HEADER VIRAL PROTEIN/NUCLEAR PROTEIN 09-OCT-07 2RHK TITLE CRYSTAL STRUCTURE OF INFLUENZA A NS1A PROTEIN IN COMPLEX TITLE 2 WITH F2F3 FRAGMENT OF HUMAN CELLULAR FACTOR CPSF30 COMPND MOL_ID: 1; COMPND 2 MOLECULE: NON-STRUCTURAL PROTEIN 1; COMPND 3 CHAIN: A, B; COMPND 4 FRAGMENT: NS1A EFFECTOR DOMAIN (UNP RESIDUES 85-215); COMPND 5 SYNONYM: NS1, NS1A; COMPND 6 ENGINEERED: YES; COMPND 7 MOL_ID: 2; COMPND 8 MOLECULE: CLEAVAGE AND POLYADENYLATION SPECIFICITY FACTOR COMPND 9 SUBUNIT 4; COMPND 10 CHAIN: C, D; COMPND 11 FRAGMENT: F2F3 ZINC-BINDING DOMAINS (UNP RESIDUES 61-121); COMPND 12 SYNONYM: CLEAVAGE AND POLYADENYLATION SPECIFICITY FACTOR COMPND 13 30 KDA SUBUNIT, CPSF 30 KDA SUBUNIT, NS1 EFFECTOR DOMAIN- COMPND 14 BINDING PROTEIN 1, NEB-1, NO ARCHES HOMOLOG, F2F3 ZINC- COMPND 15 BINDING DOMAINS; COMPND 16 ENGINEERED: YES; COMPND 17 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: INFLUENZA A VIRUS; SOURCE 3 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 4 EXPRESSION_SYSTEM_STRAIN: BL21; SOURCE 5 EXPRESSION_SYSTEM_VECTOR_TYPE: PET21C; SOURCE 6 MOL_ID: 2; SOURCE 7 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 8 ORGANISM_COMMON: HUMAN; SOURCE 9 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 10 EXPRESSION_SYSTEM_STRAIN: BL21; SOURCE 11 EXPRESSION_SYSTEM_VECTOR_TYPE: PET14C KEYWDS INFLUENZA A, NONSTRUCTURAL PROTEIN, VIRAL PROTEIN: HOST KEYWDS 2 COMPLEX, ZN FINGER, ALTERNATIVE SPLICING, CYTOPLASM, HOST- KEYWDS 3 VIRUS INTERACTION, INTERFERON ANTIVIRAL SYSTEM EVASION, KEYWDS 4 NUCLEUS, RNA-BINDING, SUPPRESSOR OF RNA SILENCING, METAL- KEYWDS 5 BINDING, MRNA PROCESSING, ZINC, ZINC-FINGER, METAL BINDING KEYWDS 6 PROTEIN, VIRAL PROTEIN/METAL BINDING PROTEIN COMPLEX, VIRAL KEYWDS 7 PROTEIN/NUCLEAR PROTEIN COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR K.DAS,L.-C.MA,R.XIAO,B.RADVANSKY,J.ARAMINI,L.ZHAO,E.ARNOLD, AUTHOR 2 R.M.KRUG,G.T.MONTELIONE REVDAT 3 24-FEB-09 2RHK 1 VERSN REVDAT 2 23-SEP-08 2RHK 1 JRNL REVDAT 1 01-JUL-08 2RHK 0 JRNL AUTH K.DAS,L.C.MA,R.XIAO,B.RADVANSKY,J.ARAMINI,L.ZHAO, JRNL AUTH 2 J.MARKLUND,R.L.KUO,K.Y.TWU,E.ARNOLD,R.M.KRUG, JRNL AUTH 3 G.T.MONTELIONE JRNL TITL STRUCTURAL BASIS FOR SUPPRESSION OF A HOST JRNL TITL 2 ANTIVIRAL RESPONSE BY INFLUENZA A VIRUS. JRNL REF PROC.NATL.ACAD.SCI.USA V. 105 13093 2008 JRNL REFN ISSN 0027-8424 JRNL PMID 18725644 JRNL DOI 10.1073/PNAS.0805213105 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 1.95 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS 1.1 REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE- REMARK 3 : KUNSTLEVE,JIANG,KUSZEWSKI,NILGES, PANNU, REMARK 3 : READ,RICE,SIMONSON,WARREN REMARK 3 REMARK 3 REFINEMENT TARGET : ENGH & HUBER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.95 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 50.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 1225055.450 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0000 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 97.8 REMARK 3 NUMBER OF REFLECTIONS : 37096 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 SET) : 0.210 REMARK 3 FREE R VALUE : 0.234 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 3.100 REMARK 3 FREE R VALUE TEST SET COUNT : 1159 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.007 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 6 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 1.95 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.07 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 92.00 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 5620 REMARK 3 BIN R VALUE (WORKING SET) : 0.2700 REMARK 3 BIN FREE R VALUE : 0.2950 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 2.90 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 170 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.023 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2911 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 32 REMARK 3 SOLVENT ATOMS : 185 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 39.60 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 6.66000 REMARK 3 B22 (A**2) : 6.66000 REMARK 3 B33 (A**2) : -13.33000 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.23 REMARK 3 ESD FROM SIGMAA (A) : 0.21 REMARK 3 LOW RESOLUTION CUTOFF (A) : 6.00 REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : 0.28 REMARK 3 ESD FROM C-V SIGMAA (A) : 0.26 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.008 REMARK 3 BOND ANGLES (DEGREES) : 1.50 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 24.20 REMARK 3 IMPROPER ANGLES (DEGREES) : 1.13 REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : RESTRAINED REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : FLAT MODEL REMARK 3 KSOL : 0.37 REMARK 3 BSOL : 53.03 REMARK 3 REMARK 3 NCS MODEL : NULL REMARK 3 REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL REMARK 3 REMARK 3 PARAMETER FILE 1 : PROTEIN_REP.PARAM REMARK 3 PARAMETER FILE 2 : ION.PARAM REMARK 3 PARAMETER FILE 3 : WATER.PARAM REMARK 3 PARAMETER FILE 4 : NO3.PAR REMARK 3 PARAMETER FILE 5 : TRS.PAR REMARK 3 PARAMETER FILE 6 : NULL REMARK 3 TOPOLOGY FILE 1 : PROTEIN.TOP REMARK 3 TOPOLOGY FILE 2 : ION.TOP REMARK 3 TOPOLOGY FILE 3 : WATER.TOP REMARK 3 TOPOLOGY FILE 4 : NO3.TOP REMARK 3 TOPOLOGY FILE 5 : TRS.TOP REMARK 3 TOPOLOGY FILE 6 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 2RHK COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 15-NOV-07. REMARK 100 THE RCSB ID CODE IS RCSB044867. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 19-JUL-06; NULL REMARK 200 TEMPERATURE (KELVIN) : 100.0; NULL REMARK 200 PH : 5.50 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y; NULL REMARK 200 RADIATION SOURCE : NSLS; NULL REMARK 200 BEAMLINE : X25; NULL REMARK 200 X-RAY GENERATOR MODEL : NULL; NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M; M REMARK 200 WAVELENGTH OR RANGE (A) : 0.9800; NULL REMARK 200 MONOCHROMATOR : GRAPHITE; NULL REMARK 200 OPTICS : NULL; NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD; NULL REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 315; NULL REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 37297 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.950 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : -0.500 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 97.7 REMARK 200 DATA REDUNDANCY : 5.000 REMARK 200 R MERGE (I) : 0.09500 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 9.0000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.95 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.02 REMARK 200 COMPLETENESS FOR SHELL (%) : 88.4 REMARK 200 DATA REDUNDANCY IN SHELL : 3.10 REMARK 200 R MERGE FOR SHELL (I) : 0.43000 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 3.000 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH; NULL REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MAD REMARK 200 SOFTWARE USED: SOLVE REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 54.74 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.72 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.5 M KNO3, 10% SUCROES, 0.1M REMARK 280 SODIUM ACITATE, PH 5.5, EVAPORATION, TEMPERATURE 293K, PH 5.50 REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 41 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z+1/2 REMARK 290 3555 -Y,X,Z+1/4 REMARK 290 4555 Y,-X,Z+3/4 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 102.69500 REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 51.34750 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 154.04250 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1, 2, 3, 4 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TETRAMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TETRAMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 5870 ANGSTROM**2 REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, C, D, B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 REMARK 350 BIOMOLECULE: 2 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: HEXAMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: HEXAMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 4870 ANGSTROM**2 REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, C, D REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, D, B REMARK 350 BIOMT1 2 1.000000 0.000000 0.000000 50.96000 REMARK 350 BIOMT2 2 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 2 0.000000 0.000000 1.000000 0.00000 REMARK 350 REMARK 350 BIOMOLECULE: 3 REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TRIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 1830 ANGSTROM**2 REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, C, D REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 REMARK 350 BIOMOLECULE: 4 REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TRIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 1810 ANGSTROM**2 REMARK 350 APPLY THE FOLLOWING TO CHAINS: B, D, A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 MET A 84 REMARK 465 GLY A 204 REMARK 465 SER A 205 REMARK 465 SER A 206 REMARK 465 ASN A 207 REMARK 465 GLU A 208 REMARK 465 ASN A 209 REMARK 465 GLY A 210 REMARK 465 ARG A 211 REMARK 465 PRO A 212 REMARK 465 PRO A 213 REMARK 465 LEU A 214 REMARK 465 THR A 215 REMARK 465 LEU A 216 REMARK 465 GLU A 217 REMARK 465 HIS A 218 REMARK 465 HIS A 219 REMARK 465 HIS A 220 REMARK 465 HIS A 221 REMARK 465 HIS A 222 REMARK 465 HIS A 223 REMARK 465 MET B 84 REMARK 465 GLY B 204 REMARK 465 SER B 205 REMARK 465 SER B 206 REMARK 465 ASN B 207 REMARK 465 GLU B 208 REMARK 465 ASN B 209 REMARK 465 GLY B 210 REMARK 465 ARG B 211 REMARK 465 PRO B 212 REMARK 465 PRO B 213 REMARK 465 LEU B 214 REMARK 465 THR B 215 REMARK 465 LEU B 216 REMARK 465 GLU B 217 REMARK 465 HIS B 218 REMARK 465 HIS B 219 REMARK 465 HIS B 220 REMARK 465 HIS B 221 REMARK 465 HIS B 222 REMARK 465 HIS B 223 REMARK 465 MET C 50 REMARK 465 GLY C 51 REMARK 465 HIS C 52 REMARK 465 HIS C 53 REMARK 465 HIS C 54 REMARK 465 HIS C 55 REMARK 465 SER C 119 REMARK 465 LYS C 120 REMARK 465 ILE C 121 REMARK 465 MET D 50 REMARK 465 GLY D 51 REMARK 465 HIS D 52 REMARK 465 HIS D 53 REMARK 465 HIS D 54 REMARK 465 HIS D 55 REMARK 465 HIS D 56 REMARK 465 HIS D 57 REMARK 465 GLU D 118 REMARK 465 SER D 119 REMARK 465 LYS D 120 REMARK 465 ILE D 121 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 PRO D 117 N - CA - C ANGL. DEV. = -16.4 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ALA A 202 -36.16 -147.30 REMARK 500 GLU B 142 -60.62 -102.45 REMARK 500 SER B 165 10.77 -64.52 REMARK 500 HIS C 86 47.07 -103.58 REMARK 500 MET C 90 -9.33 -56.00 REMARK 500 HIS D 86 65.17 -104.28 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 C 501 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS C 68 SG REMARK 620 2 CYS C 76 SG 115.4 REMARK 620 3 CYS C 82 SG 109.5 111.2 REMARK 620 4 HIS C 86 NE2 111.9 102.7 105.5 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN C 502 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS C 96 SG REMARK 620 2 CYS C 105 SG 109.8 REMARK 620 3 CYS C 110 SG 114.3 108.5 REMARK 620 4 HIS C 114 NE2 116.6 103.0 103.9 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN D 501 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS D 68 SG REMARK 620 2 CYS D 76 SG 110.2 REMARK 620 3 CYS D 82 SG 110.0 113.7 REMARK 620 4 HIS D 86 NE2 115.2 98.5 108.9 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN D 502 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS D 96 SG REMARK 620 2 CYS D 105 SG 107.7 REMARK 620 3 CYS D 110 SG 115.6 108.1 REMARK 620 4 HIS D 114 NE2 115.8 102.8 105.9 REMARK 620 N 1 2 3 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NO3 A 2 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NO3 A 3 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NO3 A 4 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NO3 A 5 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN C 502 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN C 501 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NO3 C 1 REMARK 800 SITE_IDENTIFIER: AC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN D 502 REMARK 800 SITE_IDENTIFIER: AC9 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN D 501 REMARK 800 SITE_IDENTIFIER: BC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE TRS D 11 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 2D9N RELATED DB: PDB REMARK 900 SOLUTION STRUCTURE OF CCCH TYPE ZINC-FINGER DOMAIN 2 IN REMARK 900 CLEAVAGE AND POLYADENYLATION SPECIFICITY FACTOR. REMARK 900 RELATED ID: 2GX9 RELATED DB: PDB REMARK 900 X-RAY STRUCTURE OF INFLUENZA VIRUS NS1 EFFECTOR DOMAIN. DBREF 2RHK A 85 215 UNP P03495 NS1_IAUDO 85 215 DBREF 2RHK B 85 215 UNP P03495 NS1_IAUDO 85 215 DBREF 2RHK C 61 121 UNP O95639 CPSF4_HUMAN 61 121 DBREF 2RHK D 61 121 UNP O95639 CPSF4_HUMAN 61 121 SEQADV 2RHK MET A 84 UNP P03495 INITIATING METHIONINE SEQADV 2RHK LEU A 216 UNP P03495 EXPRESSION TAG SEQADV 2RHK GLU A 217 UNP P03495 EXPRESSION TAG SEQADV 2RHK HIS A 218 UNP P03495 EXPRESSION TAG SEQADV 2RHK HIS A 219 UNP P03495 EXPRESSION TAG SEQADV 2RHK HIS A 220 UNP P03495 EXPRESSION TAG SEQADV 2RHK HIS A 221 UNP P03495 EXPRESSION TAG SEQADV 2RHK HIS A 222 UNP P03495 EXPRESSION TAG SEQADV 2RHK HIS A 223 UNP P03495 EXPRESSION TAG SEQADV 2RHK MET B 84 UNP P03495 INITIATING METHIONINE SEQADV 2RHK LEU B 216 UNP P03495 EXPRESSION TAG SEQADV 2RHK GLU B 217 UNP P03495 EXPRESSION TAG SEQADV 2RHK HIS B 218 UNP P03495 EXPRESSION TAG SEQADV 2RHK HIS B 219 UNP P03495 EXPRESSION TAG SEQADV 2RHK HIS B 220 UNP P03495 EXPRESSION TAG SEQADV 2RHK HIS B 221 UNP P03495 EXPRESSION TAG SEQADV 2RHK HIS B 222 UNP P03495 EXPRESSION TAG SEQADV 2RHK HIS B 223 UNP P03495 EXPRESSION TAG SEQADV 2RHK MET C 50 UNP O95639 EXPRESSION TAG SEQADV 2RHK GLY C 51 UNP O95639 EXPRESSION TAG SEQADV 2RHK HIS C 52 UNP O95639 EXPRESSION TAG SEQADV 2RHK HIS C 53 UNP O95639 EXPRESSION TAG SEQADV 2RHK HIS C 54 UNP O95639 EXPRESSION TAG SEQADV 2RHK HIS C 55 UNP O95639 EXPRESSION TAG SEQADV 2RHK HIS C 56 UNP O95639 EXPRESSION TAG SEQADV 2RHK HIS C 57 UNP O95639 EXPRESSION TAG SEQADV 2RHK SER C 58 UNP O95639 EXPRESSION TAG SEQADV 2RHK HIS C 59 UNP O95639 EXPRESSION TAG SEQADV 2RHK MET C 60 UNP O95639 EXPRESSION TAG SEQADV 2RHK SER C 94 UNP O95639 PRO 94 ENGINEERED SEQADV 2RHK MET D 50 UNP O95639 EXPRESSION TAG SEQADV 2RHK GLY D 51 UNP O95639 EXPRESSION TAG SEQADV 2RHK HIS D 52 UNP O95639 EXPRESSION TAG SEQADV 2RHK HIS D 53 UNP O95639 EXPRESSION TAG SEQADV 2RHK HIS D 54 UNP O95639 EXPRESSION TAG SEQADV 2RHK HIS D 55 UNP O95639 EXPRESSION TAG SEQADV 2RHK HIS D 56 UNP O95639 EXPRESSION TAG SEQADV 2RHK HIS D 57 UNP O95639 EXPRESSION TAG SEQADV 2RHK SER D 58 UNP O95639 EXPRESSION TAG SEQADV 2RHK HIS D 59 UNP O95639 EXPRESSION TAG SEQADV 2RHK MET D 60 UNP O95639 EXPRESSION TAG SEQADV 2RHK SER D 94 UNP O95639 PRO 94 ENGINEERED SEQRES 1 A 140 MET PRO ALA SER ARG TYR ILE THR ASP MET THR ILE GLU SEQRES 2 A 140 GLU LEU SER ARG ASP TRP PHE MET LEU MET PRO LYS GLN SEQRES 3 A 140 LYS VAL GLU GLY PRO LEU CYS ILE ARG ILE ASP GLN ALA SEQRES 4 A 140 ILE MET ASP LYS ASN ILE MET LEU LYS ALA ASN PHE SER SEQRES 5 A 140 VAL ILE PHE ASP ARG LEU GLU THR LEU ILE LEU LEU ARG SEQRES 6 A 140 ALA PHE THR GLU GLU GLY ALA ILE VAL GLY GLU ILE SER SEQRES 7 A 140 PRO LEU PRO SER PHE PRO GLY HIS THR ILE GLU ASP VAL SEQRES 8 A 140 LYS ASN ALA ILE GLY VAL LEU ILE GLY GLY LEU GLU TRP SEQRES 9 A 140 ASN ASP ASN THR VAL ARG VAL SER LYS THR LEU GLN ARG SEQRES 10 A 140 PHE ALA TRP GLY SER SER ASN GLU ASN GLY ARG PRO PRO SEQRES 11 A 140 LEU THR LEU GLU HIS HIS HIS HIS HIS HIS SEQRES 1 B 140 MET PRO ALA SER ARG TYR ILE THR ASP MET THR ILE GLU SEQRES 2 B 140 GLU LEU SER ARG ASP TRP PHE MET LEU MET PRO LYS GLN SEQRES 3 B 140 LYS VAL GLU GLY PRO LEU CYS ILE ARG ILE ASP GLN ALA SEQRES 4 B 140 ILE MET ASP LYS ASN ILE MET LEU LYS ALA ASN PHE SER SEQRES 5 B 140 VAL ILE PHE ASP ARG LEU GLU THR LEU ILE LEU LEU ARG SEQRES 6 B 140 ALA PHE THR GLU GLU GLY ALA ILE VAL GLY GLU ILE SER SEQRES 7 B 140 PRO LEU PRO SER PHE PRO GLY HIS THR ILE GLU ASP VAL SEQRES 8 B 140 LYS ASN ALA ILE GLY VAL LEU ILE GLY GLY LEU GLU TRP SEQRES 9 B 140 ASN ASP ASN THR VAL ARG VAL SER LYS THR LEU GLN ARG SEQRES 10 B 140 PHE ALA TRP GLY SER SER ASN GLU ASN GLY ARG PRO PRO SEQRES 11 B 140 LEU THR LEU GLU HIS HIS HIS HIS HIS HIS SEQRES 1 C 72 MET GLY HIS HIS HIS HIS HIS HIS SER HIS MET SER GLY SEQRES 2 C 72 GLU LYS THR VAL VAL CYS LYS HIS TRP LEU ARG GLY LEU SEQRES 3 C 72 CYS LYS LYS GLY ASP GLN CYS GLU PHE LEU HIS GLU TYR SEQRES 4 C 72 ASP MET THR LYS MET SER GLU CYS TYR PHE TYR SER LYS SEQRES 5 C 72 PHE GLY GLU CYS SER ASN LYS GLU CYS PRO PHE LEU HIS SEQRES 6 C 72 ILE ASP PRO GLU SER LYS ILE SEQRES 1 D 72 MET GLY HIS HIS HIS HIS HIS HIS SER HIS MET SER GLY SEQRES 2 D 72 GLU LYS THR VAL VAL CYS LYS HIS TRP LEU ARG GLY LEU SEQRES 3 D 72 CYS LYS LYS GLY ASP GLN CYS GLU PHE LEU HIS GLU TYR SEQRES 4 D 72 ASP MET THR LYS MET SER GLU CYS TYR PHE TYR SER LYS SEQRES 5 D 72 PHE GLY GLU CYS SER ASN LYS GLU CYS PRO PHE LEU HIS SEQRES 6 D 72 ILE ASP PRO GLU SER LYS ILE HET NO3 A 2 4 HET NO3 A 3 4 HET NO3 A 4 4 HET NO3 A 5 4 HET ZN C 502 1 HET ZN C 501 1 HET NO3 C 1 4 HET ZN D 502 1 HET ZN D 501 1 HET TRS D 11 8 HETNAM NO3 NITRATE ION HETNAM ZN ZINC ION HETNAM TRS 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL HETSYN TRS TRIS BUFFER FORMUL 5 NO3 5(N O3 1-) FORMUL 9 ZN 4(ZN 2+) FORMUL 14 TRS C4 H12 N O3 1+ FORMUL 15 HOH *185(H2 O) HELIX 1 1 THR A 94 ARG A 100 1 7 HELIX 2 2 THR A 170 ASN A 188 1 19 HELIX 3 3 SER A 195 ALA A 202 1 8 HELIX 4 4 THR B 94 ARG B 100 1 7 HELIX 5 5 THR B 170 ASN B 188 1 19 HELIX 6 6 SER B 195 ALA B 202 1 8 HELIX 7 7 CYS C 68 ARG C 73 1 6 HELIX 8 8 LYS C 78 CYS C 82 5 5 HELIX 9 9 CYS C 96 GLY C 103 1 8 HELIX 10 10 CYS D 68 ARG D 73 1 6 HELIX 11 11 LYS D 78 CYS D 82 5 5 HELIX 12 12 ASP D 89 MET D 93 5 5 HELIX 13 13 CYS D 96 GLY D 103 1 8 SHEET 1 A 6 ARG A 88 THR A 91 0 SHEET 2 A 6 ASN A 127 ILE A 137 -1 O PHE A 134 N ILE A 90 SHEET 3 A 6 ARG A 140 THR A 151 -1 O GLU A 142 N SER A 135 SHEET 4 A 6 ILE A 156 PRO A 162 -1 O VAL A 157 N ALA A 149 SHEET 5 A 6 LEU A 115 ASP A 120 -1 N CYS A 116 O SER A 161 SHEET 6 A 6 PRO A 107 GLU A 112 -1 N LYS A 110 O ILE A 117 SHEET 1 B 3 ARG A 88 THR A 91 0 SHEET 2 B 3 ASN A 127 ILE A 137 -1 O PHE A 134 N ILE A 90 SHEET 3 B 3 THR A 191 VAL A 194 1 O THR A 191 N ILE A 128 SHEET 1 C 6 ARG B 88 THR B 91 0 SHEET 2 C 6 ASN B 127 ILE B 137 -1 O PHE B 134 N ILE B 90 SHEET 3 C 6 ARG B 140 PHE B 150 -1 O GLU B 142 N SER B 135 SHEET 4 C 6 ILE B 156 PRO B 162 -1 O GLY B 158 N ALA B 149 SHEET 5 C 6 LEU B 115 ASP B 120 -1 N CYS B 116 O SER B 161 SHEET 6 C 6 PRO B 107 GLU B 112 -1 N GLU B 112 O LEU B 115 SHEET 1 D 3 ARG B 88 THR B 91 0 SHEET 2 D 3 ASN B 127 ILE B 137 -1 O PHE B 134 N ILE B 90 SHEET 3 D 3 THR B 191 VAL B 194 1 O THR B 191 N ILE B 128 LINK SG CYS C 68 ZN ZN C 501 1555 1555 2.42 LINK SG CYS C 76 ZN ZN C 501 1555 1555 2.36 LINK SG CYS C 82 ZN ZN C 501 1555 1555 2.42 LINK NE2 HIS C 86 ZN ZN C 501 1555 1555 2.18 LINK SG CYS C 96 ZN ZN C 502 1555 1555 2.35 LINK SG CYS C 105 ZN ZN C 502 1555 1555 2.38 LINK SG CYS C 110 ZN ZN C 502 1555 1555 2.34 LINK NE2 HIS C 114 ZN ZN C 502 1555 1555 2.15 LINK SG CYS D 68 ZN ZN D 501 1555 1555 2.50 LINK SG CYS D 76 ZN ZN D 501 1555 1555 2.35 LINK SG CYS D 82 ZN ZN D 501 1555 1555 2.41 LINK NE2 HIS D 86 ZN ZN D 501 1555 1555 2.20 LINK SG CYS D 96 ZN ZN D 502 1555 1555 2.30 LINK SG CYS D 105 ZN ZN D 502 1555 1555 2.42 LINK SG CYS D 110 ZN ZN D 502 1555 1555 2.38 LINK NE2 HIS D 114 ZN ZN D 502 1555 1555 2.13 SITE 1 AC1 3 LYS A 126 THR A 151 GLU A 153 SITE 1 AC2 2 GLU A 186 TRP A 203 SITE 1 AC3 5 ARG A 88 ARG A 200 PHE A 201 LYS B 175 SITE 2 AC3 5 TRP B 203 SITE 1 AC4 6 ARG A 88 PHE A 138 ASP A 139 ILE B 182 SITE 2 AC4 6 GLY B 183 GLU B 186 SITE 1 AC5 4 CYS C 96 CYS C 105 CYS C 110 HIS C 114 SITE 1 AC6 4 CYS C 68 CYS C 76 CYS C 82 HIS C 86 SITE 1 AC7 5 PRO B 167 TYR C 99 GLY C 103 ASP C 116 SITE 2 AC7 5 PRO C 117 SITE 1 AC8 4 CYS D 96 CYS D 105 CYS D 110 HIS D 114 SITE 1 AC9 4 CYS D 68 CYS D 76 CYS D 82 HIS D 86 SITE 1 BC1 5 PHE A 138 ARG A 140 TRP B 187 GLU D 95 SITE 2 BC1 5 TYR D 97 CRYST1 50.960 50.960 205.390 90.00 90.00 90.00 P 41 8 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 0.019623 0.000000 0.000000 0.00000 SCALE2 0.000000 0.019623 0.000000 0.00000 SCALE3 0.000000 0.000000 0.004869 0.00000 REMARK PdbStat -- REMARK PdbStat -- PDB COORDINATES FOR 2RHK.PDB, MODEL/S 1 2RHK.PDB REMARK PdbStat -- SEQRES 1 A 556 PRO ALA SER ARG TYR ILE THR ASP MET THR ILE GLU GLU SEQRES 2 A 556 LEU SER ARG ASP TRP PHE MET LEU MET PRO LYS GLN LYS SEQRES 3 A 556 VAL GLU GLY PRO LEU CYS ILE ARG ILE ASP GLN ALA ILE SEQRES 4 A 556 MET ASP LYS ASN ILE MET LEU LYS ALA ASN PHE SER VAL SEQRES 5 A 556 ILE PHE ASP ARG LEU GLU THR LEU ILE LEU LEU ARG ALA SEQRES 6 A 556 PHE THR GLU GLU GLY ALA ILE VAL GLY GLU ILE SER PRO SEQRES 7 A 556 LEU PRO SER PHE PRO GLY HIS THR ILE GLU ASP VAL LYS SEQRES 8 A 556 ASN ALA ILE GLY VAL LEU ILE GLY GLY LEU GLU TRP ASN SEQRES 9 A 556 ASP ASN THR VAL ARG VAL SER LYS THR LEU GLN ARG PHE SEQRES 10 A 556 ALA TRP PRO ALA SER ARG TYR ILE THR ASP MET THR ILE SEQRES 11 A 556 GLU GLU LEU SER ARG ASP TRP PHE MET LEU MET PRO LYS SEQRES 12 A 556 GLN LYS VAL GLU GLY PRO LEU CYS ILE ARG ILE ASP GLN SEQRES 13 A 556 ALA ILE MET ASP LYS ASN ILE MET LEU LYS ALA ASN PHE SEQRES 14 A 556 SER VAL ILE PHE ASP ARG LEU GLU THR LEU ILE LEU LEU SEQRES 15 A 556 ARG ALA PHE THR GLU GLU GLY ALA ILE VAL GLY GLU ILE SEQRES 16 A 556 SER PRO LEU PRO SER PHE PRO GLY HIS THR ILE GLU ASP SEQRES 17 A 556 VAL LYS ASN ALA ILE GLY VAL LEU ILE GLY GLY LEU GLU SEQRES 18 A 556 TRP ASN ASP ASN THR VAL ARG VAL SER LYS THR LEU GLN SEQRES 19 A 556 ARG PHE ALA TRP HIS HIS SER HIS MET SER GLY GLU LYS SEQRES 20 A 556 THR VAL VAL CYS LYS HIS TRP LEU ARG GLY LEU CYS LYS SEQRES 21 A 556 LYS GLY ASP GLN CYS GLU PHE LEU HIS GLU TYR ASP MET SEQRES 22 A 556 THR LYS MET SER GLU CYS TYR PHE TYR SER LYS PHE GLY SEQRES 23 A 556 GLU CYS SER ASN LYS GLU CYS PRO PHE LEU HIS ILE ASP SEQRES 24 A 556 PRO GLU SER HIS MET SER GLY GLU LYS THR VAL VAL CYS SEQRES 25 A 556 LYS HIS TRP LEU ARG GLY LEU CYS LYS LYS GLY ASP GLN SEQRES 26 A 556 CYS GLU PHE LEU HIS GLU TYR ASP MET THR LYS MET SER SEQRES 27 A 556 GLU CYS TYR PHE TYR SER LYS PHE GLY GLU CYS SER ASN SEQRES 28 A 556 LYS GLU CYS PRO PHE LEU HIS ILE ASP PRO NO3 NO3 NO3 SEQRES 29 A 556 NO3 ZN ZN NO3 ZN ZN TRS HOH HOH HOH HOH HOH HOH SEQRES 30 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 31 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 32 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 33 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 34 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 35 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 36 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 37 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 38 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 39 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 40 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 41 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 42 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 43 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH REMARK PdbStat -- REMARK PdbStat -- PDB COORDINATES FOR 2RHK.PDB, MODEL/S 1 2RHK.PDB REMARK PdbStat -- SEQRES 1 A 556 PRO ALA SER ARG TYR ILE THR ASP MET THR ILE GLU GLU SEQRES 2 A 556 LEU SER ARG ASP TRP PHE MET LEU MET PRO LYS GLN LYS SEQRES 3 A 556 VAL GLU GLY PRO LEU CYS ILE ARG ILE ASP GLN ALA ILE SEQRES 4 A 556 MET ASP LYS ASN ILE MET LEU LYS ALA ASN PHE SER VAL SEQRES 5 A 556 ILE PHE ASP ARG LEU GLU THR LEU ILE LEU LEU ARG ALA SEQRES 6 A 556 PHE THR GLU GLU GLY ALA ILE VAL GLY GLU ILE SER PRO SEQRES 7 A 556 LEU PRO SER PHE PRO GLY HIS THR ILE GLU ASP VAL LYS SEQRES 8 A 556 ASN ALA ILE GLY VAL LEU ILE GLY GLY LEU GLU TRP ASN SEQRES 9 A 556 ASP ASN THR VAL ARG VAL SER LYS THR LEU GLN ARG PHE SEQRES 10 A 556 ALA TRP PRO ALA SER ARG TYR ILE THR ASP MET THR ILE SEQRES 11 A 556 GLU GLU LEU SER ARG ASP TRP PHE MET LEU MET PRO LYS SEQRES 12 A 556 GLN LYS VAL GLU GLY PRO LEU CYS ILE ARG ILE ASP GLN SEQRES 13 A 556 ALA ILE MET ASP LYS ASN ILE MET LEU LYS ALA ASN PHE SEQRES 14 A 556 SER VAL ILE PHE ASP ARG LEU GLU THR LEU ILE LEU LEU SEQRES 15 A 556 ARG ALA PHE THR GLU GLU GLY ALA ILE VAL GLY GLU ILE SEQRES 16 A 556 SER PRO LEU PRO SER PHE PRO GLY HIS THR ILE GLU ASP SEQRES 17 A 556 VAL LYS ASN ALA ILE GLY VAL LEU ILE GLY GLY LEU GLU SEQRES 18 A 556 TRP ASN ASP ASN THR VAL ARG VAL SER LYS THR LEU GLN SEQRES 19 A 556 ARG PHE ALA TRP HIS HIS SER HIS MET SER GLY GLU LYS SEQRES 20 A 556 THR VAL VAL CYS LYS HIS TRP LEU ARG GLY LEU CYS LYS SEQRES 21 A 556 LYS GLY ASP GLN CYS GLU PHE LEU HIS GLU TYR ASP MET SEQRES 22 A 556 THR LYS MET SER GLU CYS TYR PHE TYR SER LYS PHE GLY SEQRES 23 A 556 GLU CYS SER ASN LYS GLU CYS PRO PHE LEU HIS ILE ASP SEQRES 24 A 556 PRO GLU SER HIS MET SER GLY GLU LYS THR VAL VAL CYS SEQRES 25 A 556 LYS HIS TRP LEU ARG GLY LEU CYS LYS LYS GLY ASP GLN SEQRES 26 A 556 CYS GLU PHE LEU HIS GLU TYR ASP MET THR LYS MET SER SEQRES 27 A 556 GLU CYS TYR PHE TYR SER LYS PHE GLY GLU CYS SER ASN SEQRES 28 A 556 LYS GLU CYS PRO PHE LEU HIS ILE ASP PRO NO3 NO3 NO3 SEQRES 29 A 556 NO3 ZN ZN NO3 ZN ZN TRS HOH HOH HOH HOH HOH HOH SEQRES 30 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 31 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 32 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 33 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 34 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 35 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 36 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 37 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 38 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 39 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 40 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 41 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 42 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 43 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH REMARK PdbStat -- REMARK PdbStat -- PDB COORDINATES FOR 2RHK.PDB, MODEL/S 1 2RHK.PDB REMARK PdbStat -- SEQRES 1 A 556 PRO ALA SER ARG TYR ILE THR ASP MET THR ILE GLU GLU SEQRES 2 A 556 LEU SER ARG ASP TRP PHE MET LEU MET PRO LYS GLN LYS SEQRES 3 A 556 VAL GLU GLY PRO LEU CYS ILE ARG ILE ASP GLN ALA ILE SEQRES 4 A 556 MET ASP LYS ASN ILE MET LEU LYS ALA ASN PHE SER VAL SEQRES 5 A 556 ILE PHE ASP ARG LEU GLU THR LEU ILE LEU LEU ARG ALA SEQRES 6 A 556 PHE THR GLU GLU GLY ALA ILE VAL GLY GLU ILE SER PRO SEQRES 7 A 556 LEU PRO SER PHE PRO GLY HIS THR ILE GLU ASP VAL LYS SEQRES 8 A 556 ASN ALA ILE GLY VAL LEU ILE GLY GLY LEU GLU TRP ASN SEQRES 9 A 556 ASP ASN THR VAL ARG VAL SER LYS THR LEU GLN ARG PHE SEQRES 10 A 556 ALA TRP PRO ALA SER ARG TYR ILE THR ASP MET THR ILE SEQRES 11 A 556 GLU GLU LEU SER ARG ASP TRP PHE MET LEU MET PRO LYS SEQRES 12 A 556 GLN LYS VAL GLU GLY PRO LEU CYS ILE ARG ILE ASP GLN SEQRES 13 A 556 ALA ILE MET ASP LYS ASN ILE MET LEU LYS ALA ASN PHE SEQRES 14 A 556 SER VAL ILE PHE ASP ARG LEU GLU THR LEU ILE LEU LEU SEQRES 15 A 556 ARG ALA PHE THR GLU GLU GLY ALA ILE VAL GLY GLU ILE SEQRES 16 A 556 SER PRO LEU PRO SER PHE PRO GLY HIS THR ILE GLU ASP SEQRES 17 A 556 VAL LYS ASN ALA ILE GLY VAL LEU ILE GLY GLY LEU GLU SEQRES 18 A 556 TRP ASN ASP ASN THR VAL ARG VAL SER LYS THR LEU GLN SEQRES 19 A 556 ARG PHE ALA TRP HIS HIS SER HIS MET SER GLY GLU LYS SEQRES 20 A 556 THR VAL VAL CYS LYS HIS TRP LEU ARG GLY LEU CYS LYS SEQRES 21 A 556 LYS GLY ASP GLN CYS GLU PHE LEU HIS GLU TYR ASP MET SEQRES 22 A 556 THR LYS MET SER GLU CYS TYR PHE TYR SER LYS PHE GLY SEQRES 23 A 556 GLU CYS SER ASN LYS GLU CYS PRO PHE LEU HIS ILE ASP SEQRES 24 A 556 PRO GLU SER HIS MET SER GLY GLU LYS THR VAL VAL CYS SEQRES 25 A 556 LYS HIS TRP LEU ARG GLY LEU CYS LYS LYS GLY ASP GLN SEQRES 26 A 556 CYS GLU PHE LEU HIS GLU TYR ASP MET THR LYS MET SER SEQRES 27 A 556 GLU CYS TYR PHE TYR SER LYS PHE GLY GLU CYS SER ASN SEQRES 28 A 556 LYS GLU CYS PRO PHE LEU HIS ILE ASP PRO NO3 NO3 NO3 SEQRES 29 A 556 NO3 ZN ZN NO3 ZN ZN TRS HOH HOH HOH HOH HOH HOH SEQRES 30 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 31 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 32 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 33 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 34 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 35 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 36 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 37 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 38 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 39 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 40 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 41 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 42 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 43 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH REMARK PdbStat -- REMARK PdbStat -- PDB COORDINATES FOR 2RHK.PDB, MODEL/S 1 2RHK.PDB REMARK PdbStat -- SEQRES 1 A 556 PRO ALA SER ARG TYR ILE THR ASP MET THR ILE GLU GLU SEQRES 2 A 556 LEU SER ARG ASP TRP PHE MET LEU MET PRO LYS GLN LYS SEQRES 3 A 556 VAL GLU GLY PRO LEU CYS ILE ARG ILE ASP GLN ALA ILE SEQRES 4 A 556 MET ASP LYS ASN ILE MET LEU LYS ALA ASN PHE SER VAL SEQRES 5 A 556 ILE PHE ASP ARG LEU GLU THR LEU ILE LEU LEU ARG ALA SEQRES 6 A 556 PHE THR GLU GLU GLY ALA ILE VAL GLY GLU ILE SER PRO SEQRES 7 A 556 LEU PRO SER PHE PRO GLY HIS THR ILE GLU ASP VAL LYS SEQRES 8 A 556 ASN ALA ILE GLY VAL LEU ILE GLY GLY LEU GLU TRP ASN SEQRES 9 A 556 ASP ASN THR VAL ARG VAL SER LYS THR LEU GLN ARG PHE SEQRES 10 A 556 ALA TRP PRO ALA SER ARG TYR ILE THR ASP MET THR ILE SEQRES 11 A 556 GLU GLU LEU SER ARG ASP TRP PHE MET LEU MET PRO LYS SEQRES 12 A 556 GLN LYS VAL GLU GLY PRO LEU CYS ILE ARG ILE ASP GLN SEQRES 13 A 556 ALA ILE MET ASP LYS ASN ILE MET LEU LYS ALA ASN PHE SEQRES 14 A 556 SER VAL ILE PHE ASP ARG LEU GLU THR LEU ILE LEU LEU SEQRES 15 A 556 ARG ALA PHE THR GLU GLU GLY ALA ILE VAL GLY GLU ILE SEQRES 16 A 556 SER PRO LEU PRO SER PHE PRO GLY HIS THR ILE GLU ASP SEQRES 17 A 556 VAL LYS ASN ALA ILE GLY VAL LEU ILE GLY GLY LEU GLU SEQRES 18 A 556 TRP ASN ASP ASN THR VAL ARG VAL SER LYS THR LEU GLN SEQRES 19 A 556 ARG PHE ALA TRP HIS HIS SER HIS MET SER GLY GLU LYS SEQRES 20 A 556 THR VAL VAL CYS LYS HIS TRP LEU ARG GLY LEU CYS LYS SEQRES 21 A 556 LYS GLY ASP GLN CYS GLU PHE LEU HIS GLU TYR ASP MET SEQRES 22 A 556 THR LYS MET SER GLU CYS TYR PHE TYR SER LYS PHE GLY SEQRES 23 A 556 GLU CYS SER ASN LYS GLU CYS PRO PHE LEU HIS ILE ASP SEQRES 24 A 556 PRO GLU SER HIS MET SER GLY GLU LYS THR VAL VAL CYS SEQRES 25 A 556 LYS HIS TRP LEU ARG GLY LEU CYS LYS LYS GLY ASP GLN SEQRES 26 A 556 CYS GLU PHE LEU HIS GLU TYR ASP MET THR LYS MET SER SEQRES 27 A 556 GLU CYS TYR PHE TYR SER LYS PHE GLY GLU CYS SER ASN SEQRES 28 A 556 LYS GLU CYS PRO PHE LEU HIS ILE ASP PRO NO3 NO3 NO3 SEQRES 29 A 556 NO3 ZN ZN NO3 ZN ZN TRS HOH HOH HOH HOH HOH HOH SEQRES 30 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 31 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 32 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 33 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 34 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 35 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 36 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 37 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 38 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 39 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 40 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 41 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 42 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH SEQRES 43 A 556 HOH HOH HOH HOH HOH HOH HOH HOH HOH HOH MODEL 1 REMARK CONFORMATION 1 ENERGY 0.0000 REMARK FAMILY or FILE: 2RHK.pdb ATOM 1 N PRO A 2 -19.246 13.662 39.053 1.00 73.06 N ATOM 2 CA PRO A 2 -19.960 14.558 38.114 1.00 72.87 C ATOM 3 C PRO A 2 -19.725 14.157 36.657 1.00 73.29 C ATOM 4 O PRO A 2 -18.675 13.605 36.316 1.00 74.41 O ATOM 5 CB PRO A 2 -19.447 15.969 38.373 1.00 72.84 C ATOM 6 CG PRO A 2 -19.006 15.867 39.836 1.00 75.42 C ATOM 7 CD PRO A 2 -18.398 14.459 39.959 1.00 74.36 C ATOM 8 N ALA A 3 -20.708 14.435 35.803 1.00 70.53 N ATOM 9 CA ALA A 3 -20.604 14.114 34.384 1.00 68.90 C ATOM 10 C ALA A 3 -19.492 14.949 33.754 1.00 66.33 C ATOM 11 O ALA A 3 -19.642 16.155 33.570 1.00 67.12 O ATOM 12 CB ALA A 3 -21.928 14.391 33.686 1.00 70.21 C ATOM 13 N SER A 4 -18.383 14.293 33.427 1.00 64.10 N ATOM 14 CA SER A 4 -17.219 14.950 32.832 1.00 61.33 C ATOM 15 C SER A 4 -17.514 15.577 31.473 1.00 56.48 C ATOM 16 O SER A 4 -18.533 15.284 30.850 1.00 55.61 O ATOM 17 CB SER A 4 -16.075 13.941 32.674 1.00 61.00 C ATOM 18 OG SER A 4 -15.841 13.229 33.876 1.00 61.56 O ATOM 19 N ARG A 5 -16.612 16.446 31.025 1.00 51.78 N ATOM 20 CA ARG A 5 -16.751 17.100 29.728 1.00 48.06 C ATOM 21 C ARG A 5 -16.463 16.080 28.634 1.00 41.78 C ATOM 22 O ARG A 5 -15.693 15.145 28.848 1.00 39.10 O ATOM 23 CB ARG A 5 -15.734 18.231 29.577 1.00 51.58 C ATOM 24 CG ARG A 5 -16.038 19.533 30.282 1.00 58.85 C ATOM 25 CD ARG A 5 -14.910 20.515 29.979 1.00 58.46 C ATOM 26 NE ARG A 5 -14.595 20.509 28.552 1.00 61.67 N ATOM 27 CZ ARG A 5 -13.499 21.037 28.012 1.00 60.54 C ATOM 28 NH1 ARG A 5 -12.585 21.628 28.775 1.00 52.24 N ATOM 29 NH2 ARG A 5 -13.315 20.962 26.700 1.00 62.62 N ATOM 30 N TYR A 6 -17.069 16.271 27.467 1.00 36.85 N ATOM 31 CA TYR A 6 -16.830 15.385 26.335 1.00 42.23 C ATOM 32 C TYR A 6 -16.192 16.141 25.177 1.00 40.36 C ATOM 33 O TYR A 6 -16.638 17.233 24.819 1.00 41.90 O ATOM 34 CB TYR A 6 -18.126 14.750 25.825 1.00 42.31 C ATOM 35 CG TYR A 6 -18.641 13.607 26.655 1.00 54.05 C ATOM 36 CD1 TYR A 6 -19.674 13.795 27.574 1.00 59.60 C ATOM 37 CD2 TYR A 6 -18.114 12.324 26.506 1.00 55.37 C ATOM 38 CE1 TYR A 6 -20.175 12.726 28.327 1.00 62.16 C ATOM 39 CE2 TYR A 6 -18.604 11.250 27.252 1.00 57.76 C ATOM 40 CZ TYR A 6 -19.635 11.458 28.157 1.00 62.55 C ATOM 41 OH TYR A 6 -20.130 10.396 28.881 1.00 64.84 O ATOM 42 N ILE A 7 -15.139 15.558 24.608 1.00 36.27 N ATOM 43 CA ILE A 7 -14.457 16.130 23.455 1.00 31.17 C ATOM 44 C ILE A 7 -14.899 15.292 22.259 1.00 31.92 C ATOM 45 O ILE A 7 -14.844 14.063 22.310 1.00 31.74 O ATOM 46 CB ILE A 7 -12.921 16.002 23.558 1.00 36.08 C ATOM 47 CG1 ILE A 7 -12.398 16.749 24.789 1.00 35.23 C ATOM 48 CG2 ILE A 7 -12.289 16.516 22.276 1.00 34.88 C ATOM 49 CD1 ILE A 7 -12.702 18.248 24.798 1.00 41.52 C ATOM 50 N THR A 8 -15.329 15.944 21.187 1.00 29.86 N ATOM 51 CA THR A 8 -15.773 15.219 20.004 1.00 33.45 C ATOM 52 C THR A 8 -15.087 15.685 18.722 1.00 32.59 C ATOM 53 O THR A 8 -15.593 16.562 18.036 1.00 31.58 O ATOM 54 CB THR A 8 -17.322 15.324 19.825 1.00 35.91 C ATOM 55 OG1 THR A 8 -17.713 16.699 19.693 1.00 30.98 O ATOM 56 CG2 THR A 8 -18.038 14.715 21.028 1.00 32.17 C ATOM 57 N ASP A 9 -13.927 15.106 18.409 1.00 29.35 N ATOM 58 CA ASP A 9 -13.209 15.458 17.178 1.00 30.22 C ATOM 59 C ASP A 9 -14.004 14.953 15.976 1.00 32.14 C ATOM 60 O ASP A 9 -13.985 15.565 14.912 1.00 31.99 O ATOM 61 CB ASP A 9 -11.823 14.789 17.089 1.00 30.84 C ATOM 62 CG ASP A 9 -10.816 15.326 18.086 1.00 36.24 C ATOM 63 OD1 ASP A 9 -11.036 16.414 18.666 1.00 31.90 O ATOM 64 OD2 ASP A 9 -9.772 14.645 18.272 1.00 27.60 O ATOM 65 N MET A 10 -14.689 13.821 16.146 1.00 29.99 N ATOM 66 CA MET A 10 -15.443 13.218 15.056 1.00 31.45 C ATOM 67 C MET A 10 -16.911 13.583 15.020 1.00 35.17 C ATOM 68 O MET A 10 -17.536 13.812 16.052 1.00 36.65 O ATOM 69 CB MET A 10 -15.340 11.683 15.109 1.00 30.57 C ATOM 70 CG MET A 10 -13.991 11.104 14.679 1.00 23.84 C ATOM 71 SD MET A 10 -13.932 9.275 14.861 1.00 23.82 S ATOM 72 CE MET A 10 -13.538 9.146 16.557 1.00 18.87 C ATOM 73 N THR A 11 -17.454 13.620 13.809 1.00 37.54 N ATOM 74 CA THR A 11 -18.863 13.902 13.615 1.00 37.76 C ATOM 75 C THR A 11 -19.581 12.591 13.895 1.00 40.49 C ATOM 76 O THR A 11 -18.946 11.531 13.966 1.00 34.52 O ATOM 77 CB THR A 11 -19.146 14.336 12.171 1.00 40.64 C ATOM 78 OG1 THR A 11 -18.627 13.355 11.262 1.00 38.46 O ATOM 79 CG2 THR A 11 -18.497 15.686 11.890 1.00 41.33 C ATOM 80 N ILE A 12 -20.897 12.651 14.060 1.00 39.99 N ATOM 81 CA ILE A 12 -21.663 11.444 14.322 1.00 41.24 C ATOM 82 C ILE A 12 -21.464 10.423 13.196 1.00 39.43 C ATOM 83 O ILE A 12 -21.366 9.226 13.449 1.00 42.64 O ATOM 84 CB ILE A 12 -23.166 11.767 14.481 1.00 44.75 C ATOM 85 CG1 ILE A 12 -23.366 12.671 15.703 1.00 50.59 C ATOM 86 CG2 ILE A 12 -23.959 10.484 14.637 1.00 46.31 C ATOM 87 CD1 ILE A 12 -24.822 13.005 16.004 1.00 56.14 C ATOM 88 N GLU A 13 -21.395 10.901 11.959 1.00 37.16 N ATOM 89 CA GLU A 13 -21.192 10.026 10.805 1.00 39.42 C ATOM 90 C GLU A 13 -19.820 9.336 10.878 1.00 38.37 C ATOM 91 O GLU A 13 -19.727 8.118 10.741 1.00 36.18 O ATOM 92 CB GLU A 13 -21.306 10.841 9.508 1.00 39.82 C ATOM 93 CG GLU A 13 -21.320 10.029 8.208 1.00 42.41 C ATOM 94 CD GLU A 13 -19.939 9.562 7.762 1.00 47.98 C ATOM 95 OE1 GLU A 13 -18.999 10.387 7.765 1.00 41.89 O ATOM 96 OE2 GLU A 13 -19.800 8.374 7.392 1.00 42.89 O ATOM 97 N GLU A 14 -18.758 10.106 11.107 1.00 36.89 N ATOM 98 CA GLU A 14 -17.421 9.513 11.188 1.00 35.83 C ATOM 99 C GLU A 14 -17.355 8.487 12.310 1.00 36.54 C ATOM 100 O GLU A 14 -16.718 7.440 12.189 1.00 34.67 O ATOM 101 CB GLU A 14 -16.363 10.593 11.423 1.00 34.51 C ATOM 102 CG GLU A 14 -16.159 11.527 10.253 1.00 37.18 C ATOM 103 CD GLU A 14 -15.199 12.654 10.590 1.00 41.39 C ATOM 104 OE1 GLU A 14 -15.344 13.241 11.686 1.00 37.41 O ATOM 105 OE2 GLU A 14 -14.311 12.955 9.762 1.00 41.36 O ATOM 106 N LEU A 15 -18.042 8.787 13.401 1.00 34.02 N ATOM 107 CA LEU A 15 -18.057 7.909 14.552 1.00 32.57 C ATOM 108 C LEU A 15 -18.831 6.622 14.280 1.00 36.78 C ATOM 109 O LEU A 15 -18.487 5.556 14.801 1.00 31.22 O ATOM 110 CB LEU A 15 -18.678 8.661 15.733 1.00 40.77 C ATOM 111 CG LEU A 15 -18.713 8.023 17.117 1.00 41.31 C ATOM 112 CD1 LEU A 15 -17.305 7.915 17.662 1.00 40.97 C ATOM 113 CD2 LEU A 15 -19.567 8.890 18.043 1.00 47.04 C ATOM 114 N SER A 16 -19.863 6.727 13.445 1.00 34.48 N ATOM 115 CA SER A 16 -20.731 5.598 13.121 1.00 38.24 C ATOM 116 C SER A 16 -20.332 4.781 11.901 1.00 35.85 C ATOM 117 O SER A 16 -20.813 3.664 11.720 1.00 34.18 O ATOM 118 CB SER A 16 -22.164 6.098 12.904 1.00 34.99 C ATOM 119 OG SER A 16 -22.628 6.801 14.038 1.00 49.10 O ATOM 120 N ARG A 17 -19.464 5.336 11.067 1.00 32.08 N ATOM 121 CA ARG A 17 -19.042 4.660 9.846 1.00 32.84 C ATOM 122 C ARG A 17 -18.306 3.358 10.123 1.00 31.03 C ATOM 123 O ARG A 17 -17.630 3.226 11.141 1.00 32.76 O ATOM 124 CB ARG A 17 -18.131 5.587 9.041 1.00 32.46 C ATOM 125 CG ARG A 17 -17.948 5.200 7.586 1.00 32.76 C ATOM 126 CD ARG A 17 -16.808 6.004 6.966 1.00 31.15 C ATOM 127 NE ARG A 17 -17.020 7.441 7.109 1.00 33.74 N ATOM 128 CZ ARG A 17 -16.069 8.353 6.941 1.00 39.28 C ATOM 129 NH1 ARG A 17 -14.835 7.971 6.623 1.00 34.64 N ATOM 130 NH2 ARG A 17 -16.349 9.644 7.090 1.00 37.25 N ATOM 131 N ASP A 18 -18.467 2.389 9.229 1.00 31.67 N ATOM 132 CA ASP A 18 -17.762 1.121 9.344 1.00 32.28 C ATOM 133 C ASP A 18 -16.720 1.210 8.244 1.00 31.70 C ATOM 134 O ASP A 18 -16.972 1.806 7.202 1.00 34.51 O ATOM 135 CB ASP A 18 -18.667 -0.075 9.060 1.00 35.53 C ATOM 136 CG ASP A 18 -19.796 -0.204 10.056 1.00 34.01 C ATOM 137 OD1 ASP A 18 -19.542 -0.076 11.273 1.00 37.44 O ATOM 138 OD2 ASP A 18 -20.933 -0.449 9.610 1.00 34.41 O ATOM 139 N TRP A 19 -15.547 0.639 8.467 1.00 31.47 N ATOM 140 CA TRP A 19 -14.516 0.701 7.448 1.00 24.98 C ATOM 141 C TRP A 19 -13.948 -0.680 7.174 1.00 29.93 C ATOM 142 O TRP A 19 -14.165 -1.619 7.941 1.00 29.78 O ATOM 143 CB TRP A 19 -13.418 1.686 7.854 1.00 27.66 C ATOM 144 CG TRP A 19 -12.784 1.391 9.172 1.00 28.56 C ATOM 145 CD1 TRP A 19 -13.361 1.490 10.406 1.00 26.19 C ATOM 146 CD2 TRP A 19 -11.439 0.955 9.391 1.00 30.09 C ATOM 147 NE1 TRP A 19 -12.460 1.142 11.382 1.00 26.72 N ATOM 148 CE2 TRP A 19 -11.269 0.811 10.787 1.00 28.48 C ATOM 149 CE3 TRP A 19 -10.359 0.677 8.543 1.00 27.22 C ATOM 150 CZ2 TRP A 19 -10.062 0.391 11.357 1.00 31.16 C ATOM 151 CZ3 TRP A 19 -9.152 0.257 9.111 1.00 25.94 C ATOM 152 CH2 TRP A 19 -9.016 0.120 10.506 1.00 26.04 C ATOM 153 N PHE A 20 -13.212 -0.782 6.074 1.00 31.03 N ATOM 154 CA PHE A 20 -12.648 -2.042 5.594 1.00 30.05 C ATOM 155 C PHE A 20 -11.119 -2.068 5.582 1.00 27.14 C ATOM 156 O PHE A 20 -10.491 -1.074 5.241 1.00 27.03 O ATOM 157 CB PHE A 20 -13.181 -2.253 4.172 1.00 30.70 C ATOM 158 CG PHE A 20 -12.474 -3.323 3.382 1.00 35.12 C ATOM 159 CD1 PHE A 20 -12.925 -4.639 3.402 1.00 37.26 C ATOM 160 CD2 PHE A 20 -11.398 -2.996 2.564 1.00 39.77 C ATOM 161 CE1 PHE A 20 -12.310 -5.620 2.606 1.00 32.82 C ATOM 162 CE2 PHE A 20 -10.780 -3.964 1.772 1.00 40.85 C ATOM 163 CZ PHE A 20 -11.239 -5.275 1.793 1.00 36.91 C ATOM 164 N MET A 21 -10.536 -3.203 5.965 1.00 24.48 N ATOM 165 CA MET A 21 -9.077 -3.380 5.949 1.00 26.32 C ATOM 166 C MET A 21 -8.767 -4.454 4.909 1.00 27.24 C ATOM 167 O MET A 21 -9.356 -5.536 4.935 1.00 29.04 O ATOM 168 CB MET A 21 -8.539 -3.855 7.309 1.00 22.81 C ATOM 169 CG MET A 21 -8.738 -2.884 8.468 1.00 26.40 C ATOM 170 SD MET A 21 -8.444 -3.672 10.072 1.00 30.75 S ATOM 171 CE MET A 21 -10.062 -4.298 10.398 1.00 30.99 C ATOM 172 N LEU A 22 -7.853 -4.146 3.993 1.00 29.22 N ATOM 173 CA LEU A 22 -7.442 -5.091 2.967 1.00 28.66 C ATOM 174 C LEU A 22 -6.583 -6.169 3.610 1.00 26.05 C ATOM 175 O LEU A 22 -6.685 -7.351 3.268 1.00 26.52 O ATOM 176 CB LEU A 22 -6.647 -4.368 1.879 1.00 27.27 C ATOM 177 CG LEU A 22 -6.197 -5.224 0.692 1.00 36.63 C ATOM 178 CD1 LEU A 22 -7.406 -5.861 -0.000 1.00 27.79 C ATOM 179 CD2 LEU A 22 -5.423 -4.341 -0.278 1.00 35.26 C ATOM 180 N MET A 23 -5.742 -5.747 4.551 1.00 25.08 N ATOM 181 CA MET A 23 -4.845 -6.633 5.284 1.00 24.05 C ATOM 182 C MET A 23 -5.110 -6.343 6.760 1.00 25.03 C ATOM 183 O MET A 23 -4.322 -5.667 7.420 1.00 24.00 O ATOM 184 CB MET A 23 -3.385 -6.301 4.928 1.00 23.60 C ATOM 185 CG MET A 23 -3.022 -6.640 3.468 1.00 29.76 C ATOM 186 SD MET A 23 -1.324 -6.174 3.042 1.00 29.75 S ATOM 187 CE MET A 23 -1.546 -5.576 1.330 1.00 40.95 C ATOM 188 N PRO A 24 -6.223 -6.871 7.295 1.00 28.24 N ATOM 189 CA PRO A 24 -6.600 -6.648 8.692 1.00 27.49 C ATOM 190 C PRO A 24 -5.571 -7.031 9.740 1.00 30.48 C ATOM 191 O PRO A 24 -4.928 -8.079 9.658 1.00 26.00 O ATOM 192 CB PRO A 24 -7.892 -7.466 8.852 1.00 31.93 C ATOM 193 CG PRO A 24 -8.350 -7.754 7.439 1.00 35.53 C ATOM 194 CD PRO A 24 -7.064 -7.922 6.694 1.00 31.98 C ATOM 195 N LYS A 25 -5.427 -6.156 10.726 1.00 29.87 N ATOM 196 CA LYS A 25 -4.543 -6.386 11.855 1.00 27.91 C ATOM 197 C LYS A 25 -5.384 -5.915 13.035 1.00 30.74 C ATOM 198 O LYS A 25 -5.918 -4.796 13.034 1.00 26.12 O ATOM 199 CB LYS A 25 -3.268 -5.544 11.755 1.00 33.92 C ATOM 200 CG LYS A 25 -2.292 -5.934 10.632 1.00 33.35 C ATOM 201 CD LYS A 25 -1.415 -7.121 10.999 1.00 33.99 C ATOM 202 CE LYS A 25 -1.986 -8.444 10.543 1.00 35.39 C ATOM 203 NZ LYS A 25 -2.171 -8.502 9.067 1.00 37.70 N ATOM 204 N GLN A 26 -5.521 -6.766 14.038 1.00 28.17 N ATOM 205 CA GLN A 26 -6.306 -6.402 15.208 1.00 32.77 C ATOM 206 C GLN A 26 -5.632 -6.962 16.435 1.00 34.34 C ATOM 207 O GLN A 26 -5.184 -8.109 16.438 1.00 33.60 O ATOM 208 CB GLN A 26 -7.724 -6.958 15.096 1.00 31.33 C ATOM 209 CG GLN A 26 -8.635 -6.566 16.241 1.00 46.55 C ATOM 210 CD GLN A 26 -9.837 -7.485 16.365 1.00 52.00 C ATOM 211 OE1 GLN A 26 -9.759 -8.551 16.980 1.00 52.49 O ATOM 212 NE2 GLN A 26 -10.951 -7.085 15.764 1.00 51.81 N ATOM 213 N LYS A 27 -5.538 -6.141 17.471 1.00 31.59 N ATOM 214 CA LYS A 27 -4.912 -6.563 18.708 1.00 35.91 C ATOM 215 C LYS A 27 -5.696 -6.034 19.895 1.00 38.84 C ATOM 216 O LYS A 27 -6.040 -4.851 19.957 1.00 34.47 O ATOM 217 CB LYS A 27 -3.483 -6.029 18.800 1.00 34.73 C ATOM 218 CG LYS A 27 -2.745 -6.494 20.046 1.00 49.43 C ATOM 219 CD LYS A 27 -1.318 -5.981 20.080 1.00 50.54 C ATOM 220 CE LYS A 27 -0.525 -6.644 21.193 1.00 55.53 C ATOM 221 NZ LYS A 27 0.913 -6.249 21.161 1.00 55.51 N ATOM 222 N VAL A 28 -5.989 -6.914 20.838 1.00 35.54 N ATOM 223 CA VAL A 28 -6.682 -6.484 22.028 1.00 38.59 C ATOM 224 C VAL A 28 -5.599 -6.288 23.061 1.00 39.87 C ATOM 225 O VAL A 28 -4.922 -7.239 23.434 1.00 44.81 O ATOM 226 CB VAL A 28 -7.684 -7.541 22.513 1.00 40.58 C ATOM 227 CG1 VAL A 28 -8.245 -7.146 23.865 1.00 42.99 C ATOM 228 CG2 VAL A 28 -8.813 -7.671 21.496 1.00 43.60 C ATOM 229 N GLU A 29 -5.396 -5.045 23.482 1.00 37.95 N ATOM 230 CA GLU A 29 -4.400 -4.752 24.500 1.00 41.94 C ATOM 231 C GLU A 29 -5.106 -4.179 25.717 1.00 43.26 C ATOM 232 O GLU A 29 -5.584 -3.042 25.710 1.00 38.56 O ATOM 233 CB GLU A 29 -3.346 -3.784 23.969 1.00 43.37 C ATOM 234 CG GLU A 29 -2.296 -4.497 23.133 1.00 54.27 C ATOM 235 CD GLU A 29 -1.025 -3.695 22.950 1.00 53.50 C ATOM 236 OE1 GLU A 29 -0.616 -2.996 23.904 1.00 60.14 O ATOM 237 OE2 GLU A 29 -0.427 -3.778 21.859 1.00 60.27 O ATOM 238 N GLY A 30 -5.185 -4.992 26.761 1.00 45.84 N ATOM 239 CA GLY A 30 -5.863 -4.561 27.963 1.00 45.25 C ATOM 240 C GLY A 30 -7.331 -4.380 27.642 1.00 42.07 C ATOM 241 O GLY A 30 -7.932 -5.221 26.976 1.00 42.94 O ATOM 242 N PRO A 31 -7.939 -3.280 28.094 1.00 38.30 N ATOM 243 CA PRO A 31 -9.355 -3.015 27.839 1.00 35.16 C ATOM 244 C PRO A 31 -9.635 -2.329 26.499 1.00 32.49 C ATOM 245 O PRO A 31 -10.765 -1.912 26.241 1.00 29.16 O ATOM 246 CB PRO A 31 -9.744 -2.143 29.026 1.00 35.56 C ATOM 247 CG PRO A 31 -8.510 -1.316 29.203 1.00 35.38 C ATOM 248 CD PRO A 31 -7.389 -2.319 29.069 1.00 36.87 C ATOM 249 N LEU A 32 -8.620 -2.238 25.640 1.00 29.65 N ATOM 250 CA LEU A 32 -8.777 -1.580 24.337 1.00 27.70 C ATOM 251 C LEU A 32 -8.445 -2.470 23.141 1.00 29.21 C ATOM 252 O LEU A 32 -7.576 -3.336 23.222 1.00 28.85 O ATOM 253 CB LEU A 32 -7.875 -0.347 24.264 1.00 33.35 C ATOM 254 CG LEU A 32 -8.031 0.727 25.346 1.00 29.45 C ATOM 255 CD1 LEU A 32 -6.863 1.702 25.255 1.00 30.64 C ATOM 256 CD2 LEU A 32 -9.354 1.447 25.174 1.00 31.58 C ATOM 257 N CYS A 33 -9.126 -2.221 22.025 1.00 28.21 N ATOM 258 CA CYS A 33 -8.899 -2.958 20.783 1.00 27.02 C ATOM 259 C CYS A 33 -8.246 -2.038 19.755 1.00 28.45 C ATOM 260 O CYS A 33 -8.746 -0.940 19.498 1.00 29.24 O ATOM 261 CB CYS A 33 -10.222 -3.471 20.208 1.00 27.54 C ATOM 262 SG CYS A 33 -10.015 -4.374 18.623 1.00 36.68 S ATOM 263 N ILE A 34 -7.127 -2.483 19.184 1.00 23.29 N ATOM 264 CA ILE A 34 -6.407 -1.718 18.168 1.00 23.88 C ATOM 265 C ILE A 34 -6.563 -2.369 16.793 1.00 25.50 C ATOM 266 O ILE A 34 -6.365 -3.581 16.642 1.00 25.37 O ATOM 267 CB ILE A 34 -4.898 -1.659 18.481 1.00 30.00 C ATOM 268 CG1 ILE A 34 -4.681 -1.133 19.902 1.00 26.21 C ATOM 269 CG2 ILE A 34 -4.192 -0.758 17.463 1.00 23.68 C ATOM 270 CD1 ILE A 34 -3.298 -1.400 20.446 1.00 32.98 C ATOM 271 N ARG A 35 -6.918 -1.571 15.794 1.00 20.28 N ATOM 272 CA ARG A 35 -7.063 -2.077 14.434 1.00 20.62 C ATOM 273 C ARG A 35 -6.307 -1.214 13.451 1.00 24.81 C ATOM 274 O ARG A 35 -6.277 0.015 13.571 1.00 23.41 O ATOM 275 CB ARG A 35 -8.533 -2.102 14.007 1.00 27.70 C ATOM 276 CG ARG A 35 -9.313 -3.257 14.565 1.00 31.08 C ATOM 277 CD ARG A 35 -10.793 -3.004 14.388 1.00 43.09 C ATOM 278 NE ARG A 35 -11.581 -4.119 14.882 1.00 49.11 N ATOM 279 CZ ARG A 35 -12.818 -4.005 15.344 1.00 50.77 C ATOM 280 NH1 ARG A 35 -13.404 -2.817 15.377 1.00 51.90 N ATOM 281 NH2 ARG A 35 -13.463 -5.082 15.774 1.00 50.52 N ATOM 282 N ILE A 36 -5.724 -1.854 12.448 1.00 24.34 N ATOM 283 CA ILE A 36 -4.988 -1.114 11.449 1.00 24.80 C ATOM 284 C ILE A 36 -4.915 -1.911 10.153 1.00 25.65 C ATOM 285 O ILE A 36 -4.840 -3.137 10.180 1.00 27.58 O ATOM 286 CB ILE A 36 -3.569 -0.800 11.964 1.00 28.84 C ATOM 287 CG1 ILE A 36 -2.789 -0.016 10.912 1.00 31.21 C ATOM 288 CG2 ILE A 36 -2.853 -2.096 12.329 1.00 31.43 C ATOM 289 CD1 ILE A 36 -1.425 0.458 11.386 1.00 35.12 C ATOM 290 N ASP A 37 -4.988 -1.217 9.021 1.00 24.18 N ATOM 291 CA ASP A 37 -4.878 -1.888 7.737 1.00 22.92 C ATOM 292 C ASP A 37 -3.395 -1.910 7.384 1.00 24.89 C ATOM 293 O ASP A 37 -2.795 -0.862 7.160 1.00 23.24 O ATOM 294 CB ASP A 37 -5.640 -1.136 6.640 1.00 25.96 C ATOM 295 CG ASP A 37 -5.719 -1.932 5.351 1.00 27.28 C ATOM 296 OD1 ASP A 37 -5.074 -3.005 5.264 1.00 26.74 O ATOM 297 OD2 ASP A 37 -6.416 -1.495 4.425 1.00 24.11 O ATOM 298 N GLN A 38 -2.809 -3.100 7.348 1.00 23.38 N ATOM 299 CA GLN A 38 -1.390 -3.248 7.019 1.00 24.05 C ATOM 300 C GLN A 38 -1.097 -2.813 5.585 1.00 26.36 C ATOM 301 O GLN A 38 0.059 -2.572 5.217 1.00 24.14 O ATOM 302 CB GLN A 38 -0.963 -4.710 7.225 1.00 26.14 C ATOM 303 CG GLN A 38 0.439 -5.033 6.736 1.00 29.45 C ATOM 304 CD GLN A 38 0.898 -6.429 7.127 1.00 34.47 C ATOM 305 OE1 GLN A 38 0.089 -7.337 7.313 1.00 25.81 O ATOM 306 NE2 GLN A 38 2.211 -6.609 7.233 1.00 30.07 N ATOM 307 N ALA A 39 -2.150 -2.692 4.781 1.00 24.48 N ATOM 308 CA ALA A 39 -1.995 -2.308 3.377 1.00 24.24 C ATOM 309 C ALA A 39 -1.800 -0.812 3.137 1.00 25.27 C ATOM 310 O ALA A 39 -1.311 -0.407 2.079 1.00 26.60 O ATOM 311 CB ALA A 39 -3.211 -2.811 2.565 1.00 20.51 C ATOM 312 N ILE A 40 -2.166 0.011 4.115 1.00 23.20 N ATOM 313 CA ILE A 40 -2.064 1.462 3.955 1.00 23.55 C ATOM 314 C ILE A 40 -0.664 2.021 4.167 1.00 27.17 C ATOM 315 O ILE A 40 -0.088 1.871 5.242 1.00 27.54 O ATOM 316 CB ILE A 40 -3.036 2.174 4.902 1.00 25.66 C ATOM 317 CG1 ILE A 40 -4.473 1.776 4.536 1.00 29.55 C ATOM 318 CG2 ILE A 40 -2.871 3.688 4.787 1.00 23.73 C ATOM 319 CD1 ILE A 40 -4.862 2.157 3.121 1.00 31.85 C ATOM 320 N MET A 41 -0.136 2.687 3.139 1.00 24.62 N ATOM 321 CA MET A 41 1.214 3.247 3.201 1.00 30.27 C ATOM 322 C MET A 41 1.308 4.631 2.565 1.00 31.82 C ATOM 323 O MET A 41 0.427 5.044 1.800 1.00 28.57 O ATOM 324 CB MET A 41 2.192 2.325 2.457 1.00 27.95 C ATOM 325 CG MET A 41 2.159 0.860 2.879 1.00 35.07 C ATOM 326 SD MET A 41 3.366 -0.185 1.951 1.00 37.47 S ATOM 327 CE MET A 41 4.864 0.310 2.766 1.00 40.41 C ATOM 328 N ASP A 42 2.390 5.334 2.902 1.00 30.44 N ATOM 329 CA ASP A 42 2.727 6.646 2.345 1.00 34.47 C ATOM 330 C ASP A 42 1.700 7.763 2.383 1.00 34.92 C ATOM 331 O ASP A 42 1.707 8.623 1.508 1.00 35.88 O ATOM 332 CB ASP A 42 3.172 6.478 0.886 1.00 35.29 C ATOM 333 CG ASP A 42 4.207 5.388 0.715 1.00 38.76 C ATOM 334 OD1 ASP A 42 5.234 5.434 1.418 1.00 38.17 O ATOM 335 OD2 ASP A 42 3.996 4.487 -0.125 1.00 42.72 O ATOM 336 N LYS A 43 0.829 7.778 3.381 1.00 32.49 N ATOM 337 CA LYS A 43 -0.173 8.830 3.442 1.00 31.85 C ATOM 338 C LYS A 43 -0.012 9.736 4.650 1.00 30.20 C ATOM 339 O LYS A 43 0.674 9.393 5.609 1.00 32.74 O ATOM 340 CB LYS A 43 -1.573 8.208 3.448 1.00 36.73 C ATOM 341 CG LYS A 43 -1.959 7.592 2.105 1.00 42.02 C ATOM 342 CD LYS A 43 -3.257 6.836 2.194 1.00 50.06 C ATOM 343 CE LYS A 43 -3.743 6.453 0.811 1.00 50.60 C ATOM 344 NZ LYS A 43 -4.067 7.667 0.004 1.00 55.30 N ATOM 345 N ASN A 44 -0.623 10.910 4.579 1.00 29.75 N ATOM 346 CA ASN A 44 -0.607 11.828 5.705 1.00 30.97 C ATOM 347 C ASN A 44 -1.865 11.408 6.466 1.00 31.27 C ATOM 348 O ASN A 44 -2.967 11.431 5.919 1.00 28.07 O ATOM 349 CB ASN A 44 -0.696 13.270 5.215 1.00 34.69 C ATOM 350 CG ASN A 44 0.566 13.702 4.490 1.00 38.66 C ATOM 351 OD1 ASN A 44 1.668 13.575 5.022 1.00 41.81 O ATOM 352 ND2 ASN A 44 0.413 14.211 3.278 1.00 40.86 N ATOM 353 N ILE A 45 -1.675 10.992 7.711 1.00 29.81 N ATOM 354 CA ILE A 45 -2.759 10.489 8.559 1.00 30.77 C ATOM 355 C ILE A 45 -2.991 11.402 9.758 1.00 28.39 C ATOM 356 O ILE A 45 -2.041 11.898 10.359 1.00 30.22 O ATOM 357 CB ILE A 45 -2.402 9.071 9.110 1.00 32.12 C ATOM 358 CG1 ILE A 45 -2.119 8.099 7.954 1.00 30.50 C ATOM 359 CG2 ILE A 45 -3.510 8.562 10.028 1.00 29.23 C ATOM 360 CD1 ILE A 45 -3.281 7.860 7.022 1.00 32.61 C ATOM 361 N MET A 46 -4.249 11.608 10.121 1.00 28.01 N ATOM 362 CA MET A 46 -4.559 12.447 11.274 1.00 28.75 C ATOM 363 C MET A 46 -5.374 11.626 12.261 1.00 28.99 C ATOM 364 O MET A 46 -6.374 11.009 11.885 1.00 28.88 O ATOM 365 CB MET A 46 -5.363 13.678 10.846 1.00 28.97 C ATOM 366 CG MET A 46 -5.943 14.507 12.013 1.00 35.32 C ATOM 367 SD MET A 46 -4.710 15.357 13.037 1.00 34.80 S ATOM 368 CE MET A 46 -4.302 16.726 11.971 1.00 44.39 C ATOM 369 N LEU A 47 -4.939 11.600 13.515 1.00 26.54 N ATOM 370 CA LEU A 47 -5.675 10.868 14.537 1.00 27.87 C ATOM 371 C LEU A 47 -6.711 11.805 15.156 1.00 28.38 C ATOM 372 O LEU A 47 -6.378 12.917 15.566 1.00 29.12 O ATOM 373 CB LEU A 47 -4.733 10.367 15.641 1.00 25.61 C ATOM 374 CG LEU A 47 -3.606 9.408 15.254 1.00 30.11 C ATOM 375 CD1 LEU A 47 -3.133 8.711 16.514 1.00 24.91 C ATOM 376 CD2 LEU A 47 -4.090 8.370 14.224 1.00 23.81 C ATOM 377 N LYS A 48 -7.960 11.355 15.203 1.00 27.45 N ATOM 378 CA LYS A 48 -9.052 12.123 15.798 1.00 27.87 C ATOM 379 C LYS A 48 -9.733 11.225 16.830 1.00 30.22 C ATOM 380 O LYS A 48 -9.784 10.005 16.660 1.00 26.53 O ATOM 381 CB LYS A 48 -10.075 12.532 14.738 1.00 29.85 C ATOM 382 CG LYS A 48 -9.587 13.581 13.748 1.00 32.49 C ATOM 383 CD LYS A 48 -10.730 13.990 12.820 1.00 35.68 C ATOM 384 CE LYS A 48 -10.317 15.097 11.872 1.00 45.39 C ATOM 385 NZ LYS A 48 -11.454 15.501 11.002 1.00 48.88 N ATOM 386 N ALA A 49 -10.265 11.814 17.895 1.00 24.85 N ATOM 387 CA ALA A 49 -10.920 11.007 18.914 1.00 24.99 C ATOM 388 C ALA A 49 -12.059 11.709 19.631 1.00 27.10 C ATOM 389 O ALA A 49 -12.182 12.937 19.611 1.00 26.71 O ATOM 390 CB ALA A 49 -9.879 10.518 19.948 1.00 23.07 C ATOM 391 N ASN A 50 -12.904 10.893 20.249 1.00 26.48 N ATOM 392 CA ASN A 50 -14.026 11.367 21.046 1.00 27.24 C ATOM 393 C ASN A 50 -13.734 10.728 22.392 1.00 27.15 C ATOM 394 O ASN A 50 -13.555 9.502 22.499 1.00 24.16 O ATOM 395 CB ASN A 50 -15.356 10.868 20.476 1.00 26.30 C ATOM 396 CG ASN A 50 -15.816 11.676 19.267 1.00 32.45 C ATOM 397 OD1 ASN A 50 -15.008 12.189 18.498 1.00 30.76 O ATOM 398 ND2 ASN A 50 -17.126 11.778 19.093 1.00 32.56 N ATOM 399 N PHE A 51 -13.668 11.557 23.421 1.00 25.00 N ATOM 400 CA PHE A 51 -13.347 11.075 24.747 1.00 23.62 C ATOM 401 C PHE A 51 -13.790 12.073 25.800 1.00 28.09 C ATOM 402 O PHE A 51 -14.042 13.241 25.495 1.00 26.05 O ATOM 403 CB PHE A 51 -11.833 10.881 24.842 1.00 26.72 C ATOM 404 CG PHE A 51 -11.037 12.099 24.438 1.00 25.87 C ATOM 405 CD1 PHE A 51 -10.571 12.998 25.397 1.00 25.97 C ATOM 406 CD2 PHE A 51 -10.750 12.345 23.099 1.00 20.51 C ATOM 407 CE1 PHE A 51 -9.824 14.127 25.026 1.00 27.99 C ATOM 408 CE2 PHE A 51 -10.007 13.463 22.712 1.00 27.90 C ATOM 409 CZ PHE A 51 -9.541 14.361 23.681 1.00 27.36 C ATOM 410 N SER A 52 -13.893 11.612 27.042 1.00 32.39 N ATOM 411 CA SER A 52 -14.261 12.506 28.127 1.00 32.82 C ATOM 412 C SER A 52 -12.943 12.932 28.765 1.00 33.41 C ATOM 413 O SER A 52 -11.946 12.226 28.643 1.00 30.78 O ATOM 414 CB SER A 52 -15.136 11.780 29.157 1.00 32.31 C ATOM 415 OG SER A 52 -14.445 10.697 29.739 1.00 31.66 O ATOM 416 N VAL A 53 -12.935 14.088 29.426 1.00 30.23 N ATOM 417 CA VAL A 53 -11.735 14.583 30.087 1.00 28.35 C ATOM 418 C VAL A 53 -12.075 14.952 31.532 1.00 28.73 C ATOM 419 O VAL A 53 -13.221 15.239 31.845 1.00 29.68 O ATOM 420 CB VAL A 53 -11.180 15.848 29.385 1.00 30.88 C ATOM 421 CG1 VAL A 53 -10.830 15.534 27.937 1.00 27.01 C ATOM 422 CG2 VAL A 53 -12.210 16.964 29.433 1.00 31.25 C ATOM 423 N ILE A 54 -11.076 14.916 32.401 1.00 29.28 N ATOM 424 CA ILE A 54 -11.247 15.290 33.800 1.00 31.64 C ATOM 425 C ILE A 54 -9.856 15.666 34.256 1.00 29.91 C ATOM 426 O ILE A 54 -8.883 15.063 33.819 1.00 30.45 O ATOM 427 CB ILE A 54 -11.792 14.121 34.669 1.00 37.77 C ATOM 428 CG1 ILE A 54 -12.232 14.667 36.030 1.00 40.15 C ATOM 429 CG2 ILE A 54 -10.724 13.039 34.862 1.00 33.00 C ATOM 430 CD1 ILE A 54 -12.864 13.621 36.932 1.00 46.06 C ATOM 431 N PHE A 55 -9.754 16.680 35.111 1.00 32.68 N ATOM 432 CA PHE A 55 -8.461 17.145 35.599 1.00 27.56 C ATOM 433 C PHE A 55 -7.495 17.473 34.459 1.00 26.61 C ATOM 434 O PHE A 55 -6.304 17.172 34.528 1.00 29.03 O ATOM 435 CB PHE A 55 -7.816 16.116 36.532 1.00 28.15 C ATOM 436 CG PHE A 55 -8.741 15.599 37.597 1.00 33.27 C ATOM 437 CD1 PHE A 55 -9.729 16.416 38.138 1.00 33.73 C ATOM 438 CD2 PHE A 55 -8.625 14.292 38.062 1.00 33.76 C ATOM 439 CE1 PHE A 55 -10.597 15.940 39.130 1.00 34.77 C ATOM 440 CE2 PHE A 55 -9.484 13.806 39.050 1.00 34.27 C ATOM 441 CZ PHE A 55 -10.473 14.634 39.585 1.00 37.02 C ATOM 442 N ASP A 56 -8.010 18.098 33.411 1.00 26.77 N ATOM 443 CA ASP A 56 -7.176 18.501 32.272 1.00 31.35 C ATOM 444 C ASP A 56 -6.470 17.360 31.529 1.00 32.33 C ATOM 445 O ASP A 56 -5.374 17.545 30.987 1.00 30.67 O ATOM 446 CB ASP A 56 -6.131 19.518 32.749 1.00 26.66 C ATOM 447 CG ASP A 56 -5.470 20.256 31.599 1.00 24.11 C ATOM 448 OD1 ASP A 56 -6.201 20.657 30.669 1.00 26.47 O ATOM 449 OD2 ASP A 56 -4.232 20.435 31.635 0.50 16.61 O ATOM 450 N ARG A 57 -7.092 16.186 31.499 1.00 29.47 N ATOM 451 CA ARG A 57 -6.512 15.041 30.800 1.00 32.73 C ATOM 452 C ARG A 57 -7.613 14.112 30.322 1.00 27.51 C ATOM 453 O ARG A 57 -8.730 14.143 30.830 1.00 28.65 O ATOM 454 CB ARG A 57 -5.574 14.254 31.717 1.00 36.28 C ATOM 455 CG ARG A 57 -6.296 13.588 32.870 1.00 43.48 C ATOM 456 CD ARG A 57 -5.390 12.631 33.624 1.00 44.85 C ATOM 457 NE ARG A 57 -6.040 12.137 34.835 1.00 50.12 N ATOM 458 CZ ARG A 57 -7.065 11.291 34.851 1.00 55.63 C ATOM 459 NH1 ARG A 57 -7.570 10.824 33.713 1.00 54.41 N ATOM 460 NH2 ARG A 57 -7.589 10.916 36.012 1.00 53.34 N ATOM 461 N LEU A 58 -7.298 13.290 29.331 1.00 32.63 N ATOM 462 CA LEU A 58 -8.268 12.337 28.812 1.00 30.88 C ATOM 463 C LEU A 58 -8.676 11.433 29.967 1.00 29.67 C ATOM 464 O LEU A 58 -7.847 11.053 30.783 1.00 28.84 O ATOM 465 CB LEU A 58 -7.639 11.504 27.684 1.00 31.80 C ATOM 466 CG LEU A 58 -8.491 10.396 27.055 1.00 32.37 C ATOM 467 CD1 LEU A 58 -8.093 10.203 25.600 1.00 27.89 C ATOM 468 CD2 LEU A 58 -8.319 9.112 27.842 1.00 30.72 C ATOM 469 N GLU A 59 -9.958 11.105 30.043 1.00 29.58 N ATOM 470 CA GLU A 59 -10.447 10.241 31.106 1.00 31.20 C ATOM 471 C GLU A 59 -10.882 8.902 30.533 1.00 30.03 C ATOM 472 O GLU A 59 -10.319 7.862 30.866 1.00 32.17 O ATOM 473 CB GLU A 59 -11.635 10.884 31.806 1.00 35.57 C ATOM 474 CG GLU A 59 -12.300 9.974 32.817 1.00 35.07 C ATOM 475 CD GLU A 59 -13.508 10.612 33.437 1.00 43.13 C ATOM 476 OE1 GLU A 59 -14.416 11.025 32.681 1.00 47.90 O ATOM 477 OE2 GLU A 59 -13.548 10.702 34.682 1.00 48.33 O ATOM 478 N THR A 60 -11.886 8.942 29.667 1.00 29.31 N ATOM 479 CA THR A 60 -12.402 7.728 29.048 1.00 31.74 C ATOM 480 C THR A 60 -12.510 7.873 27.532 1.00 31.36 C ATOM 481 O THR A 60 -13.191 8.754 27.021 1.00 32.01 O ATOM 482 CB THR A 60 -13.797 7.368 29.614 1.00 31.22 C ATOM 483 OG1 THR A 60 -13.697 7.167 31.031 1.00 31.85 O ATOM 484 CG2 THR A 60 -14.332 6.096 28.960 1.00 36.27 C ATOM 485 N LEU A 61 -11.836 6.995 26.810 1.00 29.61 N ATOM 486 CA LEU A 61 -11.890 7.046 25.360 1.00 23.47 C ATOM 487 C LEU A 61 -13.189 6.431 24.857 1.00 26.13 C ATOM 488 O LEU A 61 -13.591 5.364 25.319 1.00 27.33 O ATOM 489 CB LEU A 61 -10.703 6.280 24.768 1.00 23.67 C ATOM 490 CG LEU A 61 -10.707 6.203 23.236 1.00 26.70 C ATOM 491 CD1 LEU A 61 -10.404 7.569 22.653 1.00 24.33 C ATOM 492 CD2 LEU A 61 -9.696 5.192 22.774 1.00 24.24 C ATOM 493 N ILE A 62 -13.858 7.108 23.931 1.00 24.79 N ATOM 494 CA ILE A 62 -15.067 6.559 23.340 1.00 27.33 C ATOM 495 C ILE A 62 -14.602 5.870 22.052 1.00 31.62 C ATOM 496 O ILE A 62 -14.923 4.708 21.798 1.00 27.84 O ATOM 497 CB ILE A 62 -16.086 7.649 22.978 1.00 29.84 C ATOM 498 CG1 ILE A 62 -16.550 8.372 24.250 1.00 37.97 C ATOM 499 CG2 ILE A 62 -17.264 7.032 22.239 1.00 30.60 C ATOM 500 CD1 ILE A 62 -17.028 7.444 25.341 1.00 37.38 C ATOM 501 N LEU A 63 -13.818 6.589 21.255 1.00 29.76 N ATOM 502 CA LEU A 63 -13.305 6.037 20.010 1.00 24.62 C ATOM 503 C LEU A 63 -12.245 6.940 19.425 1.00 27.21 C ATOM 504 O LEU A 63 -12.358 8.173 19.504 1.00 24.29 O ATOM 505 CB LEU A 63 -14.431 5.899 18.988 1.00 23.63 C ATOM 506 CG LEU A 63 -14.085 5.242 17.644 1.00 29.32 C ATOM 507 CD1 LEU A 63 -13.755 3.769 17.858 1.00 29.38 C ATOM 508 CD2 LEU A 63 -15.265 5.382 16.689 1.00 27.09 C ATOM 509 N LEU A 64 -11.213 6.329 18.848 1.00 25.03 N ATOM 510 CA LEU A 64 -10.148 7.077 18.176 1.00 23.31 C ATOM 511 C LEU A 64 -9.991 6.452 16.799 1.00 25.40 C ATOM 512 O LEU A 64 -9.960 5.224 16.678 1.00 24.18 O ATOM 513 CB LEU A 64 -8.820 6.986 18.943 1.00 24.49 C ATOM 514 CG LEU A 64 -7.621 7.693 18.281 1.00 24.44 C ATOM 515 CD1 LEU A 64 -6.568 8.016 19.334 1.00 22.17 C ATOM 516 CD2 LEU A 64 -7.026 6.822 17.171 1.00 21.23 C ATOM 517 N ARG A 65 -9.935 7.281 15.758 1.00 24.90 N ATOM 518 CA ARG A 65 -9.749 6.754 14.407 1.00 27.42 C ATOM 519 C ARG A 65 -8.666 7.515 13.675 1.00 26.70 C ATOM 520 O ARG A 65 -8.406 8.692 13.967 1.00 27.39 O ATOM 521 CB ARG A 65 -11.063 6.783 13.615 1.00 25.35 C ATOM 522 CG ARG A 65 -11.964 5.628 14.007 1.00 29.38 C ATOM 523 CD ARG A 65 -13.327 5.640 13.362 1.00 26.23 C ATOM 524 NE ARG A 65 -13.912 4.307 13.470 1.00 27.39 N ATOM 525 CZ ARG A 65 -15.144 3.984 13.085 1.00 30.28 C ATOM 526 NH1 ARG A 65 -15.955 4.896 12.568 1.00 24.94 N ATOM 527 NH2 ARG A 65 -15.547 2.730 13.182 1.00 25.37 N ATOM 528 N ALA A 66 -8.017 6.820 12.750 1.00 25.40 N ATOM 529 CA ALA A 66 -6.946 7.396 11.947 1.00 25.89 C ATOM 530 C ALA A 66 -7.515 7.692 10.560 1.00 26.22 C ATOM 531 O ALA A 66 -7.982 6.778 9.887 1.00 25.71 O ATOM 532 CB ALA A 66 -5.781 6.403 11.859 1.00 21.57 C ATOM 533 N PHE A 67 -7.471 8.962 10.144 1.00 23.66 N ATOM 534 CA PHE A 67 -8.021 9.391 8.851 1.00 25.32 C ATOM 535 C PHE A 67 -6.981 9.862 7.826 1.00 26.46 C ATOM 536 O PHE A 67 -6.020 10.525 8.184 1.00 24.41 O ATOM 537 CB PHE A 67 -9.000 10.567 9.039 1.00 26.82 C ATOM 538 CG PHE A 67 -10.233 10.232 9.835 1.00 25.68 C ATOM 539 CD1 PHE A 67 -10.216 10.286 11.225 1.00 26.65 C ATOM 540 CD2 PHE A 67 -11.412 9.877 9.189 1.00 27.85 C ATOM 541 CE1 PHE A 67 -11.354 9.993 11.969 1.00 30.20 C ATOM 542 CE2 PHE A 67 -12.570 9.580 9.923 1.00 28.84 C ATOM 543 CZ PHE A 67 -12.538 9.639 11.316 1.00 26.41 C ATOM 544 N THR A 68 -7.195 9.539 6.551 1.00 28.99 N ATOM 545 CA THR A 68 -6.294 10.004 5.505 1.00 29.48 C ATOM 546 C THR A 68 -6.817 11.409 5.174 1.00 31.86 C ATOM 547 O THR A 68 -7.860 11.821 5.682 1.00 26.66 O ATOM 548 CB THR A 68 -6.375 9.148 4.226 1.00 30.44 C ATOM 549 OG1 THR A 68 -7.654 9.332 3.613 1.00 31.11 O ATOM 550 CG2 THR A 68 -6.178 7.670 4.543 1.00 30.48 C ATOM 551 N GLU A 69 -6.103 12.139 4.328 1.00 34.93 N ATOM 552 CA GLU A 69 -6.517 13.487 3.954 1.00 38.96 C ATOM 553 C GLU A 69 -7.864 13.483 3.237 1.00 41.75 C ATOM 554 O GLU A 69 -8.588 14.480 3.256 1.00 43.14 O ATOM 555 CB GLU A 69 -5.458 14.130 3.058 1.00 40.92 C ATOM 556 CG GLU A 69 -4.137 14.367 3.756 1.00 44.99 C ATOM 557 CD GLU A 69 -3.114 15.033 2.859 1.00 55.54 C ATOM 558 OE1 GLU A 69 -2.703 14.411 1.857 1.00 59.38 O ATOM 559 OE2 GLU A 69 -2.724 16.181 3.156 1.00 58.52 O ATOM 560 N GLU A 70 -8.193 12.357 2.606 1.00 40.49 N ATOM 561 CA GLU A 70 -9.450 12.217 1.889 1.00 42.76 C ATOM 562 C GLU A 70 -10.593 11.812 2.812 1.00 42.47 C ATOM 563 O GLU A 70 -11.714 11.584 2.357 1.00 43.84 O ATOM 564 CB GLU A 70 -9.317 11.181 0.767 1.00 46.33 C ATOM 565 CG GLU A 70 -8.490 11.628 -0.432 1.00 57.45 C ATOM 566 CD GLU A 70 -7.020 11.827 -0.109 1.00 64.52 C ATOM 567 OE1 GLU A 70 -6.433 10.959 0.577 1.00 66.36 O ATOM 568 OE2 GLU A 70 -6.449 12.847 -0.559 1.00 69.15 O ATOM 569 N GLY A 71 -10.306 11.697 4.105 1.00 36.60 N ATOM 570 CA GLY A 71 -11.351 11.335 5.047 1.00 34.58 C ATOM 571 C GLY A 71 -11.583 9.851 5.281 1.00 33.13 C ATOM 572 O GLY A 71 -12.496 9.483 6.018 1.00 33.63 O ATOM 573 N ALA A 72 -10.770 8.995 4.673 1.00 31.34 N ATOM 574 CA ALA A 72 -10.926 7.549 4.848 1.00 31.68 C ATOM 575 C ALA A 72 -10.293 7.049 6.155 1.00 29.14 C ATOM 576 O ALA A 72 -9.218 7.503 6.543 1.00 29.20 O ATOM 577 CB ALA A 72 -10.304 6.815 3.662 1.00 31.72 C ATOM 578 N ILE A 73 -10.953 6.099 6.813 1.00 28.59 N ATOM 579 CA ILE A 73 -10.444 5.528 8.066 1.00 29.58 C ATOM 580 C ILE A 73 -9.464 4.392 7.751 1.00 28.67 C ATOM 581 O ILE A 73 -9.781 3.505 6.959 1.00 28.17 O ATOM 582 CB ILE A 73 -11.599 4.944 8.929 1.00 26.94 C ATOM 583 CG1 ILE A 73 -12.646 6.022 9.204 1.00 28.60 C ATOM 584 CG2 ILE A 73 -11.046 4.399 10.259 1.00 25.57 C ATOM 585 CD1 ILE A 73 -13.963 5.477 9.725 1.00 30.20 C ATOM 586 N VAL A 74 -8.283 4.415 8.366 1.00 27.36 N ATOM 587 CA VAL A 74 -7.281 3.376 8.129 1.00 28.44 C ATOM 588 C VAL A 74 -6.762 2.751 9.428 1.00 29.25 C ATOM 589 O VAL A 74 -5.886 1.877 9.409 1.00 27.70 O ATOM 590 CB VAL A 74 -6.084 3.937 7.327 1.00 28.59 C ATOM 591 CG1 VAL A 74 -6.570 4.457 5.975 1.00 27.90 C ATOM 592 CG2 VAL A 74 -5.386 5.058 8.118 1.00 25.40 C ATOM 593 N GLY A 75 -7.318 3.184 10.554 1.00 24.01 N ATOM 594 CA GLY A 75 -6.872 2.653 11.833 1.00 24.29 C ATOM 595 C GLY A 75 -7.826 3.055 12.927 1.00 26.37 C ATOM 596 O GLY A 75 -8.575 4.019 12.772 1.00 26.91 O ATOM 597 N GLU A 76 -7.786 2.347 14.047 1.00 23.77 N ATOM 598 CA GLU A 76 -8.702 2.661 15.125 1.00 26.78 C ATOM 599 C GLU A 76 -8.320 2.078 16.474 1.00 25.79 C ATOM 600 O GLU A 76 -7.619 1.068 16.545 1.00 25.29 O ATOM 601 CB GLU A 76 -10.089 2.159 14.704 1.00 29.28 C ATOM 602 CG GLU A 76 -11.113 1.933 15.778 1.00 34.14 C ATOM 603 CD GLU A 76 -12.371 1.295 15.187 1.00 37.22 C ATOM 604 OE1 GLU A 76 -12.939 1.883 14.244 1.00 34.25 O ATOM 605 OE2 GLU A 76 -12.779 0.210 15.647 1.00 37.22 O ATOM 606 N ILE A 77 -8.760 2.754 17.536 1.00 21.66 N ATOM 607 CA ILE A 77 -8.570 2.281 18.903 1.00 21.70 C ATOM 608 C ILE A 77 -9.956 2.423 19.502 1.00 25.96 C ATOM 609 O ILE A 77 -10.542 3.522 19.520 1.00 23.36 O ATOM 610 CB ILE A 77 -7.576 3.117 19.715 1.00 22.78 C ATOM 611 CG1 ILE A 77 -6.164 2.973 19.133 1.00 23.70 C ATOM 612 CG2 ILE A 77 -7.547 2.614 21.178 1.00 23.77 C ATOM 613 CD1 ILE A 77 -5.127 3.882 19.797 1.00 25.40 C ATOM 614 N SER A 78 -10.513 1.304 19.945 1.00 26.22 N ATOM 615 CA SER A 78 -11.846 1.342 20.518 1.00 29.45 C ATOM 616 C SER A 78 -11.873 0.592 21.823 1.00 34.16 C ATOM 617 O SER A 78 -11.144 -0.378 22.007 1.00 34.38 O ATOM 618 CB SER A 78 -12.859 0.707 19.563 1.00 36.52 C ATOM 619 OG SER A 78 -12.550 -0.661 19.353 1.00 46.25 O ATOM 620 N PRO A 79 -12.712 1.042 22.761 1.00 35.43 N ATOM 621 CA PRO A 79 -12.795 0.353 24.048 1.00 32.21 C ATOM 622 C PRO A 79 -13.539 -0.953 23.804 1.00 33.96 C ATOM 623 O PRO A 79 -14.347 -1.039 22.884 1.00 30.44 O ATOM 624 CB PRO A 79 -13.613 1.321 24.899 1.00 33.33 C ATOM 625 CG PRO A 79 -14.560 1.920 23.879 1.00 38.29 C ATOM 626 CD PRO A 79 -13.633 2.191 22.707 1.00 33.69 C ATOM 627 N LEU A 80 -13.256 -1.976 24.592 1.00 29.54 N ATOM 628 CA LEU A 80 -13.983 -3.224 24.436 1.00 40.48 C ATOM 629 C LEU A 80 -15.356 -2.977 25.079 1.00 45.26 C ATOM 630 O LEU A 80 -15.459 -2.275 26.087 1.00 43.04 O ATOM 631 CB LEU A 80 -13.249 -4.356 25.153 1.00 31.97 C ATOM 632 CG LEU A 80 -11.880 -4.681 24.555 1.00 38.10 C ATOM 633 CD1 LEU A 80 -11.129 -5.612 25.471 1.00 43.49 C ATOM 634 CD2 LEU A 80 -12.060 -5.293 23.166 1.00 36.75 C ATOM 635 N PRO A 81 -16.426 -3.539 24.497 1.00 51.44 N ATOM 636 CA PRO A 81 -17.777 -3.351 25.043 1.00 55.59 C ATOM 637 C PRO A 81 -17.867 -3.628 26.537 1.00 57.52 C ATOM 638 O PRO A 81 -18.336 -2.800 27.319 1.00 59.99 O ATOM 639 CB PRO A 81 -18.611 -4.337 24.234 1.00 55.33 C ATOM 640 CG PRO A 81 -17.923 -4.342 22.906 1.00 57.34 C ATOM 641 CD PRO A 81 -16.460 -4.399 23.301 1.00 53.27 C ATOM 642 N SER A 82 -17.400 -4.805 26.923 1.00 61.04 N ATOM 643 CA SER A 82 -17.437 -5.246 28.306 1.00 63.20 C ATOM 644 C SER A 82 -16.864 -4.307 29.374 1.00 65.37 C ATOM 645 O SER A 82 -17.305 -4.346 30.525 1.00 65.38 O ATOM 646 CB SER A 82 -16.765 -6.622 28.408 1.00 66.24 C ATOM 647 OG SER A 82 -15.546 -6.669 27.683 1.00 65.71 O ATOM 648 N PHE A 83 -15.907 -3.454 29.012 1.00 66.29 N ATOM 649 CA PHE A 83 -15.303 -2.571 30.008 1.00 64.61 C ATOM 650 C PHE A 83 -15.710 -1.113 29.986 1.00 65.72 C ATOM 651 O PHE A 83 -16.009 -0.542 28.936 1.00 66.86 O ATOM 652 CB PHE A 83 -13.778 -2.592 29.912 1.00 63.80 C ATOM 653 CG PHE A 83 -13.211 -3.935 29.630 1.00 66.84 C ATOM 654 CD1 PHE A 83 -12.588 -4.672 30.630 1.00 69.85 C ATOM 655 CD2 PHE A 83 -13.303 -4.471 28.356 1.00 68.02 C ATOM 656 CE1 PHE A 83 -12.062 -5.929 30.357 1.00 72.30 C ATOM 657 CE2 PHE A 83 -12.786 -5.719 28.075 1.00 70.93 C ATOM 658 CZ PHE A 83 -12.164 -6.450 29.074 1.00 72.55 C ATOM 659 N PRO A 84 -15.736 -0.498 31.175 1.00 65.22 N ATOM 660 CA PRO A 84 -16.069 0.900 31.430 1.00 66.85 C ATOM 661 C PRO A 84 -14.778 1.467 32.027 1.00 65.46 C ATOM 662 O PRO A 84 -14.676 2.656 32.333 1.00 67.30 O ATOM 663 CB PRO A 84 -17.157 0.790 32.478 1.00 65.37 C ATOM 664 CG PRO A 84 -16.556 -0.252 33.381 1.00 67.44 C ATOM 665 CD PRO A 84 -15.982 -1.293 32.397 1.00 66.16 C ATOM 666 N GLY A 85 -13.792 0.584 32.183 1.00 64.24 N ATOM 667 CA GLY A 85 -12.541 0.990 32.784 1.00 57.74 C ATOM 668 C GLY A 85 -11.213 0.767 32.091 1.00 53.04 C ATOM 669 O GLY A 85 -10.749 -0.365 31.898 1.00 51.80 O ATOM 670 N HIS A 86 -10.602 1.885 31.723 1.00 46.86 N ATOM 671 CA HIS A 86 -9.281 1.904 31.122 1.00 43.14 C ATOM 672 C HIS A 86 -8.689 3.225 31.597 1.00 42.37 C ATOM 673 O HIS A 86 -9.425 4.140 31.974 1.00 44.63 O ATOM 674 CB HIS A 86 -9.325 1.811 29.580 1.00 35.91 C ATOM 675 CG HIS A 86 -10.118 2.891 28.907 1.00 34.89 C ATOM 676 ND1 HIS A 86 -11.352 2.660 28.336 1.00 31.09 N ATOM 677 CD2 HIS A 86 -9.833 4.193 28.670 1.00 31.05 C ATOM 678 CE1 HIS A 86 -11.790 3.771 27.772 1.00 30.01 C ATOM 679 NE2 HIS A 86 -10.888 4.717 27.960 1.00 31.69 N ATOM 680 N THR A 87 -7.365 3.305 31.626 1.00 39.50 N ATOM 681 CA THR A 87 -6.682 4.505 32.085 1.00 38.48 C ATOM 682 C THR A 87 -6.123 5.268 30.899 1.00 37.80 C ATOM 683 O THR A 87 -6.132 4.781 29.769 1.00 36.23 O ATOM 684 CB THR A 87 -5.496 4.155 33.004 1.00 37.05 C ATOM 685 OG1 THR A 87 -4.510 3.448 32.243 1.00 37.10 O ATOM 686 CG2 THR A 87 -5.951 3.272 34.172 1.00 38.33 C ATOM 687 N ILE A 88 -5.628 6.468 31.162 1.00 33.74 N ATOM 688 CA ILE A 88 -5.047 7.268 30.102 1.00 33.77 C ATOM 689 C ILE A 88 -3.747 6.579 29.667 1.00 31.04 C ATOM 690 O ILE A 88 -3.309 6.711 28.523 1.00 31.94 O ATOM 691 CB ILE A 88 -4.775 8.715 30.589 1.00 34.02 C ATOM 692 CG1 ILE A 88 -4.244 9.559 29.427 1.00 36.07 C ATOM 693 CG2 ILE A 88 -3.797 8.707 31.761 1.00 33.83 C ATOM 694 CD1 ILE A 88 -4.219 11.050 29.722 1.00 37.40 C ATOM 695 N GLU A 89 -3.139 5.826 30.580 1.00 32.57 N ATOM 696 CA GLU A 89 -1.912 5.105 30.250 1.00 34.44 C ATOM 697 C GLU A 89 -2.228 3.974 29.261 1.00 32.75 C ATOM 698 O GLU A 89 -1.424 3.681 28.375 1.00 31.78 O ATOM 699 CB GLU A 89 -1.253 4.524 31.505 1.00 35.38 C ATOM 700 CG GLU A 89 -0.797 5.559 32.535 1.00 43.96 C ATOM 701 CD GLU A 89 -1.758 5.679 33.710 1.00 50.31 C ATOM 702 OE1 GLU A 89 -2.847 6.270 33.551 1.00 58.10 O ATOM 703 OE2 GLU A 89 -1.428 5.166 34.802 1.00 57.57 O ATOM 704 N ASP A 90 -3.385 3.330 29.421 1.00 34.24 N ATOM 705 CA ASP A 90 -3.786 2.265 28.493 1.00 34.77 C ATOM 706 C ASP A 90 -3.978 2.913 27.127 1.00 31.80 C ATOM 707 O ASP A 90 -3.615 2.355 26.091 1.00 28.75 O ATOM 708 CB ASP A 90 -5.129 1.629 28.883 1.00 29.24 C ATOM 709 CG ASP A 90 -5.057 0.836 30.161 1.00 33.84 C ATOM 710 OD1 ASP A 90 -4.020 0.193 30.404 1.00 40.94 O ATOM 711 OD2 ASP A 90 -6.048 0.848 30.913 1.00 32.00 O ATOM 712 N VAL A 91 -4.576 4.097 27.138 1.00 27.14 N ATOM 713 CA VAL A 91 -4.834 4.810 25.895 1.00 26.71 C ATOM 714 C VAL A 91 -3.535 5.211 25.207 1.00 27.05 C ATOM 715 O VAL A 91 -3.379 5.020 23.993 1.00 27.72 O ATOM 716 CB VAL A 91 -5.709 6.056 26.154 1.00 29.11 C ATOM 717 CG1 VAL A 91 -5.895 6.843 24.870 1.00 30.84 C ATOM 718 CG2 VAL A 91 -7.063 5.616 26.684 1.00 26.62 C ATOM 719 N LYS A 92 -2.593 5.751 25.971 1.00 26.42 N ATOM 720 CA LYS A 92 -1.317 6.161 25.390 1.00 28.55 C ATOM 721 C LYS A 92 -0.570 4.959 24.821 1.00 28.42 C ATOM 722 O LYS A 92 0.016 5.039 23.745 1.00 29.67 O ATOM 723 CB LYS A 92 -0.462 6.874 26.438 1.00 31.01 C ATOM 724 CG LYS A 92 -1.058 8.214 26.888 1.00 34.87 C ATOM 725 CD LYS A 92 -0.431 8.692 28.196 1.00 42.54 C ATOM 726 CE LYS A 92 0.939 9.317 27.992 1.00 48.90 C ATOM 727 NZ LYS A 92 0.829 10.744 27.569 1.00 54.75 N ATOM 728 N ASN A 93 -0.587 3.844 25.544 1.00 29.39 N ATOM 729 CA ASN A 93 0.079 2.639 25.059 1.00 30.17 C ATOM 730 C ASN A 93 -0.503 2.244 23.706 1.00 26.14 C ATOM 731 O ASN A 93 0.234 1.978 22.758 1.00 27.33 O ATOM 732 CB ASN A 93 -0.116 1.484 26.047 1.00 33.45 C ATOM 733 CG ASN A 93 0.729 1.635 27.292 1.00 43.42 C ATOM 734 OD1 ASN A 93 0.458 1.009 28.317 1.00 47.48 O ATOM 735 ND2 ASN A 93 1.771 2.460 27.207 1.00 46.89 N ATOM 736 N ALA A 94 -1.828 2.212 23.619 1.00 24.98 N ATOM 737 CA ALA A 94 -2.493 1.832 22.377 1.00 25.46 C ATOM 738 C ALA A 94 -2.172 2.787 21.245 1.00 25.71 C ATOM 739 O ALA A 94 -1.971 2.360 20.104 1.00 26.02 O ATOM 740 CB ALA A 94 -4.006 1.763 22.584 1.00 21.98 C ATOM 741 N ILE A 95 -2.136 4.082 21.553 1.00 24.02 N ATOM 742 CA ILE A 95 -1.842 5.080 20.540 1.00 23.66 C ATOM 743 C ILE A 95 -0.437 4.847 20.000 1.00 26.07 C ATOM 744 O ILE A 95 -0.203 4.955 18.795 1.00 24.42 O ATOM 745 CB ILE A 95 -1.951 6.513 21.110 1.00 24.36 C ATOM 746 CG1 ILE A 95 -3.424 6.878 21.307 1.00 25.46 C ATOM 747 CG2 ILE A 95 -1.290 7.512 20.159 1.00 24.86 C ATOM 748 CD1 ILE A 95 -3.639 8.233 22.020 1.00 27.30 C ATOM 749 N GLY A 96 0.488 4.512 20.897 1.00 28.52 N ATOM 750 CA GLY A 96 1.861 4.252 20.489 1.00 27.29 C ATOM 751 C GLY A 96 1.962 3.052 19.560 1.00 30.82 C ATOM 752 O GLY A 96 2.788 3.042 18.643 1.00 29.81 O ATOM 753 N VAL A 97 1.131 2.036 19.784 1.00 28.47 N ATOM 754 CA VAL A 97 1.154 0.853 18.920 1.00 29.24 C ATOM 755 C VAL A 97 0.591 1.209 17.544 1.00 29.55 C ATOM 756 O VAL A 97 1.149 0.830 16.511 1.00 30.02 O ATOM 757 CB VAL A 97 0.329 -0.306 19.518 1.00 32.06 C ATOM 758 CG1 VAL A 97 0.176 -1.428 18.493 1.00 32.43 C ATOM 759 CG2 VAL A 97 1.013 -0.838 20.762 1.00 31.54 C ATOM 760 N LEU A 98 -0.519 1.941 17.534 1.00 30.02 N ATOM 761 CA LEU A 98 -1.132 2.360 16.280 1.00 28.93 C ATOM 762 C LEU A 98 -0.181 3.270 15.490 1.00 25.88 C ATOM 763 O LEU A 98 0.067 3.044 14.305 1.00 23.67 O ATOM 764 CB LEU A 98 -2.460 3.090 16.554 1.00 25.46 C ATOM 765 CG LEU A 98 -3.177 3.637 15.314 1.00 28.34 C ATOM 766 CD1 LEU A 98 -3.426 2.488 14.323 1.00 23.42 C ATOM 767 CD2 LEU A 98 -4.489 4.311 15.723 1.00 27.73 C ATOM 768 N ILE A 99 0.345 4.307 16.133 1.00 25.80 N ATOM 769 CA ILE A 99 1.259 5.217 15.443 1.00 28.28 C ATOM 770 C ILE A 99 2.502 4.483 14.938 1.00 28.48 C ATOM 771 O ILE A 99 3.016 4.777 13.853 1.00 28.10 O ATOM 772 CB ILE A 99 1.702 6.389 16.360 1.00 30.17 C ATOM 773 CG1 ILE A 99 0.535 7.361 16.560 1.00 28.96 C ATOM 774 CG2 ILE A 99 2.885 7.123 15.736 1.00 31.67 C ATOM 775 CD1 ILE A 99 0.824 8.514 17.538 1.00 24.66 C ATOM 776 N GLY A 100 2.972 3.522 15.725 1.00 30.56 N ATOM 777 CA GLY A 100 4.144 2.755 15.340 1.00 30.89 C ATOM 778 C GLY A 100 3.930 1.954 14.068 1.00 31.63 C ATOM 779 O GLY A 100 4.822 1.858 13.220 1.00 27.32 O ATOM 780 N GLY A 101 2.740 1.379 13.928 1.00 29.47 N ATOM 781 CA GLY A 101 2.434 0.591 12.747 1.00 28.48 C ATOM 782 C GLY A 101 2.278 1.493 11.545 1.00 27.45 C ATOM 783 O GLY A 101 2.768 1.190 10.460 1.00 30.00 O ATOM 784 N LEU A 102 1.604 2.619 11.737 1.00 28.02 N ATOM 785 CA LEU A 102 1.399 3.566 10.649 1.00 24.64 C ATOM 786 C LEU A 102 2.728 4.150 10.145 1.00 28.36 C ATOM 787 O LEU A 102 2.944 4.252 8.930 1.00 25.81 O ATOM 788 CB LEU A 102 0.482 4.695 11.111 1.00 24.93 C ATOM 789 CG LEU A 102 -0.971 4.282 11.404 1.00 27.60 C ATOM 790 CD1 LEU A 102 -1.734 5.470 12.026 1.00 23.06 C ATOM 791 CD2 LEU A 102 -1.626 3.816 10.105 1.00 23.77 C ATOM 792 N GLU A 103 3.604 4.540 11.071 1.00 26.78 N ATOM 793 CA GLU A 103 4.901 5.119 10.696 1.00 28.60 C ATOM 794 C GLU A 103 5.820 4.081 10.075 1.00 30.13 C ATOM 795 O GLU A 103 6.650 4.402 9.208 1.00 29.64 O ATOM 796 CB GLU A 103 5.580 5.771 11.908 1.00 26.29 C ATOM 797 CG GLU A 103 4.770 6.927 12.474 1.00 35.15 C ATOM 798 CD GLU A 103 5.503 7.719 13.548 1.00 33.79 C ATOM 799 OE1 GLU A 103 6.254 7.115 14.340 1.00 38.21 O ATOM 800 OE2 GLU A 103 5.308 8.949 13.606 1.00 36.34 O ATOM 801 N TRP A 104 5.678 2.835 10.510 1.00 29.02 N ATOM 802 CA TRP A 104 6.494 1.768 9.945 1.00 33.48 C ATOM 803 C TRP A 104 6.147 1.646 8.461 1.00 32.67 C ATOM 804 O TRP A 104 7.015 1.375 7.622 1.00 27.12 O ATOM 805 CB TRP A 104 6.206 0.445 10.644 1.00 33.29 C ATOM 806 CG TRP A 104 7.272 -0.564 10.413 1.00 42.40 C ATOM 807 CD1 TRP A 104 8.537 -0.560 10.942 1.00 44.44 C ATOM 808 CD2 TRP A 104 7.180 -1.737 9.602 1.00 41.32 C ATOM 809 NE1 TRP A 104 9.233 -1.664 10.512 1.00 41.21 N ATOM 810 CE2 TRP A 104 8.425 -2.405 9.690 1.00 42.36 C ATOM 811 CE3 TRP A 104 6.166 -2.295 8.811 1.00 39.96 C ATOM 812 CZ2 TRP A 104 8.682 -3.601 9.017 1.00 42.25 C ATOM 813 CZ3 TRP A 104 6.420 -3.484 8.143 1.00 44.76 C ATOM 814 CH2 TRP A 104 7.671 -4.126 8.252 1.00 46.80 C ATOM 815 N ASN A 105 4.868 1.846 8.142 1.00 28.10 N ATOM 816 CA ASN A 105 4.400 1.779 6.757 1.00 29.92 C ATOM 817 C ASN A 105 4.594 3.105 6.019 1.00 30.08 C ATOM 818 O ASN A 105 3.938 3.378 5.008 1.00 28.24 O ATOM 819 CB ASN A 105 2.920 1.363 6.708 1.00 27.69 C ATOM 820 CG ASN A 105 2.749 -0.137 6.551 1.00 32.22 C ATOM 821 OD1 ASN A 105 3.721 -0.859 6.330 1.00 31.63 O ATOM 822 ND2 ASN A 105 1.515 -0.611 6.652 1.00 29.23 N ATOM 823 N ASP A 106 5.497 3.923 6.540 1.00 29.45 N ATOM 824 CA ASP A 106 5.837 5.205 5.945 1.00 30.17 C ATOM 825 C ASP A 106 4.722 6.229 5.809 1.00 33.13 C ATOM 826 O ASP A 106 4.705 7.037 4.875 1.00 30.68 O ATOM 827 CB ASP A 106 6.519 4.964 4.593 1.00 34.48 C ATOM 828 CG ASP A 106 7.828 4.203 4.745 1.00 40.64 C ATOM 829 OD1 ASP A 106 8.659 4.624 5.585 1.00 38.72 O ATOM 830 OD2 ASP A 106 8.024 3.186 4.044 1.00 40.99 O ATOM 831 N ASN A 107 3.784 6.194 6.745 1.00 29.55 N ATOM 832 CA ASN A 107 2.713 7.165 6.754 1.00 28.85 C ATOM 833 C ASN A 107 3.198 8.261 7.686 1.00 28.22 C ATOM 834 O ASN A 107 3.917 7.982 8.639 1.00 29.64 O ATOM 835 CB ASN A 107 1.423 6.550 7.321 1.00 25.61 C ATOM 836 CG ASN A 107 0.846 5.489 6.419 1.00 23.08 C ATOM 837 OD1 ASN A 107 0.353 5.791 5.335 1.00 26.03 O ATOM 838 ND2 ASN A 107 0.914 4.238 6.851 1.00 23.71 N ATOM 839 N THR A 108 2.823 9.504 7.403 1.00 29.07 N ATOM 840 CA THR A 108 3.185 10.617 8.271 1.00 31.03 C ATOM 841 C THR A 108 1.960 10.826 9.164 1.00 29.01 C ATOM 842 O THR A 108 0.872 11.134 8.679 1.00 28.59 O ATOM 843 CB THR A 108 3.493 11.871 7.446 1.00 33.22 C ATOM 844 OG1 THR A 108 4.677 11.631 6.678 1.00 34.11 O ATOM 845 CG2 THR A 108 3.723 13.073 8.356 1.00 36.59 C ATOM 846 N VAL A 109 2.151 10.648 10.466 1.00 29.37 N ATOM 847 CA VAL A 109 1.065 10.737 11.435 1.00 28.46 C ATOM 848 C VAL A 109 1.028 11.991 12.306 1.00 34.54 C ATOM 849 O VAL A 109 2.018 12.364 12.928 1.00 35.05 O ATOM 850 CB VAL A 109 1.107 9.521 12.383 1.00 28.75 C ATOM 851 CG1 VAL A 109 -0.084 9.549 13.329 1.00 28.81 C ATOM 852 CG2 VAL A 109 1.135 8.221 11.564 1.00 29.46 C ATOM 853 N ARG A 110 -0.129 12.638 12.341 1.00 31.20 N ATOM 854 CA ARG A 110 -0.327 13.805 13.181 1.00 31.75 C ATOM 855 C ARG A 110 -1.525 13.495 14.081 1.00 33.55 C ATOM 856 O ARG A 110 -2.389 12.681 13.736 1.00 28.73 O ATOM 857 CB ARG A 110 -0.599 15.057 12.346 1.00 35.67 C ATOM 858 CG ARG A 110 0.579 15.498 11.487 1.00 37.79 C ATOM 859 CD ARG A 110 0.346 16.893 10.933 1.00 45.12 C ATOM 860 NE ARG A 110 -0.934 16.991 10.241 1.00 54.89 N ATOM 861 CZ ARG A 110 -1.494 18.134 9.850 1.00 59.02 C ATOM 862 NH1 ARG A 110 -0.887 19.292 10.084 1.00 58.69 N ATOM 863 NH2 ARG A 110 -2.663 18.120 9.220 1.00 60.44 N ATOM 864 N VAL A 111 -1.561 14.155 15.230 1.00 32.99 N ATOM 865 CA VAL A 111 -2.594 13.974 16.237 1.00 31.85 C ATOM 866 C VAL A 111 -3.425 15.254 16.394 1.00 33.48 C ATOM 867 O VAL A 111 -2.879 16.357 16.326 1.00 30.10 O ATOM 868 CB VAL A 111 -1.884 13.555 17.558 1.00 38.57 C ATOM 869 CG1 VAL A 111 -2.670 13.959 18.762 1.00 39.29 C ATOM 870 CG2 VAL A 111 -1.647 12.049 17.542 1.00 35.36 C ATOM 871 N SER A 112 -4.738 15.119 16.594 1.00 28.37 N ATOM 872 CA SER A 112 -5.606 16.298 16.724 1.00 30.36 C ATOM 873 C SER A 112 -5.149 17.192 17.876 1.00 26.56 C ATOM 874 O SER A 112 -4.447 16.741 18.782 1.00 26.15 O ATOM 875 CB SER A 112 -7.070 15.888 16.958 1.00 28.25 C ATOM 876 OG SER A 112 -7.247 15.323 18.252 1.00 25.00 O ATOM 877 N LYS A 113 -5.555 18.457 17.844 1.00 26.96 N ATOM 878 CA LYS A 113 -5.154 19.379 18.901 1.00 29.79 C ATOM 879 C LYS A 113 -5.705 18.964 20.263 1.00 27.26 C ATOM 880 O LYS A 113 -5.040 19.145 21.282 1.00 27.44 O ATOM 881 CB LYS A 113 -5.598 20.800 18.544 1.00 30.89 C ATOM 882 CG LYS A 113 -4.852 21.339 17.331 1.00 41.31 C ATOM 883 CD LYS A 113 -5.345 22.711 16.914 1.00 50.71 C ATOM 884 CE LYS A 113 -4.544 23.231 15.729 1.00 54.85 C ATOM 885 NZ LYS A 113 -3.087 23.306 16.041 1.00 57.43 N ATOM 886 N THR A 114 -6.916 18.403 20.287 1.00 25.82 N ATOM 887 CA THR A 114 -7.489 17.974 21.557 1.00 28.95 C ATOM 888 C THR A 114 -6.709 16.783 22.093 1.00 27.53 C ATOM 889 O THR A 114 -6.467 16.680 23.301 1.00 27.20 O ATOM 890 CB THR A 114 -8.985 17.597 21.433 1.00 29.65 C ATOM 891 OG1 THR A 114 -9.147 16.544 20.475 1.00 30.24 O ATOM 892 CG2 THR A 114 -9.803 18.815 21.003 1.00 27.33 C ATOM 893 N LEU A 115 -6.301 15.881 21.205 1.00 27.01 N ATOM 894 CA LEU A 115 -5.513 14.735 21.656 1.00 28.85 C ATOM 895 C LEU A 115 -4.177 15.232 22.195 1.00 26.27 C ATOM 896 O LEU A 115 -3.670 14.714 23.190 1.00 27.28 O ATOM 897 CB LEU A 115 -5.269 13.744 20.511 1.00 30.37 C ATOM 898 CG LEU A 115 -6.362 12.701 20.297 1.00 28.35 C ATOM 899 CD1 LEU A 115 -6.041 11.857 19.063 1.00 30.37 C ATOM 900 CD2 LEU A 115 -6.460 11.820 21.538 1.00 25.12 C ATOM 901 N GLN A 116 -3.609 16.237 21.534 1.00 29.76 N ATOM 902 CA GLN A 116 -2.336 16.807 21.977 1.00 33.74 C ATOM 903 C GLN A 116 -2.519 17.435 23.348 1.00 30.73 C ATOM 904 O GLN A 116 -1.722 17.234 24.259 1.00 26.43 O ATOM 905 CB GLN A 116 -1.865 17.900 21.017 1.00 32.64 C ATOM 906 CG GLN A 116 -1.374 17.408 19.681 1.00 41.84 C ATOM 907 CD GLN A 116 -1.039 18.561 18.757 1.00 48.41 C ATOM 908 OE1 GLN A 116 -0.384 19.528 19.164 1.00 53.41 O ATOM 909 NE2 GLN A 116 -1.484 18.471 17.510 1.00 43.19 N ATOM 910 N ARG A 117 -3.589 18.204 23.476 1.00 32.45 N ATOM 911 CA ARG A 117 -3.894 18.898 24.719 1.00 31.54 C ATOM 912 C ARG A 117 -4.161 17.998 25.919 1.00 29.79 C ATOM 913 O ARG A 117 -3.672 18.268 27.015 1.00 31.00 O ATOM 914 CB ARG A 117 -5.109 19.814 24.507 1.00 30.96 C ATOM 915 CG ARG A 117 -5.634 20.502 25.777 1.00 34.22 C ATOM 916 CD ARG A 117 -6.779 21.453 25.446 1.00 27.92 C ATOM 917 NE ARG A 117 -6.357 22.432 24.447 1.00 31.11 N ATOM 918 CZ ARG A 117 -6.839 22.512 23.207 1.00 31.75 C ATOM 919 NH1 ARG A 117 -7.784 21.682 22.791 1.00 27.49 N ATOM 920 NH2 ARG A 117 -6.335 23.399 22.355 1.00 32.79 N ATOM 921 N PHE A 118 -4.929 16.934 25.715 1.00 30.56 N ATOM 922 CA PHE A 118 -5.312 16.059 26.819 1.00 30.94 C ATOM 923 C PHE A 118 -4.659 14.685 26.931 1.00 32.78 C ATOM 924 O PHE A 118 -4.821 14.024 27.955 1.00 31.41 O ATOM 925 CB PHE A 118 -6.831 15.849 26.792 1.00 28.54 C ATOM 926 CG PHE A 118 -7.628 17.118 26.893 1.00 25.71 C ATOM 927 CD1 PHE A 118 -7.646 17.857 28.073 1.00 30.56 C ATOM 928 CD2 PHE A 118 -8.367 17.571 25.809 1.00 28.28 C ATOM 929 CE1 PHE A 118 -8.395 19.035 28.168 1.00 30.14 C ATOM 930 CE2 PHE A 118 -9.120 18.749 25.894 1.00 28.34 C ATOM 931 CZ PHE A 118 -9.132 19.481 27.076 1.00 29.27 C ATOM 932 N ALA A 119 -3.910 14.250 25.925 1.00 32.97 N ATOM 933 CA ALA A 119 -3.355 12.905 26.016 1.00 40.18 C ATOM 934 C ALA A 119 -2.004 12.620 25.389 1.00 43.46 C ATOM 935 O ALA A 119 -1.231 11.837 25.931 1.00 46.22 O ATOM 936 CB ALA A 119 -4.381 11.910 25.453 1.00 29.23 C ATOM 937 N TRP A 120 -1.723 13.245 24.252 1.00 44.48 N ATOM 938 CA TRP A 120 -0.481 12.993 23.530 1.00 47.84 C ATOM 939 C TRP A 120 0.338 14.261 23.313 1.00 50.65 C ATOM 940 O TRP A 120 0.369 14.737 22.159 1.00 53.52 O ATOM 941 CB TRP A 120 -0.829 12.353 22.183 1.00 43.49 C ATOM 942 CG TRP A 120 0.291 11.631 21.508 1.00 42.84 C ATOM 943 CD1 TRP A 120 1.002 12.049 20.416 1.00 40.14 C ATOM 944 CD2 TRP A 120 0.771 10.322 21.821 1.00 39.87 C ATOM 945 NE1 TRP A 120 1.887 11.074 20.023 1.00 38.74 N ATOM 946 CE2 TRP A 120 1.770 10.002 20.872 1.00 39.99 C ATOM 947 CE3 TRP A 120 0.457 9.385 22.818 1.00 41.37 C ATOM 948 CZ2 TRP A 120 2.451 8.777 20.881 1.00 37.42 C ATOM 949 CZ3 TRP A 120 1.137 8.161 22.828 1.00 37.77 C ATOM 950 CH2 TRP A 120 2.124 7.873 21.865 1.00 35.60 C TER 952 TRP A 120 ATOM 952 N PRO B 2 14.326 6.519 -43.582 1.00 67.03 N ATOM 953 CA PRO B 2 15.039 7.172 -42.461 1.00 66.46 C ATOM 954 C PRO B 2 15.623 6.150 -41.490 1.00 64.89 C ATOM 955 O PRO B 2 15.098 5.046 -41.340 1.00 64.26 O ATOM 956 CB PRO B 2 14.028 8.067 -41.758 1.00 66.20 C ATOM 957 CG PRO B 2 13.075 8.389 -42.900 1.00 66.15 C ATOM 958 CD PRO B 2 12.965 7.074 -43.694 1.00 68.62 C ATOM 959 N ALA B 3 16.722 6.523 -40.844 1.00 63.72 N ATOM 960 CA ALA B 3 17.370 5.648 -39.882 1.00 60.98 C ATOM 961 C ALA B 3 16.546 5.639 -38.602 1.00 61.80 C ATOM 962 O ALA B 3 15.835 6.599 -38.304 1.00 61.92 O ATOM 963 CB ALA B 3 18.775 6.143 -39.592 1.00 60.13 C ATOM 964 N SER B 4 16.630 4.546 -37.851 1.00 61.36 N ATOM 965 CA SER B 4 15.899 4.450 -36.597 1.00 61.25 C ATOM 966 C SER B 4 16.403 5.547 -35.681 1.00 59.19 C ATOM 967 O SER B 4 17.563 5.948 -35.761 1.00 57.48 O ATOM 968 CB SER B 4 16.148 3.096 -35.925 1.00 61.02 C ATOM 969 OG SER B 4 15.562 2.041 -36.660 1.00 69.93 O ATOM 970 N ARG B 5 15.528 6.051 -34.823 1.00 57.83 N ATOM 971 CA ARG B 5 15.940 7.067 -33.874 1.00 56.81 C ATOM 972 C ARG B 5 15.471 6.592 -32.508 1.00 53.82 C ATOM 973 O ARG B 5 14.461 5.895 -32.402 1.00 49.81 O ATOM 974 CB ARG B 5 15.363 8.439 -34.246 1.00 57.06 C ATOM 975 CG ARG B 5 13.862 8.571 -34.230 1.00 60.13 C ATOM 976 CD ARG B 5 13.452 9.815 -35.011 1.00 62.00 C ATOM 977 NE ARG B 5 12.135 10.318 -34.635 1.00 65.62 N ATOM 978 CZ ARG B 5 11.884 10.976 -33.507 1.00 69.35 C ATOM 979 NH1 ARG B 5 12.864 11.214 -32.645 1.00 68.96 N ATOM 980 NH2 ARG B 5 10.655 11.397 -33.239 1.00 69.53 N ATOM 981 N TYR B 6 16.228 6.943 -31.475 1.00 48.95 N ATOM 982 CA TYR B 6 15.907 6.517 -30.121 1.00 47.14 C ATOM 983 C TYR B 6 15.175 7.533 -29.270 1.00 45.30 C ATOM 984 O TYR B 6 15.488 8.726 -29.270 1.00 46.21 O ATOM 985 CB TYR B 6 17.177 6.110 -29.370 1.00 48.48 C ATOM 986 CG TYR B 6 17.816 4.833 -29.849 1.00 53.39 C ATOM 987 CD1 TYR B 6 18.919 4.861 -30.699 1.00 58.61 C ATOM 988 CD2 TYR B 6 17.331 3.592 -29.437 1.00 53.88 C ATOM 989 CE1 TYR B 6 19.530 3.681 -31.125 1.00 61.00 C ATOM 990 CE2 TYR B 6 17.930 2.408 -29.857 1.00 55.84 C ATOM 991 CZ TYR B 6 19.031 2.460 -30.698 1.00 61.08 C ATOM 992 OH TYR B 6 19.646 1.293 -31.099 1.00 62.35 O ATOM 993 N ILE B 7 14.190 7.041 -28.536 1.00 40.19 N ATOM 994 CA ILE B 7 13.440 7.875 -27.625 1.00 37.08 C ATOM 995 C ILE B 7 13.987 7.464 -26.265 1.00 35.45 C ATOM 996 O ILE B 7 14.103 6.266 -25.974 1.00 32.77 O ATOM 997 CB ILE B 7 11.926 7.568 -27.680 1.00 39.84 C ATOM 998 CG1 ILE B 7 11.388 7.780 -29.102 1.00 42.19 C ATOM 999 CG2 ILE B 7 11.191 8.436 -26.681 1.00 35.33 C ATOM 1000 CD1 ILE B 7 11.715 9.139 -29.703 1.00 45.27 C ATOM 1001 N THR B 8 14.351 8.441 -25.443 1.00 32.87 N ATOM 1002 CA THR B 8 14.879 8.143 -24.121 1.00 34.48 C ATOM 1003 C THR B 8 14.157 8.953 -23.058 1.00 36.94 C ATOM 1004 O THR B 8 14.598 10.042 -22.692 1.00 36.35 O ATOM 1005 CB THR B 8 16.400 8.445 -24.035 1.00 39.22 C ATOM 1006 OG1 THR B 8 16.639 9.814 -24.380 1.00 42.42 O ATOM 1007 CG2 THR B 8 17.180 7.549 -24.973 1.00 37.86 C ATOM 1008 N ASP B 9 13.039 8.426 -22.568 1.00 37.31 N ATOM 1009 CA ASP B 9 12.271 9.118 -21.534 1.00 37.50 C ATOM 1010 C ASP B 9 13.048 9.118 -20.222 1.00 36.60 C ATOM 1011 O ASP B 9 13.011 10.086 -19.467 1.00 36.66 O ATOM 1012 CB ASP B 9 10.924 8.426 -21.269 1.00 36.74 C ATOM 1013 CG ASP B 9 9.937 8.559 -22.418 1.00 40.06 C ATOM 1014 OD1 ASP B 9 10.120 9.410 -23.317 1.00 39.09 O ATOM 1015 OD2 ASP B 9 8.946 7.805 -22.398 1.00 33.37 O ATOM 1016 N MET B 10 13.739 8.018 -19.949 1.00 34.01 N ATOM 1017 CA MET B 10 14.485 7.879 -18.705 1.00 36.88 C ATOM 1018 C MET B 10 15.916 8.384 -18.766 1.00 37.18 C ATOM 1019 O MET B 10 16.555 8.328 -19.809 1.00 32.19 O ATOM 1020 CB MET B 10 14.528 6.408 -18.275 1.00 35.01 C ATOM 1021 CG MET B 10 13.207 5.816 -17.862 1.00 31.11 C ATOM 1022 SD MET B 10 13.347 4.084 -17.385 1.00 33.09 S ATOM 1023 CE MET B 10 12.836 3.277 -18.888 1.00 29.76 C ATOM 1024 N THR B 11 16.413 8.864 -17.630 1.00 36.92 N ATOM 1025 CA THR B 11 17.795 9.321 -17.545 1.00 39.13 C ATOM 1026 C THR B 11 18.633 8.065 -17.356 1.00 35.90 C ATOM 1027 O THR B 11 18.097 6.990 -17.087 1.00 32.69 O ATOM 1028 CB THR B 11 18.036 10.229 -16.322 1.00 40.95 C ATOM 1029 OG1 THR B 11 17.645 9.529 -15.136 1.00 36.45 O ATOM 1030 CG2 THR B 11 17.243 11.530 -16.440 1.00 38.37 C ATOM 1031 N ILE B 12 19.947 8.202 -17.488 1.00 37.15 N ATOM 1032 CA ILE B 12 20.848 7.075 -17.323 1.00 36.64 C ATOM 1033 C ILE B 12 20.652 6.430 -15.956 1.00 34.67 C ATOM 1034 O ILE B 12 20.686 5.205 -15.819 1.00 38.36 O ATOM 1035 CB ILE B 12 22.330 7.527 -17.467 1.00 40.05 C ATOM 1036 CG1 ILE B 12 22.588 8.015 -18.896 1.00 48.44 C ATOM 1037 CG2 ILE B 12 23.254 6.377 -17.148 1.00 42.64 C ATOM 1038 CD1 ILE B 12 24.002 8.520 -19.145 1.00 52.37 C ATOM 1039 N GLU B 13 20.444 7.258 -14.944 1.00 34.11 N ATOM 1040 CA GLU B 13 20.251 6.764 -13.583 1.00 40.69 C ATOM 1041 C GLU B 13 18.946 5.957 -13.455 1.00 39.91 C ATOM 1042 O GLU B 13 18.931 4.845 -12.925 1.00 36.83 O ATOM 1043 CB GLU B 13 20.258 7.961 -12.615 1.00 43.83 C ATOM 1044 CG GLU B 13 20.285 7.620 -11.129 1.00 45.79 C ATOM 1045 CD GLU B 13 18.929 7.215 -10.589 1.00 50.74 C ATOM 1046 OE1 GLU B 13 17.920 7.833 -10.990 1.00 48.89 O ATOM 1047 OE2 GLU B 13 18.875 6.291 -9.748 1.00 52.94 O ATOM 1048 N GLU B 14 17.852 6.516 -13.955 1.00 39.18 N ATOM 1049 CA GLU B 14 16.565 5.834 -13.879 1.00 39.52 C ATOM 1050 C GLU B 14 16.595 4.478 -14.579 1.00 38.34 C ATOM 1051 O GLU B 14 16.001 3.502 -14.114 1.00 38.02 O ATOM 1052 CB GLU B 14 15.476 6.709 -14.503 1.00 38.40 C ATOM 1053 CG GLU B 14 15.277 8.041 -13.781 1.00 43.61 C ATOM 1054 CD GLU B 14 14.223 8.920 -14.433 1.00 46.50 C ATOM 1055 OE1 GLU B 14 14.314 9.163 -15.659 1.00 40.95 O ATOM 1056 OE2 GLU B 14 13.306 9.377 -13.714 1.00 49.41 O ATOM 1057 N LEU B 15 17.316 4.418 -15.688 1.00 35.35 N ATOM 1058 CA LEU B 15 17.399 3.205 -16.485 1.00 36.55 C ATOM 1059 C LEU B 15 18.223 2.111 -15.829 1.00 38.89 C ATOM 1060 O LEU B 15 17.894 0.928 -15.937 1.00 36.85 O ATOM 1061 CB LEU B 15 17.994 3.547 -17.854 1.00 41.44 C ATOM 1062 CG LEU B 15 17.887 2.551 -19.008 1.00 49.98 C ATOM 1063 CD1 LEU B 15 16.438 2.418 -19.463 1.00 48.83 C ATOM 1064 CD2 LEU B 15 18.741 3.046 -20.160 1.00 52.26 C ATOM 1065 N SER B 16 19.284 2.510 -15.136 1.00 39.10 N ATOM 1066 CA SER B 16 20.190 1.558 -14.498 1.00 40.34 C ATOM 1067 C SER B 16 19.834 1.157 -13.079 1.00 36.80 C ATOM 1068 O SER B 16 20.288 0.131 -12.595 1.00 34.71 O ATOM 1069 CB SER B 16 21.611 2.125 -14.506 1.00 46.27 C ATOM 1070 OG SER B 16 21.665 3.357 -13.808 1.00 53.99 O ATOM 1071 N ARG B 17 19.026 1.966 -12.410 1.00 41.81 N ATOM 1072 CA ARG B 17 18.641 1.679 -11.034 1.00 40.71 C ATOM 1073 C ARG B 17 17.985 0.311 -10.878 1.00 38.77 C ATOM 1074 O ARG B 17 17.253 -0.132 -11.756 1.00 38.60 O ATOM 1075 CB ARG B 17 17.669 2.752 -10.541 1.00 42.71 C ATOM 1076 CG ARG B 17 17.398 2.724 -9.048 1.00 44.15 C ATOM 1077 CD ARG B 17 16.228 3.629 -8.715 1.00 43.73 C ATOM 1078 NE ARG B 17 16.370 4.955 -9.316 1.00 41.93 N ATOM 1079 CZ ARG B 17 15.366 5.811 -9.465 1.00 42.36 C ATOM 1080 NH1 ARG B 17 14.150 5.477 -9.056 1.00 47.43 N ATOM 1081 NH2 ARG B 17 15.572 6.994 -10.026 1.00 45.87 N ATOM 1082 N ASP B 18 18.279 -0.368 -9.773 1.00 35.76 N ATOM 1083 CA ASP B 18 17.648 -1.650 -9.479 1.00 37.22 C ATOM 1084 C ASP B 18 16.597 -1.250 -8.452 1.00 37.65 C ATOM 1085 O ASP B 18 16.869 -0.422 -7.579 1.00 36.45 O ATOM 1086 CB ASP B 18 18.612 -2.647 -8.822 1.00 41.49 C ATOM 1087 CG ASP B 18 19.683 -3.148 -9.766 1.00 40.03 C ATOM 1088 OD1 ASP B 18 19.359 -3.454 -10.931 1.00 41.49 O ATOM 1089 OD2 ASP B 18 20.850 -3.256 -9.327 1.00 43.63 O ATOM 1090 N TRP B 19 15.405 -1.826 -8.537 1.00 36.31 N ATOM 1091 CA TRP B 19 14.370 -1.459 -7.586 1.00 33.81 C ATOM 1092 C TRP B 19 13.778 -2.631 -6.801 1.00 35.01 C ATOM 1093 O TRP B 19 13.899 -3.801 -7.181 1.00 30.33 O ATOM 1094 CB TRP B 19 13.276 -0.645 -8.297 1.00 39.00 C ATOM 1095 CG TRP B 19 12.671 -1.346 -9.459 1.00 34.11 C ATOM 1096 CD1 TRP B 19 13.270 -1.637 -10.653 1.00 35.83 C ATOM 1097 CD2 TRP B 19 11.360 -1.913 -9.518 1.00 39.44 C ATOM 1098 NE1 TRP B 19 12.412 -2.359 -11.451 1.00 35.37 N ATOM 1099 CE2 TRP B 19 11.233 -2.547 -10.776 1.00 37.73 C ATOM 1100 CE3 TRP B 19 10.281 -1.956 -8.625 1.00 37.86 C ATOM 1101 CZ2 TRP B 19 10.065 -3.211 -11.167 1.00 34.19 C ATOM 1102 CZ3 TRP B 19 9.115 -2.617 -9.017 1.00 32.55 C ATOM 1103 CH2 TRP B 19 9.022 -3.238 -10.275 1.00 31.61 C ATOM 1104 N PHE B 20 13.140 -2.276 -5.688 1.00 36.36 N ATOM 1105 CA PHE B 20 12.549 -3.211 -4.735 1.00 32.60 C ATOM 1106 C PHE B 20 11.025 -3.324 -4.816 1.00 29.79 C ATOM 1107 O PHE B 20 10.331 -2.327 -4.994 1.00 29.33 O ATOM 1108 CB PHE B 20 12.956 -2.747 -3.326 1.00 31.77 C ATOM 1109 CG PHE B 20 12.237 -3.442 -2.199 1.00 35.63 C ATOM 1110 CD1 PHE B 20 12.650 -4.690 -1.754 1.00 35.11 C ATOM 1111 CD2 PHE B 20 11.173 -2.814 -1.544 1.00 39.46 C ATOM 1112 CE1 PHE B 20 12.022 -5.308 -0.668 1.00 32.84 C ATOM 1113 CE2 PHE B 20 10.536 -3.423 -0.455 1.00 35.66 C ATOM 1114 CZ PHE B 20 10.964 -4.672 -0.018 1.00 34.89 C ATOM 1115 N MET B 21 10.532 -4.552 -4.683 1.00 29.00 N ATOM 1116 CA MET B 21 9.098 -4.844 -4.670 1.00 31.39 C ATOM 1117 C MET B 21 8.810 -5.512 -3.316 1.00 31.55 C ATOM 1118 O MET B 21 9.441 -6.508 -2.967 1.00 30.42 O ATOM 1119 CB MET B 21 8.721 -5.822 -5.796 1.00 29.19 C ATOM 1120 CG MET B 21 8.752 -5.246 -7.208 1.00 30.55 C ATOM 1121 SD MET B 21 8.495 -6.541 -8.454 1.00 31.86 S ATOM 1122 CE MET B 21 10.135 -7.224 -8.556 1.00 34.31 C ATOM 1123 N LEU B 22 7.877 -4.956 -2.551 1.00 28.11 N ATOM 1124 CA LEU B 22 7.517 -5.536 -1.259 1.00 26.59 C ATOM 1125 C LEU B 22 6.715 -6.815 -1.490 1.00 26.66 C ATOM 1126 O LEU B 22 6.888 -7.804 -0.782 1.00 29.34 O ATOM 1127 CB LEU B 22 6.680 -4.536 -0.457 1.00 27.90 C ATOM 1128 CG LEU B 22 6.226 -4.954 0.942 1.00 31.72 C ATOM 1129 CD1 LEU B 22 7.437 -5.281 1.817 1.00 31.62 C ATOM 1130 CD2 LEU B 22 5.415 -3.823 1.550 1.00 36.81 C ATOM 1131 N MET B 23 5.833 -6.784 -2.487 1.00 29.49 N ATOM 1132 CA MET B 23 5.002 -7.936 -2.836 1.00 29.70 C ATOM 1133 C MET B 23 5.275 -8.177 -4.315 1.00 30.76 C ATOM 1134 O MET B 23 4.481 -7.800 -5.180 1.00 29.20 O ATOM 1135 CB MET B 23 3.515 -7.612 -2.612 1.00 26.12 C ATOM 1136 CG MET B 23 3.181 -7.178 -1.189 1.00 33.70 C ATOM 1137 SD MET B 23 1.398 -6.864 -0.932 1.00 30.64 S ATOM 1138 CE MET B 23 0.995 -8.197 0.210 1.00 43.70 C ATOM 1139 N PRO B 24 6.415 -8.809 -4.620 1.00 33.82 N ATOM 1140 CA PRO B 24 6.846 -9.109 -5.991 1.00 29.63 C ATOM 1141 C PRO B 24 5.820 -9.828 -6.863 1.00 29.98 C ATOM 1142 O PRO B 24 5.133 -10.743 -6.411 1.00 27.48 O ATOM 1143 CB PRO B 24 8.094 -9.973 -5.791 1.00 29.52 C ATOM 1144 CG PRO B 24 8.544 -9.658 -4.374 1.00 33.34 C ATOM 1145 CD PRO B 24 7.251 -9.527 -3.639 1.00 29.96 C ATOM 1146 N LYS B 25 5.735 -9.387 -8.113 1.00 28.05 N ATOM 1147 CA LYS B 25 4.864 -9.979 -9.116 1.00 32.17 C ATOM 1148 C LYS B 25 5.675 -9.948 -10.402 1.00 29.74 C ATOM 1149 O LYS B 25 6.195 -8.904 -10.783 1.00 31.32 O ATOM 1150 CB LYS B 25 3.571 -9.167 -9.286 1.00 32.98 C ATOM 1151 CG LYS B 25 2.563 -9.413 -8.167 1.00 28.62 C ATOM 1152 CD LYS B 25 2.161 -10.879 -8.154 1.00 34.01 C ATOM 1153 CE LYS B 25 1.581 -11.299 -6.827 1.00 37.57 C ATOM 1154 NZ LYS B 25 2.591 -11.177 -5.747 1.00 38.44 N ATOM 1155 N GLN B 26 5.807 -11.099 -11.047 1.00 30.02 N ATOM 1156 CA GLN B 26 6.562 -11.179 -12.289 1.00 35.95 C ATOM 1157 C GLN B 26 5.851 -12.117 -13.234 1.00 36.70 C ATOM 1158 O GLN B 26 5.443 -13.213 -12.845 1.00 36.96 O ATOM 1159 CB GLN B 26 7.977 -11.691 -12.025 1.00 37.07 C ATOM 1160 CG GLN B 26 8.859 -11.689 -13.252 1.00 46.32 C ATOM 1161 CD GLN B 26 10.206 -12.336 -13.002 1.00 52.83 C ATOM 1162 OE1 GLN B 26 10.944 -11.933 -12.102 1.00 58.67 O ATOM 1163 NE2 GLN B 26 10.533 -13.347 -13.799 1.00 56.87 N ATOM 1164 N LYS B 27 5.699 -11.681 -14.476 1.00 35.16 N ATOM 1165 CA LYS B 27 5.031 -12.487 -15.481 1.00 39.41 C ATOM 1166 C LYS B 27 5.805 -12.434 -16.790 1.00 38.51 C ATOM 1167 O LYS B 27 6.208 -11.364 -17.238 1.00 36.76 O ATOM 1168 CB LYS B 27 3.615 -11.961 -15.717 1.00 37.14 C ATOM 1169 CG LYS B 27 2.816 -12.704 -16.773 1.00 41.88 C ATOM 1170 CD LYS B 27 1.591 -11.895 -17.169 1.00 42.14 C ATOM 1171 CE LYS B 27 0.715 -12.626 -18.174 1.00 48.82 C ATOM 1172 NZ LYS B 27 0.123 -13.855 -17.585 1.00 50.51 N ATOM 1173 N VAL B 28 6.034 -13.600 -17.380 1.00 38.87 N ATOM 1174 CA VAL B 28 6.704 -13.677 -18.665 1.00 40.24 C ATOM 1175 C VAL B 28 5.562 -13.721 -19.666 1.00 41.17 C ATOM 1176 O VAL B 28 4.732 -14.624 -19.632 1.00 41.86 O ATOM 1177 CB VAL B 28 7.540 -14.955 -18.796 1.00 45.19 C ATOM 1178 CG1 VAL B 28 8.022 -15.113 -20.232 1.00 47.10 C ATOM 1179 CG2 VAL B 28 8.715 -14.894 -17.839 1.00 45.83 C ATOM 1180 N GLU B 29 5.487 -12.724 -20.530 1.00 38.71 N ATOM 1181 CA GLU B 29 4.419 -12.705 -21.511 1.00 41.32 C ATOM 1182 C GLU B 29 5.045 -12.650 -22.890 1.00 38.99 C ATOM 1183 O GLU B 29 5.510 -11.600 -23.328 1.00 35.01 O ATOM 1184 CB GLU B 29 3.532 -11.493 -21.287 1.00 42.87 C ATOM 1185 CG GLU B 29 2.198 -11.607 -21.970 1.00 51.49 C ATOM 1186 CD GLU B 29 1.347 -10.399 -21.721 1.00 54.73 C ATOM 1187 OE1 GLU B 29 1.740 -9.306 -22.181 1.00 55.43 O ATOM 1188 OE2 GLU B 29 0.298 -10.544 -21.061 1.00 54.06 O ATOM 1189 N GLY B 30 5.063 -13.786 -23.576 1.00 38.89 N ATOM 1190 CA GLY B 30 5.686 -13.805 -24.882 1.00 36.13 C ATOM 1191 C GLY B 30 7.166 -13.519 -24.661 1.00 33.11 C ATOM 1192 O GLY B 30 7.775 -14.105 -23.768 1.00 36.54 O ATOM 1193 N PRO B 31 7.767 -12.606 -25.434 1.00 32.50 N ATOM 1194 CA PRO B 31 9.186 -12.255 -25.311 1.00 34.01 C ATOM 1195 C PRO B 31 9.467 -11.161 -24.280 1.00 33.26 C ATOM 1196 O PRO B 31 10.590 -10.662 -24.193 1.00 29.39 O ATOM 1197 CB PRO B 31 9.532 -11.797 -26.718 1.00 32.05 C ATOM 1198 CG PRO B 31 8.297 -11.051 -27.092 1.00 32.56 C ATOM 1199 CD PRO B 31 7.182 -11.969 -26.628 1.00 35.18 C ATOM 1200 N LEU B 32 8.458 -10.799 -23.490 1.00 29.58 N ATOM 1201 CA LEU B 32 8.627 -9.742 -22.504 1.00 28.93 C ATOM 1202 C LEU B 32 8.365 -10.180 -21.076 1.00 28.89 C ATOM 1203 O LEU B 32 7.636 -11.138 -20.823 1.00 30.50 O ATOM 1204 CB LEU B 32 7.714 -8.558 -22.839 1.00 26.08 C ATOM 1205 CG LEU B 32 7.860 -7.998 -24.252 1.00 31.30 C ATOM 1206 CD1 LEU B 32 6.838 -6.890 -24.439 1.00 31.66 C ATOM 1207 CD2 LEU B 32 9.293 -7.472 -24.474 1.00 27.92 C ATOM 1208 N CYS B 33 8.974 -9.454 -20.148 1.00 27.15 N ATOM 1209 CA CYS B 33 8.830 -9.720 -18.731 1.00 26.84 C ATOM 1210 C CYS B 33 8.162 -8.520 -18.095 1.00 30.70 C ATOM 1211 O CYS B 33 8.576 -7.379 -18.315 1.00 27.89 O ATOM 1212 CB CYS B 33 10.198 -9.940 -18.088 1.00 29.48 C ATOM 1213 SG CYS B 33 10.104 -10.272 -16.310 1.00 36.92 S ATOM 1214 N ILE B 34 7.118 -8.780 -17.314 1.00 30.32 N ATOM 1215 CA ILE B 34 6.378 -7.720 -16.644 1.00 27.95 C ATOM 1216 C ILE B 34 6.540 -7.900 -15.143 1.00 24.88 C ATOM 1217 O ILE B 34 6.353 -8.992 -14.621 1.00 28.39 O ATOM 1218 CB ILE B 34 4.882 -7.788 -16.986 1.00 32.04 C ATOM 1219 CG1 ILE B 34 4.709 -7.801 -18.504 1.00 32.30 C ATOM 1220 CG2 ILE B 34 4.149 -6.590 -16.376 1.00 28.47 C ATOM 1221 CD1 ILE B 34 3.424 -8.433 -18.961 1.00 32.74 C ATOM 1222 N ARG B 35 6.907 -6.823 -14.464 1.00 26.91 N ATOM 1223 CA ARG B 35 7.081 -6.850 -13.022 1.00 27.20 C ATOM 1224 C ARG B 35 6.276 -5.724 -12.408 1.00 25.78 C ATOM 1225 O ARG B 35 6.136 -4.657 -12.992 1.00 25.53 O ATOM 1226 CB ARG B 35 8.554 -6.645 -12.640 1.00 29.61 C ATOM 1227 CG ARG B 35 9.502 -7.751 -13.042 1.00 37.36 C ATOM 1228 CD ARG B 35 10.884 -7.465 -12.459 1.00 43.22 C ATOM 1229 NE ARG B 35 11.806 -8.575 -12.659 1.00 50.88 N ATOM 1230 CZ ARG B 35 12.619 -8.690 -13.701 1.00 54.15 C ATOM 1231 NH1 ARG B 35 12.632 -7.755 -14.642 1.00 56.42 N ATOM 1232 NH2 ARG B 35 13.416 -9.748 -13.801 1.00 56.93 N ATOM 1233 N ILE B 36 5.764 -5.952 -11.210 1.00 27.03 N ATOM 1234 CA ILE B 36 5.010 -4.912 -10.540 1.00 24.42 C ATOM 1235 C ILE B 36 4.973 -5.240 -9.062 1.00 22.34 C ATOM 1236 O ILE B 36 5.064 -6.405 -8.677 1.00 24.76 O ATOM 1237 CB ILE B 36 3.559 -4.801 -11.114 1.00 30.41 C ATOM 1238 CG1 ILE B 36 2.806 -3.643 -10.431 1.00 28.23 C ATOM 1239 CG2 ILE B 36 2.835 -6.133 -10.960 1.00 29.10 C ATOM 1240 CD1 ILE B 36 1.335 -3.474 -10.884 1.00 29.73 C ATOM 1241 N ASP B 37 4.906 -4.200 -8.238 1.00 23.44 N ATOM 1242 CA ASP B 37 4.823 -4.386 -6.799 1.00 26.69 C ATOM 1243 C ASP B 37 3.334 -4.296 -6.458 1.00 24.68 C ATOM 1244 O ASP B 37 2.717 -3.246 -6.615 1.00 25.11 O ATOM 1245 CB ASP B 37 5.581 -3.287 -6.059 1.00 26.32 C ATOM 1246 CG ASP B 37 5.652 -3.530 -4.557 1.00 30.06 C ATOM 1247 OD1 ASP B 37 4.999 -4.473 -4.068 1.00 27.21 O ATOM 1248 OD2 ASP B 37 6.366 -2.774 -3.862 1.00 30.32 O ATOM 1249 N GLN B 38 2.773 -5.406 -6.012 1.00 27.03 N ATOM 1250 CA GLN B 38 1.360 -5.477 -5.639 1.00 29.75 C ATOM 1251 C GLN B 38 1.023 -4.591 -4.427 1.00 29.09 C ATOM 1252 O GLN B 38 -0.139 -4.265 -4.187 1.00 27.13 O ATOM 1253 CB GLN B 38 0.992 -6.943 -5.339 1.00 28.55 C ATOM 1254 CG GLN B 38 -0.465 -7.162 -4.916 1.00 28.47 C ATOM 1255 CD GLN B 38 -0.807 -8.621 -4.715 1.00 29.29 C ATOM 1256 OE1 GLN B 38 0.067 -9.483 -4.719 1.00 27.77 O ATOM 1257 NE2 GLN B 38 -2.092 -8.907 -4.524 1.00 29.73 N ATOM 1258 N ALA B 39 2.042 -4.185 -3.674 1.00 29.84 N ATOM 1259 CA ALA B 39 1.829 -3.362 -2.480 1.00 26.51 C ATOM 1260 C ALA B 39 1.586 -1.888 -2.778 1.00 26.80 C ATOM 1261 O ALA B 39 1.063 -1.154 -1.934 1.00 25.07 O ATOM 1262 CB ALA B 39 3.027 -3.488 -1.551 1.00 29.20 C ATOM 1263 N ILE B 40 1.966 -1.446 -3.972 1.00 24.70 N ATOM 1264 CA ILE B 40 1.823 -0.038 -4.321 1.00 27.81 C ATOM 1265 C ILE B 40 0.415 0.388 -4.717 1.00 29.18 C ATOM 1266 O ILE B 40 -0.145 -0.107 -5.700 1.00 27.03 O ATOM 1267 CB ILE B 40 2.807 0.342 -5.445 1.00 28.98 C ATOM 1268 CG1 ILE B 40 4.245 0.235 -4.922 1.00 32.52 C ATOM 1269 CG2 ILE B 40 2.522 1.756 -5.939 1.00 31.93 C ATOM 1270 CD1 ILE B 40 4.599 1.236 -3.838 1.00 29.99 C ATOM 1271 N MET B 41 -0.121 1.351 -3.967 1.00 26.17 N ATOM 1272 CA MET B 41 -1.473 1.854 -4.186 1.00 32.39 C ATOM 1273 C MET B 41 -1.593 3.363 -4.028 1.00 33.24 C ATOM 1274 O MET B 41 -0.704 4.019 -3.488 1.00 33.13 O ATOM 1275 CB MET B 41 -2.435 1.208 -3.183 1.00 30.37 C ATOM 1276 CG MET B 41 -2.404 -0.299 -3.151 1.00 37.04 C ATOM 1277 SD MET B 41 -3.698 -0.931 -2.046 1.00 40.04 S ATOM 1278 CE MET B 41 -3.007 -2.411 -1.537 1.00 31.59 C ATOM 1279 N ASP B 42 -2.712 3.894 -4.517 1.00 35.29 N ATOM 1280 CA ASP B 42 -3.058 5.310 -4.406 1.00 37.78 C ATOM 1281 C ASP B 42 -2.045 6.356 -4.829 1.00 40.37 C ATOM 1282 O ASP B 42 -2.019 7.446 -4.269 1.00 41.40 O ATOM 1283 CB ASP B 42 -3.476 5.611 -2.967 1.00 40.21 C ATOM 1284 CG ASP B 42 -4.590 4.717 -2.494 1.00 42.71 C ATOM 1285 OD1 ASP B 42 -5.654 4.708 -3.152 1.00 52.98 O ATOM 1286 OD2 ASP B 42 -4.403 4.023 -1.470 1.00 45.42 O ATOM 1287 N LYS B 43 -1.221 6.059 -5.820 1.00 34.70 N ATOM 1288 CA LYS B 43 -0.253 7.043 -6.250 1.00 35.45 C ATOM 1289 C LYS B 43 -0.458 7.450 -7.701 1.00 37.79 C ATOM 1290 O LYS B 43 -1.146 6.760 -8.463 1.00 36.57 O ATOM 1291 CB LYS B 43 1.168 6.499 -6.021 1.00 36.56 C ATOM 1292 CG LYS B 43 1.511 6.379 -4.527 1.00 38.19 C ATOM 1293 CD LYS B 43 2.781 5.585 -4.270 1.00 47.31 C ATOM 1294 CE LYS B 43 2.972 5.301 -2.777 1.00 45.04 C ATOM 1295 NZ LYS B 43 2.005 4.298 -2.198 1.00 48.66 N ATOM 1296 N ASN B 44 0.092 8.608 -8.057 1.00 35.37 N ATOM 1297 CA ASN B 44 0.034 9.095 -9.427 1.00 38.38 C ATOM 1298 C ASN B 44 1.267 8.456 -10.069 1.00 40.86 C ATOM 1299 O ASN B 44 2.398 8.738 -9.668 1.00 39.93 O ATOM 1300 CB ASN B 44 0.136 10.622 -9.463 1.00 41.38 C ATOM 1301 CG ASN B 44 -1.115 11.296 -8.936 1.00 47.01 C ATOM 1302 OD1 ASN B 44 -2.220 11.005 -9.391 1.00 46.51 O ATOM 1303 ND2 ASN B 44 -0.948 12.200 -7.976 1.00 46.47 N ATOM 1304 N ILE B 45 1.037 7.580 -11.040 1.00 38.40 N ATOM 1305 CA ILE B 45 2.115 6.856 -11.708 1.00 38.91 C ATOM 1306 C ILE B 45 2.297 7.318 -13.150 1.00 39.15 C ATOM 1307 O ILE B 45 1.321 7.547 -13.862 1.00 39.60 O ATOM 1308 CB ILE B 45 1.811 5.329 -11.711 1.00 40.15 C ATOM 1309 CG1 ILE B 45 1.583 4.833 -10.279 1.00 34.64 C ATOM 1310 CG2 ILE B 45 2.936 4.561 -12.390 1.00 37.30 C ATOM 1311 CD1 ILE B 45 2.796 4.927 -9.380 1.00 42.11 C ATOM 1312 N MET B 46 3.552 7.449 -13.578 1.00 40.69 N ATOM 1313 CA MET B 46 3.866 7.861 -14.945 1.00 38.20 C ATOM 1314 C MET B 46 4.737 6.810 -15.635 1.00 39.37 C ATOM 1315 O MET B 46 5.809 6.448 -15.136 1.00 34.93 O ATOM 1316 CB MET B 46 4.606 9.204 -14.948 1.00 37.11 C ATOM 1317 CG MET B 46 5.135 9.642 -16.322 1.00 38.51 C ATOM 1318 SD MET B 46 3.866 10.026 -17.566 1.00 42.80 S ATOM 1319 CE MET B 46 3.509 11.760 -17.175 1.00 48.17 C ATOM 1320 N LEU B 47 4.281 6.314 -16.780 1.00 35.27 N ATOM 1321 CA LEU B 47 5.067 5.324 -17.497 1.00 35.89 C ATOM 1322 C LEU B 47 6.027 6.034 -18.442 1.00 34.59 C ATOM 1323 O LEU B 47 5.615 6.861 -19.242 1.00 36.07 O ATOM 1324 CB LEU B 47 4.171 4.390 -18.313 1.00 37.46 C ATOM 1325 CG LEU B 47 3.067 3.603 -17.612 1.00 39.33 C ATOM 1326 CD1 LEU B 47 2.604 2.484 -18.547 1.00 39.11 C ATOM 1327 CD2 LEU B 47 3.572 3.022 -16.306 1.00 34.77 C ATOM 1328 N LYS B 48 7.307 5.707 -18.331 1.00 33.67 N ATOM 1329 CA LYS B 48 8.341 6.279 -19.185 1.00 33.42 C ATOM 1330 C LYS B 48 9.084 5.119 -19.847 1.00 29.80 C ATOM 1331 O LYS B 48 9.242 4.054 -19.256 1.00 29.72 O ATOM 1332 CB LYS B 48 9.319 7.115 -18.360 1.00 33.96 C ATOM 1333 CG LYS B 48 8.722 8.391 -17.796 1.00 39.08 C ATOM 1334 CD LYS B 48 9.769 9.193 -17.045 1.00 39.77 C ATOM 1335 CE LYS B 48 9.168 10.451 -16.440 1.00 42.95 C ATOM 1336 NZ LYS B 48 10.203 11.257 -15.732 1.00 46.05 N ATOM 1337 N ALA B 49 9.536 5.313 -21.076 1.00 29.86 N ATOM 1338 CA ALA B 49 10.243 4.237 -21.749 1.00 29.98 C ATOM 1339 C ALA B 49 11.353 4.735 -22.661 1.00 29.34 C ATOM 1340 O ALA B 49 11.359 5.892 -23.084 1.00 26.98 O ATOM 1341 CB ALA B 49 9.246 3.382 -22.562 1.00 24.93 C ATOM 1342 N ASN B 50 12.294 3.838 -22.937 1.00 29.01 N ATOM 1343 CA ASN B 50 13.410 4.097 -23.846 1.00 28.84 C ATOM 1344 C ASN B 50 13.181 3.064 -24.947 1.00 27.61 C ATOM 1345 O ASN B 50 13.002 1.871 -24.670 1.00 27.05 O ATOM 1346 CB ASN B 50 14.747 3.858 -23.136 1.00 32.69 C ATOM 1347 CG ASN B 50 15.138 5.014 -22.240 1.00 32.58 C ATOM 1348 OD1 ASN B 50 14.284 5.728 -21.733 1.00 35.95 O ATOM 1349 ND2 ASN B 50 16.436 5.200 -22.035 1.00 39.52 N ATOM 1350 N PHE B 51 13.160 3.513 -26.194 1.00 27.27 N ATOM 1351 CA PHE B 51 12.892 2.594 -27.280 1.00 30.22 C ATOM 1352 C PHE B 51 13.260 3.224 -28.604 1.00 31.48 C ATOM 1353 O PHE B 51 13.493 4.425 -28.692 1.00 32.29 O ATOM 1354 CB PHE B 51 11.398 2.235 -27.277 1.00 34.09 C ATOM 1355 CG PHE B 51 10.486 3.435 -27.351 1.00 35.47 C ATOM 1356 CD1 PHE B 51 10.064 3.935 -28.576 1.00 36.90 C ATOM 1357 CD2 PHE B 51 10.089 4.092 -26.193 1.00 33.04 C ATOM 1358 CE1 PHE B 51 9.260 5.077 -28.647 1.00 36.14 C ATOM 1359 CE2 PHE B 51 9.286 5.232 -26.252 1.00 37.94 C ATOM 1360 CZ PHE B 51 8.871 5.726 -27.487 1.00 38.03 C ATOM 1361 N SER B 52 13.309 2.409 -29.644 1.00 34.03 N ATOM 1362 CA SER B 52 13.635 2.936 -30.959 1.00 33.36 C ATOM 1363 C SER B 52 12.344 3.077 -31.735 1.00 35.42 C ATOM 1364 O SER B 52 11.363 2.392 -31.447 1.00 33.40 O ATOM 1365 CB SER B 52 14.576 1.985 -31.698 1.00 34.89 C ATOM 1366 OG SER B 52 13.935 0.754 -31.954 1.00 35.10 O ATOM 1367 N VAL B 53 12.338 3.978 -32.711 1.00 36.26 N ATOM 1368 CA VAL B 53 11.164 4.165 -33.537 1.00 37.93 C ATOM 1369 C VAL B 53 11.598 4.177 -34.985 1.00 42.31 C ATOM 1370 O VAL B 53 12.720 4.573 -35.315 1.00 39.82 O ATOM 1371 CB VAL B 53 10.423 5.491 -33.237 1.00 44.58 C ATOM 1372 CG1 VAL B 53 9.813 5.454 -31.841 1.00 42.46 C ATOM 1373 CG2 VAL B 53 11.375 6.654 -33.372 1.00 45.85 C ATOM 1374 N ILE B 54 10.704 3.706 -35.838 1.00 43.06 N ATOM 1375 CA ILE B 54 10.942 3.671 -37.265 1.00 48.30 C ATOM 1376 C ILE B 54 9.570 3.926 -37.883 1.00 49.18 C ATOM 1377 O ILE B 54 8.585 3.305 -37.487 1.00 50.09 O ATOM 1378 CB ILE B 54 11.524 2.289 -37.698 1.00 50.35 C ATOM 1379 CG1 ILE B 54 11.984 2.347 -39.155 1.00 53.96 C ATOM 1380 CG2 ILE B 54 10.492 1.189 -37.503 1.00 52.92 C ATOM 1381 CD1 ILE B 54 12.651 1.071 -39.631 1.00 56.91 C ATOM 1382 N PHE B 55 9.502 4.875 -38.813 1.00 52.17 N ATOM 1383 CA PHE B 55 8.248 5.218 -39.481 1.00 53.74 C ATOM 1384 C PHE B 55 7.200 5.691 -38.474 1.00 53.82 C ATOM 1385 O PHE B 55 6.043 5.271 -38.525 1.00 54.67 O ATOM 1386 CB PHE B 55 7.718 4.001 -40.251 1.00 56.12 C ATOM 1387 CG PHE B 55 8.709 3.425 -41.226 1.00 60.82 C ATOM 1388 CD1 PHE B 55 8.932 2.051 -41.279 1.00 64.50 C ATOM 1389 CD2 PHE B 55 9.436 4.255 -42.077 1.00 61.19 C ATOM 1390 CE1 PHE B 55 9.870 1.509 -42.166 1.00 64.73 C ATOM 1391 CE2 PHE B 55 10.375 3.723 -42.967 1.00 64.35 C ATOM 1392 CZ PHE B 55 10.592 2.349 -43.009 1.00 61.89 C ATOM 1393 N ASP B 56 7.614 6.568 -37.564 1.00 52.01 N ATOM 1394 CA ASP B 56 6.724 7.101 -36.534 1.00 54.10 C ATOM 1395 C ASP B 56 5.972 6.045 -35.737 1.00 52.00 C ATOM 1396 O ASP B 56 4.836 6.262 -35.313 1.00 53.29 O ATOM 1397 CB ASP B 56 5.720 8.080 -37.146 1.00 60.03 C ATOM 1398 CG ASP B 56 6.333 9.438 -37.419 1.00 62.37 C ATOM 1399 OD1 ASP B 56 6.931 10.009 -36.482 1.00 64.79 O ATOM 1400 OD2 ASP B 56 6.216 9.932 -38.562 0.50 62.93 O ATOM 1401 N ARG B 57 6.612 4.903 -35.525 1.00 49.48 N ATOM 1402 CA ARG B 57 6.000 3.824 -34.767 1.00 46.08 C ATOM 1403 C ARG B 57 7.061 3.195 -33.872 1.00 43.56 C ATOM 1404 O ARG B 57 8.229 3.120 -34.250 1.00 41.25 O ATOM 1405 CB ARG B 57 5.430 2.766 -35.716 1.00 52.75 C ATOM 1406 CG ARG B 57 4.694 1.643 -35.006 1.00 59.25 C ATOM 1407 CD ARG B 57 4.034 0.683 -35.984 1.00 63.56 C ATOM 1408 NE ARG B 57 2.802 0.134 -35.422 1.00 65.24 N ATOM 1409 CZ ARG B 57 2.001 -0.724 -36.046 1.00 68.89 C ATOM 1410 NH1 ARG B 57 2.297 -1.150 -37.268 1.00 68.69 N ATOM 1411 NH2 ARG B 57 0.894 -1.147 -35.449 1.00 66.90 N ATOM 1412 N LEU B 58 6.667 2.756 -32.683 1.00 41.39 N ATOM 1413 CA LEU B 58 7.631 2.129 -31.794 1.00 39.05 C ATOM 1414 C LEU B 58 8.081 0.850 -32.476 1.00 41.65 C ATOM 1415 O LEU B 58 7.261 0.057 -32.942 1.00 38.65 O ATOM 1416 CB LEU B 58 7.011 1.819 -30.426 1.00 36.60 C ATOM 1417 CG LEU B 58 7.934 1.089 -29.436 1.00 33.24 C ATOM 1418 CD1 LEU B 58 7.584 1.492 -28.011 1.00 36.91 C ATOM 1419 CD2 LEU B 58 7.818 -0.422 -29.635 1.00 27.54 C ATOM 1420 N GLU B 59 9.396 0.670 -32.539 1.00 40.22 N ATOM 1421 CA GLU B 59 9.996 -0.489 -33.176 1.00 38.38 C ATOM 1422 C GLU B 59 10.475 -1.519 -32.159 1.00 35.16 C ATOM 1423 O GLU B 59 10.017 -2.659 -32.145 1.00 35.58 O ATOM 1424 CB GLU B 59 11.176 -0.032 -34.045 1.00 43.91 C ATOM 1425 CG GLU B 59 12.085 -1.151 -34.523 1.00 47.92 C ATOM 1426 CD GLU B 59 13.311 -0.633 -35.258 1.00 55.63 C ATOM 1427 OE1 GLU B 59 13.960 0.314 -34.759 1.00 54.97 O ATOM 1428 OE2 GLU B 59 13.634 -1.181 -36.333 1.00 56.46 O ATOM 1429 N THR B 60 11.400 -1.102 -31.306 1.00 33.62 N ATOM 1430 CA THR B 60 11.971 -1.990 -30.302 1.00 32.17 C ATOM 1431 C THR B 60 11.993 -1.347 -28.929 1.00 31.53 C ATOM 1432 O THR B 60 12.499 -0.229 -28.759 1.00 31.90 O ATOM 1433 CB THR B 60 13.427 -2.363 -30.666 1.00 36.38 C ATOM 1434 OG1 THR B 60 13.438 -3.082 -31.905 1.00 37.22 O ATOM 1435 CG2 THR B 60 14.056 -3.223 -29.569 1.00 32.25 C ATOM 1436 N LEU B 61 11.446 -2.052 -27.946 1.00 28.61 N ATOM 1437 CA LEU B 61 11.452 -1.536 -26.588 1.00 28.33 C ATOM 1438 C LEU B 61 12.763 -1.921 -25.912 1.00 26.07 C ATOM 1439 O LEU B 61 13.198 -3.075 -25.976 1.00 27.59 O ATOM 1440 CB LEU B 61 10.286 -2.114 -25.777 1.00 26.66 C ATOM 1441 CG LEU B 61 10.300 -1.771 -24.284 1.00 25.31 C ATOM 1442 CD1 LEU B 61 10.008 -0.300 -24.108 1.00 23.76 C ATOM 1443 CD2 LEU B 61 9.254 -2.599 -23.544 1.00 29.29 C ATOM 1444 N ILE B 62 13.393 -0.952 -25.267 1.00 28.57 N ATOM 1445 CA ILE B 62 14.618 -1.231 -24.535 1.00 30.03 C ATOM 1446 C ILE B 62 14.172 -1.480 -23.097 1.00 28.61 C ATOM 1447 O ILE B 62 14.430 -2.534 -22.525 1.00 25.85 O ATOM 1448 CB ILE B 62 15.583 -0.035 -24.597 1.00 32.74 C ATOM 1449 CG1 ILE B 62 16.107 0.126 -26.029 1.00 35.42 C ATOM 1450 CG2 ILE B 62 16.733 -0.240 -23.618 1.00 31.94 C ATOM 1451 CD1 ILE B 62 16.828 1.436 -26.262 1.00 40.33 C ATOM 1452 N LEU B 63 13.462 -0.515 -22.525 1.00 27.45 N ATOM 1453 CA LEU B 63 12.969 -0.661 -21.164 1.00 26.13 C ATOM 1454 C LEU B 63 11.832 0.302 -20.879 1.00 26.06 C ATOM 1455 O LEU B 63 11.851 1.442 -21.335 1.00 28.66 O ATOM 1456 CB LEU B 63 14.099 -0.409 -20.163 1.00 25.41 C ATOM 1457 CG LEU B 63 13.762 -0.568 -18.673 1.00 31.28 C ATOM 1458 CD1 LEU B 63 13.446 -2.031 -18.360 1.00 26.14 C ATOM 1459 CD2 LEU B 63 14.934 -0.070 -17.829 1.00 30.97 C ATOM 1460 N LEU B 64 10.834 -0.164 -20.133 1.00 26.68 N ATOM 1461 CA LEU B 64 9.714 0.689 -19.752 1.00 24.74 C ATOM 1462 C LEU B 64 9.588 0.558 -18.250 1.00 23.74 C ATOM 1463 O LEU B 64 9.624 -0.547 -17.724 1.00 25.65 O ATOM 1464 CB LEU B 64 8.408 0.236 -20.425 1.00 25.13 C ATOM 1465 CG LEU B 64 7.163 1.078 -20.092 1.00 28.80 C ATOM 1466 CD1 LEU B 64 6.126 0.911 -21.193 1.00 28.53 C ATOM 1467 CD2 LEU B 64 6.594 0.671 -18.735 1.00 26.01 C ATOM 1468 N ARG B 65 9.447 1.679 -17.558 1.00 26.59 N ATOM 1469 CA ARG B 65 9.304 1.641 -16.110 1.00 28.71 C ATOM 1470 C ARG B 65 8.211 2.585 -15.650 1.00 27.74 C ATOM 1471 O ARG B 65 7.962 3.603 -16.291 1.00 28.95 O ATOM 1472 CB ARG B 65 10.634 1.998 -15.430 1.00 27.00 C ATOM 1473 CG ARG B 65 11.595 0.812 -15.385 1.00 29.10 C ATOM 1474 CD ARG B 65 12.935 1.119 -14.730 1.00 28.78 C ATOM 1475 NE ARG B 65 13.616 -0.138 -14.436 1.00 28.94 N ATOM 1476 CZ ARG B 65 14.809 -0.239 -13.856 1.00 34.52 C ATOM 1477 NH1 ARG B 65 15.481 0.849 -13.498 1.00 31.67 N ATOM 1478 NH2 ARG B 65 15.321 -1.434 -13.625 1.00 28.55 N ATOM 1479 N ALA B 66 7.572 2.236 -14.536 1.00 29.94 N ATOM 1480 CA ALA B 66 6.496 3.043 -13.966 1.00 30.56 C ATOM 1481 C ALA B 66 7.048 3.805 -12.767 1.00 28.59 C ATOM 1482 O ALA B 66 7.576 3.205 -11.833 1.00 28.78 O ATOM 1483 CB ALA B 66 5.338 2.136 -13.536 1.00 25.27 C ATOM 1484 N PHE B 67 6.920 5.128 -12.793 1.00 29.92 N ATOM 1485 CA PHE B 67 7.442 5.966 -11.715 1.00 35.73 C ATOM 1486 C PHE B 67 6.388 6.736 -10.928 1.00 34.04 C ATOM 1487 O PHE B 67 5.415 7.228 -11.495 1.00 37.25 O ATOM 1488 CB PHE B 67 8.430 6.999 -12.272 1.00 32.60 C ATOM 1489 CG PHE B 67 9.632 6.402 -12.936 1.00 35.56 C ATOM 1490 CD1 PHE B 67 9.576 5.986 -14.263 1.00 35.58 C ATOM 1491 CD2 PHE B 67 10.834 6.278 -12.239 1.00 35.03 C ATOM 1492 CE1 PHE B 67 10.700 5.457 -14.892 1.00 33.15 C ATOM 1493 CE2 PHE B 67 11.961 5.752 -12.855 1.00 37.67 C ATOM 1494 CZ PHE B 67 11.898 5.341 -14.183 1.00 32.73 C ATOM 1495 N THR B 68 6.602 6.850 -9.622 1.00 36.77 N ATOM 1496 CA THR B 68 5.702 7.619 -8.773 1.00 38.58 C ATOM 1497 C THR B 68 6.210 9.048 -8.897 1.00 41.53 C ATOM 1498 O THR B 68 7.242 9.285 -9.525 1.00 36.90 O ATOM 1499 CB THR B 68 5.788 7.193 -7.304 1.00 33.01 C ATOM 1500 OG1 THR B 68 7.079 7.533 -6.784 1.00 38.90 O ATOM 1501 CG2 THR B 68 5.578 5.692 -7.181 1.00 37.97 C ATOM 1502 N GLU B 69 5.503 10.000 -8.303 1.00 45.93 N ATOM 1503 CA GLU B 69 5.917 11.392 -8.397 1.00 47.10 C ATOM 1504 C GLU B 69 7.247 11.658 -7.715 1.00 49.05 C ATOM 1505 O GLU B 69 7.938 12.615 -8.058 1.00 52.17 O ATOM 1506 CB GLU B 69 4.843 12.301 -7.809 1.00 54.14 C ATOM 1507 CG GLU B 69 3.497 12.133 -8.472 1.00 54.13 C ATOM 1508 CD GLU B 69 2.483 13.129 -7.969 1.00 54.53 C ATOM 1509 OE1 GLU B 69 2.352 13.268 -6.737 1.00 55.69 O ATOM 1510 OE2 GLU B 69 1.812 13.768 -8.805 1.00 59.37 O ATOM 1511 N GLU B 70 7.606 10.812 -6.753 1.00 48.44 N ATOM 1512 CA GLU B 70 8.865 10.970 -6.037 1.00 49.39 C ATOM 1513 C GLU B 70 9.998 10.327 -6.832 1.00 49.72 C ATOM 1514 O GLU B 70 11.151 10.328 -6.397 1.00 47.03 O ATOM 1515 CB GLU B 70 8.790 10.307 -4.662 1.00 53.91 C ATOM 1516 CG GLU B 70 7.391 10.214 -4.064 1.00 63.26 C ATOM 1517 CD GLU B 70 6.794 11.565 -3.719 1.00 65.85 C ATOM 1518 OE1 GLU B 70 7.428 12.323 -2.951 1.00 66.76 O ATOM 1519 OE2 GLU B 70 5.683 11.865 -4.208 1.00 69.19 O ATOM 1520 N GLY B 71 9.663 9.756 -7.987 1.00 46.47 N ATOM 1521 CA GLY B 71 10.674 9.123 -8.815 1.00 39.11 C ATOM 1522 C GLY B 71 10.969 7.675 -8.467 1.00 37.04 C ATOM 1523 O GLY B 71 11.957 7.118 -8.930 1.00 37.57 O ATOM 1524 N ALA B 72 10.129 7.055 -7.646 1.00 34.30 N ATOM 1525 CA ALA B 72 10.344 5.654 -7.281 1.00 34.24 C ATOM 1526 C ALA B 72 9.742 4.726 -8.351 1.00 33.70 C ATOM 1527 O ALA B 72 8.675 5.012 -8.895 1.00 34.97 O ATOM 1528 CB ALA B 72 9.716 5.368 -5.924 1.00 35.89 C ATOM 1529 N ILE B 73 10.431 3.621 -8.641 1.00 32.56 N ATOM 1530 CA ILE B 73 9.976 2.657 -9.652 1.00 32.45 C ATOM 1531 C ILE B 73 9.037 1.637 -9.029 1.00 32.68 C ATOM 1532 O ILE B 73 9.380 1.004 -8.023 1.00 30.23 O ATOM 1533 CB ILE B 73 11.165 1.892 -10.277 1.00 28.48 C ATOM 1534 CG1 ILE B 73 12.127 2.876 -10.946 1.00 32.08 C ATOM 1535 CG2 ILE B 73 10.661 0.882 -11.299 1.00 31.56 C ATOM 1536 CD1 ILE B 73 13.500 2.288 -11.257 1.00 26.53 C ATOM 1537 N VAL B 74 7.856 1.462 -9.619 1.00 29.67 N ATOM 1538 CA VAL B 74 6.903 0.506 -9.062 1.00 32.53 C ATOM 1539 C VAL B 74 6.521 -0.636 -10.003 1.00 31.59 C ATOM 1540 O VAL B 74 5.825 -1.566 -9.602 1.00 31.64 O ATOM 1541 CB VAL B 74 5.620 1.223 -8.575 1.00 31.25 C ATOM 1542 CG1 VAL B 74 5.981 2.255 -7.499 1.00 32.83 C ATOM 1543 CG2 VAL B 74 4.915 1.898 -9.742 1.00 28.10 C ATOM 1544 N GLY B 75 6.993 -0.567 -11.245 1.00 30.74 N ATOM 1545 CA GLY B 75 6.707 -1.609 -12.217 1.00 28.36 C ATOM 1546 C GLY B 75 7.588 -1.435 -13.437 1.00 30.38 C ATOM 1547 O GLY B 75 8.156 -0.359 -13.652 1.00 27.96 O ATOM 1548 N GLU B 76 7.729 -2.486 -14.235 1.00 26.36 N ATOM 1549 CA GLU B 76 8.550 -2.373 -15.429 1.00 30.07 C ATOM 1550 C GLU B 76 8.272 -3.478 -16.438 1.00 26.87 C ATOM 1551 O GLU B 76 7.722 -4.525 -16.100 1.00 28.26 O ATOM 1552 CB GLU B 76 10.043 -2.375 -15.049 1.00 30.25 C ATOM 1553 CG GLU B 76 10.752 -3.700 -15.251 1.00 36.43 C ATOM 1554 CD GLU B 76 12.207 -3.716 -14.742 1.00 39.11 C ATOM 1555 OE1 GLU B 76 12.792 -2.641 -14.466 1.00 34.43 O ATOM 1556 OE2 GLU B 76 12.763 -4.826 -14.626 1.00 38.09 O ATOM 1557 N ILE B 77 8.631 -3.207 -17.690 1.00 26.59 N ATOM 1558 CA ILE B 77 8.484 -4.171 -18.764 1.00 29.89 C ATOM 1559 C ILE B 77 9.854 -4.205 -19.429 1.00 30.81 C ATOM 1560 O ILE B 77 10.381 -3.166 -19.820 1.00 30.25 O ATOM 1561 CB ILE B 77 7.414 -3.731 -19.787 1.00 29.88 C ATOM 1562 CG1 ILE B 77 6.050 -3.615 -19.094 1.00 28.52 C ATOM 1563 CG2 ILE B 77 7.319 -4.752 -20.916 1.00 29.63 C ATOM 1564 CD1 ILE B 77 4.951 -3.024 -19.985 1.00 27.61 C ATOM 1565 N SER B 78 10.445 -5.390 -19.514 1.00 31.46 N ATOM 1566 CA SER B 78 11.756 -5.530 -20.137 1.00 33.86 C ATOM 1567 C SER B 78 11.800 -6.750 -21.036 1.00 32.02 C ATOM 1568 O SER B 78 11.120 -7.748 -20.786 1.00 31.52 O ATOM 1569 CB SER B 78 12.854 -5.637 -19.071 1.00 31.54 C ATOM 1570 OG SER B 78 12.576 -6.682 -18.160 1.00 43.52 O ATOM 1571 N PRO B 79 12.591 -6.675 -22.116 1.00 30.80 N ATOM 1572 CA PRO B 79 12.714 -7.793 -23.054 1.00 33.17 C ATOM 1573 C PRO B 79 13.483 -8.937 -22.411 1.00 34.19 C ATOM 1574 O PRO B 79 14.397 -8.704 -21.626 1.00 38.90 O ATOM 1575 CB PRO B 79 13.482 -7.182 -24.229 1.00 35.03 C ATOM 1576 CG PRO B 79 13.107 -5.731 -24.165 1.00 36.12 C ATOM 1577 CD PRO B 79 13.185 -5.452 -22.678 1.00 31.25 C ATOM 1578 N LEU B 80 13.100 -10.165 -22.739 1.00 34.79 N ATOM 1579 CA LEU B 80 13.765 -11.350 -22.213 1.00 39.99 C ATOM 1580 C LEU B 80 14.933 -11.677 -23.137 1.00 43.92 C ATOM 1581 O LEU B 80 14.772 -11.758 -24.356 1.00 38.46 O ATOM 1582 CB LEU B 80 12.806 -12.534 -22.184 1.00 41.39 C ATOM 1583 CG LEU B 80 11.613 -12.437 -21.234 1.00 45.50 C ATOM 1584 CD1 LEU B 80 10.655 -13.573 -21.514 1.00 46.47 C ATOM 1585 CD2 LEU B 80 12.105 -12.491 -19.795 1.00 47.88 C ATOM 1586 N PRO B 81 16.124 -11.881 -22.559 1.00 48.44 N ATOM 1587 CA PRO B 81 17.356 -12.202 -23.291 1.00 52.03 C ATOM 1588 C PRO B 81 17.216 -13.365 -24.271 1.00 53.65 C ATOM 1589 O PRO B 81 17.605 -13.261 -25.437 1.00 56.04 O ATOM 1590 CB PRO B 81 18.345 -12.529 -22.173 1.00 51.71 C ATOM 1591 CG PRO B 81 17.849 -11.694 -21.031 1.00 54.39 C ATOM 1592 CD PRO B 81 16.359 -11.915 -21.106 1.00 47.99 C ATOM 1593 N SER B 82 16.652 -14.467 -23.784 1.00 55.34 N ATOM 1594 CA SER B 82 16.478 -15.678 -24.578 1.00 55.49 C ATOM 1595 C SER B 82 15.542 -15.565 -25.775 1.00 56.56 C ATOM 1596 O SER B 82 15.170 -16.578 -26.372 1.00 57.57 O ATOM 1597 CB SER B 82 15.995 -16.815 -23.683 1.00 56.41 C ATOM 1598 OG SER B 82 14.708 -16.528 -23.170 1.00 60.73 O ATOM 1599 N PHE B 83 15.142 -14.349 -26.126 1.00 53.88 N ATOM 1600 CA PHE B 83 14.268 -14.170 -27.276 1.00 50.95 C ATOM 1601 C PHE B 83 14.961 -13.315 -28.316 1.00 49.92 C ATOM 1602 O PHE B 83 15.634 -12.343 -27.985 1.00 47.99 O ATOM 1603 CB PHE B 83 12.939 -13.544 -26.858 1.00 50.88 C ATOM 1604 CG PHE B 83 11.932 -14.545 -26.365 1.00 54.57 C ATOM 1605 CD1 PHE B 83 11.024 -15.127 -27.243 1.00 56.11 C ATOM 1606 CD2 PHE B 83 11.906 -14.925 -25.026 1.00 57.39 C ATOM 1607 CE1 PHE B 83 10.101 -16.073 -26.798 1.00 57.96 C ATOM 1608 CE2 PHE B 83 10.990 -15.871 -24.568 1.00 55.54 C ATOM 1609 CZ PHE B 83 10.084 -16.447 -25.458 1.00 60.19 C ATOM 1610 N PRO B 84 14.813 -13.678 -29.596 1.00 50.34 N ATOM 1611 CA PRO B 84 15.442 -12.930 -30.687 1.00 49.40 C ATOM 1612 C PRO B 84 14.835 -11.542 -30.896 1.00 51.35 C ATOM 1613 O PRO B 84 15.467 -10.669 -31.495 1.00 49.71 O ATOM 1614 CB PRO B 84 15.243 -13.848 -31.887 1.00 51.23 C ATOM 1615 CG PRO B 84 13.906 -14.470 -31.595 1.00 54.07 C ATOM 1616 CD PRO B 84 13.997 -14.793 -30.113 1.00 47.44 C ATOM 1617 N GLY B 85 13.614 -11.339 -30.400 1.00 46.17 N ATOM 1618 CA GLY B 85 12.973 -10.045 -30.556 1.00 40.67 C ATOM 1619 C GLY B 85 11.507 -10.010 -30.150 1.00 38.51 C ATOM 1620 O GLY B 85 10.976 -10.980 -29.626 1.00 36.25 O ATOM 1621 N HIS B 86 10.856 -8.878 -30.392 1.00 37.47 N ATOM 1622 CA HIS B 86 9.445 -8.708 -30.057 1.00 37.32 C ATOM 1623 C HIS B 86 8.865 -7.640 -30.974 1.00 36.69 C ATOM 1624 O HIS B 86 9.601 -6.976 -31.705 1.00 35.59 O ATOM 1625 CB HIS B 86 9.302 -8.252 -28.604 1.00 32.86 C ATOM 1626 CG HIS B 86 10.002 -6.960 -28.318 1.00 31.96 C ATOM 1627 ND1 HIS B 86 11.278 -6.905 -27.797 1.00 29.51 N ATOM 1628 CD2 HIS B 86 9.627 -5.675 -28.534 1.00 26.95 C ATOM 1629 CE1 HIS B 86 11.660 -5.642 -27.707 1.00 33.33 C ATOM 1630 NE2 HIS B 86 10.676 -4.876 -28.147 1.00 31.58 N ATOM 1631 N THR B 87 7.551 -7.456 -30.928 1.00 36.59 N ATOM 1632 CA THR B 87 6.909 -6.448 -31.769 1.00 37.95 C ATOM 1633 C THR B 87 6.136 -5.436 -30.921 1.00 36.96 C ATOM 1634 O THR B 87 5.934 -5.642 -29.720 1.00 33.09 O ATOM 1635 CB THR B 87 5.915 -7.091 -32.746 1.00 39.91 C ATOM 1636 OG1 THR B 87 4.737 -7.473 -32.027 1.00 44.49 O ATOM 1637 CG2 THR B 87 6.523 -8.336 -33.393 1.00 38.48 C ATOM 1638 N ILE B 88 5.703 -4.346 -31.550 1.00 34.22 N ATOM 1639 CA ILE B 88 4.930 -3.322 -30.853 1.00 36.21 C ATOM 1640 C ILE B 88 3.690 -3.991 -30.265 1.00 34.96 C ATOM 1641 O ILE B 88 3.108 -3.526 -29.281 1.00 34.63 O ATOM 1642 CB ILE B 88 4.470 -2.202 -31.816 1.00 38.98 C ATOM 1643 CG1 ILE B 88 3.671 -1.155 -31.036 1.00 37.80 C ATOM 1644 CG2 ILE B 88 3.593 -2.789 -32.936 1.00 37.61 C ATOM 1645 CD1 ILE B 88 3.290 0.057 -31.848 1.00 36.79 C ATOM 1646 N GLU B 89 3.288 -5.092 -30.886 1.00 35.15 N ATOM 1647 CA GLU B 89 2.125 -5.839 -30.427 1.00 35.90 C ATOM 1648 C GLU B 89 2.404 -6.515 -29.081 1.00 34.11 C ATOM 1649 O GLU B 89 1.524 -6.597 -28.218 1.00 30.19 O ATOM 1650 CB GLU B 89 1.724 -6.875 -31.481 1.00 40.31 C ATOM 1651 CG GLU B 89 1.118 -8.139 -30.893 1.00 45.14 C ATOM 1652 CD GLU B 89 -0.160 -8.569 -31.592 1.00 53.24 C ATOM 1653 OE1 GLU B 89 -0.134 -9.581 -32.328 1.00 54.29 O ATOM 1654 OE2 GLU B 89 -1.193 -7.890 -31.408 1.00 53.00 O ATOM 1655 N ASP B 90 3.622 -7.012 -28.903 1.00 30.04 N ATOM 1656 CA ASP B 90 3.981 -7.639 -27.640 1.00 28.54 C ATOM 1657 C ASP B 90 4.048 -6.547 -26.587 1.00 24.55 C ATOM 1658 O ASP B 90 3.671 -6.753 -25.432 1.00 29.20 O ATOM 1659 CB ASP B 90 5.347 -8.318 -27.737 1.00 30.31 C ATOM 1660 CG ASP B 90 5.342 -9.494 -28.678 1.00 35.57 C ATOM 1661 OD1 ASP B 90 4.503 -10.397 -28.483 1.00 34.03 O ATOM 1662 OD2 ASP B 90 6.177 -9.511 -29.603 1.00 40.85 O ATOM 1663 N VAL B 91 4.545 -5.385 -26.992 1.00 26.23 N ATOM 1664 CA VAL B 91 4.673 -4.260 -26.079 1.00 28.62 C ATOM 1665 C VAL B 91 3.292 -3.821 -25.600 1.00 28.95 C ATOM 1666 O VAL B 91 3.072 -3.621 -24.410 1.00 26.46 O ATOM 1667 CB VAL B 91 5.394 -3.082 -26.756 1.00 29.49 C ATOM 1668 CG1 VAL B 91 5.441 -1.884 -25.821 1.00 26.26 C ATOM 1669 CG2 VAL B 91 6.815 -3.500 -27.135 1.00 34.17 C ATOM 1670 N LYS B 92 2.353 -3.689 -26.528 1.00 29.48 N ATOM 1671 CA LYS B 92 1.002 -3.281 -26.157 1.00 28.08 C ATOM 1672 C LYS B 92 0.343 -4.277 -25.203 1.00 26.34 C ATOM 1673 O LYS B 92 -0.327 -3.876 -24.254 1.00 27.63 O ATOM 1674 CB LYS B 92 0.154 -3.097 -27.414 1.00 26.45 C ATOM 1675 CG LYS B 92 0.472 -1.828 -28.173 1.00 31.31 C ATOM 1676 CD LYS B 92 -0.091 -1.897 -29.582 1.00 38.32 C ATOM 1677 CE LYS B 92 0.098 -0.592 -30.293 1.00 42.03 C ATOM 1678 NZ LYS B 92 -0.734 0.441 -29.639 1.00 50.98 N ATOM 1679 N ASN B 93 0.524 -5.576 -25.446 1.00 25.75 N ATOM 1680 CA ASN B 93 -0.053 -6.586 -24.559 1.00 22.70 C ATOM 1681 C ASN B 93 0.470 -6.380 -23.135 1.00 25.81 C ATOM 1682 O ASN B 93 -0.304 -6.350 -22.164 1.00 24.27 O ATOM 1683 CB ASN B 93 0.334 -8.014 -24.988 1.00 27.78 C ATOM 1684 CG ASN B 93 -0.290 -8.434 -26.309 1.00 31.37 C ATOM 1685 OD1 ASN B 93 -1.324 -7.908 -26.726 1.00 32.38 O ATOM 1686 ND2 ASN B 93 0.331 -9.411 -26.963 1.00 32.76 N ATOM 1687 N ALA B 94 1.794 -6.258 -23.023 1.00 25.10 N ATOM 1688 CA ALA B 94 2.461 -6.075 -21.735 1.00 24.25 C ATOM 1689 C ALA B 94 2.070 -4.774 -21.045 1.00 21.64 C ATOM 1690 O ALA B 94 1.887 -4.756 -19.829 1.00 24.32 O ATOM 1691 CB ALA B 94 3.989 -6.137 -21.912 1.00 30.80 C ATOM 1692 N ILE B 95 1.953 -3.688 -21.799 1.00 22.75 N ATOM 1693 CA ILE B 95 1.552 -2.419 -21.199 1.00 26.69 C ATOM 1694 C ILE B 95 0.131 -2.531 -20.622 1.00 28.45 C ATOM 1695 O ILE B 95 -0.159 -2.005 -19.549 1.00 29.82 O ATOM 1696 CB ILE B 95 1.623 -1.258 -22.229 1.00 25.81 C ATOM 1697 CG1 ILE B 95 3.094 -0.915 -22.505 1.00 28.19 C ATOM 1698 CG2 ILE B 95 0.908 -0.021 -21.687 1.00 26.15 C ATOM 1699 CD1 ILE B 95 3.287 0.171 -23.535 1.00 28.54 C ATOM 1700 N GLY B 96 -0.748 -3.230 -21.331 1.00 28.16 N ATOM 1701 CA GLY B 96 -2.099 -3.407 -20.833 1.00 27.66 C ATOM 1702 C GLY B 96 -2.110 -4.155 -19.507 1.00 29.02 C ATOM 1703 O GLY B 96 -2.859 -3.798 -18.606 1.00 30.59 O ATOM 1704 N VAL B 97 -1.289 -5.198 -19.377 1.00 31.07 N ATOM 1705 CA VAL B 97 -1.237 -5.957 -18.126 1.00 27.06 C ATOM 1706 C VAL B 97 -0.697 -5.089 -16.992 1.00 26.89 C ATOM 1707 O VAL B 97 -1.238 -5.104 -15.879 1.00 27.42 O ATOM 1708 CB VAL B 97 -0.346 -7.212 -18.243 1.00 30.88 C ATOM 1709 CG1 VAL B 97 -0.128 -7.833 -16.861 1.00 27.40 C ATOM 1710 CG2 VAL B 97 -0.989 -8.221 -19.171 1.00 26.94 C ATOM 1711 N LEU B 98 0.363 -4.333 -17.274 1.00 26.91 N ATOM 1712 CA LEU B 98 0.965 -3.457 -16.266 1.00 28.88 C ATOM 1713 C LEU B 98 0.011 -2.342 -15.826 1.00 27.68 C ATOM 1714 O LEU B 98 -0.184 -2.120 -14.630 1.00 27.82 O ATOM 1715 CB LEU B 98 2.266 -2.828 -16.799 1.00 26.59 C ATOM 1716 CG LEU B 98 2.947 -1.776 -15.907 1.00 28.07 C ATOM 1717 CD1 LEU B 98 3.317 -2.383 -14.575 1.00 25.98 C ATOM 1718 CD2 LEU B 98 4.196 -1.240 -16.596 1.00 25.33 C ATOM 1719 N ILE B 99 -0.565 -1.632 -16.790 1.00 26.81 N ATOM 1720 CA ILE B 99 -1.491 -0.550 -16.480 1.00 26.44 C ATOM 1721 C ILE B 99 -2.706 -1.090 -15.729 1.00 28.54 C ATOM 1722 O ILE B 99 -3.222 -0.435 -14.814 1.00 26.67 O ATOM 1723 CB ILE B 99 -1.975 0.156 -17.760 1.00 30.92 C ATOM 1724 CG1 ILE B 99 -0.843 1.019 -18.336 1.00 26.21 C ATOM 1725 CG2 ILE B 99 -3.219 0.988 -17.457 1.00 30.22 C ATOM 1726 CD1 ILE B 99 -1.239 1.810 -19.595 1.00 25.93 C ATOM 1727 N GLY B 100 -3.153 -2.285 -16.120 1.00 28.50 N ATOM 1728 CA GLY B 100 -4.304 -2.896 -15.475 1.00 30.99 C ATOM 1729 C GLY B 100 -4.060 -3.189 -14.003 1.00 32.04 C ATOM 1730 O GLY B 100 -4.950 -3.001 -13.168 1.00 28.32 O ATOM 1731 N GLY B 101 -2.858 -3.656 -13.676 1.00 25.08 N ATOM 1732 CA GLY B 101 -2.544 -3.949 -12.286 1.00 28.09 C ATOM 1733 C GLY B 101 -2.452 -2.677 -11.457 1.00 30.44 C ATOM 1734 O GLY B 101 -2.945 -2.629 -10.332 1.00 30.71 O ATOM 1735 N LEU B 102 -1.829 -1.641 -12.013 1.00 29.07 N ATOM 1736 CA LEU B 102 -1.688 -0.369 -11.312 1.00 27.97 C ATOM 1737 C LEU B 102 -3.069 0.261 -11.061 1.00 32.02 C ATOM 1738 O LEU B 102 -3.347 0.749 -9.962 1.00 30.18 O ATOM 1739 CB LEU B 102 -0.815 0.584 -12.125 1.00 26.69 C ATOM 1740 CG LEU B 102 0.675 0.206 -12.260 1.00 27.35 C ATOM 1741 CD1 LEU B 102 1.336 1.122 -13.281 1.00 25.35 C ATOM 1742 CD2 LEU B 102 1.372 0.309 -10.904 1.00 27.46 C ATOM 1743 N GLU B 103 -3.926 0.251 -12.081 1.00 25.70 N ATOM 1744 CA GLU B 103 -5.280 0.800 -11.957 1.00 30.67 C ATOM 1745 C GLU B 103 -6.043 0.002 -10.915 1.00 28.47 C ATOM 1746 O GLU B 103 -6.735 0.564 -10.072 1.00 33.62 O ATOM 1747 CB GLU B 103 -6.051 0.705 -13.282 1.00 29.83 C ATOM 1748 CG GLU B 103 -5.498 1.520 -14.423 1.00 37.51 C ATOM 1749 CD GLU B 103 -6.315 1.334 -15.694 1.00 41.66 C ATOM 1750 OE1 GLU B 103 -6.773 0.195 -15.954 1.00 41.79 O ATOM 1751 OE2 GLU B 103 -6.489 2.324 -16.430 1.00 41.72 O ATOM 1752 N TRP B 104 -5.920 -1.318 -10.979 1.00 28.03 N ATOM 1753 CA TRP B 104 -6.612 -2.159 -10.033 1.00 30.73 C ATOM 1754 C TRP B 104 -6.264 -1.788 -8.597 1.00 30.83 C ATOM 1755 O TRP B 104 -7.111 -1.887 -7.713 1.00 23.84 O ATOM 1756 CB TRP B 104 -6.277 -3.626 -10.266 1.00 30.22 C ATOM 1757 CG TRP B 104 -7.364 -4.499 -9.770 1.00 37.90 C ATOM 1758 CD1 TRP B 104 -8.625 -4.622 -10.297 1.00 41.03 C ATOM 1759 CD2 TRP B 104 -7.335 -5.326 -8.613 1.00 40.24 C ATOM 1760 NE1 TRP B 104 -9.380 -5.469 -9.531 1.00 38.07 N ATOM 1761 CE2 TRP B 104 -8.614 -5.914 -8.486 1.00 41.38 C ATOM 1762 CE3 TRP B 104 -6.356 -5.618 -7.656 1.00 36.57 C ATOM 1763 CZ2 TRP B 104 -8.933 -6.790 -7.453 1.00 44.01 C ATOM 1764 CZ3 TRP B 104 -6.674 -6.487 -6.629 1.00 43.34 C ATOM 1765 CH2 TRP B 104 -7.955 -7.059 -6.530 1.00 47.28 C ATOM 1766 N ASN B 105 -5.010 -1.395 -8.369 1.00 27.66 N ATOM 1767 CA ASN B 105 -4.544 -0.993 -7.037 1.00 31.19 C ATOM 1768 C ASN B 105 -4.782 0.493 -6.761 1.00 30.79 C ATOM 1769 O ASN B 105 -4.121 1.105 -5.917 1.00 32.75 O ATOM 1770 CB ASN B 105 -3.052 -1.323 -6.863 1.00 35.05 C ATOM 1771 CG ASN B 105 -2.825 -2.683 -6.216 1.00 32.29 C ATOM 1772 OD1 ASN B 105 -3.769 -3.333 -5.788 1.00 32.90 O ATOM 1773 ND2 ASN B 105 -1.567 -3.110 -6.134 1.00 31.65 N ATOM 1774 N ASP B 106 -5.738 1.064 -7.486 1.00 35.22 N ATOM 1775 CA ASP B 106 -6.132 2.463 -7.345 1.00 32.25 C ATOM 1776 C ASP B 106 -5.069 3.527 -7.567 1.00 38.23 C ATOM 1777 O ASP B 106 -5.071 4.576 -6.911 1.00 32.67 O ATOM 1778 CB ASP B 106 -6.812 2.680 -5.987 1.00 36.23 C ATOM 1779 CG ASP B 106 -8.098 1.881 -5.859 1.00 43.01 C ATOM 1780 OD1 ASP B 106 -8.939 1.985 -6.776 1.00 40.09 O ATOM 1781 OD2 ASP B 106 -8.270 1.150 -4.858 1.00 47.33 O ATOM 1782 N ASN B 107 -4.155 3.255 -8.490 1.00 33.01 N ATOM 1783 CA ASN B 107 -3.141 4.229 -8.835 1.00 33.34 C ATOM 1784 C ASN B 107 -3.675 4.928 -10.077 1.00 33.13 C ATOM 1785 O ASN B 107 -4.374 4.317 -10.886 1.00 33.06 O ATOM 1786 CB ASN B 107 -1.812 3.539 -9.174 1.00 29.29 C ATOM 1787 CG ASN B 107 -1.196 2.847 -7.978 1.00 26.38 C ATOM 1788 OD1 ASN B 107 -0.732 3.495 -7.032 1.00 26.61 O ATOM 1789 ND2 ASN B 107 -1.197 1.521 -8.004 1.00 25.45 N ATOM 1790 N THR B 108 -3.373 6.212 -10.212 1.00 33.83 N ATOM 1791 CA THR B 108 -3.776 6.974 -11.381 1.00 34.85 C ATOM 1792 C THR B 108 -2.588 6.841 -12.332 1.00 36.70 C ATOM 1793 O THR B 108 -1.467 7.222 -11.984 1.00 37.04 O ATOM 1794 CB THR B 108 -4.016 8.448 -11.008 1.00 39.78 C ATOM 1795 OG1 THR B 108 -5.160 8.533 -10.147 1.00 43.01 O ATOM 1796 CG2 THR B 108 -4.260 9.285 -12.247 1.00 41.95 C ATOM 1797 N VAL B 109 -2.826 6.295 -13.522 1.00 35.87 N ATOM 1798 CA VAL B 109 -1.748 6.072 -14.481 1.00 35.99 C ATOM 1799 C VAL B 109 -1.704 6.962 -15.712 1.00 36.99 C ATOM 1800 O VAL B 109 -2.668 7.037 -16.466 1.00 40.87 O ATOM 1801 CB VAL B 109 -1.748 4.604 -14.987 1.00 32.76 C ATOM 1802 CG1 VAL B 109 -0.546 4.372 -15.915 1.00 36.02 C ATOM 1803 CG2 VAL B 109 -1.709 3.647 -13.815 1.00 29.58 C ATOM 1804 N ARG B 110 -0.564 7.616 -15.918 1.00 37.31 N ATOM 1805 CA ARG B 110 -0.346 8.460 -17.092 1.00 41.00 C ATOM 1806 C ARG B 110 0.779 7.826 -17.916 1.00 42.01 C ATOM 1807 O ARG B 110 1.618 7.103 -17.378 1.00 39.73 O ATOM 1808 CB ARG B 110 0.068 9.882 -16.693 1.00 40.73 C ATOM 1809 CG ARG B 110 -1.078 10.771 -16.208 1.00 49.76 C ATOM 1810 CD ARG B 110 -0.550 12.095 -15.654 1.00 54.72 C ATOM 1811 NE ARG B 110 -0.292 13.105 -16.682 1.00 62.11 N ATOM 1812 CZ ARG B 110 0.570 14.112 -16.540 1.00 63.83 C ATOM 1813 NH1 ARG B 110 1.270 14.238 -15.418 1.00 63.93 N ATOM 1814 NH2 ARG B 110 0.718 15.007 -17.508 1.00 64.80 N ATOM 1815 N VAL B 111 0.795 8.109 -19.213 1.00 41.63 N ATOM 1816 CA VAL B 111 1.812 7.569 -20.110 1.00 42.39 C ATOM 1817 C VAL B 111 2.567 8.733 -20.745 1.00 42.84 C ATOM 1818 O VAL B 111 1.968 9.762 -21.065 1.00 40.16 O ATOM 1819 CB VAL B 111 1.151 6.686 -21.201 1.00 46.23 C ATOM 1820 CG1 VAL B 111 2.161 6.279 -22.244 1.00 49.65 C ATOM 1821 CG2 VAL B 111 0.559 5.441 -20.555 1.00 40.79 C ATOM 1822 N SER B 112 3.879 8.581 -20.914 1.00 38.39 N ATOM 1823 CA SER B 112 4.691 9.643 -21.498 1.00 36.66 C ATOM 1824 C SER B 112 4.137 10.046 -22.865 1.00 38.75 C ATOM 1825 O SER B 112 3.547 9.222 -23.570 1.00 35.65 O ATOM 1826 CB SER B 112 6.147 9.182 -21.643 1.00 34.39 C ATOM 1827 OG SER B 112 6.276 8.239 -22.692 1.00 34.93 O ATOM 1828 N LYS B 113 4.319 11.312 -23.235 1.00 37.30 N ATOM 1829 CA LYS B 113 3.834 11.790 -24.524 1.00 41.34 C ATOM 1830 C LYS B 113 4.468 11.012 -25.669 1.00 38.32 C ATOM 1831 O LYS B 113 3.825 10.784 -26.687 1.00 40.33 O ATOM 1832 CB LYS B 113 4.125 13.281 -24.702 1.00 44.80 C ATOM 1833 CG LYS B 113 3.400 14.176 -23.710 1.00 53.93 C ATOM 1834 CD LYS B 113 3.402 15.624 -24.192 1.00 57.18 C ATOM 1835 CE LYS B 113 2.843 16.571 -23.137 1.00 59.18 C ATOM 1836 NZ LYS B 113 3.705 16.612 -21.917 1.00 60.87 N ATOM 1837 N THR B 114 5.726 10.606 -25.511 1.00 37.33 N ATOM 1838 CA THR B 114 6.386 9.836 -26.564 1.00 37.37 C ATOM 1839 C THR B 114 5.743 8.459 -26.694 1.00 32.84 C ATOM 1840 O THR B 114 5.523 7.978 -27.797 1.00 36.76 O ATOM 1841 CB THR B 114 7.893 9.641 -26.296 1.00 37.77 C ATOM 1842 OG1 THR B 114 8.080 8.965 -25.044 1.00 40.67 O ATOM 1843 CG2 THR B 114 8.609 10.985 -26.283 1.00 41.02 C ATOM 1844 N LEU B 115 5.458 7.818 -25.568 1.00 37.53 N ATOM 1845 CA LEU B 115 4.819 6.509 -25.602 1.00 36.90 C ATOM 1846 C LEU B 115 3.436 6.650 -26.232 1.00 40.97 C ATOM 1847 O LEU B 115 3.036 5.834 -27.057 1.00 41.16 O ATOM 1848 CB LEU B 115 4.674 5.938 -24.193 1.00 38.70 C ATOM 1849 CG LEU B 115 5.806 5.061 -23.658 1.00 34.39 C ATOM 1850 CD1 LEU B 115 5.589 4.803 -22.179 1.00 35.37 C ATOM 1851 CD2 LEU B 115 5.846 3.747 -24.448 1.00 29.17 C ATOM 1852 N GLN B 116 2.706 7.688 -25.839 1.00 43.67 N ATOM 1853 CA GLN B 116 1.372 7.913 -26.388 1.00 46.08 C ATOM 1854 C GLN B 116 1.458 8.095 -27.891 1.00 45.28 C ATOM 1855 O GLN B 116 0.650 7.553 -28.638 1.00 47.33 O ATOM 1856 CB GLN B 116 0.733 9.162 -25.777 1.00 46.18 C ATOM 1857 CG GLN B 116 0.473 9.065 -24.286 1.00 51.63 C ATOM 1858 CD GLN B 116 -0.269 10.273 -23.747 1.00 58.75 C ATOM 1859 OE1 GLN B 116 -1.420 10.518 -24.109 1.00 62.48 O ATOM 1860 NE2 GLN B 116 0.389 11.038 -22.881 1.00 55.91 N ATOM 1861 N ARG B 117 2.453 8.854 -28.331 1.00 46.39 N ATOM 1862 CA ARG B 117 2.622 9.115 -29.754 1.00 48.65 C ATOM 1863 C ARG B 117 3.119 7.942 -30.588 1.00 49.15 C ATOM 1864 O ARG B 117 2.575 7.654 -31.652 1.00 48.41 O ATOM 1865 CB ARG B 117 3.578 10.281 -29.977 1.00 49.48 C ATOM 1866 CG ARG B 117 3.842 10.527 -31.452 1.00 54.92 C ATOM 1867 CD ARG B 117 4.938 11.541 -31.703 1.00 58.05 C ATOM 1868 NE ARG B 117 5.109 11.756 -33.137 1.00 63.34 N ATOM 1869 CZ ARG B 117 6.057 12.511 -33.682 1.00 64.26 C ATOM 1870 NH1 ARG B 117 6.938 13.139 -32.913 1.00 61.50 N ATOM 1871 NH2 ARG B 117 6.122 12.638 -35.003 1.00 65.62 N ATOM 1872 N PHE B 118 4.155 7.268 -30.108 1.00 48.06 N ATOM 1873 CA PHE B 118 4.740 6.175 -30.868 1.00 47.91 C ATOM 1874 C PHE B 118 4.164 4.794 -30.634 1.00 48.14 C ATOM 1875 O PHE B 118 4.298 3.914 -31.485 1.00 47.93 O ATOM 1876 CB PHE B 118 6.251 6.176 -30.657 1.00 44.63 C ATOM 1877 CG PHE B 118 6.915 7.428 -31.158 1.00 46.83 C ATOM 1878 CD1 PHE B 118 6.822 7.786 -32.499 1.00 49.17 C ATOM 1879 CD2 PHE B 118 7.614 8.258 -30.291 1.00 45.50 C ATOM 1880 CE1 PHE B 118 7.413 8.952 -32.970 1.00 47.80 C ATOM 1881 CE2 PHE B 118 8.208 9.425 -30.749 1.00 48.03 C ATOM 1882 CZ PHE B 118 8.108 9.774 -32.093 1.00 51.71 C ATOM 1883 N ALA B 119 3.531 4.593 -29.487 1.00 48.32 N ATOM 1884 CA ALA B 119 2.921 3.307 -29.204 1.00 53.21 C ATOM 1885 C ALA B 119 1.430 3.417 -29.533 1.00 57.74 C ATOM 1886 O ALA B 119 0.683 2.458 -29.369 1.00 60.08 O ATOM 1887 CB ALA B 119 3.128 2.928 -27.746 1.00 52.88 C ATOM 1888 N TRP B 120 1.019 4.597 -30.004 1.00 59.99 N ATOM 1889 CA TRP B 120 -0.370 4.891 -30.391 1.00 62.82 C ATOM 1890 C TRP B 120 -0.435 6.097 -31.328 1.00 63.54 C ATOM 1891 O TRP B 120 -1.191 7.046 -31.024 1.00 63.48 O ATOM 1892 CB TRP B 120 -1.230 5.180 -29.157 1.00 62.06 C ATOM 1893 CG TRP B 120 -1.487 3.982 -28.330 1.00 63.53 C ATOM 1894 CD1 TRP B 120 -2.308 2.936 -28.637 1.00 65.75 C ATOM 1895 CD2 TRP B 120 -0.873 3.658 -27.079 1.00 65.35 C ATOM 1896 NE1 TRP B 120 -2.240 1.976 -27.657 1.00 68.92 N ATOM 1897 CE2 TRP B 120 -1.362 2.392 -26.689 1.00 66.51 C ATOM 1898 CE3 TRP B 120 0.052 4.309 -26.255 1.00 67.90 C ATOM 1899 CZ2 TRP B 120 -0.965 1.767 -25.503 1.00 64.47 C ATOM 1900 CZ3 TRP B 120 0.448 3.689 -25.076 1.00 68.11 C ATOM 1901 CH2 TRP B 120 -0.058 2.427 -24.714 1.00 68.00 C TER 1903 TRP B 120 ATOM 1903 N HIS C -27 41.516 -16.767 9.568 1.00 69.48 N ATOM 1904 CA HIS C -27 41.069 -16.299 10.874 1.00 70.05 C ATOM 1905 C HIS C -27 41.340 -14.808 11.048 1.00 68.64 C ATOM 1906 O HIS C -27 41.899 -14.382 12.059 1.00 69.79 O ATOM 1907 CB HIS C -27 41.754 -17.091 11.990 1.00 71.77 C ATOM 1908 CG HIS C -27 43.237 -17.207 11.826 1.00 74.62 C ATOM 1909 ND1 HIS C -27 43.829 -18.226 11.110 1.00 78.05 N ATOM 1910 CD2 HIS C -27 44.249 -16.433 12.284 1.00 74.99 C ATOM 1911 CE1 HIS C -27 45.141 -18.074 11.135 1.00 77.60 C ATOM 1912 NE2 HIS C -27 45.422 -16.994 11.841 1.00 76.11 N ATOM 1913 N HIS C -26 40.939 -14.019 10.056 1.00 66.13 N ATOM 1914 CA HIS C -26 41.195 -12.584 10.067 1.00 64.25 C ATOM 1915 C HIS C -26 40.061 -11.817 9.395 1.00 60.36 C ATOM 1916 O HIS C -26 39.718 -12.081 8.243 1.00 61.36 O ATOM 1917 CB HIS C -26 42.524 -12.271 9.376 1.00 66.00 C ATOM 1918 CG HIS C -26 43.706 -12.312 10.294 1.00 69.88 C ATOM 1919 ND1 HIS C -26 44.259 -11.177 10.847 1.00 71.71 N ATOM 1920 CD2 HIS C -26 44.441 -13.352 10.755 1.00 73.03 C ATOM 1921 CE1 HIS C -26 45.283 -11.516 11.609 1.00 71.85 C ATOM 1922 NE2 HIS C -26 45.415 -12.829 11.571 1.00 73.78 N ATOM 1923 N SER C -25 39.484 -10.866 10.123 1.00 54.31 N ATOM 1924 CA SER C -25 38.420 -10.028 9.583 1.00 49.07 C ATOM 1925 C SER C -25 38.985 -8.765 8.942 1.00 44.53 C ATOM 1926 O SER C -25 39.882 -8.126 9.492 1.00 39.99 O ATOM 1927 CB SER C -25 37.420 -9.659 10.680 1.00 54.53 C ATOM 1928 OG SER C -25 36.508 -8.673 10.228 1.00 56.36 O ATOM 1929 N HIS C -24 38.455 -8.411 7.776 1.00 37.79 N ATOM 1930 CA HIS C -24 38.966 -7.277 7.014 1.00 34.29 C ATOM 1931 C HIS C -24 38.275 -5.981 7.424 1.00 33.41 C ATOM 1932 O HIS C -24 38.842 -4.896 7.294 1.00 35.47 O ATOM 1933 CB HIS C -24 38.787 -7.516 5.514 1.00 31.76 C ATOM 1934 CG HIS C -24 39.773 -8.483 4.935 1.00 32.38 C ATOM 1935 ND1 HIS C -24 40.971 -8.083 4.382 1.00 27.01 N ATOM 1936 CD2 HIS C -24 39.739 -9.832 4.822 1.00 30.61 C ATOM 1937 CE1 HIS C -24 41.632 -9.144 3.954 1.00 31.12 C ATOM 1938 NE2 HIS C -24 40.906 -10.218 4.209 1.00 28.38 N ATOM 1939 N MET C -23 37.047 -6.102 7.920 1.00 33.37 N ATOM 1940 CA MET C -23 36.257 -4.937 8.301 1.00 30.60 C ATOM 1941 C MET C -23 36.365 -4.663 9.797 1.00 29.37 C ATOM 1942 O MET C -23 36.419 -5.589 10.605 1.00 28.50 O ATOM 1943 CB MET C -23 34.792 -5.132 7.906 1.00 34.80 C ATOM 1944 CG MET C -23 34.558 -5.210 6.406 1.00 45.85 C ATOM 1945 SD MET C -23 34.899 -3.652 5.566 1.00 47.93 S ATOM 1946 CE MET C -23 33.336 -2.803 5.780 1.00 50.69 C ATOM 1947 N SER C -22 36.396 -3.384 10.158 1.00 29.22 N ATOM 1948 CA SER C -22 36.492 -2.985 11.558 1.00 29.70 C ATOM 1949 C SER C -22 35.165 -3.255 12.269 1.00 32.21 C ATOM 1950 O SER C -22 35.111 -3.365 13.494 1.00 31.54 O ATOM 1951 CB SER C -22 36.820 -1.494 11.656 1.00 33.35 C ATOM 1952 OG SER C -22 35.763 -0.701 11.133 1.00 30.93 O ATOM 1953 N GLY C -21 34.103 -3.343 11.479 1.00 34.25 N ATOM 1954 CA GLY C -21 32.766 -3.600 11.994 1.00 35.46 C ATOM 1955 C GLY C -21 31.857 -3.616 10.774 1.00 38.17 C ATOM 1956 O GLY C -21 32.345 -3.459 9.657 1.00 37.73 O ATOM 1957 N GLU C -20 30.555 -3.798 10.946 1.00 38.00 N ATOM 1958 CA GLU C -20 29.683 -3.809 9.776 1.00 41.76 C ATOM 1959 C GLU C -20 28.254 -3.387 10.094 1.00 43.14 C ATOM 1960 O GLU C -20 27.811 -3.472 11.237 1.00 40.01 O ATOM 1961 CB GLU C -20 29.669 -5.207 9.136 1.00 45.21 C ATOM 1962 CG GLU C -20 28.981 -6.282 9.974 1.00 51.70 C ATOM 1963 CD GLU C -20 29.015 -7.659 9.320 1.00 56.53 C ATOM 1964 OE1 GLU C -20 28.456 -7.815 8.210 1.00 54.85 O ATOM 1965 OE2 GLU C -20 29.600 -8.588 9.921 1.00 57.81 O ATOM 1966 N LYS C -19 27.543 -2.922 9.071 1.00 42.45 N ATOM 1967 CA LYS C -19 26.153 -2.518 9.235 1.00 42.33 C ATOM 1968 C LYS C -19 25.375 -3.817 9.342 1.00 40.30 C ATOM 1969 O LYS C -19 25.482 -4.691 8.487 1.00 42.92 O ATOM 1970 CB LYS C -19 25.711 -1.683 8.037 1.00 38.28 C ATOM 1971 CG LYS C -19 26.402 -0.335 8.011 1.00 39.60 C ATOM 1972 CD LYS C -19 26.042 0.484 6.801 1.00 41.57 C ATOM 1973 CE LYS C -19 26.693 1.852 6.886 1.00 41.33 C ATOM 1974 NZ LYS C -19 26.442 2.669 5.669 1.00 46.15 N ATOM 1975 N THR C -18 24.598 -3.950 10.406 1.00 42.71 N ATOM 1976 CA THR C -18 23.868 -5.185 10.640 1.00 44.62 C ATOM 1977 C THR C -18 22.439 -5.272 10.119 1.00 41.16 C ATOM 1978 O THR C -18 21.868 -6.358 10.092 1.00 40.71 O ATOM 1979 CB THR C -18 23.870 -5.523 12.140 1.00 45.23 C ATOM 1980 OG1 THR C -18 23.369 -4.403 12.880 1.00 47.97 O ATOM 1981 CG2 THR C -18 25.291 -5.836 12.611 1.00 50.02 C ATOM 1982 N VAL C -17 21.851 -4.153 9.707 1.00 41.27 N ATOM 1983 CA VAL C -17 20.484 -4.208 9.188 1.00 37.18 C ATOM 1984 C VAL C -17 20.260 -3.310 7.972 1.00 33.61 C ATOM 1985 O VAL C -17 20.743 -2.172 7.913 1.00 34.22 O ATOM 1986 CB VAL C -17 19.459 -3.883 10.316 1.00 43.00 C ATOM 1987 CG1 VAL C -17 19.846 -2.612 11.004 1.00 44.97 C ATOM 1988 CG2 VAL C -17 18.043 -3.774 9.752 1.00 41.44 C ATOM 1989 N VAL C -16 19.529 -3.838 6.991 1.00 34.98 N ATOM 1990 CA VAL C -16 19.236 -3.108 5.759 1.00 32.82 C ATOM 1991 C VAL C -16 18.313 -1.924 6.022 1.00 32.89 C ATOM 1992 O VAL C -16 17.394 -2.007 6.835 1.00 34.34 O ATOM 1993 CB VAL C -16 18.576 -4.038 4.708 1.00 39.53 C ATOM 1994 CG1 VAL C -16 18.137 -3.226 3.479 1.00 32.00 C ATOM 1995 CG2 VAL C -16 19.553 -5.148 4.311 1.00 39.80 C ATOM 1996 N CYS C -15 18.564 -0.820 5.331 1.00 33.02 N ATOM 1997 CA CYS C -15 17.761 0.380 5.494 1.00 33.48 C ATOM 1998 C CYS C -15 16.410 0.197 4.804 1.00 33.76 C ATOM 1999 O CYS C -15 16.344 0.176 3.577 1.00 30.25 O ATOM 2000 CB CYS C -15 18.481 1.572 4.879 1.00 31.93 C ATOM 2001 SG CYS C -15 17.633 3.113 5.143 1.00 36.53 S ATOM 2002 N LYS C -14 15.336 0.076 5.581 1.00 33.64 N ATOM 2003 CA LYS C -14 14.023 -0.113 4.969 1.00 33.68 C ATOM 2004 C LYS C -14 13.588 1.114 4.176 1.00 33.67 C ATOM 2005 O LYS C -14 12.886 0.992 3.177 1.00 34.12 O ATOM 2006 CB LYS C -14 12.969 -0.504 6.024 1.00 38.44 C ATOM 2007 CG LYS C -14 12.787 0.463 7.176 1.00 42.51 C ATOM 2008 CD LYS C -14 11.770 -0.079 8.188 1.00 46.75 C ATOM 2009 CE LYS C -14 10.329 -0.010 7.664 1.00 45.74 C ATOM 2010 NZ LYS C -14 9.796 1.396 7.623 1.00 38.91 N ATOM 2011 N HIS C -13 14.024 2.298 4.593 1.00 38.93 N ATOM 2012 CA HIS C -13 13.665 3.511 3.864 1.00 40.03 C ATOM 2013 C HIS C -13 14.336 3.483 2.498 1.00 43.02 C ATOM 2014 O HIS C -13 13.732 3.855 1.486 1.00 41.70 O ATOM 2015 CB HIS C -13 14.098 4.746 4.650 1.00 43.45 C ATOM 2016 CG HIS C -13 13.371 4.901 5.949 1.00 50.51 C ATOM 2017 ND1 HIS C -13 13.990 5.319 7.106 1.00 51.89 N ATOM 2018 CD2 HIS C -13 12.081 4.656 6.280 1.00 50.60 C ATOM 2019 CE1 HIS C -13 13.114 5.321 8.096 1.00 51.58 C ATOM 2020 NE2 HIS C -13 11.948 4.922 7.621 1.00 53.34 N ATOM 2021 N TRP C -12 15.587 3.029 2.471 1.00 41.85 N ATOM 2022 CA TRP C -12 16.334 2.937 1.221 1.00 40.14 C ATOM 2023 C TRP C -12 15.648 1.958 0.268 1.00 38.54 C ATOM 2024 O TRP C -12 15.632 2.164 -0.944 1.00 37.60 O ATOM 2025 CB TRP C -12 17.770 2.466 1.488 1.00 38.15 C ATOM 2026 CG TRP C -12 18.487 2.067 0.245 1.00 34.86 C ATOM 2027 CD1 TRP C -12 19.016 2.898 -0.701 1.00 38.62 C ATOM 2028 CD2 TRP C -12 18.706 0.733 -0.226 1.00 32.50 C ATOM 2029 NE1 TRP C -12 19.546 2.163 -1.735 1.00 31.02 N ATOM 2030 CE2 TRP C -12 19.363 0.829 -1.471 1.00 36.35 C ATOM 2031 CE3 TRP C -12 18.396 -0.538 0.280 1.00 32.13 C ATOM 2032 CZ2 TRP C -12 19.731 -0.295 -2.217 1.00 33.45 C ATOM 2033 CZ3 TRP C -12 18.760 -1.657 -0.460 1.00 36.55 C ATOM 2034 CH2 TRP C -12 19.416 -1.525 -1.701 1.00 37.86 C ATOM 2035 N LEU C -11 15.099 0.881 0.815 1.00 38.12 N ATOM 2036 CA LEU C -11 14.412 -0.107 -0.008 1.00 39.48 C ATOM 2037 C LEU C -11 13.267 0.534 -0.794 1.00 41.11 C ATOM 2038 O LEU C -11 12.972 0.128 -1.922 1.00 38.30 O ATOM 2039 CB LEU C -11 13.854 -1.230 0.869 1.00 39.18 C ATOM 2040 CG LEU C -11 14.834 -2.239 1.467 1.00 41.75 C ATOM 2041 CD1 LEU C -11 14.107 -3.099 2.481 1.00 41.30 C ATOM 2042 CD2 LEU C -11 15.428 -3.096 0.368 1.00 37.32 C ATOM 2043 N ARG C -10 12.637 1.542 -0.200 1.00 41.76 N ATOM 2044 CA ARG C -10 11.514 2.225 -0.833 1.00 44.78 C ATOM 2045 C ARG C -10 11.884 3.611 -1.354 1.00 48.91 C ATOM 2046 O ARG C -10 11.013 4.452 -1.590 1.00 48.39 O ATOM 2047 CB ARG C -10 10.343 2.323 0.154 1.00 44.82 C ATOM 2048 CG ARG C -10 9.953 0.981 0.774 1.00 43.28 C ATOM 2049 CD ARG C -10 8.607 1.047 1.497 1.00 49.18 C ATOM 2050 NE ARG C -10 7.508 1.259 0.557 1.00 48.07 N ATOM 2051 CZ ARG C -10 6.757 2.355 0.506 1.00 47.36 C ATOM 2052 NH1 ARG C -10 6.968 3.354 1.353 1.00 43.03 N ATOM 2053 NH2 ARG C -10 5.810 2.463 -0.422 1.00 43.23 N ATOM 2054 N GLY C -9 13.184 3.838 -1.530 1.00 48.31 N ATOM 2055 CA GLY C -9 13.669 5.109 -2.040 1.00 48.99 C ATOM 2056 C GLY C -9 13.384 6.319 -1.174 1.00 49.82 C ATOM 2057 O GLY C -9 13.261 7.434 -1.681 1.00 52.22 O ATOM 2058 N LEU C -8 13.290 6.114 0.134 1.00 50.18 N ATOM 2059 CA LEU C -8 13.001 7.213 1.050 1.00 51.16 C ATOM 2060 C LEU C -8 14.212 7.638 1.881 1.00 52.19 C ATOM 2061 O LEU C -8 14.058 8.265 2.930 1.00 51.75 O ATOM 2062 CB LEU C -8 11.854 6.821 1.988 1.00 50.65 C ATOM 2063 CG LEU C -8 10.482 6.580 1.352 1.00 49.66 C ATOM 2064 CD1 LEU C -8 9.560 5.917 2.356 1.00 51.84 C ATOM 2065 CD2 LEU C -8 9.900 7.898 0.876 1.00 50.20 C ATOM 2066 N CYS C -7 15.413 7.290 1.423 1.00 52.57 N ATOM 2067 CA CYS C -7 16.627 7.655 2.151 1.00 51.35 C ATOM 2068 C CYS C -7 17.636 8.320 1.228 1.00 48.46 C ATOM 2069 O CYS C -7 17.892 7.840 0.128 1.00 47.27 O ATOM 2070 CB CYS C -7 17.262 6.426 2.806 1.00 50.36 C ATOM 2071 SG CYS C -7 18.642 6.830 3.913 1.00 44.17 S ATOM 2072 N LYS C -6 18.208 9.425 1.698 1.00 51.86 N ATOM 2073 CA LYS C -6 19.184 10.198 0.932 1.00 54.48 C ATOM 2074 C LYS C -6 20.594 10.142 1.533 1.00 51.59 C ATOM 2075 O LYS C -6 21.518 10.758 1.007 1.00 53.72 O ATOM 2076 CB LYS C -6 18.737 11.667 0.859 1.00 55.66 C ATOM 2077 CG LYS C -6 17.331 11.867 0.324 1.00 60.53 C ATOM 2078 CD LYS C -6 17.206 11.301 -1.078 1.00 63.23 C ATOM 2079 CE LYS C -6 15.761 11.263 -1.532 1.00 66.24 C ATOM 2080 NZ LYS C -6 15.639 10.679 -2.899 1.00 71.25 N ATOM 2081 N LYS C -5 20.753 9.401 2.624 1.00 49.89 N ATOM 2082 CA LYS C -5 22.038 9.297 3.309 1.00 48.03 C ATOM 2083 C LYS C -5 23.153 8.508 2.604 1.00 48.11 C ATOM 2084 O LYS C -5 24.316 8.580 3.015 1.00 47.31 O ATOM 2085 CB LYS C -5 21.806 8.733 4.711 1.00 45.40 C ATOM 2086 CG LYS C -5 20.816 9.558 5.515 1.00 52.69 C ATOM 2087 CD LYS C -5 20.527 8.944 6.871 1.00 53.64 C ATOM 2088 CE LYS C -5 19.511 9.782 7.632 1.00 56.75 C ATOM 2089 NZ LYS C -5 19.243 9.241 8.993 1.00 61.06 N ATOM 2090 N GLY C -4 22.812 7.764 1.554 1.00 45.48 N ATOM 2091 CA GLY C -4 23.816 6.997 0.833 1.00 44.90 C ATOM 2092 C GLY C -4 24.732 6.165 1.721 1.00 43.43 C ATOM 2093 O GLY C -4 24.277 5.528 2.671 1.00 42.03 O ATOM 2094 N ASP C -3 26.027 6.171 1.410 1.00 43.77 N ATOM 2095 CA ASP C -3 27.011 5.409 2.181 1.00 44.18 C ATOM 2096 C ASP C -3 27.047 5.825 3.642 1.00 42.04 C ATOM 2097 O ASP C -3 27.438 5.041 4.509 1.00 42.30 O ATOM 2098 CB ASP C -3 28.427 5.583 1.606 1.00 44.04 C ATOM 2099 CG ASP C -3 28.596 4.947 0.240 1.00 44.90 C ATOM 2100 OD1 ASP C -3 27.747 4.117 -0.153 1.00 44.72 O ATOM 2101 OD2 ASP C -3 29.596 5.268 -0.439 1.00 45.17 O ATOM 2102 N GLN C -2 26.634 7.056 3.915 1.00 41.92 N ATOM 2103 CA GLN C -2 26.657 7.574 5.277 1.00 42.63 C ATOM 2104 C GLN C -2 25.469 7.188 6.155 1.00 42.52 C ATOM 2105 O GLN C -2 25.419 7.573 7.321 1.00 41.49 O ATOM 2106 CB GLN C -2 26.805 9.099 5.255 1.00 41.85 C ATOM 2107 CG GLN C -2 28.162 9.597 4.770 1.00 41.91 C ATOM 2108 CD GLN C -2 28.400 9.324 3.299 1.00 45.89 C ATOM 2109 OE1 GLN C -2 27.528 9.565 2.467 1.00 46.14 O ATOM 2110 NE2 GLN C -2 29.590 8.829 2.968 1.00 44.91 N ATOM 2111 N CYS C -1 24.515 6.433 5.617 1.00 40.95 N ATOM 2112 CA CYS C -1 23.376 6.035 6.435 1.00 40.75 C ATOM 2113 C CYS C -1 23.843 5.038 7.481 1.00 42.17 C ATOM 2114 O CYS C -1 24.813 4.313 7.272 1.00 40.22 O ATOM 2115 CB CYS C -1 22.264 5.397 5.595 1.00 38.81 C ATOM 2116 SG CYS C -1 20.818 4.938 6.603 1.00 41.06 S ATOM 2117 N GLU C 0 23.152 5.018 8.613 1.00 40.30 N ATOM 2118 CA GLU C 0 23.472 4.110 9.704 1.00 40.48 C ATOM 2119 C GLU C 0 23.204 2.681 9.256 1.00 39.33 C ATOM 2120 O GLU C 0 23.799 1.729 9.764 1.00 36.86 O ATOM 2121 CB GLU C 0 22.588 4.432 10.913 1.00 45.31 C ATOM 2122 CG GLU C 0 22.786 3.521 12.112 1.00 46.49 C ATOM 2123 CD GLU C 0 21.726 3.732 13.189 1.00 55.13 C ATOM 2124 OE1 GLU C 0 21.157 4.844 13.263 1.00 56.69 O ATOM 2125 OE2 GLU C 0 21.471 2.789 13.969 1.00 54.53 O ATOM 2126 N PHE C 1 22.295 2.537 8.299 1.00 40.12 N ATOM 2127 CA PHE C 1 21.920 1.218 7.810 1.00 37.18 C ATOM 2128 C PHE C 1 22.457 0.889 6.423 1.00 33.77 C ATOM 2129 O PHE C 1 22.840 1.771 5.666 1.00 33.78 O ATOM 2130 CB PHE C 1 20.392 1.079 7.861 1.00 37.95 C ATOM 2131 CG PHE C 1 19.823 1.337 9.229 1.00 38.23 C ATOM 2132 CD1 PHE C 1 19.259 2.568 9.550 1.00 41.72 C ATOM 2133 CD2 PHE C 1 19.918 0.369 10.219 1.00 41.61 C ATOM 2134 CE1 PHE C 1 18.804 2.828 10.844 1.00 43.09 C ATOM 2135 CE2 PHE C 1 19.467 0.618 11.512 1.00 44.29 C ATOM 2136 CZ PHE C 1 18.911 1.848 11.823 1.00 41.32 C ATOM 2137 N LEU C 2 22.470 -0.399 6.102 1.00 33.65 N ATOM 2138 CA LEU C 2 22.995 -0.879 4.832 1.00 34.64 C ATOM 2139 C LEU C 2 22.126 -0.555 3.623 1.00 38.47 C ATOM 2140 O LEU C 2 20.911 -0.763 3.648 1.00 37.85 O ATOM 2141 CB LEU C 2 23.199 -2.391 4.917 1.00 34.09 C ATOM 2142 CG LEU C 2 23.947 -3.051 3.761 1.00 36.38 C ATOM 2143 CD1 LEU C 2 25.368 -2.486 3.680 1.00 33.99 C ATOM 2144 CD2 LEU C 2 23.983 -4.555 3.981 1.00 35.35 C ATOM 2145 N HIS C 3 22.754 -0.048 2.564 1.00 34.54 N ATOM 2146 CA HIS C 3 22.033 0.268 1.342 1.00 35.57 C ATOM 2147 C HIS C 3 22.231 -0.738 0.221 1.00 35.32 C ATOM 2148 O HIS C 3 22.501 -0.368 -0.920 1.00 38.92 O ATOM 2149 CB HIS C 3 22.383 1.668 0.843 1.00 34.75 C ATOM 2150 CG HIS C 3 21.686 2.756 1.596 1.00 36.12 C ATOM 2151 ND1 HIS C 3 21.463 4.003 1.057 1.00 39.18 N ATOM 2152 CD2 HIS C 3 21.188 2.794 2.853 1.00 35.14 C ATOM 2153 CE1 HIS C 3 20.860 4.764 1.951 1.00 34.78 C ATOM 2154 NE2 HIS C 3 20.682 4.053 3.049 1.00 33.52 N ATOM 2155 N GLU C 4 22.109 -2.016 0.561 1.00 35.38 N ATOM 2156 CA GLU C 4 22.210 -3.096 -0.406 1.00 37.75 C ATOM 2157 C GLU C 4 21.147 -4.102 0.018 1.00 38.79 C ATOM 2158 O GLU C 4 20.795 -4.170 1.198 1.00 37.50 O ATOM 2159 CB GLU C 4 23.596 -3.750 -0.368 1.00 41.59 C ATOM 2160 CG GLU C 4 24.742 -2.862 -0.853 1.00 43.57 C ATOM 2161 CD GLU C 4 24.522 -2.320 -2.261 1.00 50.27 C ATOM 2162 OE1 GLU C 4 23.664 -2.862 -2.995 1.00 41.90 O ATOM 2163 OE2 GLU C 4 25.215 -1.348 -2.636 1.00 49.28 O ATOM 2164 N TYR C 5 20.617 -4.880 -0.917 1.00 39.09 N ATOM 2165 CA TYR C 5 19.612 -5.845 -0.506 1.00 43.95 C ATOM 2166 C TYR C 5 20.224 -7.144 -0.010 1.00 43.12 C ATOM 2167 O TYR C 5 20.638 -7.994 -0.793 1.00 46.12 O ATOM 2168 CB TYR C 5 18.603 -6.159 -1.623 1.00 46.45 C ATOM 2169 CG TYR C 5 17.474 -7.024 -1.088 1.00 52.74 C ATOM 2170 CD1 TYR C 5 16.660 -6.562 -0.049 1.00 53.38 C ATOM 2171 CD2 TYR C 5 17.306 -8.341 -1.513 1.00 52.97 C ATOM 2172 CE1 TYR C 5 15.722 -7.390 0.567 1.00 55.28 C ATOM 2173 CE2 TYR C 5 16.364 -9.182 -0.902 1.00 57.58 C ATOM 2174 CZ TYR C 5 15.582 -8.700 0.144 1.00 54.93 C ATOM 2175 OH TYR C 5 14.719 -9.540 0.816 1.00 52.85 O ATOM 2176 N ASP C 6 20.271 -7.296 1.305 1.00 42.43 N ATOM 2177 CA ASP C 6 20.808 -8.503 1.907 1.00 44.48 C ATOM 2178 C ASP C 6 19.684 -9.144 2.716 1.00 44.07 C ATOM 2179 O ASP C 6 19.426 -8.740 3.849 1.00 42.43 O ATOM 2180 CB ASP C 6 21.977 -8.154 2.825 1.00 44.96 C ATOM 2181 CG ASP C 6 22.693 -9.380 3.337 1.00 45.72 C ATOM 2182 OD1 ASP C 6 22.059 -10.458 3.385 1.00 44.23 O ATOM 2183 OD2 ASP C 6 23.885 -9.261 3.701 1.00 47.30 O ATOM 2184 N MET C 7 19.028 -10.146 2.138 1.00 45.24 N ATOM 2185 CA MET C 7 17.911 -10.809 2.802 1.00 48.80 C ATOM 2186 C MET C 7 18.234 -11.380 4.176 1.00 50.33 C ATOM 2187 O MET C 7 17.331 -11.806 4.895 1.00 48.94 O ATOM 2188 CB MET C 7 17.341 -11.924 1.915 1.00 51.71 C ATOM 2189 CG MET C 7 18.295 -13.084 1.663 1.00 60.29 C ATOM 2190 SD MET C 7 17.503 -14.450 0.761 1.00 71.24 S ATOM 2191 CE MET C 7 17.501 -13.780 -0.922 1.00 60.40 C ATOM 2192 N THR C 8 19.510 -11.393 4.546 1.00 47.26 N ATOM 2193 CA THR C 8 19.890 -11.931 5.847 1.00 46.19 C ATOM 2194 C THR C 8 20.060 -10.826 6.874 1.00 43.54 C ATOM 2195 O THR C 8 20.292 -11.095 8.048 1.00 44.45 O ATOM 2196 CB THR C 8 21.212 -12.742 5.771 1.00 53.03 C ATOM 2197 OG1 THR C 8 22.303 -11.862 5.468 1.00 50.33 O ATOM 2198 CG2 THR C 8 21.117 -13.817 4.691 1.00 49.81 C ATOM 2199 N LYS C 9 19.945 -9.579 6.432 1.00 39.10 N ATOM 2200 CA LYS C 9 20.096 -8.445 7.337 1.00 39.93 C ATOM 2201 C LYS C 9 18.864 -7.544 7.371 1.00 38.60 C ATOM 2202 O LYS C 9 18.969 -6.348 7.632 1.00 37.91 O ATOM 2203 CB LYS C 9 21.314 -7.612 6.931 1.00 40.33 C ATOM 2204 CG LYS C 9 22.631 -8.375 6.960 1.00 46.81 C ATOM 2205 CD LYS C 9 23.788 -7.458 6.592 1.00 42.00 C ATOM 2206 CE LYS C 9 25.121 -8.192 6.650 1.00 54.08 C ATOM 2207 NZ LYS C 9 26.253 -7.237 6.464 1.00 50.40 N ATOM 2208 N MET C 10 17.698 -8.116 7.104 1.00 38.08 N ATOM 2209 CA MET C 10 16.467 -7.341 7.106 1.00 35.22 C ATOM 2210 C MET C 10 15.995 -7.113 8.542 1.00 34.66 C ATOM 2211 O MET C 10 16.204 -7.958 9.409 1.00 31.40 O ATOM 2212 CB MET C 10 15.399 -8.073 6.286 1.00 35.35 C ATOM 2213 CG MET C 10 15.695 -8.108 4.779 1.00 26.54 C ATOM 2214 SD MET C 10 15.586 -6.480 4.018 1.00 32.45 S ATOM 2215 CE MET C 10 13.909 -6.501 3.406 1.00 43.22 C ATOM 2216 N SER C 11 15.370 -5.967 8.802 1.00 32.82 N ATOM 2217 CA SER C 11 14.897 -5.679 10.152 1.00 36.51 C ATOM 2218 C SER C 11 13.662 -6.503 10.500 1.00 37.62 C ATOM 2219 O SER C 11 13.116 -7.218 9.651 1.00 33.95 O ATOM 2220 CB SER C 11 14.614 -4.180 10.330 1.00 38.39 C ATOM 2221 OG SER C 11 13.767 -3.678 9.322 1.00 43.74 O ATOM 2222 N GLU C 12 13.234 -6.409 11.754 1.00 32.73 N ATOM 2223 CA GLU C 12 12.091 -7.172 12.216 1.00 31.50 C ATOM 2224 C GLU C 12 10.786 -6.595 11.685 1.00 27.80 C ATOM 2225 O GLU C 12 10.636 -5.383 11.552 1.00 26.77 O ATOM 2226 CB GLU C 12 12.058 -7.220 13.754 1.00 36.34 C ATOM 2227 CG GLU C 12 10.881 -8.029 14.304 1.00 36.27 C ATOM 2228 CD GLU C 12 10.969 -8.303 15.796 1.00 42.29 C ATOM 2229 OE1 GLU C 12 11.812 -7.683 16.474 1.00 47.07 O ATOM 2230 OE2 GLU C 12 10.180 -9.138 16.287 1.00 46.26 O ATOM 2231 N CYS C 13 9.849 -7.477 11.375 1.00 30.25 N ATOM 2232 CA CYS C 13 8.550 -7.043 10.871 1.00 29.27 C ATOM 2233 C CYS C 13 7.738 -6.455 12.026 1.00 27.29 C ATOM 2234 O CYS C 13 7.452 -7.138 13.008 1.00 30.17 O ATOM 2235 CB CYS C 13 7.813 -8.228 10.269 1.00 25.89 C ATOM 2236 SG CYS C 13 6.163 -7.832 9.612 1.00 29.13 S ATOM 2237 N TYR C 14 7.366 -5.187 11.911 1.00 27.76 N ATOM 2238 CA TYR C 14 6.595 -4.544 12.971 1.00 29.10 C ATOM 2239 C TYR C 14 5.273 -5.261 13.234 1.00 29.37 C ATOM 2240 O TYR C 14 4.875 -5.451 14.386 1.00 29.15 O ATOM 2241 CB TYR C 14 6.303 -3.084 12.608 1.00 31.19 C ATOM 2242 CG TYR C 14 5.582 -2.320 13.702 1.00 33.81 C ATOM 2243 CD1 TYR C 14 6.294 -1.558 14.630 1.00 34.41 C ATOM 2244 CD2 TYR C 14 4.188 -2.402 13.841 1.00 32.23 C ATOM 2245 CE1 TYR C 14 5.644 -0.893 15.674 1.00 34.87 C ATOM 2246 CE2 TYR C 14 3.525 -1.742 14.885 1.00 30.64 C ATOM 2247 CZ TYR C 14 4.259 -0.991 15.794 1.00 32.85 C ATOM 2248 OH TYR C 14 3.623 -0.328 16.821 1.00 32.72 O ATOM 2249 N PHE C 15 4.590 -5.661 12.165 1.00 30.15 N ATOM 2250 CA PHE C 15 3.294 -6.319 12.315 1.00 26.39 C ATOM 2251 C PHE C 15 3.372 -7.709 12.931 1.00 30.83 C ATOM 2252 O PHE C 15 2.570 -8.046 13.807 1.00 25.38 O ATOM 2253 CB PHE C 15 2.578 -6.336 10.966 1.00 32.74 C ATOM 2254 CG PHE C 15 2.183 -4.962 10.499 1.00 30.28 C ATOM 2255 CD1 PHE C 15 1.120 -4.300 11.097 1.00 29.23 C ATOM 2256 CD2 PHE C 15 2.931 -4.296 9.532 1.00 29.44 C ATOM 2257 CE1 PHE C 15 0.810 -2.982 10.743 1.00 29.34 C ATOM 2258 CE2 PHE C 15 2.633 -2.980 9.171 1.00 35.42 C ATOM 2259 CZ PHE C 15 1.570 -2.323 9.779 1.00 32.50 C ATOM 2260 N TYR C 16 4.334 -8.522 12.499 1.00 28.81 N ATOM 2261 CA TYR C 16 4.444 -9.850 13.097 1.00 32.68 C ATOM 2262 C TYR C 16 4.815 -9.710 14.578 1.00 32.66 C ATOM 2263 O TYR C 16 4.384 -10.500 15.417 1.00 33.25 O ATOM 2264 CB TYR C 16 5.512 -10.690 12.400 1.00 29.07 C ATOM 2265 CG TYR C 16 5.381 -12.159 12.726 1.00 31.03 C ATOM 2266 CD1 TYR C 16 4.522 -12.974 11.994 1.00 29.94 C ATOM 2267 CD2 TYR C 16 6.081 -12.723 13.795 1.00 35.40 C ATOM 2268 CE1 TYR C 16 4.357 -14.315 12.311 1.00 31.91 C ATOM 2269 CE2 TYR C 16 5.922 -14.067 14.125 1.00 38.01 C ATOM 2270 CZ TYR C 16 5.057 -14.859 13.378 1.00 39.54 C ATOM 2271 OH TYR C 16 4.886 -16.193 13.692 1.00 40.79 O ATOM 2272 N SER C 17 5.608 -8.692 14.891 1.00 31.42 N ATOM 2273 CA SER C 17 6.034 -8.455 16.268 1.00 37.08 C ATOM 2274 C SER C 17 4.935 -7.969 17.213 1.00 36.00 C ATOM 2275 O SER C 17 4.771 -8.517 18.307 1.00 37.22 O ATOM 2276 CB SER C 17 7.186 -7.453 16.293 1.00 36.96 C ATOM 2277 OG SER C 17 7.487 -7.076 17.625 1.00 47.26 O ATOM 2278 N LYS C 18 4.191 -6.943 16.805 1.00 32.74 N ATOM 2279 CA LYS C 18 3.132 -6.397 17.651 1.00 34.59 C ATOM 2280 C LYS C 18 1.805 -7.138 17.560 1.00 36.89 C ATOM 2281 O LYS C 18 1.038 -7.152 18.520 1.00 37.25 O ATOM 2282 CB LYS C 18 2.877 -4.921 17.316 1.00 35.77 C ATOM 2283 CG LYS C 18 4.115 -4.052 17.275 1.00 42.32 C ATOM 2284 CD LYS C 18 4.800 -3.952 18.622 1.00 45.08 C ATOM 2285 CE LYS C 18 6.080 -3.131 18.505 1.00 50.45 C ATOM 2286 NZ LYS C 18 6.844 -3.084 19.783 1.00 54.94 N ATOM 2287 N PHE C 19 1.535 -7.758 16.413 1.00 37.18 N ATOM 2288 CA PHE C 19 0.270 -8.450 16.205 1.00 34.56 C ATOM 2289 C PHE C 19 0.373 -9.967 16.102 1.00 37.58 C ATOM 2290 O PHE C 19 -0.645 -10.657 16.079 1.00 36.54 O ATOM 2291 CB PHE C 19 -0.415 -7.887 14.954 1.00 32.65 C ATOM 2292 CG PHE C 19 -0.856 -6.451 15.096 1.00 32.43 C ATOM 2293 CD1 PHE C 19 -2.143 -6.141 15.525 1.00 34.45 C ATOM 2294 CD2 PHE C 19 0.025 -5.409 14.827 1.00 29.79 C ATOM 2295 CE1 PHE C 19 -2.545 -4.808 15.680 1.00 26.18 C ATOM 2296 CE2 PHE C 19 -0.361 -4.080 14.979 1.00 33.64 C ATOM 2297 CZ PHE C 19 -1.651 -3.776 15.408 1.00 34.33 C ATOM 2298 N GLY C 20 1.592 -10.491 16.028 1.00 31.57 N ATOM 2299 CA GLY C 20 1.748 -11.932 15.942 1.00 36.09 C ATOM 2300 C GLY C 20 1.396 -12.538 14.593 1.00 33.86 C ATOM 2301 O GLY C 20 1.216 -13.743 14.473 1.00 35.52 O ATOM 2302 N GLU C 21 1.300 -11.703 13.567 1.00 34.63 N ATOM 2303 CA GLU C 21 0.991 -12.193 12.240 1.00 33.24 C ATOM 2304 C GLU C 21 1.208 -11.100 11.209 1.00 27.71 C ATOM 2305 O GLU C 21 1.244 -9.915 11.543 1.00 29.11 O ATOM 2306 CB GLU C 21 -0.444 -12.684 12.188 1.00 41.89 C ATOM 2307 CG GLU C 21 -1.420 -11.653 12.640 1.00 46.87 C ATOM 2308 CD GLU C 21 -2.807 -11.976 12.175 1.00 55.86 C ATOM 2309 OE1 GLU C 21 -3.457 -12.850 12.785 1.00 60.35 O ATOM 2310 OE2 GLU C 21 -3.235 -11.366 11.176 1.00 57.32 O ATOM 2311 N CYS C 22 1.319 -11.510 9.953 1.00 28.14 N ATOM 2312 CA CYS C 22 1.603 -10.592 8.860 1.00 27.61 C ATOM 2313 C CYS C 22 0.896 -11.073 7.600 1.00 27.69 C ATOM 2314 O CYS C 22 0.884 -12.270 7.312 1.00 26.10 O ATOM 2315 CB CYS C 22 3.123 -10.562 8.668 1.00 26.87 C ATOM 2316 SG CYS C 22 3.714 -9.666 7.251 1.00 25.59 S ATOM 2317 N SER C 23 0.310 -10.143 6.847 1.00 26.82 N ATOM 2318 CA SER C 23 -0.439 -10.500 5.636 1.00 29.69 C ATOM 2319 C SER C 23 0.365 -10.699 4.360 1.00 28.09 C ATOM 2320 O SER C 23 -0.187 -11.114 3.348 1.00 27.03 O ATOM 2321 CB SER C 23 -1.514 -9.436 5.354 1.00 30.16 C ATOM 2322 OG SER C 23 -2.383 -9.275 6.460 1.00 33.58 O ATOM 2323 N ASN C 24 1.659 -10.399 4.387 1.00 29.55 N ATOM 2324 CA ASN C 24 2.465 -10.531 3.179 1.00 27.50 C ATOM 2325 C ASN C 24 3.118 -11.900 3.064 1.00 29.25 C ATOM 2326 O ASN C 24 4.079 -12.190 3.774 1.00 27.68 O ATOM 2327 CB ASN C 24 3.544 -9.443 3.164 1.00 29.07 C ATOM 2328 CG ASN C 24 4.266 -9.349 1.837 1.00 30.51 C ATOM 2329 OD1 ASN C 24 4.061 -10.170 0.945 1.00 28.60 O ATOM 2330 ND2 ASN C 24 5.121 -8.335 1.700 1.00 27.66 N ATOM 2331 N LYS C 25 2.609 -12.732 2.162 1.00 28.97 N ATOM 2332 CA LYS C 25 3.170 -14.068 1.962 1.00 29.37 C ATOM 2333 C LYS C 25 4.654 -13.963 1.631 1.00 33.63 C ATOM 2334 O LYS C 25 5.423 -14.884 1.896 1.00 30.12 O ATOM 2335 CB LYS C 25 2.465 -14.787 0.809 1.00 33.74 C ATOM 2336 CG LYS C 25 1.003 -15.129 1.058 1.00 36.83 C ATOM 2337 CD LYS C 25 0.422 -15.865 -0.142 1.00 32.20 C ATOM 2338 CE LYS C 25 -1.087 -16.004 -0.026 1.00 33.97 C ATOM 2339 NZ LYS C 25 -1.695 -16.371 -1.348 1.00 37.01 N ATOM 2340 N GLU C 26 5.049 -12.835 1.046 1.00 29.69 N ATOM 2341 CA GLU C 26 6.439 -12.616 0.668 1.00 33.64 C ATOM 2342 C GLU C 26 7.121 -11.620 1.599 1.00 30.80 C ATOM 2343 O GLU C 26 8.088 -10.967 1.198 1.00 30.95 O ATOM 2344 CB GLU C 26 6.529 -12.085 -0.774 1.00 34.45 C ATOM 2345 CG GLU C 26 6.363 -13.118 -1.883 1.00 42.69 C ATOM 2346 CD GLU C 26 4.975 -13.730 -1.942 1.00 46.49 C ATOM 2347 OE1 GLU C 26 3.993 -12.994 -2.188 1.00 43.03 O ATOM 2348 OE2 GLU C 26 4.870 -14.961 -1.747 1.00 54.20 O ATOM 2349 N CYS C 27 6.641 -11.486 2.834 1.00 27.97 N ATOM 2350 CA CYS C 27 7.281 -10.530 3.724 1.00 28.56 C ATOM 2351 C CYS C 27 8.776 -10.807 3.842 1.00 30.36 C ATOM 2352 O CYS C 27 9.189 -11.919 4.156 1.00 27.58 O ATOM 2353 CB CYS C 27 6.685 -10.545 5.126 1.00 26.47 C ATOM 2354 SG CYS C 27 7.326 -9.153 6.087 1.00 30.50 S ATOM 2355 N PRO C 28 9.604 -9.785 3.605 1.00 32.82 N ATOM 2356 CA PRO C 28 11.058 -9.969 3.696 1.00 33.40 C ATOM 2357 C PRO C 28 11.608 -9.673 5.092 1.00 35.16 C ATOM 2358 O PRO C 28 12.779 -9.910 5.371 1.00 33.40 O ATOM 2359 CB PRO C 28 11.577 -8.993 2.653 1.00 33.64 C ATOM 2360 CG PRO C 28 10.633 -7.811 2.848 1.00 36.78 C ATOM 2361 CD PRO C 28 9.267 -8.490 2.978 1.00 33.05 C ATOM 2362 N PHE C 29 10.759 -9.163 5.974 1.00 31.49 N ATOM 2363 CA PHE C 29 11.202 -8.819 7.320 1.00 33.05 C ATOM 2364 C PHE C 29 11.091 -9.991 8.305 1.00 35.13 C ATOM 2365 O PHE C 29 10.295 -10.908 8.118 1.00 32.99 O ATOM 2366 CB PHE C 29 10.413 -7.592 7.801 1.00 29.97 C ATOM 2367 CG PHE C 29 10.562 -6.395 6.896 1.00 33.04 C ATOM 2368 CD1 PHE C 29 11.727 -5.635 6.911 1.00 28.65 C ATOM 2369 CD2 PHE C 29 9.548 -6.045 6.004 1.00 29.90 C ATOM 2370 CE1 PHE C 29 11.884 -4.547 6.056 1.00 32.96 C ATOM 2371 CE2 PHE C 29 9.691 -4.959 5.143 1.00 31.67 C ATOM 2372 CZ PHE C 29 10.861 -4.205 5.166 1.00 35.93 C ATOM 2373 N LEU C 30 11.906 -9.959 9.356 1.00 34.58 N ATOM 2374 CA LEU C 30 11.910 -11.027 10.353 1.00 34.56 C ATOM 2375 C LEU C 30 10.591 -11.244 11.103 1.00 34.29 C ATOM 2376 O LEU C 30 10.000 -10.306 11.629 1.00 34.98 O ATOM 2377 CB LEU C 30 13.005 -10.770 11.393 1.00 36.73 C ATOM 2378 CG LEU C 30 14.438 -10.536 10.920 1.00 41.15 C ATOM 2379 CD1 LEU C 30 15.326 -10.260 12.127 1.00 42.47 C ATOM 2380 CD2 LEU C 30 14.934 -11.749 10.154 1.00 43.43 C ATOM 2381 N HIS C 31 10.153 -12.497 11.154 1.00 33.04 N ATOM 2382 CA HIS C 31 8.955 -12.884 11.883 1.00 38.14 C ATOM 2383 C HIS C 31 9.442 -13.708 13.074 1.00 38.87 C ATOM 2384 O HIS C 31 9.652 -14.916 12.959 1.00 40.94 O ATOM 2385 CB HIS C 31 8.033 -13.743 11.019 1.00 35.09 C ATOM 2386 CG HIS C 31 7.309 -12.984 9.952 1.00 31.20 C ATOM 2387 ND1 HIS C 31 6.454 -13.596 9.062 1.00 32.17 N ATOM 2388 CD2 HIS C 31 7.296 -11.665 9.640 1.00 27.03 C ATOM 2389 CE1 HIS C 31 5.944 -12.691 8.246 1.00 30.55 C ATOM 2390 NE2 HIS C 31 6.438 -11.511 8.576 1.00 22.24 N ATOM 2391 N ILE C 32 9.623 -13.041 14.205 1.00 40.28 N ATOM 2392 CA ILE C 32 10.106 -13.674 15.429 1.00 46.70 C ATOM 2393 C ILE C 32 8.972 -13.970 16.413 1.00 48.29 C ATOM 2394 O ILE C 32 8.261 -13.065 16.840 1.00 45.20 O ATOM 2395 CB ILE C 32 11.141 -12.766 16.115 1.00 45.06 C ATOM 2396 CG1 ILE C 32 12.304 -12.513 15.155 1.00 46.46 C ATOM 2397 CG2 ILE C 32 11.625 -13.402 17.404 1.00 50.76 C ATOM 2398 CD1 ILE C 32 13.275 -11.466 15.634 1.00 51.87 C ATOM 2399 N ASP C 33 8.811 -15.241 16.767 1.00 52.03 N ATOM 2400 CA ASP C 33 7.762 -15.645 17.697 1.00 56.54 C ATOM 2401 C ASP C 33 8.137 -15.319 19.133 1.00 59.61 C ATOM 2402 O ASP C 33 9.318 -15.297 19.488 1.00 58.87 O ATOM 2403 CB ASP C 33 7.494 -17.144 17.584 1.00 57.88 C ATOM 2404 CG ASP C 33 6.909 -17.530 16.246 1.00 64.17 C ATOM 2405 OD1 ASP C 33 5.895 -16.917 15.848 1.00 63.27 O ATOM 2406 OD2 ASP C 33 7.459 -18.448 15.599 1.00 66.48 O ATOM 2407 N PRO C 34 7.132 -15.054 19.982 1.00 62.47 N ATOM 2408 CA PRO C 34 7.388 -14.732 21.388 1.00 65.41 C ATOM 2409 C PRO C 34 8.259 -15.822 22.003 1.00 67.97 C ATOM 2410 O PRO C 34 7.846 -16.980 22.111 1.00 67.72 O ATOM 2411 CB PRO C 34 5.988 -14.690 21.986 1.00 64.44 C ATOM 2412 CG PRO C 34 5.168 -14.176 20.843 1.00 65.26 C ATOM 2413 CD PRO C 34 5.691 -14.991 19.685 1.00 63.07 C ATOM 2414 N GLU C 35 9.473 -15.443 22.386 1.00 70.39 N ATOM 2415 CA GLU C 35 10.423 -16.379 22.962 1.00 72.72 C ATOM 2416 C GLU C 35 10.249 -16.497 24.472 1.00 73.72 C ATOM 2417 O GLU C 35 10.332 -17.593 25.030 1.00 76.79 O ATOM 2418 CB GLU C 35 11.843 -15.927 22.623 1.00 72.57 C ATOM 2419 CG GLU C 35 12.928 -16.926 22.969 1.00 78.09 C ATOM 2420 CD GLU C 35 14.275 -16.520 22.404 1.00 81.43 C ATOM 2421 OE1 GLU C 35 14.389 -15.378 21.910 1.00 82.75 O ATOM 2422 OE2 GLU C 35 15.219 -17.336 22.458 1.00 82.80 O TER 2424 GLU C 35 ATOM 2424 N SER D -25 -38.955 -13.034 -6.444 1.00 52.02 N ATOM 2425 CA SER D -25 -38.008 -12.107 -5.836 1.00 49.23 C ATOM 2426 C SER D -25 -38.637 -10.734 -5.628 1.00 44.92 C ATOM 2427 O SER D -25 -39.508 -10.317 -6.391 1.00 43.26 O ATOM 2428 CB SER D -25 -36.750 -11.984 -6.698 1.00 55.87 C ATOM 2429 OG SER D -25 -35.881 -10.985 -6.193 1.00 56.38 O ATOM 2430 N HIS D -24 -38.190 -10.035 -4.589 1.00 38.03 N ATOM 2431 CA HIS D -24 -38.741 -8.728 -4.251 1.00 36.51 C ATOM 2432 C HIS D -24 -38.114 -7.628 -5.100 1.00 35.78 C ATOM 2433 O HIS D -24 -38.700 -6.561 -5.283 1.00 35.82 O ATOM 2434 CB HIS D -24 -38.534 -8.428 -2.765 1.00 37.07 C ATOM 2435 CG HIS D -24 -39.550 -9.069 -1.872 1.00 37.66 C ATOM 2436 ND1 HIS D -24 -40.802 -8.531 -1.663 1.00 33.80 N ATOM 2437 CD2 HIS D -24 -39.500 -10.203 -1.133 1.00 36.81 C ATOM 2438 CE1 HIS D -24 -41.479 -9.306 -0.834 1.00 35.13 C ATOM 2439 NE2 HIS D -24 -40.712 -10.327 -0.498 1.00 35.07 N ATOM 2440 N MET D -23 -36.919 -7.895 -5.616 1.00 35.99 N ATOM 2441 CA MET D -23 -36.193 -6.916 -6.417 1.00 32.58 C ATOM 2442 C MET D -23 -36.352 -7.196 -7.907 1.00 31.84 C ATOM 2443 O MET D -23 -36.356 -8.350 -8.335 1.00 31.30 O ATOM 2444 CB MET D -23 -34.711 -6.906 -6.038 1.00 34.80 C ATOM 2445 CG MET D -23 -34.446 -6.575 -4.578 1.00 33.12 C ATOM 2446 SD MET D -23 -34.903 -4.883 -4.154 1.00 34.37 S ATOM 2447 CE MET D -23 -33.688 -3.959 -5.090 1.00 45.37 C ATOM 2448 N SER D -22 -36.482 -6.132 -8.694 1.00 35.75 N ATOM 2449 CA SER D -22 -36.653 -6.262 -10.136 1.00 38.17 C ATOM 2450 C SER D -22 -35.403 -6.843 -10.789 1.00 42.31 C ATOM 2451 O SER D -22 -35.491 -7.710 -11.659 1.00 41.44 O ATOM 2452 CB SER D -22 -36.990 -4.907 -10.760 1.00 40.72 C ATOM 2453 OG SER D -22 -36.009 -3.937 -10.435 1.00 39.27 O ATOM 2454 N GLY D -21 -34.240 -6.360 -10.364 1.00 40.19 N ATOM 2455 CA GLY D -21 -33.019 -7.140 -10.437 1.00 47.68 C ATOM 2456 C GLY D -21 -32.057 -6.817 -9.310 1.00 46.28 C ATOM 2457 O GLY D -21 -32.340 -5.968 -8.464 1.00 44.82 O ATOM 2458 N GLU D -20 -30.916 -7.498 -9.299 1.00 48.68 N ATOM 2459 CA GLU D -20 -29.996 -7.434 -8.169 1.00 51.01 C ATOM 2460 C GLU D -20 -28.578 -7.157 -8.628 1.00 50.95 C ATOM 2461 O GLU D -20 -28.199 -7.499 -9.751 1.00 51.32 O ATOM 2462 CB GLU D -20 -30.010 -8.753 -7.387 1.00 57.47 C ATOM 2463 CG GLU D -20 -29.251 -9.890 -8.075 1.00 62.48 C ATOM 2464 CD GLU D -20 -29.244 -11.175 -7.263 1.00 67.34 C ATOM 2465 OE1 GLU D -20 -28.892 -11.122 -6.064 1.00 70.32 O ATOM 2466 OE2 GLU D -20 -29.583 -12.240 -7.824 1.00 68.15 O ATOM 2467 N LYS D -19 -27.799 -6.517 -7.765 1.00 46.91 N ATOM 2468 CA LYS D -19 -26.406 -6.247 -8.083 1.00 45.89 C ATOM 2469 C LYS D -19 -25.693 -7.569 -7.826 1.00 46.15 C ATOM 2470 O LYS D -19 -26.136 -8.378 -7.010 1.00 49.68 O ATOM 2471 CB LYS D -19 -25.851 -5.156 -7.178 1.00 42.64 C ATOM 2472 CG LYS D -19 -26.429 -3.779 -7.440 1.00 40.43 C ATOM 2473 CD LYS D -19 -25.909 -2.801 -6.404 1.00 45.47 C ATOM 2474 CE LYS D -19 -26.413 -1.398 -6.643 1.00 44.87 C ATOM 2475 NZ LYS D -19 -25.847 -0.459 -5.635 1.00 44.18 N ATOM 2476 N THR D -18 -24.588 -7.799 -8.514 1.00 46.32 N ATOM 2477 CA THR D -18 -23.884 -9.056 -8.344 1.00 45.31 C ATOM 2478 C THR D -18 -22.472 -8.920 -7.796 1.00 42.84 C ATOM 2479 O THR D -18 -21.917 -9.889 -7.286 1.00 43.44 O ATOM 2480 CB THR D -18 -23.797 -9.793 -9.679 1.00 47.92 C ATOM 2481 OG1 THR D -18 -23.123 -8.954 -10.627 1.00 48.05 O ATOM 2482 CG2 THR D -18 -25.199 -10.123 -10.200 1.00 53.06 C ATOM 2483 N VAL D -17 -21.887 -7.732 -7.896 1.00 40.30 N ATOM 2484 CA VAL D -17 -20.519 -7.553 -7.418 1.00 40.73 C ATOM 2485 C VAL D -17 -20.340 -6.395 -6.441 1.00 36.77 C ATOM 2486 O VAL D -17 -20.870 -5.305 -6.647 1.00 35.84 O ATOM 2487 CB VAL D -17 -19.554 -7.358 -8.617 1.00 41.15 C ATOM 2488 CG1 VAL D -17 -18.105 -7.364 -8.140 1.00 42.09 C ATOM 2489 CG2 VAL D -17 -19.788 -8.460 -9.647 1.00 41.01 C ATOM 2490 N VAL D -16 -19.589 -6.646 -5.372 1.00 38.43 N ATOM 2491 CA VAL D -16 -19.314 -5.617 -4.371 1.00 33.02 C ATOM 2492 C VAL D -16 -18.415 -4.571 -5.017 1.00 34.58 C ATOM 2493 O VAL D -16 -17.518 -4.910 -5.783 1.00 36.87 O ATOM 2494 CB VAL D -16 -18.580 -6.215 -3.144 1.00 39.14 C ATOM 2495 CG1 VAL D -16 -18.204 -5.108 -2.165 1.00 35.54 C ATOM 2496 CG2 VAL D -16 -19.453 -7.259 -2.467 1.00 37.27 C ATOM 2497 N CYS D -15 -18.655 -3.304 -4.710 1.00 32.36 N ATOM 2498 CA CYS D -15 -17.865 -2.210 -5.255 1.00 31.30 C ATOM 2499 C CYS D -15 -16.491 -2.105 -4.570 1.00 34.72 C ATOM 2500 O CYS D -15 -16.410 -1.747 -3.392 1.00 28.99 O ATOM 2501 CB CYS D -15 -18.620 -0.903 -5.056 1.00 29.70 C ATOM 2502 SG CYS D -15 -17.749 0.538 -5.630 1.00 35.75 S ATOM 2503 N LYS D -14 -15.410 -2.389 -5.293 1.00 31.54 N ATOM 2504 CA LYS D -14 -14.098 -2.315 -4.660 1.00 34.66 C ATOM 2505 C LYS D -14 -13.733 -0.897 -4.233 1.00 32.16 C ATOM 2506 O LYS D -14 -13.063 -0.709 -3.226 1.00 35.81 O ATOM 2507 CB LYS D -14 -13.013 -2.919 -5.568 1.00 39.56 C ATOM 2508 CG LYS D -14 -12.807 -2.227 -6.895 1.00 42.36 C ATOM 2509 CD LYS D -14 -11.745 -2.970 -7.706 1.00 42.46 C ATOM 2510 CE LYS D -14 -10.344 -2.765 -7.130 1.00 42.41 C ATOM 2511 NZ LYS D -14 -9.792 -1.441 -7.534 1.00 39.64 N ATOM 2512 N HIS D -13 -14.185 0.104 -4.979 1.00 34.08 N ATOM 2513 CA HIS D -13 -13.901 1.494 -4.621 1.00 34.45 C ATOM 2514 C HIS D -13 -14.604 1.870 -3.325 1.00 37.17 C ATOM 2515 O HIS D -13 -14.059 2.604 -2.495 1.00 33.93 O ATOM 2516 CB HIS D -13 -14.351 2.435 -5.738 1.00 39.68 C ATOM 2517 CG HIS D -13 -13.479 2.381 -6.953 1.00 47.29 C ATOM 2518 ND1 HIS D -13 -13.984 2.411 -8.236 1.00 46.43 N ATOM 2519 CD2 HIS D -13 -12.133 2.280 -7.082 1.00 47.32 C ATOM 2520 CE1 HIS D -13 -12.989 2.324 -9.100 1.00 49.24 C ATOM 2521 NE2 HIS D -13 -11.856 2.243 -8.426 1.00 48.32 N ATOM 2522 N TRP D -12 -15.825 1.367 -3.153 1.00 35.31 N ATOM 2523 CA TRP D -12 -16.586 1.649 -1.942 1.00 32.87 C ATOM 2524 C TRP D -12 -15.882 1.037 -0.732 1.00 31.08 C ATOM 2525 O TRP D -12 -15.825 1.635 0.338 1.00 32.95 O ATOM 2526 CB TRP D -12 -18.000 1.070 -2.059 1.00 32.37 C ATOM 2527 CG TRP D -12 -18.731 1.100 -0.772 1.00 31.31 C ATOM 2528 CD1 TRP D -12 -19.263 2.196 -0.157 1.00 35.63 C ATOM 2529 CD2 TRP D -12 -18.958 -0.006 0.105 1.00 33.89 C ATOM 2530 NE1 TRP D -12 -19.803 1.842 1.053 1.00 31.53 N ATOM 2531 CE2 TRP D -12 -19.629 0.495 1.241 1.00 34.17 C ATOM 2532 CE3 TRP D -12 -18.655 -1.376 0.044 1.00 31.72 C ATOM 2533 CZ2 TRP D -12 -20.007 -0.325 2.312 1.00 39.13 C ATOM 2534 CZ3 TRP D -12 -19.031 -2.194 1.108 1.00 37.22 C ATOM 2535 CH2 TRP D -12 -19.699 -1.662 2.229 1.00 36.64 C ATOM 2536 N LEU D -11 -15.358 -0.171 -0.901 1.00 31.41 N ATOM 2537 CA LEU D -11 -14.649 -0.847 0.178 1.00 33.39 C ATOM 2538 C LEU D -11 -13.531 0.019 0.741 1.00 35.09 C ATOM 2539 O LEU D -11 -13.255 -0.006 1.945 1.00 32.40 O ATOM 2540 CB LEU D -11 -14.030 -2.152 -0.318 1.00 32.04 C ATOM 2541 CG LEU D -11 -14.905 -3.337 -0.698 1.00 34.34 C ATOM 2542 CD1 LEU D -11 -14.007 -4.429 -1.247 1.00 37.15 C ATOM 2543 CD2 LEU D -11 -15.666 -3.841 0.510 1.00 36.42 C ATOM 2544 N ARG D -10 -12.886 0.782 -0.136 1.00 36.02 N ATOM 2545 CA ARG D -10 -11.779 1.634 0.271 1.00 42.38 C ATOM 2546 C ARG D -10 -12.201 3.082 0.492 1.00 47.50 C ATOM 2547 O ARG D -10 -11.369 3.939 0.801 1.00 48.53 O ATOM 2548 CB ARG D -10 -10.657 1.549 -0.771 1.00 42.40 C ATOM 2549 CG ARG D -10 -10.259 0.110 -1.098 1.00 38.89 C ATOM 2550 CD ARG D -10 -8.886 0.024 -1.749 1.00 51.47 C ATOM 2551 NE ARG D -10 -7.861 0.560 -0.857 1.00 51.36 N ATOM 2552 CZ ARG D -10 -7.057 1.570 -1.166 1.00 45.09 C ATOM 2553 NH1 ARG D -10 -7.148 2.154 -2.353 1.00 42.07 N ATOM 2554 NH2 ARG D -10 -6.183 2.017 -0.274 1.00 43.03 N ATOM 2555 N GLY D -9 -13.498 3.346 0.347 1.00 47.89 N ATOM 2556 CA GLY D -9 -14.017 4.690 0.550 1.00 50.05 C ATOM 2557 C GLY D -9 -13.782 5.613 -0.630 1.00 50.01 C ATOM 2558 O GLY D -9 -13.789 6.836 -0.482 1.00 51.92 O ATOM 2559 N LEU D -8 -13.584 5.028 -1.805 1.00 50.58 N ATOM 2560 CA LEU D -8 -13.333 5.798 -3.019 1.00 53.34 C ATOM 2561 C LEU D -8 -14.550 5.967 -3.930 1.00 55.05 C ATOM 2562 O LEU D -8 -14.418 6.485 -5.040 1.00 56.75 O ATOM 2563 CB LEU D -8 -12.206 5.146 -3.829 1.00 55.52 C ATOM 2564 CG LEU D -8 -10.827 5.016 -3.179 1.00 56.79 C ATOM 2565 CD1 LEU D -8 -9.910 4.221 -4.097 1.00 54.97 C ATOM 2566 CD2 LEU D -8 -10.255 6.400 -2.910 1.00 52.98 C ATOM 2567 N CYS D -7 -15.726 5.523 -3.492 1.00 53.14 N ATOM 2568 CA CYS D -7 -16.908 5.667 -4.336 1.00 52.09 C ATOM 2569 C CYS D -7 -17.749 6.851 -3.888 1.00 52.55 C ATOM 2570 O CYS D -7 -18.036 7.018 -2.700 1.00 50.50 O ATOM 2571 CB CYS D -7 -17.764 4.393 -4.326 1.00 52.61 C ATOM 2572 SG CYS D -7 -19.014 4.309 -5.672 1.00 42.59 S ATOM 2573 N LYS D -6 -18.133 7.675 -4.856 1.00 53.83 N ATOM 2574 CA LYS D -6 -18.943 8.853 -4.587 1.00 58.02 C ATOM 2575 C LYS D -6 -20.283 8.781 -5.323 1.00 56.96 C ATOM 2576 O LYS D -6 -20.980 9.787 -5.452 1.00 58.37 O ATOM 2577 CB LYS D -6 -18.183 10.113 -5.014 1.00 59.72 C ATOM 2578 CG LYS D -6 -16.840 10.305 -4.320 1.00 61.99 C ATOM 2579 CD LYS D -6 -16.992 10.385 -2.803 1.00 63.70 C ATOM 2580 CE LYS D -6 -15.637 10.547 -2.124 1.00 63.94 C ATOM 2581 NZ LYS D -6 -15.683 10.164 -0.681 1.00 65.95 N ATOM 2582 N LYS D -5 -20.632 7.590 -5.800 1.00 56.99 N ATOM 2583 CA LYS D -5 -21.885 7.379 -6.523 1.00 54.31 C ATOM 2584 C LYS D -5 -23.038 7.026 -5.591 1.00 52.18 C ATOM 2585 O LYS D -5 -24.198 7.079 -5.992 1.00 52.36 O ATOM 2586 CB LYS D -5 -21.740 6.253 -7.546 1.00 53.75 C ATOM 2587 CG LYS D -5 -20.780 6.521 -8.683 1.00 59.79 C ATOM 2588 CD LYS D -5 -20.812 5.357 -9.661 1.00 64.05 C ATOM 2589 CE LYS D -5 -19.785 5.511 -10.766 1.00 69.63 C ATOM 2590 NZ LYS D -5 -19.816 4.349 -11.706 1.00 73.66 N ATOM 2591 N GLY D -4 -22.719 6.648 -4.358 1.00 49.52 N ATOM 2592 CA GLY D -4 -23.756 6.286 -3.407 1.00 45.98 C ATOM 2593 C GLY D -4 -24.699 5.209 -3.930 1.00 45.72 C ATOM 2594 O GLY D -4 -24.258 4.194 -4.479 1.00 38.64 O ATOM 2595 N ASP D -3 -26.002 5.435 -3.770 1.00 45.81 N ATOM 2596 CA ASP D -3 -27.007 4.474 -4.217 1.00 45.72 C ATOM 2597 C ASP D -3 -27.118 4.327 -5.725 1.00 46.33 C ATOM 2598 O ASP D -3 -27.740 3.385 -6.208 1.00 47.08 O ATOM 2599 CB ASP D -3 -28.380 4.826 -3.639 1.00 47.51 C ATOM 2600 CG ASP D -3 -28.456 4.584 -2.150 1.00 49.81 C ATOM 2601 OD1 ASP D -3 -27.773 3.654 -1.676 1.00 58.41 O ATOM 2602 OD2 ASP D -3 -29.204 5.303 -1.456 1.00 47.42 O ATOM 2603 N GLN D -2 -26.515 5.249 -6.468 1.00 45.05 N ATOM 2604 CA GLN D -2 -26.555 5.181 -7.924 1.00 49.91 C ATOM 2605 C GLN D -2 -25.472 4.256 -8.482 1.00 51.42 C ATOM 2606 O GLN D -2 -25.416 4.020 -9.689 1.00 52.80 O ATOM 2607 CB GLN D -2 -26.394 6.579 -8.540 1.00 54.14 C ATOM 2608 CG GLN D -2 -27.635 7.468 -8.468 1.00 54.77 C ATOM 2609 CD GLN D -2 -28.033 7.817 -7.048 1.00 60.21 C ATOM 2610 OE1 GLN D -2 -27.253 8.414 -6.297 1.00 64.35 O ATOM 2611 NE2 GLN D -2 -29.251 7.450 -6.669 1.00 58.13 N ATOM 2612 N CYS D -1 -24.611 3.727 -7.614 1.00 51.05 N ATOM 2613 CA CYS D -1 -23.555 2.836 -8.088 1.00 47.37 C ATOM 2614 C CYS D -1 -24.128 1.527 -8.609 1.00 45.20 C ATOM 2615 O CYS D -1 -25.133 1.026 -8.101 1.00 46.62 O ATOM 2616 CB CYS D -1 -22.537 2.526 -6.983 1.00 45.06 C ATOM 2617 SG CYS D -1 -21.122 1.528 -7.596 1.00 43.90 S ATOM 2618 N GLU D 0 -23.471 0.977 -9.624 1.00 42.78 N ATOM 2619 CA GLU D 0 -23.881 -0.278 -10.243 1.00 41.90 C ATOM 2620 C GLU D 0 -23.415 -1.473 -9.423 1.00 39.68 C ATOM 2621 O GLU D 0 -23.855 -2.605 -9.637 1.00 40.97 O ATOM 2622 CB GLU D 0 -23.292 -0.356 -11.649 1.00 48.92 C ATOM 2623 CG GLU D 0 -21.824 0.055 -11.691 1.00 57.85 C ATOM 2624 CD GLU D 0 -21.267 0.121 -13.097 1.00 64.95 C ATOM 2625 OE1 GLU D 0 -21.391 -0.884 -13.835 1.00 67.09 O ATOM 2626 OE2 GLU D 0 -20.698 1.176 -13.460 1.00 67.00 O ATOM 2627 N PHE D 1 -22.516 -1.226 -8.479 1.00 38.73 N ATOM 2628 CA PHE D 1 -22.018 -2.308 -7.651 1.00 36.15 C ATOM 2629 C PHE D 1 -22.566 -2.218 -6.224 1.00 34.75 C ATOM 2630 O PHE D 1 -22.991 -1.162 -5.766 1.00 30.82 O ATOM 2631 CB PHE D 1 -20.480 -2.310 -7.636 1.00 36.86 C ATOM 2632 CG PHE D 1 -19.860 -2.454 -9.001 1.00 41.36 C ATOM 2633 CD1 PHE D 1 -19.350 -1.346 -9.670 1.00 40.76 C ATOM 2634 CD2 PHE D 1 -19.801 -3.698 -9.622 1.00 45.17 C ATOM 2635 CE1 PHE D 1 -18.790 -1.475 -10.942 1.00 45.43 C ATOM 2636 CE2 PHE D 1 -19.244 -3.838 -10.893 1.00 49.20 C ATOM 2637 CZ PHE D 1 -18.738 -2.722 -11.552 1.00 43.72 C ATOM 2638 N LEU D 2 -22.544 -3.354 -5.541 1.00 32.28 N ATOM 2639 CA LEU D 2 -23.022 -3.485 -4.172 1.00 34.99 C ATOM 2640 C LEU D 2 -22.213 -2.692 -3.143 1.00 39.53 C ATOM 2641 O LEU D 2 -20.982 -2.811 -3.081 1.00 35.98 O ATOM 2642 CB LEU D 2 -22.984 -4.958 -3.748 1.00 37.09 C ATOM 2643 CG LEU D 2 -23.933 -6.009 -4.318 1.00 48.35 C ATOM 2644 CD1 LEU D 2 -23.544 -7.402 -3.796 1.00 44.42 C ATOM 2645 CD2 LEU D 2 -25.355 -5.664 -3.903 1.00 44.99 C ATOM 2646 N HIS D 3 -22.902 -1.890 -2.333 1.00 37.45 N ATOM 2647 CA HIS D 3 -22.241 -1.160 -1.258 1.00 35.22 C ATOM 2648 C HIS D 3 -22.578 -1.869 0.053 1.00 36.30 C ATOM 2649 O HIS D 3 -23.273 -1.337 0.918 1.00 36.29 O ATOM 2650 CB HIS D 3 -22.691 0.297 -1.193 1.00 35.69 C ATOM 2651 CG HIS D 3 -22.018 1.184 -2.193 1.00 32.62 C ATOM 2652 ND1 HIS D 3 -21.996 2.557 -2.069 1.00 31.65 N ATOM 2653 CD2 HIS D 3 -21.363 0.900 -3.343 1.00 29.81 C ATOM 2654 CE1 HIS D 3 -21.358 3.082 -3.098 1.00 31.49 C ATOM 2655 NE2 HIS D 3 -20.963 2.097 -3.885 1.00 29.41 N ATOM 2656 N GLU D 4 -22.094 -3.099 0.166 1.00 35.00 N ATOM 2657 CA GLU D 4 -22.280 -3.930 1.346 1.00 38.03 C ATOM 2658 C GLU D 4 -21.168 -4.961 1.273 1.00 40.39 C ATOM 2659 O GLU D 4 -20.839 -5.450 0.187 1.00 38.97 O ATOM 2660 CB GLU D 4 -23.635 -4.650 1.322 1.00 38.11 C ATOM 2661 CG GLU D 4 -23.670 -5.882 2.236 1.00 42.44 C ATOM 2662 CD GLU D 4 -24.989 -6.653 2.195 1.00 42.94 C ATOM 2663 OE1 GLU D 4 -25.641 -6.679 1.132 1.00 35.30 O ATOM 2664 OE2 GLU D 4 -25.360 -7.256 3.230 1.00 43.01 O ATOM 2665 N TYR D 5 -20.569 -5.296 2.407 1.00 41.43 N ATOM 2666 CA TYR D 5 -19.520 -6.286 2.334 1.00 45.28 C ATOM 2667 C TYR D 5 -20.111 -7.667 2.324 1.00 45.01 C ATOM 2668 O TYR D 5 -20.631 -8.136 3.329 1.00 51.21 O ATOM 2669 CB TYR D 5 -18.521 -6.195 3.490 1.00 47.74 C ATOM 2670 CG TYR D 5 -17.349 -7.137 3.255 1.00 52.61 C ATOM 2671 CD1 TYR D 5 -16.395 -6.859 2.272 1.00 54.94 C ATOM 2672 CD2 TYR D 5 -17.253 -8.356 3.929 1.00 52.89 C ATOM 2673 CE1 TYR D 5 -15.382 -7.773 1.962 1.00 52.39 C ATOM 2674 CE2 TYR D 5 -16.241 -9.275 3.620 1.00 53.43 C ATOM 2675 CZ TYR D 5 -15.316 -8.970 2.634 1.00 43.90 C ATOM 2676 OH TYR D 5 -14.334 -9.866 2.318 1.00 53.82 O ATOM 2677 N ASP D 6 -20.036 -8.312 1.171 1.00 47.37 N ATOM 2678 CA ASP D 6 -20.517 -9.670 1.025 1.00 49.56 C ATOM 2679 C ASP D 6 -19.324 -10.434 0.472 1.00 50.09 C ATOM 2680 O ASP D 6 -19.050 -10.375 -0.726 1.00 48.02 O ATOM 2681 CB ASP D 6 -21.674 -9.737 0.031 1.00 49.27 C ATOM 2682 CG ASP D 6 -22.302 -11.112 -0.022 1.00 51.60 C ATOM 2683 OD1 ASP D 6 -21.589 -12.100 0.256 1.00 48.80 O ATOM 2684 OD2 ASP D 6 -23.503 -11.204 -0.349 1.00 55.81 O ATOM 2685 N MET D 7 -18.614 -11.138 1.349 1.00 53.20 N ATOM 2686 CA MET D 7 -17.432 -11.898 0.958 1.00 56.02 C ATOM 2687 C MET D 7 -17.672 -12.873 -0.189 1.00 56.64 C ATOM 2688 O MET D 7 -16.726 -13.255 -0.878 1.00 58.27 O ATOM 2689 CB MET D 7 -16.863 -12.660 2.166 1.00 60.30 C ATOM 2690 CG MET D 7 -17.741 -13.802 2.675 1.00 64.91 C ATOM 2691 SD MET D 7 -17.189 -14.503 4.260 1.00 71.50 S ATOM 2692 CE MET D 7 -15.958 -15.703 3.708 1.00 66.10 C ATOM 2693 N THR D 8 -18.924 -13.271 -0.403 1.00 56.09 N ATOM 2694 CA THR D 8 -19.235 -14.216 -1.479 1.00 53.48 C ATOM 2695 C THR D 8 -19.516 -13.550 -2.821 1.00 52.06 C ATOM 2696 O THR D 8 -19.710 -14.239 -3.828 1.00 51.22 O ATOM 2697 CB THR D 8 -20.450 -15.113 -1.128 1.00 56.29 C ATOM 2698 OG1 THR D 8 -21.599 -14.295 -0.883 1.00 53.05 O ATOM 2699 CG2 THR D 8 -20.158 -15.952 0.107 1.00 57.33 C ATOM 2700 N LYS D 9 -19.539 -12.219 -2.845 1.00 46.38 N ATOM 2701 CA LYS D 9 -19.798 -11.501 -4.089 1.00 45.06 C ATOM 2702 C LYS D 9 -18.690 -10.522 -4.460 1.00 40.66 C ATOM 2703 O LYS D 9 -18.931 -9.515 -5.114 1.00 39.39 O ATOM 2704 CB LYS D 9 -21.131 -10.756 -4.006 1.00 44.90 C ATOM 2705 CG LYS D 9 -22.334 -11.677 -3.941 1.00 46.35 C ATOM 2706 CD LYS D 9 -23.623 -10.889 -4.035 1.00 50.14 C ATOM 2707 CE LYS D 9 -24.826 -11.808 -4.157 1.00 55.03 C ATOM 2708 NZ LYS D 9 -26.076 -11.020 -4.336 1.00 56.74 N ATOM 2709 N MET D 10 -17.469 -10.826 -4.047 1.00 41.61 N ATOM 2710 CA MET D 10 -16.347 -9.953 -4.353 1.00 37.74 C ATOM 2711 C MET D 10 -15.854 -10.204 -5.779 1.00 37.79 C ATOM 2712 O MET D 10 -16.011 -11.301 -6.317 1.00 36.99 O ATOM 2713 CB MET D 10 -15.231 -10.197 -3.335 1.00 39.09 C ATOM 2714 CG MET D 10 -15.566 -9.709 -1.920 1.00 32.30 C ATOM 2715 SD MET D 10 -15.432 -7.924 -1.781 1.00 32.71 S ATOM 2716 CE MET D 10 -13.618 -7.772 -1.501 1.00 41.46 C ATOM 2717 N SER D 11 -15.261 -9.188 -6.396 1.00 37.92 N ATOM 2718 CA SER D 11 -14.750 -9.343 -7.751 1.00 39.67 C ATOM 2719 C SER D 11 -13.517 -10.247 -7.756 1.00 39.59 C ATOM 2720 O SER D 11 -12.980 -10.595 -6.700 1.00 36.36 O ATOM 2721 CB SER D 11 -14.409 -7.979 -8.346 1.00 35.75 C ATOM 2722 OG SER D 11 -13.426 -7.324 -7.565 1.00 49.85 O ATOM 2723 N GLU D 12 -13.084 -10.634 -8.951 1.00 37.96 N ATOM 2724 CA GLU D 12 -11.927 -11.506 -9.117 1.00 38.17 C ATOM 2725 C GLU D 12 -10.635 -10.743 -8.829 1.00 30.67 C ATOM 2726 O GLU D 12 -10.501 -9.581 -9.195 1.00 30.26 O ATOM 2727 CB GLU D 12 -11.890 -12.053 -10.550 1.00 39.68 C ATOM 2728 CG GLU D 12 -11.002 -13.273 -10.721 1.00 47.43 C ATOM 2729 CD GLU D 12 -11.022 -13.832 -12.138 1.00 55.23 C ATOM 2730 OE1 GLU D 12 -11.968 -13.522 -12.896 1.00 58.40 O ATOM 2731 OE2 GLU D 12 -10.097 -14.599 -12.489 1.00 55.28 O ATOM 2732 N CYS D 13 -9.690 -11.395 -8.166 1.00 30.77 N ATOM 2733 CA CYS D 13 -8.410 -10.751 -7.846 1.00 30.59 C ATOM 2734 C CYS D 13 -7.619 -10.554 -9.132 1.00 28.82 C ATOM 2735 O CYS D 13 -7.303 -11.520 -9.810 1.00 27.06 O ATOM 2736 CB CYS D 13 -7.612 -11.626 -6.890 1.00 28.36 C ATOM 2737 SG CYS D 13 -5.965 -10.986 -6.452 1.00 29.23 S ATOM 2738 N TYR D 14 -7.302 -9.311 -9.473 1.00 24.74 N ATOM 2739 CA TYR D 14 -6.546 -9.056 -10.696 1.00 28.95 C ATOM 2740 C TYR D 14 -5.190 -9.763 -10.728 1.00 32.06 C ATOM 2741 O TYR D 14 -4.785 -10.325 -11.760 1.00 30.85 O ATOM 2742 CB TYR D 14 -6.306 -7.555 -10.884 1.00 32.57 C ATOM 2743 CG TYR D 14 -5.576 -7.220 -12.171 1.00 31.71 C ATOM 2744 CD1 TYR D 14 -6.275 -7.040 -13.366 1.00 30.28 C ATOM 2745 CD2 TYR D 14 -4.183 -7.108 -12.197 1.00 28.03 C ATOM 2746 CE1 TYR D 14 -5.605 -6.752 -14.560 1.00 30.23 C ATOM 2747 CE2 TYR D 14 -3.502 -6.825 -13.386 1.00 24.80 C ATOM 2748 CZ TYR D 14 -4.217 -6.645 -14.559 1.00 32.94 C ATOM 2749 OH TYR D 14 -3.555 -6.339 -15.731 1.00 28.20 O ATOM 2750 N PHE D 15 -4.480 -9.740 -9.604 1.00 29.24 N ATOM 2751 CA PHE D 15 -3.157 -10.361 -9.570 1.00 31.44 C ATOM 2752 C PHE D 15 -3.191 -11.874 -9.670 1.00 32.40 C ATOM 2753 O PHE D 15 -2.376 -12.470 -10.377 1.00 30.17 O ATOM 2754 CB PHE D 15 -2.406 -9.895 -8.327 1.00 28.68 C ATOM 2755 CG PHE D 15 -2.079 -8.435 -8.363 1.00 30.25 C ATOM 2756 CD1 PHE D 15 -1.020 -7.970 -9.129 1.00 26.12 C ATOM 2757 CD2 PHE D 15 -2.888 -7.510 -7.704 1.00 31.02 C ATOM 2758 CE1 PHE D 15 -0.771 -6.595 -9.247 1.00 31.02 C ATOM 2759 CE2 PHE D 15 -2.645 -6.142 -7.815 1.00 32.78 C ATOM 2760 CZ PHE D 15 -1.584 -5.685 -8.589 1.00 31.11 C ATOM 2761 N TYR D 16 -4.138 -12.508 -8.989 1.00 33.14 N ATOM 2762 CA TYR D 16 -4.215 -13.955 -9.070 1.00 32.54 C ATOM 2763 C TYR D 16 -4.526 -14.382 -10.502 1.00 35.98 C ATOM 2764 O TYR D 16 -4.006 -15.389 -10.989 1.00 34.60 O ATOM 2765 CB TYR D 16 -5.294 -14.504 -8.144 1.00 34.53 C ATOM 2766 CG TYR D 16 -5.194 -15.999 -7.972 1.00 38.42 C ATOM 2767 CD1 TYR D 16 -4.294 -16.554 -7.065 1.00 37.25 C ATOM 2768 CD2 TYR D 16 -5.960 -16.862 -8.754 1.00 41.19 C ATOM 2769 CE1 TYR D 16 -4.159 -17.933 -6.940 1.00 39.57 C ATOM 2770 CE2 TYR D 16 -5.830 -18.244 -8.635 1.00 42.99 C ATOM 2771 CZ TYR D 16 -4.929 -18.770 -7.729 1.00 41.45 C ATOM 2772 OH TYR D 16 -4.798 -20.134 -7.610 1.00 48.93 O ATOM 2773 N SER D 17 -5.373 -13.611 -11.175 1.00 35.66 N ATOM 2774 CA SER D 17 -5.753 -13.927 -12.549 1.00 39.64 C ATOM 2775 C SER D 17 -4.643 -13.708 -13.565 1.00 38.10 C ATOM 2776 O SER D 17 -4.398 -14.559 -14.422 1.00 38.94 O ATOM 2777 CB SER D 17 -6.963 -13.097 -12.971 1.00 40.55 C ATOM 2778 OG SER D 17 -8.079 -13.420 -12.172 1.00 54.92 O ATOM 2779 N LYS D 18 -3.978 -12.563 -13.474 1.00 34.10 N ATOM 2780 CA LYS D 18 -2.920 -12.232 -14.415 1.00 35.14 C ATOM 2781 C LYS D 18 -1.564 -12.831 -14.090 1.00 37.23 C ATOM 2782 O LYS D 18 -0.797 -13.138 -14.994 1.00 38.05 O ATOM 2783 CB LYS D 18 -2.774 -10.712 -14.526 1.00 34.85 C ATOM 2784 CG LYS D 18 -3.973 -10.019 -15.128 1.00 42.19 C ATOM 2785 CD LYS D 18 -4.213 -10.471 -16.557 1.00 44.77 C ATOM 2786 CE LYS D 18 -5.458 -9.818 -17.132 1.00 48.31 C ATOM 2787 NZ LYS D 18 -5.743 -10.303 -18.510 1.00 49.10 N ATOM 2788 N PHE D 19 -1.271 -13.005 -12.808 1.00 34.01 N ATOM 2789 CA PHE D 19 0.026 -13.526 -12.395 1.00 34.76 C ATOM 2790 C PHE D 19 -0.006 -14.922 -11.794 1.00 38.06 C ATOM 2791 O PHE D 19 1.042 -15.496 -11.499 1.00 37.47 O ATOM 2792 CB PHE D 19 0.664 -12.550 -11.402 1.00 35.19 C ATOM 2793 CG PHE D 19 1.003 -11.219 -12.003 1.00 31.65 C ATOM 2794 CD1 PHE D 19 2.244 -11.003 -12.598 1.00 33.77 C ATOM 2795 CD2 PHE D 19 0.076 -10.190 -12.008 1.00 34.41 C ATOM 2796 CE1 PHE D 19 2.552 -9.781 -13.187 1.00 32.34 C ATOM 2797 CE2 PHE D 19 0.373 -8.959 -12.599 1.00 37.47 C ATOM 2798 CZ PHE D 19 1.620 -8.757 -13.191 1.00 33.34 C ATOM 2799 N GLY D 20 -1.204 -15.470 -11.619 1.00 35.58 N ATOM 2800 CA GLY D 20 -1.327 -16.795 -11.042 1.00 35.53 C ATOM 2801 C GLY D 20 -0.912 -16.867 -9.580 1.00 34.76 C ATOM 2802 O GLY D 20 -0.726 -17.956 -9.037 1.00 34.06 O ATOM 2803 N GLU D 21 -0.760 -15.718 -8.928 1.00 30.72 N ATOM 2804 CA GLU D 21 -0.370 -15.709 -7.523 1.00 30.44 C ATOM 2805 C GLU D 21 -0.790 -14.380 -6.897 1.00 31.87 C ATOM 2806 O GLU D 21 -0.997 -13.394 -7.606 1.00 28.85 O ATOM 2807 CB GLU D 21 1.157 -15.901 -7.379 1.00 29.78 C ATOM 2808 CG GLU D 21 1.971 -14.654 -7.694 1.00 37.11 C ATOM 2809 CD GLU D 21 3.472 -14.846 -7.498 1.00 43.71 C ATOM 2810 OE1 GLU D 21 3.895 -15.217 -6.381 1.00 50.41 O ATOM 2811 OE2 GLU D 21 4.228 -14.616 -8.467 1.00 51.94 O ATOM 2812 N CYS D 22 -0.916 -14.368 -5.572 1.00 31.22 N ATOM 2813 CA CYS D 22 -1.322 -13.170 -4.835 1.00 30.98 C ATOM 2814 C CYS D 22 -0.617 -13.160 -3.484 1.00 27.51 C ATOM 2815 O CYS D 22 -0.643 -14.156 -2.762 1.00 27.31 O ATOM 2816 CB CYS D 22 -2.847 -13.162 -4.637 1.00 30.16 C ATOM 2817 SG CYS D 22 -3.444 -11.735 -3.698 1.00 29.55 S ATOM 2818 N SER D 23 0.005 -12.035 -3.146 1.00 28.15 N ATOM 2819 CA SER D 23 0.771 -11.907 -1.895 1.00 29.74 C ATOM 2820 C SER D 23 -0.035 -11.689 -0.616 1.00 29.09 C ATOM 2821 O SER D 23 0.507 -11.795 0.485 1.00 26.73 O ATOM 2822 CB SER D 23 1.767 -10.747 -2.003 1.00 33.01 C ATOM 2823 OG SER D 23 2.658 -10.902 -3.082 1.00 36.26 O ATOM 2824 N ASN D 24 -1.317 -11.377 -0.747 1.00 26.68 N ATOM 2825 CA ASN D 24 -2.124 -11.102 0.435 1.00 28.63 C ATOM 2826 C ASN D 24 -2.722 -12.376 1.001 1.00 25.94 C ATOM 2827 O ASN D 24 -3.610 -12.962 0.388 1.00 30.00 O ATOM 2828 CB ASN D 24 -3.230 -10.102 0.068 1.00 26.25 C ATOM 2829 CG ASN D 24 -4.000 -9.604 1.279 1.00 28.87 C ATOM 2830 OD1 ASN D 24 -3.715 -9.982 2.416 1.00 26.37 O ATOM 2831 ND2 ASN D 24 -4.978 -8.740 1.038 1.00 24.30 N ATOM 2832 N LYS D 25 -2.244 -12.805 2.169 1.00 27.52 N ATOM 2833 CA LYS D 25 -2.771 -14.023 2.793 1.00 32.30 C ATOM 2834 C LYS D 25 -4.257 -13.868 3.082 1.00 32.17 C ATOM 2835 O LYS D 25 -4.984 -14.851 3.156 1.00 30.55 O ATOM 2836 CB LYS D 25 -2.069 -14.330 4.120 1.00 32.99 C ATOM 2837 CG LYS D 25 -0.574 -14.537 4.041 1.00 38.71 C ATOM 2838 CD LYS D 25 -0.025 -14.888 5.413 1.00 38.14 C ATOM 2839 CE LYS D 25 1.487 -14.814 5.437 1.00 38.88 C ATOM 2840 NZ LYS D 25 2.015 -14.861 6.829 1.00 40.48 N ATOM 2841 N GLU D 26 -4.700 -12.628 3.266 1.00 30.62 N ATOM 2842 CA GLU D 26 -6.107 -12.374 3.558 1.00 32.83 C ATOM 2843 C GLU D 26 -6.823 -11.739 2.377 1.00 29.56 C ATOM 2844 O GLU D 26 -7.805 -11.031 2.571 1.00 32.54 O ATOM 2845 CB GLU D 26 -6.271 -11.438 4.771 1.00 34.34 C ATOM 2846 CG GLU D 26 -5.987 -12.048 6.143 1.00 40.59 C ATOM 2847 CD GLU D 26 -4.510 -12.226 6.418 1.00 45.59 C ATOM 2848 OE1 GLU D 26 -3.756 -11.242 6.283 1.00 47.94 O ATOM 2849 OE2 GLU D 26 -4.103 -13.350 6.778 1.00 48.98 O ATOM 2850 N CYS D 27 -6.349 -11.973 1.157 1.00 26.14 N ATOM 2851 CA CYS D 27 -7.024 -11.386 0.010 1.00 24.94 C ATOM 2852 C CYS D 27 -8.515 -11.744 0.012 1.00 26.94 C ATOM 2853 O CYS D 27 -8.881 -12.910 0.112 1.00 23.77 O ATOM 2854 CB CYS D 27 -6.419 -11.869 -1.299 1.00 24.18 C ATOM 2855 SG CYS D 27 -7.118 -10.992 -2.665 1.00 29.25 S ATOM 2856 N PRO D 28 -9.387 -10.737 -0.096 1.00 28.83 N ATOM 2857 CA PRO D 28 -10.835 -10.968 -0.106 1.00 30.39 C ATOM 2858 C PRO D 28 -11.392 -11.121 -1.519 1.00 31.59 C ATOM 2859 O PRO D 28 -12.595 -11.333 -1.694 1.00 32.80 O ATOM 2860 CB PRO D 28 -11.372 -9.722 0.568 1.00 28.18 C ATOM 2861 CG PRO D 28 -10.475 -8.668 -0.018 1.00 31.00 C ATOM 2862 CD PRO D 28 -9.093 -9.303 0.098 1.00 27.90 C ATOM 2863 N PHE D 29 -10.528 -11.007 -2.528 1.00 27.97 N ATOM 2864 CA PHE D 29 -10.990 -11.134 -3.913 1.00 28.54 C ATOM 2865 C PHE D 29 -10.893 -12.575 -4.401 1.00 31.35 C ATOM 2866 O PHE D 29 -10.114 -13.359 -3.873 1.00 32.50 O ATOM 2867 CB PHE D 29 -10.206 -10.175 -4.804 1.00 26.57 C ATOM 2868 CG PHE D 29 -10.408 -8.731 -4.436 1.00 30.42 C ATOM 2869 CD1 PHE D 29 -11.579 -8.070 -4.792 1.00 30.33 C ATOM 2870 CD2 PHE D 29 -9.458 -8.053 -3.680 1.00 32.51 C ATOM 2871 CE1 PHE D 29 -11.806 -6.756 -4.397 1.00 35.90 C ATOM 2872 CE2 PHE D 29 -9.670 -6.734 -3.275 1.00 40.27 C ATOM 2873 CZ PHE D 29 -10.849 -6.081 -3.634 1.00 38.10 C ATOM 2874 N LEU D 30 -11.700 -12.935 -5.393 1.00 34.93 N ATOM 2875 CA LEU D 30 -11.705 -14.316 -5.871 1.00 38.95 C ATOM 2876 C LEU D 30 -10.431 -14.801 -6.551 1.00 37.26 C ATOM 2877 O LEU D 30 -9.909 -14.154 -7.460 1.00 37.19 O ATOM 2878 CB LEU D 30 -12.880 -14.554 -6.821 1.00 43.17 C ATOM 2879 CG LEU D 30 -14.315 -14.369 -6.313 1.00 50.84 C ATOM 2880 CD1 LEU D 30 -15.215 -15.219 -7.199 1.00 50.33 C ATOM 2881 CD2 LEU D 30 -14.463 -14.794 -4.849 1.00 48.98 C ATOM 2882 N HIS D 31 -9.941 -15.952 -6.105 1.00 37.73 N ATOM 2883 CA HIS D 31 -8.751 -16.545 -6.693 1.00 40.53 C ATOM 2884 C HIS D 31 -9.212 -17.700 -7.575 1.00 45.35 C ATOM 2885 O HIS D 31 -9.319 -18.844 -7.133 1.00 47.13 O ATOM 2886 CB HIS D 31 -7.790 -17.032 -5.602 1.00 36.56 C ATOM 2887 CG HIS D 31 -7.012 -15.929 -4.947 1.00 28.14 C ATOM 2888 ND1 HIS D 31 -6.069 -16.164 -3.970 1.00 27.17 N ATOM 2889 CD2 HIS D 31 -7.024 -14.587 -5.142 1.00 30.18 C ATOM 2890 CE1 HIS D 31 -5.533 -15.018 -3.589 1.00 31.44 C ATOM 2891 NE2 HIS D 31 -6.092 -14.045 -4.285 1.00 23.62 N ATOM 2892 N ILE D 32 -9.483 -17.373 -8.834 1.00 49.45 N ATOM 2893 CA ILE D 32 -9.967 -18.348 -9.802 1.00 54.06 C ATOM 2894 C ILE D 32 -8.857 -19.065 -10.551 1.00 55.89 C ATOM 2895 O ILE D 32 -7.835 -18.488 -10.895 1.00 57.79 O ATOM 2896 CB ILE D 32 -10.880 -17.680 -10.828 1.00 53.53 C ATOM 2897 CG1 ILE D 32 -11.891 -16.776 -10.123 1.00 53.09 C ATOM 2898 CG2 ILE D 32 -11.594 -18.745 -11.648 1.00 55.10 C ATOM 2899 CD1 ILE D 32 -12.955 -17.524 -9.347 1.00 56.74 C ATOM 2900 N ASP D 33 -9.091 -20.334 -10.835 1.00 60.29 N ATOM 2901 CA ASP D 33 -8.116 -21.163 -11.534 1.00 62.23 C ATOM 2902 C ASP D 33 -8.676 -21.804 -12.773 1.00 64.39 C ATOM 2903 O ASP D 33 -9.851 -21.620 -13.134 1.00 64.21 O ATOM 2904 CB ASP D 33 -7.775 -22.409 -10.733 1.00 61.71 C ATOM 2905 CG ASP D 33 -6.620 -22.263 -9.810 1.00 63.70 C ATOM 2906 OD1 ASP D 33 -5.678 -21.510 -10.120 1.00 64.76 O ATOM 2907 OD2 ASP D 33 -6.631 -22.969 -8.780 1.00 65.13 O ATOM 2908 N PRO D 34 -7.752 -22.413 -13.532 1.00 67.23 N ATOM 2909 CA PRO D 34 -8.195 -23.145 -14.706 1.00 67.64 C ATOM 2910 C PRO D 34 -8.603 -24.413 -13.950 1.00 69.65 C ATOM 2911 O PRO D 34 -9.735 -24.551 -13.463 1.00 71.56 O ATOM 2912 CB PRO D 34 -6.908 -23.385 -15.454 1.00 67.04 C ATOM 2913 CG PRO D 34 -6.234 -22.089 -15.311 1.00 66.83 C ATOM 2914 CD PRO D 34 -6.593 -21.574 -13.916 1.00 65.20 C TER 2916 PRO D 34 HETATM 2916 N NO3 A -81 -7.131 6.922 0.816 1.00 62.51 N HETATM 2917 O1 NO3 A -81 -6.740 6.981 -0.336 1.00 58.81 O HETATM 2918 O2 NO3 A -81 -7.593 7.918 1.347 1.00 52.21 O HETATM 2919 O3 NO3 A -81 -7.062 5.865 1.436 1.00 59.72 O HETATM 2920 N NO3 A -80 3.761 11.243 17.077 1.00 52.67 N HETATM 2921 O1 NO3 A -80 3.909 10.927 15.902 1.00 48.03 O HETATM 2922 O2 NO3 A -80 3.072 12.206 17.371 1.00 48.62 O HETATM 2923 O3 NO3 A -80 4.303 10.599 17.955 1.00 48.09 O HETATM 2924 N NO3 A -79 -10.690 21.754 24.303 1.00 40.49 N HETATM 2925 O1 NO3 A -79 -9.540 21.484 24.575 1.00 46.75 O HETATM 2926 O2 NO3 A -79 -11.436 22.143 25.171 1.00 47.55 O HETATM 2927 O3 NO3 A -79 -11.098 21.640 23.158 1.00 48.89 O HETATM 2928 N NO3 A -78 -11.240 19.479 32.154 1.00 46.22 N HETATM 2929 O1 NO3 A -78 -10.465 19.134 33.039 1.00 39.25 O HETATM 2930 O2 NO3 A -78 -10.815 19.909 31.093 1.00 47.06 O HETATM 2931 O3 NO3 A -78 -12.440 19.393 32.331 1.00 49.90 O TER 2933 NO3 A -78 HETATM 2933 ZN ZN C 419 5.973 -9.498 7.967 1.00 30.29 N HETATM 2934 ZN ZN C 418 19.381 4.719 4.672 1.00 42.78 N HETATM 2935 N NO3 C -82 3.356 -14.595 17.292 1.00 59.83 N HETATM 2936 O1 NO3 C -82 4.369 -13.975 17.022 1.00 60.87 O HETATM 2937 O2 NO3 C -82 2.866 -14.501 18.401 1.00 60.09 O HETATM 2938 O3 NO3 C -82 2.831 -15.310 16.455 1.00 54.20 O TER 2940 NO3 C -82 HETATM 2940 ZN ZN D 419 -5.759 -11.942 -4.376 1.00 29.14 N HETATM 2941 ZN ZN D 418 -19.724 2.073 -5.706 1.00 44.36 N HETATM 2942 C TRS D -72 -12.017 -7.901 -12.728 1.00 45.33 C HETATM 2943 C1 TRS D -72 -12.598 -6.438 -12.872 1.00 46.09 C HETATM 2944 C2 TRS D -72 -12.975 -8.802 -11.879 1.00 45.52 C HETATM 2945 C3 TRS D -72 -10.746 -8.259 -11.861 1.00 44.93 C HETATM 2946 N TRS D -72 -11.348 -8.258 -14.103 1.00 50.70 N HETATM 2947 O1 TRS D -72 -13.625 -6.156 -11.858 1.00 51.43 O HETATM 2948 O2 TRS D -72 -14.268 -8.820 -12.189 1.00 54.54 O HETATM 2949 O3 TRS D -72 -9.512 -7.715 -12.339 1.00 48.66 O TER 2951 TRS D -72 HETATM 2951 O HOH A 141 -0.701 0.797 7.669 1.00 28.76 O HETATM 2952 O HOH A 142 -5.294 22.133 28.858 1.00 29.37 O HETATM 2953 O HOH A 143 4.839 10.475 11.596 1.00 35.26 O HETATM 2954 O HOH A 144 -13.548 5.444 5.519 1.00 34.14 O HETATM 2955 O HOH A 145 7.486 2.649 13.635 1.00 41.75 O HETATM 2956 O HOH A 146 4.690 -5.048 6.254 1.00 41.83 O HETATM 2957 O HOH A 147 -6.639 7.415 33.722 1.00 43.82 O HETATM 2958 O HOH A 148 -14.210 15.482 12.145 1.00 39.64 O HETATM 2959 O HOH A 149 0.909 16.033 15.526 1.00 44.54 O HETATM 2960 O HOH A 150 -3.089 18.376 29.588 1.00 41.69 O HETATM 2961 O HOH A 151 -10.723 -0.891 17.268 1.00 46.20 O HETATM 2962 O HOH A 152 8.895 7.041 6.300 1.00 49.93 O HETATM 2963 O HOH A 153 -12.219 0.051 27.657 1.00 38.51 O HETATM 2964 O HOH A 154 -15.244 3.306 5.150 1.00 44.89 O HETATM 2965 O HOH A 155 -5.050 13.298 7.319 1.00 41.91 O HETATM 2966 O HOH A 156 -7.093 19.282 15.333 1.00 43.77 O HETATM 2967 O HOH A 157 -3.396 -0.442 25.771 1.00 46.35 O HETATM 2968 O HOH A 158 -5.510 -9.757 20.477 1.00 39.10 O HETATM 2969 O HOH A 159 -14.147 11.593 7.054 1.00 43.78 O HETATM 2970 O HOH A 160 1.823 -3.358 3.144 1.00 35.17 O HETATM 2971 O HOH A 161 6.161 7.773 1.748 1.00 48.98 O HETATM 2972 O HOH A 162 -9.144 18.362 17.667 1.00 46.97 O HETATM 2973 O HOH A 163 -12.079 17.651 14.192 1.00 46.23 O HETATM 2974 O HOH A 164 -20.619 2.739 7.366 1.00 48.03 O HETATM 2975 O HOH A 165 -12.825 18.732 18.954 1.00 49.61 O HETATM 2976 O HOH A 166 -19.918 13.435 17.677 1.00 55.40 O HETATM 2977 O HOH A 167 -16.000 4.141 26.459 1.00 52.21 O HETATM 2978 O HOH A 168 -17.087 3.357 21.562 1.00 45.97 O HETATM 2979 O HOH A 169 -11.717 13.660 8.601 1.00 58.53 O HETATM 2980 O HOH A 170 -9.525 0.827 2.977 1.00 63.75 O HETATM 2981 O HOH A 171 4.045 -3.040 4.733 1.00 41.40 O HETATM 2982 O HOH A 172 -15.645 0.237 15.421 1.00 53.52 O HETATM 2983 O HOH A 173 -22.703 0.092 11.535 1.00 46.98 O HETATM 2984 O HOH A 174 -4.021 -2.020 31.841 1.00 55.09 O HETATM 2985 O HOH A 175 -12.571 21.284 21.150 1.00 61.08 O HETATM 2986 O HOH A 176 2.779 1.617 23.123 1.00 46.44 O HETATM 2987 O HOH A 177 -18.857 10.658 21.286 1.00 52.15 O HETATM 2988 O HOH A 178 -9.193 -5.630 30.521 1.00 59.55 O HETATM 2989 O HOH A 179 -20.654 1.314 13.354 1.00 53.18 O HETATM 2990 O HOH A 180 -0.750 22.649 30.330 1.00 64.39 O HETATM 2991 O HOH A 181 -2.679 18.778 14.366 1.00 61.02 O HETATM 2992 O HOH A 182 7.536 4.802 14.746 1.00 50.44 O HETATM 2993 O HOH A 183 -0.815 14.084 8.832 1.00 48.62 O HETATM 2994 O HOH A 184 -20.540 8.771 21.377 1.00 48.42 O HETATM 2995 O HOH A 185 -19.049 13.132 8.582 1.00 49.04 O HETATM 2996 O HOH A 186 -3.063 14.862 8.047 1.00 51.38 O HETATM 2997 O HOH A 187 -2.596 21.212 28.403 1.00 52.84 O HETATM 2998 O HOH A 188 -7.783 -8.022 27.262 1.00 49.81 O HETATM 2999 O HOH A 189 -0.165 11.663 -0.019 1.00 59.97 O HETATM 3000 O HOH A 190 -9.482 20.936 17.754 1.00 56.53 O HETATM 3001 O HOH A 191 -11.939 5.531 32.116 1.00 39.01 O HETATM 3002 O HOH A 192 -15.222 18.762 21.041 1.00 39.40 O HETATM 3003 O HOH A 193 -7.417 -10.135 18.648 1.00 48.12 O HETATM 3004 O HOH A 194 -21.750 15.711 14.429 1.00 50.11 O HETATM 3005 O HOH A 195 -16.080 20.717 25.688 1.00 55.24 O HETATM 3006 O HOH A 196 5.046 5.426 18.523 1.00 50.01 O HETATM 3007 O HOH A 197 -18.508 2.862 14.493 1.00 47.50 O HETATM 3008 O HOH A 198 -21.571 6.422 7.810 1.00 51.85 O HETATM 3009 O HOH A 199 -2.729 1.883 33.750 1.00 52.30 O HETATM 3010 O HOH A 200 -22.524 13.561 11.478 1.00 49.48 O HETATM 3011 O HOH A 201 -8.623 3.161 2.415 1.00 53.28 O HETATM 3012 O HOH A 202 -17.640 1.252 4.307 1.00 55.56 O HETATM 3013 O HOH A 203 -21.073 -1.262 13.400 1.00 53.26 O HETATM 3014 O HOH A 204 -3.952 -9.282 13.641 1.00 49.25 O HETATM 3015 O HOH A 205 9.172 3.341 11.611 1.00 53.47 O HETATM 3016 O HOH A 206 -17.013 19.296 18.452 1.00 54.22 O HETATM 3017 O HOH A 207 -4.898 -8.308 26.705 1.00 52.89 O TER 3019 HOH A 207 HETATM 3019 O HOH B 141 2.950 -10.555 -26.251 1.00 33.71 O HETATM 3020 O HOH B 142 -2.026 -4.931 -2.079 1.00 41.45 O HETATM 3021 O HOH B 143 3.333 -9.275 -33.516 1.00 50.84 O HETATM 3022 O HOH B 144 -0.220 5.817 -0.982 1.00 37.15 O HETATM 3023 O HOH B 145 11.483 -5.137 -32.687 1.00 37.59 O HETATM 3024 O HOH B 146 4.123 -9.489 -24.052 1.00 40.29 O HETATM 3025 O HOH B 147 11.643 11.626 -24.294 1.00 43.92 O HETATM 3026 O HOH B 148 15.450 -4.438 -26.581 1.00 36.97 O HETATM 3027 O HOH B 149 -3.231 -9.635 -27.748 1.00 42.83 O HETATM 3028 O HOH B 150 -10.613 -0.022 -5.147 1.00 50.55 O HETATM 3029 O HOH B 151 13.217 0.695 -5.005 1.00 47.71 O HETATM 3030 O HOH B 152 0.189 -2.209 0.378 1.00 41.37 O HETATM 3031 O HOH B 153 -1.631 9.332 -20.247 1.00 42.18 O HETATM 3032 O HOH B 154 6.903 7.111 -3.911 1.00 59.47 O HETATM 3033 O HOH B 155 -1.531 -1.461 -24.397 1.00 35.99 O HETATM 3034 O HOH B 156 13.176 3.063 -7.154 1.00 42.88 O HETATM 3035 O HOH B 157 7.897 11.808 -23.143 1.00 55.64 O HETATM 3036 O HOH B 158 13.069 11.074 -16.786 1.00 45.04 O HETATM 3037 O HOH B 159 0.400 -1.904 -7.678 1.00 39.94 O HETATM 3038 O HOH B 160 5.319 13.115 -21.148 1.00 52.57 O HETATM 3039 O HOH B 161 4.863 -16.149 -16.045 1.00 53.86 O HETATM 3040 O HOH B 162 -4.966 4.317 -17.016 1.00 50.31 O HETATM 3041 O HOH B 163 4.375 9.933 -11.306 1.00 51.68 O HETATM 3042 O HOH B 164 14.284 7.347 -46.513 1.00 59.36 O HETATM 3043 O HOH B 165 13.485 8.857 -10.525 1.00 54.93 O HETATM 3044 O HOH B 166 15.350 12.570 -20.471 1.00 55.63 O HETATM 3045 O HOH B 167 6.665 -3.891 -34.227 1.00 51.41 O HETATM 3046 O HOH B 168 15.921 -4.421 -16.245 1.00 55.46 O HETATM 3047 O HOH B 169 8.740 11.320 -20.252 1.00 50.57 O HETATM 3048 O HOH B 170 16.633 -3.692 -21.986 1.00 45.97 O HETATM 3049 O HOH B 172 20.130 -2.365 -12.985 1.00 53.56 O HETATM 3050 O HOH B 173 -7.283 4.510 -11.577 1.00 55.17 O HETATM 3051 O HOH B 174 7.557 -16.624 -23.072 1.00 59.55 O HETATM 3052 O HOH B 175 14.089 11.127 -26.158 1.00 45.89 O HETATM 3053 O HOH B 176 -3.932 5.281 -19.141 1.00 52.91 O HETATM 3054 O HOH B 177 10.934 12.158 -19.595 1.00 59.91 O HETATM 3055 O HOH B 178 2.556 9.832 -6.412 1.00 59.49 O HETATM 3056 O HOH B 181 6.781 -11.636 -31.006 1.00 43.90 O HETATM 3057 O HOH B 182 1.020 1.762 -1.506 1.00 46.62 O HETATM 3058 O HOH B 183 -5.592 5.942 -14.338 1.00 47.90 O HETATM 3059 O HOH B 184 10.061 7.772 -37.240 1.00 52.62 O HETATM 3060 O HOH B 185 -3.354 6.725 -21.419 1.00 50.86 O HETATM 3061 O HOH B 186 22.433 1.908 -31.543 1.00 53.42 O HETATM 3062 O HOH B 187 15.246 -15.094 -21.015 1.00 52.17 O HETATM 3063 O HOH B 188 18.141 -1.589 -15.885 1.00 55.12 O HETATM 3064 O HOH B 189 16.165 0.981 -4.413 1.00 54.94 O HETATM 3065 O HOH B 190 0.093 -10.793 -29.473 1.00 53.35 O HETATM 3066 O HOH B 191 3.931 -16.217 -22.503 1.00 52.21 O HETATM 3067 O HOH B 192 -8.990 4.017 -8.059 1.00 50.91 O HETATM 3068 O HOH B 193 21.088 10.355 -14.660 1.00 49.50 O HETATM 3069 O HOH B 194 10.564 10.255 -13.214 1.00 56.15 O HETATM 3070 O HOH B 195 16.419 -6.460 -20.884 1.00 54.92 O HETATM 3071 O HOH B 196 15.441 -8.406 -32.696 1.00 52.33 O TER 3073 HOH B 196 HETATM 3073 O HOH C 420 43.335 -10.416 13.611 1.00 60.20 O HETATM 3074 O HOH C 421 5.619 -7.057 4.373 1.00 34.67 O HETATM 3075 O HOH C 422 24.253 1.101 -2.353 1.00 25.09 O HETATM 3076 O HOH C 423 8.604 -10.452 14.252 1.00 34.17 O HETATM 3077 O HOH C 424 30.392 6.482 -2.447 1.00 41.21 O HETATM 3078 O HOH C 425 -4.082 -15.372 -0.808 1.00 43.14 O HETATM 3079 O HOH C 426 23.294 -1.094 10.711 1.00 43.38 O HETATM 3080 O HOH C 427 10.274 1.980 5.023 1.00 44.09 O HETATM 3081 O HOH C 428 25.576 2.794 -0.395 1.00 42.41 O HETATM 3082 O HOH C 429 24.581 2.667 3.563 1.00 33.75 O HETATM 3083 O HOH C 430 21.774 -4.493 -3.490 1.00 43.52 O HETATM 3084 O HOH C 431 33.899 -0.067 12.922 1.00 36.17 O HETATM 3085 O HOH C 432 9.176 -12.940 6.785 1.00 38.29 O HETATM 3086 O HOH C 433 15.349 2.739 7.439 1.00 54.79 O HETATM 3087 O HOH C 434 9.387 4.091 8.390 1.00 44.50 O HETATM 3088 O HOH C 435 40.648 -12.887 3.536 1.00 51.19 O HETATM 3089 O HOH C 436 -2.236 -11.154 9.019 1.00 45.18 O HETATM 3090 O HOH C 437 15.717 0.083 9.245 1.00 52.56 O HETATM 3091 O HOH C 438 27.297 0.794 3.384 1.00 58.71 O HETATM 3092 O HOH C 439 7.140 -0.644 -1.779 1.00 56.19 O HETATM 3093 O HOH C 440 5.462 0.924 19.329 1.00 56.65 O HETATM 3094 O HOH C 441 15.355 -3.909 6.716 1.00 36.49 O HETATM 3095 O HOH C 442 1.477 -14.547 9.814 1.00 41.60 O HETATM 3096 O HOH C 443 -3.507 -10.508 16.333 1.00 44.67 O HETATM 3097 O HOH C 444 20.358 -11.486 -0.104 1.00 49.95 O HETATM 3098 O HOH C 445 9.375 -9.899 18.762 1.00 52.71 O HETATM 3099 O HOH C 446 26.937 8.312 -0.003 1.00 50.81 O HETATM 3100 O HOH C 447 18.630 -9.213 10.548 1.00 51.34 O HETATM 3101 O HOH C 448 8.537 -17.436 12.155 1.00 52.52 O HETATM 3102 O HOH C 449 17.199 10.294 4.111 1.00 53.68 O HETATM 3103 O HOH C 450 5.390 -16.169 9.079 1.00 51.95 O HETATM 3104 O HOH C 451 10.795 -17.055 15.845 1.00 54.03 O HETATM 3105 O HOH C 452 7.704 -16.009 -0.594 1.00 53.36 O HETATM 3106 O HOH C 453 29.166 8.830 -1.739 1.00 51.16 O TER 3108 HOH C 453 HETATM 3108 O HOH D 180 -4.318 -6.916 -4.194 1.00 48.55 O HETATM 3109 O HOH D 420 4.366 -13.990 5.856 1.00 42.78 O HETATM 3110 O HOH D 421 -8.585 -15.112 -9.672 1.00 44.44 O HETATM 3111 O HOH D 422 -5.396 -8.279 -1.833 1.00 37.86 O HETATM 3112 O HOH D 423 -8.887 -14.830 -1.930 1.00 36.10 O HETATM 3113 O HOH D 424 -24.666 1.316 -4.062 1.00 40.10 O HETATM 3114 O HOH D 425 -12.932 1.552 4.298 1.00 34.84 O HETATM 3115 O HOH D 426 -30.181 7.357 -0.539 1.00 45.24 O HETATM 3116 O HOH D 427 -23.262 -5.268 -9.623 1.00 48.10 O HETATM 3117 O HOH D 428 -26.899 8.049 -3.111 1.00 47.13 O HETATM 3118 O HOH D 429 -4.455 -17.793 -12.601 1.00 48.20 O HETATM 3119 O HOH D 430 -25.582 0.296 1.380 1.00 52.31 O HETATM 3120 O HOH D 431 -4.017 -17.550 2.733 1.00 61.44 O HETATM 3121 O HOH D 432 -15.201 -6.781 -5.069 1.00 39.07 O HETATM 3122 O HOH D 433 -15.877 -3.925 -8.317 1.00 52.02 O HETATM 3123 O HOH D 434 -34.037 -3.968 -12.415 1.00 41.23 O HETATM 3124 O HOH D 435 1.547 -17.377 7.591 1.00 50.74 O HETATM 3125 O HOH D 437 -16.956 5.298 -0.631 1.00 55.83 O HETATM 3126 O HOH D 438 6.608 -15.319 5.532 1.00 55.01 O HETATM 3127 O HOH D 439 -1.130 -17.245 -4.326 1.00 39.45 O HETATM 3128 O HOH D 440 -14.101 -12.966 -0.058 1.00 46.99 O HETATM 3129 O HOH D 441 -25.720 -9.792 -0.459 1.00 50.69 O HETATM 3130 O HOH D 442 -5.251 -18.578 -3.240 1.00 46.59 O HETATM 3131 O HOH D 443 -28.190 -5.145 -11.487 1.00 56.38 O HETATM 3132 O HOH D 444 -11.797 -7.295 -9.326 1.00 53.02 O HETATM 3133 O HOH D 445 -30.707 -9.387 -11.729 1.00 54.37 O HETATM 3134 O HOH D 446 -9.631 0.556 -9.040 1.00 49.57 O HETATM 3135 O HOH D 447 -2.234 -15.924 -15.930 1.00 56.52 O HETATM 3136 O HOH D 448 -17.294 -12.001 -8.796 1.00 54.65 O HETATM 3137 O HOH D 449 5.903 -16.755 -5.310 1.00 53.85 O HETATM 3138 O HOH D 450 -10.874 -17.496 -4.034 1.00 52.02 O TER 3139 HOH D 450 ENDMDL MASTER END