.858 -11.092 1.00 39.76 O HETATM 3295 O HOH A2087 36.600 8.025 12.046 1.00 45.57 O HETATM 3296 O HOH B2001 37.062 -2.772 -45.583 1.00 47.39 O HETATM 3297 O HOH B2002 36.607 -0.734 -47.554 1.00 41.15 O HETATM 3298 O HOH B2003 20.258 2.291 -35.156 1.00 38.28 O HETATM 3299 O HOH B2004 8.080 8.025 -33.010 1.00 39.54 O HETATM 3300 O HOH B2005 24.042 1.484 -42.727 1.00 18.65 O HETATM 3301 O HOH B2006 17.374 5.914 -41.204 1.00 16.19 O HETATM 3302 O HOH B2007 17.281 2.857 -42.939 1.00 32.18 O HETATM 3303 O HOH B2008 9.243 11.294 -40.186 1.00 24.74 O HETATM 3304 O HOH B2009 6.469 14.496 -45.491 1.00 48.62 O HETATM 3305 O HOH B2010 46.374 6.951 -48.397 1.00 40.74 O HETATM 3306 O HOH B2011 44.677 6.826 -50.602 1.00 49.65 O HETATM 3307 O HOH B2012 37.672 -1.392 -49.910 1.00 38.81 O HETATM 3308 O HOH B2013 37.838 2.167 -53.663 1.00 35.08 O HETATM 3309 O HOH B2014 35.693 1.582 -54.666 1.00 19.95 O HETATM 3310 O HOH B2015 36.662 -2.429 -52.275 1.00 35.66 O HETATM 3311 O HOH B2016 33.649 -0.017 -55.176 1.00 36.31 O HETATM 3312 O HOH B2017 31.062 -0.502 -54.329 1.00 24.02 O HETATM 3313 O HOH B2018 26.435 4.419 -52.705 1.00 32.63 O HETATM 3314 O HOH B2019 23.279 -4.571 -50.305 1.00 11.33 O HETATM 3315 O HOH B2020 19.806 -0.208 -56.345 1.00 20.70 O HETATM 3316 O HOH B2021 18.088 -4.383 -45.857 1.00 13.17 O HETATM 3317 O HOH B2022 15.271 -2.696 -45.508 1.00 36.06 O HETATM 3318 O HOH B2023 17.987 24.527 -49.463 1.00 50.29 O HETATM 3319 O HOH B2024 16.463 3.132 -52.117 1.00 24.13 O HETATM 3320 O HOH B2025 12.264 -0.615 -40.237 1.00 21.61 O HETATM 3321 O HOH B2026 11.859 -1.069 -50.196 1.00 25.99 O HETATM 3322 O HOH B2027 16.640 10.605 -30.324 1.00 40.61 O HETATM 3323 O HOH B2028 19.737 12.665 -30.234 1.00 32.46 O HETATM 3324 O HOH B2029 10.633 1.392 -41.690 1.00 26.10 O HETATM 3325 O HOH B2030 8.110 6.452 -35.196 1.00 38.57 O HETATM 3326 O HOH B2031 8.635 2.203 -40.318 1.00 37.53 O HETATM 3327 O HOH B2032 19.297 9.799 -30.770 1.00 47.61 O HETATM 3328 O HOH B2033 10.507 3.548 -29.084 1.00 43.39 O HETATM 3329 O HOH B2034 5.738 6.389 -33.307 1.00 46.01 O HETATM 3330 O HOH B2035 18.307 1.544 -37.070 1.00 39.89 O HETATM 3331 O HOH B2036 19.269 2.060 -40.523 1.00 42.38 O HETATM 3332 O HOH B2037 18.339 -4.392 -36.711 1.00 36.42 O HETATM 3333 O HOH B2038 17.280 -1.251 -34.289 1.00 40.32 O HETATM 3334 O HOH B2039 13.526 -3.072 -42.457 1.00 33.96 O HETATM 3335 O HOH B2040 22.813 0.988 -35.577 0.50 19.26 O HETATM 3336 O HOH B2041 47.683 26.418 -51.028 1.00 38.69 O HETATM 3337 O HOH B2042 37.554 4.576 -40.521 1.00 43.56 O HETATM 3338 O HOH B2043 11.419 15.922 -49.784 1.00 46.31 O HETATM 3339 O HOH B2044 13.797 16.776 -49.336 1.00 32.06 O HETATM 3340 O HOH B2045 13.236 14.672 -57.132 1.00 41.33 O HETATM 3341 O HOH B2046 15.490 18.200 -47.301 1.00 28.20 O HETATM 3342 O HOH B2047 16.129 20.651 -49.019 1.00 49.74 O HETATM 3343 O HOH B2048 26.341 8.229 -31.406 1.00 51.09 O HETATM 3344 O HOH B2049 17.374 22.600 -47.216 1.00 30.92 O HETATM 3345 O HOH B2050 14.479 24.064 -43.194 1.00 42.86 O HETATM 3346 O HOH B2051 16.903 28.388 -44.335 1.00 42.50 O HETATM 3347 O HOH B2052 18.182 22.133 -51.697 1.00 37.25 O HETATM 3348 O HOH B2053 25.995 19.637 -53.432 1.00 40.09 O HETATM 3349 O HOH B2054 20.270 25.676 -48.223 1.00 42.74 O HETATM 3350 O HOH B2055 15.737 6.633 -32.874 1.00 18.31 O HETATM 3351 O HOH B2056 10.129 8.232 -30.293 1.00 37.79 O HETATM 3352 O HOH B2057 12.102 9.946 -31.457 1.00 32.18 O HETATM 3353 O HOH B2058 16.149 13.009 -30.828 1.00 21.10 O HETATM 3354 O HOH B2059 20.759 13.960 -32.417 1.00 16.12 O HETATM 3355 O HOH B2060 18.627 19.363 -30.663 1.00 36.73 O HETATM 3356 O HOH B2061 23.059 20.315 -29.166 1.00 34.98 O HETATM 3357 O HOH B2062 20.480 22.109 -31.706 1.00 53.40 O HETATM 3358 O HOH B2063 22.544 24.000 -33.600 1.00 38.63 O HETATM 3359 O HOH B2064 21.868 27.976 -38.000 1.00 33.15 O HETATM 3360 O HOH B2065 23.621 29.674 -39.314 1.00 42.85 O HETATM 3361 O HOH B2066 21.152 8.761 -32.478 1.00 39.90 O HETATM 3362 O HOH B2067 39.303 8.244 -38.950 1.00 30.46 O HETATM 3363 O HOH B2068 45.827 12.675 -39.036 1.00 31.26 O HETATM 3364 O HOH B2069 49.857 21.007 -45.627 1.00 33.80 O HETATM 3365 O HOH B2070 45.595 13.918 -53.115 1.00 37.57 O HETATM 3366 O HOH B2071 31.505 8.603 -58.377 1.00 35.17 O HETATM 3367 O HOH B2072 24.242 5.162 -54.214 1.00 24.96 O HETATM 3368 O HOH B2073 23.749 9.258 -56.910 1.00 40.41 O HETATM 3369 O HOH B2074 29.705 1.463 -55.944 1.00 44.50 O HETATM 3370 O HOH B2075 33.555 2.130 -56.930 1.00 41.66 O HETATM 3371 O HOH B2076 38.471 4.105 -55.920 1.00 33.71 O HETATM 3372 O HOH B2077 40.734 7.680 -58.023 1.00 44.26 O HETATM 3373 O HOH B2078 40.876 14.345 -58.801 1.00 35.08 O HETATM 3374 O HOH B2079 47.283 24.445 -52.869 1.00 30.59 O HETATM 3375 O HOH B2080 40.133 20.774 -42.438 1.00 33.28 O HETATM 3376 O HOH B2081 40.697 28.712 -52.713 1.00 50.59 O HETATM 3377 O HOH B2082 38.919 28.662 -48.915 1.00 40.35 O HETATM 3378 O HOH B2083 37.931 27.087 -56.051 1.00 42.19 O HETATM 3379 O HOH B2084 46.054 13.609 -62.712 1.00 47.54 O HETATM 3380 O HOH B2085 45.487 15.529 -64.814 1.00 56.76 O HETATM 3381 O HOH B2086 39.270 12.037 -60.215 1.00 35.22 O HETATM 3382 O HOH B2087 38.448 6.278 -59.322 1.00 40.04 O HETATM 3383 O HOH B2088 40.905 9.702 -60.007 1.00 33.21 O HETATM 3384 O HOH B2089 28.486 13.770 -67.774 1.00 38.49 O HETATM 3385 O HOH B2090 28.635 10.706 -57.008 1.00 28.58 O HETATM 3386 O HOH B2091 39.199 6.044 -42.497 1.00 36.75 O HETATM 3387 O HOH B2092 29.262 23.506 -65.485 1.00 41.76 O HETATM 3388 O HOH B2093 29.936 26.190 -67.094 1.00 45.94 O HETATM 3389 O HOH B2094 29.453 20.414 -71.268 1.00 48.16 O HETATM 3390 O HOH B2095 32.335 25.685 -46.873 1.00 33.01 O HETATM 3391 O HOH C2001 44.146 6.450 11.058 1.00 55.20 O HETATM 3392 O HOH C2002 29.038 4.500 2.823 1.00 42.26 O HETATM 3393 O HOH C2003 28.276 5.604 5.157 1.00 36.66 O HETATM 3394 O HOH C2004 23.793 3.639 3.334 1.00 43.79 O HETATM 3395 O HOH C2005 14.754 6.698 4.467 1.00 32.57 O HETATM 3396 O HOH C2006 12.929 10.883 1.602 1.00 29.38 O HETATM 3397 O HOH C2007 14.216 17.214 4.213 1.00 22.15 O HETATM 3398 O HOH C2008 17.853 5.422 6.122 1.00 33.82 O HETATM 3399 O HOH D2001 14.422 7.372 -57.661 1.00 33.28 O HETATM 3400 O HOH D2002 27.005 2.055 -55.669 1.00 44.25 O HETATM 3401 O HOH D2003 22.372 0.308 -57.568 1.00 27.13 O CONECT 434 472 CONECT 472 434 CONECT 830 3194 CONECT 843 3194 CONECT 1192 3194 CONECT 2306 3202 CONECT 2319 3202 CONECT 2668 3202 CONECT 3194 830 843 1192 3275 CONECT 3202 2306 2319 2668 3363 CONECT 3275 3194 CONECT 3363 3202 END