USER MOD reduce.3.24.130724 H: found=0, std=0, add=1631, rem=0, adj=60 USER MOD reduce.3.24.130724 removed 388 hydrogens (2 hets) HEADER COMPLEX (TRANSFERASE/PEPTIDE) 10-DEC-97 1A1B TITLE C-SRC (SH2 DOMAIN) COMPLEXED WITH ACE-PHOSPHOTYR-GLU-(N,N- TITLE 2 DIPENTYL AMINE) COMPND MOL_ID: 1; COMPND 2 MOLECULE: C-SRC TYROSINE KINASE; COMPND 3 CHAIN: A, B; COMPND 4 FRAGMENT: SH2 DOMAIN; COMPND 5 EC: 2.7.1.112; COMPND 6 ENGINEERED: YES; COMPND 7 MOL_ID: 2; COMPND 8 MOLECULE: ACE-PHOSPHOTYR-GLU-(N,N-DIPENTYL AMINE); COMPND 9 CHAIN: C, D; COMPND 0 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 CELLULAR_LOCATION: CYTOPLASM; SOURCE 6 GENE: SRC; SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 8 EXPRESSION_SYSTEM_TAXID: 511693; SOURCE 9 EXPRESSION_SYSTEM_STRAIN: BL21; SOURCE 0 EXPRESSION_SYSTEM_CELLULAR_LOCATION: CYTOPLASM; SOURCE 1 EXPRESSION_SYSTEM_PLASMID: PET11B; SOURCE 2 EXPRESSION_SYSTEM_GENE: SRC; SOURCE 3 MOL_ID: 2 KEYWDS COMPLEX (TRANSFERASE/PEPTIDE) EXPDTA X-RAY DIFFRACTION AUTHOR L.SHEWCHUK,S.JORDAN REVDAT 2 24-FEB-09 1A1B 1 VERSN REVDAT 1 08-APR-98 1A1B 0 JRNL AUTH P.S.CHARIFSON,L.M.SHEWCHUK,W.ROCQUE,C.W.HUMMEL, JRNL AUTH 2 S.R.JORDAN,C.MOHR,G.J.PACOFSKY,M.R.PEEL, JRNL AUTH 3 M.RODRIGUEZ,D.D.STERNBACH,T.G.CONSLER JRNL TITL PEPTIDE LIGANDS OF PP60(C-SRC) SH2 DOMAINS: A JRNL TITL 2 THERMODYNAMIC AND STRUCTURAL STUDY. JRNL REF BIOCHEMISTRY V. 36 6283 1997 JRNL REFN ISSN 0006-2960 JRNL PMID 9174343 JRNL DOI 10.1021/BI970019N REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 2.20 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.1 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.20 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 6.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 2.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 100000.000 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0000 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 79.0 REMARK 3 NUMBER OF REFLECTIONS : 11385 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : NULL REMARK 3 FREE R VALUE TEST SET SELECTION : NULL REMARK 3 R VALUE (WORKING SET) : 0.174 REMARK 3 FREE R VALUE : NULL REMARK 3 FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 FREE R VALUE TEST SET COUNT : NULL REMARK 3 ESTIMATED ERROR OF FREE R VALUE : NULL REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 8 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.20 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.30 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 58.00 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 2073 REMARK 3 BIN R VALUE (WORKING SET) : NULL REMARK 3 BIN FREE R VALUE : NULL REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 BIN FREE R VALUE TEST SET COUNT : NULL REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : NULL REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1634 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 78 REMARK 3 SOLVENT ATOMS : 58 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM SIGMAA (A) : NULL REMARK 3 LOW RESOLUTION CUTOFF (A) : NULL REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM C-V SIGMAA (A) : NULL REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.015 REMARK 3 BOND ANGLES (DEGREES) : 2.50 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 23.70 REMARK 3 IMPROPER ANGLES (DEGREES) : 1.19 REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : NULL 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 NCS MODEL : UNRESTRAINED 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 : PARAM19X.PRO REMARK 3 PARAMETER FILE 2 : NULL REMARK 3 PARAMETER FILE 3 : NULL REMARK 3 TOPOLOGY FILE 1 : TOPH19X.PRO REMARK 3 TOPOLOGY FILE 2 : NULL REMARK 3 TOPOLOGY FILE 3 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: PARTIALLY REFINED REMARK 4 REMARK 4 1A1B COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : SEP-93 REMARK 200 TEMPERATURE (KELVIN) : 287 REMARK 200 PH : 8.0 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N REMARK 200 RADIATION SOURCE : NULL REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : SIEMENS REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418 REMARK 200 MONOCHROMATOR : GRAPHITE(002) REMARK 200 OPTICS : COLLIMATOR REMARK 200 REMARK 200 DETECTOR TYPE : IMAGE PLATE REMARK 200 DETECTOR MANUFACTURER : RIGAKU REMARK 200 INTENSITY-INTEGRATION SOFTWARE : BIOTEX REMARK 200 DATA SCALING SOFTWARE : BIOTEX REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 12571 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.200 REMARK 200 RESOLUTION RANGE LOW (A) : 15.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 1.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 80.0 REMARK 200 DATA REDUNDANCY : 3.200 REMARK 200 R MERGE (I) : 0.07700 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 13.6000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.20 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.30 REMARK 200 COMPLETENESS FOR SHELL (%) : 80.0 REMARK 200 DATA REDUNDANCY IN SHELL : 2.70 REMARK 200 R MERGE FOR SHELL (I) : 0.21000 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 3.100 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: NULL REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: X-PLOR 3.1 REMARK 200 STARTING MODEL: PDB ENTRY 1SHD REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 54.00 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.60 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: PROTEIN WAS CRYSTALLIZED FROM 2M REMARK 280 AMMONIUM SULFATE AT 4 DEGREES C., PH 8.0, TEMPERATURE 277K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X+1/2,-Y,Z+1/2 REMARK 290 3555 -X,Y+1/2,-Z+1/2 REMARK 290 4555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 26.25000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 37.25000 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 33.55000 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 37.25000 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 26.25000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 33.55000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TETRAMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, C, B, D REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 MET A 143 REMARK 465 ASP A 144 REMARK 465 MET B 143 REMARK 465 ASP B 144 REMARK 465 SER B 145 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS(M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 GLU A 169 CG CD OE1 OE2 REMARK 470 ARG A 172 CG CD NE CZ NH1 NH2 REMARK 470 LYS A 184 CG CD CE NZ REMARK 470 ASN A 196 CG OD1 ND2 REMARK 470 LYS A 198 CG CD CE NZ REMARK 470 GLN A 222 CG CD OE1 NE2 REMARK 470 GLN B 147 CG CD OE1 NE2 REMARK 470 LYS B 155 CG CD CE NZ REMARK 470 ARG B 159 CG CD NE CZ NH1 NH2 REMARK 470 GLU B 169 CG CD OE1 OE2 REMARK 470 LYS B 184 CG CD CE NZ REMARK 470 ASN B 196 CG OD1 ND2 REMARK 470 LYS B 198 CG CD CE NZ REMARK 470 LYS B 235 CG CD CE NZ REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS 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,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) 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 RES CSSEQI ATM2 DEVIATION REMARK 500 HIS A 204 NE2 HIS A 204 CD2 -0.067 REMARK 500 HIS A 242 NE2 HIS A 242 CD2 -0.069 REMARK 500 HIS B 204 NE2 HIS B 204 CD2 -0.068 REMARK 500 HIS B 236 NE2 HIS B 236 CD2 -0.070 REMARK 500 HIS B 242 NE2 HIS B 242 CD2 -0.070 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 TRP A 151 CD1 - CG - CD2 ANGL. DEV. = 5.8 DEGREES REMARK 500 TRP A 151 CE2 - CD2 - CG ANGL. DEV. = -5.6 DEGREES REMARK 500 ARG A 158 NE - CZ - NH1 ANGL. DEV. = 3.7 DEGREES REMARK 500 ARG A 158 NE - CZ - NH2 ANGL. DEV. = -5.5 DEGREES REMARK 500 TRP B 151 CD1 - CG - CD2 ANGL. DEV. = 6.4 DEGREES REMARK 500 TRP B 151 CB - CG - CD1 ANGL. DEV. = -7.8 DEGREES REMARK 500 TRP B 151 CE2 - CD2 - CG ANGL. DEV. = -6.1 DEGREES REMARK 500 LEU B 166 CA - C - N ANGL. DEV. = -14.6 DEGREES REMARK 500 ARG B 220 NE - CZ - NH2 ANGL. DEV. = -4.3 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 ASP B 238 52.63 37.02 REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ACE C 100 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ACE D 100 DBREF 1A1B A 144 249 UNP P12931 SRC_HUMAN 143 248 DBREF 1A1B B 144 249 UNP P12931 SRC_HUMAN 143 248 DBREF 1A1B C 100 103 PDB 1A1B 1A1B 100 103 DBREF 1A1B D 100 103 PDB 1A1B 1A1B 100 103 SEQRES 1 A 107 MET ASP SER ILE GLN ALA GLU GLU TRP TYR PHE GLY LYS SEQRES 2 A 107 ILE THR ARG ARG GLU SER GLU ARG LEU LEU LEU ASN ALA SEQRES 3 A 107 GLU ASN PRO ARG GLY THR PHE LEU VAL ARG GLU SER GLU SEQRES 4 A 107 THR THR LYS GLY ALA TYR CYS LEU SER VAL SER ASP PHE SEQRES 5 A 107 ASP ASN ALA LYS GLY LEU ASN VAL LYS HIS TYR LYS ILE SEQRES 6 A 107 ARG LYS LEU ASP SER GLY GLY PHE TYR ILE THR SER ARG SEQRES 7 A 107 THR GLN PHE ASN SER LEU GLN GLN LEU VAL ALA TYR TYR SEQRES 8 A 107 SER LYS HIS ALA ASP GLY LEU CYS HIS ARG LEU THR THR SEQRES 9 A 107 VAL CYS PRO SEQRES 1 C 4 ACE PTR GLU DIP SEQRES 1 B 107 MET ASP SER ILE GLN ALA GLU GLU TRP TYR PHE GLY LYS SEQRES 2 B 107 ILE THR ARG ARG GLU SER GLU ARG LEU LEU LEU ASN ALA SEQRES 3 B 107 GLU ASN PRO ARG GLY THR PHE LEU VAL ARG GLU SER GLU SEQRES 4 B 107 THR THR LYS GLY ALA TYR CYS LEU SER VAL SER ASP PHE SEQRES 5 B 107 ASP ASN ALA LYS GLY LEU ASN VAL LYS HIS TYR LYS ILE SEQRES 6 B 107 ARG LYS LEU ASP SER GLY GLY PHE TYR ILE THR SER ARG SEQRES 7 B 107 THR GLN PHE ASN SER LEU GLN GLN LEU VAL ALA TYR TYR SEQRES 8 B 107 SER LYS HIS ALA ASP GLY LEU CYS HIS ARG LEU THR THR SEQRES 9 B 107 VAL CYS PRO SEQRES 1 D 4 ACE PTR GLU DIP MODRES 1A1B PTR C 101 TYR O-PHOSPHOTYROSINE MODRES 1A1B PTR D 101 TYR O-PHOSPHOTYROSINE HET ACE C 100 3 HET PTR C 101 17 HET DIP C 103 11 HET ACE D 100 3 HET PTR D 101 17 HET DIP D 103 11 HETNAM ACE ACETYL GROUP HETNAM PTR O-PHOSPHOTYROSINE HETNAM DIP DIPENTYLAMINE HETSYN PTR PHOSPHONOTYROSINE FORMUL 2 ACE 2(C2 H4 O) FORMUL 2 PTR 2(C9 H12 N O6 P) FORMUL 2 DIP 2(C10 H23 N) FORMUL 5 HOH *58(H2 O) HELIX 1 1 ILE A 146 ALA A 148 5 3 HELIX 2 2 ARG A 158 LEU A 165 1 8 HELIX 3 3 LEU A 226 LYS A 235 1 10 HELIX 4 4 ARG B 158 LEU B 165 1 8 HELIX 5 5 LEU B 226 LYS B 235 1 10 SHEET 1 A 3 PHE A 175 GLU A 179 0 SHEET 2 A 3 TYR A 187 ASP A 195 -1 N SER A 190 O LEU A 176 SHEET 3 A 3 GLY A 199 ILE A 207 -1 N ILE A 207 O TYR A 187 SHEET 1 B 3 PHE B 175 GLU B 179 0 SHEET 2 B 3 TYR B 187 ASP B 195 -1 N SER B 190 O LEU B 176 SHEET 3 B 3 GLY B 199 ILE B 207 -1 N ILE B 207 O TYR B 187 LINK C ACE C 100 N PTR C 101 1555 1555 1.32 LINK C PTR C 101 N GLU C 102 1555 1555 1.32 LINK N DIP C 103 C GLU C 102 1555 1555 1.36 LINK C ACE D 100 N PTR D 101 1555 1555 1.32 LINK C PTR D 101 N GLU D 102 1555 1555 1.32 LINK N DIP D 103 C GLU D 102 1555 1555 1.35 SITE *** AC1 2 ARG A 158 HOH C 500 SITE *** AC2 2 ARG B 158 HOH D 506 CRYST1 52.500 67.100 74.500 90.00 90.00 90.00 P 21 21 21 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 0.019048 0.000000 0.000000 0.00000 SCALE2 0.000000 0.014903 0.000000 0.00000 SCALE3 0.000000 0.000000 0.013423 0.00000 MTRIX1 1 -0.780600 0.308000 -0.543900 99.23890 1 MTRIX2 1 0.308400 0.946600 0.093500 -1.75440 1 MTRIX3 1 0.543600 -0.094800 -0.833900 31.34800 1 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: C 101 PTR HN2 : C 101 PTR N : C 100 ACE C :(H bumps) USER MOD NoAdj-H: C 101 PTR H : C 101 PTR N : C 100 ACE C :(H bumps) USER MOD NoAdj-H: C 103 DIP HN : C 103 DIP N : C 102 GLU C :(H bumps) USER MOD NoAdj-H: D 101 PTR HN2 : D 101 PTR N : D 100 ACE C :(H bumps) USER MOD NoAdj-H: D 101 PTR H : D 101 PTR N : D 100 ACE C :(H bumps) USER MOD NoAdj-H: D 103 DIP HN : D 103 DIP N : D 102 GLU C :(H bumps) USER MOD Set 1.1: B 225 SER OG : rot -78:sc= 1.1 USER MOD Set 1.2: B 228 GLN : amide:sc= 0.926 K(o=2,f=1.5) USER MOD Set 2.1: B 205 TYR OH : rot 165:sc= 0.303 USER MOD Set 2.2: B 241 CYS SG : rot 110:sc= -0.549 USER MOD Set 3.1: B 201 ASN : amide:sc= 0.753 K(o=2.1,f=-6.6!) USER MOD Set 3.2: B 203 LYS NZ :NH3+ -131:sc= 1.33 (180deg=-0.127) USER MOD Set 4.1: B 161 SER OG : rot -39:sc= 0.672 USER MOD Set 4.2: B 188 CYS SG : rot 70:sc= -0.712 USER MOD Set 4.3: B 190 SER OG : rot -78:sc= 1.39 USER MOD Set 4.4: B 204 HIS : no HD1:sc= 1.72 K(o=3.1,f=-6.6!) USER MOD Set 5.1: B 183 THR OG1 : rot -120:sc= 0.931 USER MOD Set 5.2: B 206 LYS NZ :NH3+ -167:sc= 1.46! (180deg=0.689) USER MOD Set 6.1: A 245 THR OG1 : rot -143:sc= 0.332 USER MOD Set 6.2: A 246 THR OG1 : rot 120:sc= -0.0115 USER MOD Set 7.1: A 205 TYR OH : rot -3:sc= 0.593 USER MOD Set 7.2: A 241 CYS SG : rot 180:sc= -0.0177 USER MOD Set 8.1: A 201 ASN : amide:sc= 0.939 K(o=3.2,f=-8!) USER MOD Set 8.2: A 203 LYS NZ :NH3+ -153:sc= 2.22 (180deg=-0.245) USER MOD Set 9.1: A 188 CYS SG : rot 160:sc= -0.141 USER MOD Set 9.2: A 190 SER OG : rot -92:sc= 0.327 USER MOD Set 9.3: A 204 HIS : no HD1:sc= 1.04 K(o=1.2,f=-3.5!) USER MOD Set10.1: A 183 THR OG1 : rot -99:sc= 0.723 USER MOD Set10.2: A 206 LYS NZ :NH3+ -179:sc= 1.82 (180deg=0.763) USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 147 GLN : amide:sc= 1.34 X(o=1.3,f=1.1) USER MOD Single : A 152 TYR OH : rot -30:sc= 1.28 USER MOD Single : A 155 LYS NZ :NH3+ 168:sc= 1.19 (180deg=0.667) USER MOD Single : A 157 THR OG1 : rot 177:sc= 0.907 USER MOD Single : A 161 SER OG : rot -47:sc= 1.34 USER MOD Single : A 167 ASN : amide:sc= 0.575 K(o=0.57,f=-4.9!) USER MOD Single : A 170 ASN : amide:sc= 0.0545 X(o=0.055,f=-0.41) USER MOD Single : A 174 THR OG1 : rot 81:sc= 0.632 USER MOD Single : A 180 SER OG : rot 69:sc= 0.234 USER MOD Single : A 182 THR OG1 : rot 180:sc= 0 USER MOD Single : A 187 TYR OH : rot 180:sc= 0 USER MOD Single : A 192 SER OG : rot 160:sc= -0.164 USER MOD Single : A 209 LYS NZ :NH3+ -172:sc=-0.00413 (180deg=-0.0342) USER MOD Single : A 212 SER OG : rot 180:sc= 0 USER MOD Single : A 216 TYR OH : rot 180:sc= 0 USER MOD Single : A 218 THR OG1 : rot -120:sc= 1.13 USER MOD Single : A 219 SER OG : rot 180:sc= 0.0107 USER MOD Single : A 221 THR OG1 : rot 102:sc= 0.95 USER MOD Single : A 224 ASN : amide:sc= 0 X(o=0,f=-0.0024) USER MOD Single : A 225 SER OG : rot -90:sc= -0.321 USER MOD Single : A 227 GLN : amide:sc= 0.286 K(o=0.29,f=-5.4!) USER MOD Single : A 228 GLN : amide:sc= -0.188 K(o=-0.19,f=-2.9!) USER MOD Single : A 232 TYR OH : rot -177:sc= 0.407 USER MOD Single : A 233 TYR OH : rot 10:sc= 2.1 USER MOD Single : A 234 SER OG : rot 77:sc= 0.458 USER MOD Single : A 235 LYS NZ :NH3+ 171:sc= -0.0169 (180deg=-0.136) USER MOD Single : A 236 HIS : no HD1:sc= -0.0151 X(o=-0.015,f=-0.0054) USER MOD Single : A 242 HIS :FLIP no HE2:sc= 1.01 F(o=-2.6!,f=1) USER MOD Single : A 248 CYS SG : rot -140:sc= -0.15 USER MOD Single : B 152 TYR OH : rot 180:sc= 0 USER MOD Single : B 157 THR OG1 : rot 180:sc=-0.00533 USER MOD Single : B 167 ASN : amide:sc= 0.429 K(o=0.43,f=-5.5!) USER MOD Single : B 170 ASN : amide:sc= -2.25! X(o=-2.3!,f=-2.5) USER MOD Single : B 174 THR OG1 : rot 90:sc= 0.39 USER MOD Single : B 180 SER OG : rot 57:sc= 0.609 USER MOD Single : B 182 THR OG1 : rot 120:sc= 0.383 USER MOD Single : B 187 TYR OH : rot 180:sc= 0 USER MOD Single : B 192 SER OG : rot 170:sc= 0 USER MOD Single : B 209 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 212 SER OG : rot -102:sc= 0.0302 USER MOD Single : B 216 TYR OH : rot 30:sc= 1.26 USER MOD Single : B 218 THR OG1 : rot -120:sc= 0.48 USER MOD Single : B 219 SER OG : rot 180:sc= 0.00769 USER MOD Single : B 221 THR OG1 : rot 113:sc= 0.405 USER MOD Single : B 222 GLN : amide:sc= 0.511 X(o=0.51,f=0.24) USER MOD Single : B 224 ASN : amide:sc= -0.129 X(o=-0.13,f=-0.0039) USER MOD Single : B 227 GLN : amide:sc= -0.285 K(o=-0.29,f=-1.1) USER MOD Single : B 232 TYR OH : rot -174:sc= 0.821 USER MOD Single : B 233 TYR OH : rot 6:sc= 1.4 USER MOD Single : B 234 SER OG : rot 74:sc= 0.684 USER MOD Single : B 236 HIS : no HD1:sc= -0.0271 X(o=-0.027,f=-0.016) USER MOD Single : B 242 HIS :FLIP no HE2:sc= 1.21 F(o=-3.7!,f=1.2) USER MOD Single : B 245 THR OG1 : rot -136:sc= 0.873 USER MOD Single : B 246 THR OG1 : rot 180:sc= 0 USER MOD Single : B 248 CYS SG : rot 160:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 145 59.828 26.341 14.313 1.00 36.45 N ATOM 2 CA SER A 145 60.142 25.500 15.447 1.00 35.26 C ATOM 3 C SER A 145 58.817 25.355 16.122 1.00 33.38 C ATOM 4 O SER A 145 58.251 26.381 16.505 1.00 33.19 O ATOM 5 CB SER A 145 61.074 26.159 16.498 1.00 36.10 C ATOM 6 OG SER A 145 61.174 25.432 17.732 1.00 35.56 O ATOM 0 HA SER A 145 60.588 24.695 15.141 1.00 35.26 H new ATOM 0 HB2 SER A 145 61.961 26.252 16.116 1.00 36.10 H new ATOM 0 HB3 SER A 145 60.751 27.054 16.687 1.00 36.10 H new ATOM 0 HG SER A 145 61.691 25.838 18.255 1.00 35.56 H new ATOM 8 N ILE A 146 58.418 24.102 16.363 1.00 28.88 N ATOM 9 CA ILE A 146 57.177 23.846 17.052 1.00 25.36 C ATOM 10 C ILE A 146 57.183 24.280 18.538 1.00 19.93 C ATOM 11 O ILE A 146 56.114 24.542 19.074 1.00 19.10 O ATOM 12 CB ILE A 146 56.886 22.337 16.815 1.00 26.95 C ATOM 13 CG1 ILE A 146 55.441 22.158 17.021 1.00 29.36 C ATOM 14 CG2 ILE A 146 57.593 21.388 17.750 1.00 27.85 C ATOM 15 CD1 ILE A 146 54.999 21.092 16.080 1.00 34.75 C ATOM 0 H ILE A 146 58.856 23.399 16.133 1.00 28.88 H new ATOM 0 HA ILE A 146 56.456 24.392 16.701 1.00 25.36 H new ATOM 0 HB ILE A 146 57.205 22.123 15.924 1.00 26.95 H new ATOM 0 HG12 ILE A 146 55.253 21.906 17.939 1.00 29.36 H new ATOM 0 HG13 ILE A 146 54.964 22.986 16.851 1.00 29.36 H new ATOM 0 HG21 ILE A 146 57.352 20.475 17.528 1.00 27.85 H new ATOM 0 HG22 ILE A 146 58.552 21.500 17.660 1.00 27.85 H new ATOM 0 HG23 ILE A 146 57.330 21.578 18.664 1.00 27.85 H new ATOM 0 HD11 ILE A 146 54.046 20.942 16.185 1.00 34.75 H new ATOM 0 HD12 ILE A 146 55.185 21.367 15.169 1.00 34.75 H new ATOM 0 HD13 ILE A 146 55.478 20.271 16.273 1.00 34.75 H new ATOM 17 N GLN A 147 58.344 24.480 19.195 1.00 11.28 N ATOM 18 CA GLN A 147 58.394 24.799 20.609 1.00 10.56 C ATOM 19 C GLN A 147 57.713 26.097 20.882 1.00 10.66 C ATOM 20 O GLN A 147 57.161 26.316 21.956 1.00 10.39 O ATOM 21 CB GLN A 147 59.828 24.949 21.120 1.00 13.69 C ATOM 22 CG GLN A 147 60.699 23.694 21.016 1.00 15.02 C ATOM 23 CD GLN A 147 60.135 22.473 21.717 1.00 14.95 C ATOM 24 OE1 GLN A 147 59.471 22.551 22.725 1.00 17.62 O ATOM 25 NE2 GLN A 147 60.373 21.276 21.259 1.00 17.99 N ATOM 0 H GLN A 147 59.116 24.431 18.820 1.00 11.28 H new ATOM 0 HA GLN A 147 57.954 24.061 21.060 1.00 10.56 H new ATOM 0 HB2 GLN A 147 60.258 25.664 20.625 1.00 13.69 H new ATOM 0 HB3 GLN A 147 59.796 25.226 22.049 1.00 13.69 H new ATOM 0 HG2 GLN A 147 60.830 23.482 20.078 1.00 15.02 H new ATOM 0 HG3 GLN A 147 61.573 23.890 21.387 1.00 15.02 H new ATOM 0 HE21 GLN A 147 60.841 21.174 20.545 1.00 17.99 H new ATOM 0 HE22 GLN A 147 60.062 20.588 21.671 1.00 17.99 H new ATOM 29 N ALA A 148 57.781 26.971 19.872 1.00 12.00 N ATOM 30 CA ALA A 148 57.245 28.312 19.979 1.00 10.94 C ATOM 31 C ALA A 148 55.865 28.452 19.390 1.00 11.58 C ATOM 32 O ALA A 148 55.346 29.574 19.359 1.00 14.62 O ATOM 33 CB ALA A 148 58.133 29.293 19.250 1.00 10.99 C ATOM 0 H ALA A 148 58.140 26.794 19.111 1.00 12.00 H new ATOM 0 HA ALA A 148 57.203 28.497 20.930 1.00 10.94 H new ATOM 0 HB1 ALA A 148 57.763 30.186 19.330 1.00 10.99 H new ATOM 0 HB2 ALA A 148 59.022 29.276 19.639 1.00 10.99 H new ATOM 0 HB3 ALA A 148 58.186 29.048 18.313 1.00 10.99 H new ATOM 35 N GLU A 149 55.234 27.389 18.897 1.00 12.14 N ATOM 36 CA GLU A 149 53.884 27.505 18.380 1.00 13.93 C ATOM 37 C GLU A 149 52.874 27.723 19.506 1.00 17.36 C ATOM 38 O GLU A 149 52.953 27.114 20.570 1.00 16.69 O ATOM 39 CB GLU A 149 53.514 26.258 17.622 1.00 15.79 C ATOM 40 CG GLU A 149 54.415 26.069 16.411 1.00 18.32 C ATOM 41 CD GLU A 149 54.108 26.919 15.179 1.00 26.62 C ATOM 42 OE1 GLU A 149 53.188 27.740 15.192 1.00 28.29 O ATOM 43 OE2 GLU A 149 54.778 26.704 14.165 1.00 31.75 O ATOM 0 H GLU A 149 55.571 26.599 18.855 1.00 12.14 H new ATOM 0 HA GLU A 149 53.860 28.273 17.788 1.00 13.93 H new ATOM 0 HB2 GLU A 149 53.586 25.487 18.206 1.00 15.79 H new ATOM 0 HB3 GLU A 149 52.589 26.312 17.336 1.00 15.79 H new ATOM 0 HG2 GLU A 149 55.328 26.251 16.683 1.00 18.32 H new ATOM 0 HG3 GLU A 149 54.378 25.135 16.150 1.00 18.32 H new ATOM 45 N GLU A 150 51.878 28.566 19.235 1.00 20.94 N ATOM 46 CA GLU A 150 50.799 28.953 20.148 1.00 24.34 C ATOM 47 C GLU A 150 49.973 27.756 20.647 1.00 19.16 C ATOM 48 O GLU A 150 49.517 27.660 21.784 1.00 18.18 O ATOM 49 CB GLU A 150 49.941 29.959 19.349 1.00 31.41 C ATOM 50 CG GLU A 150 48.694 30.587 19.970 1.00 47.90 C ATOM 51 CD GLU A 150 48.825 31.533 21.174 1.00 59.76 C ATOM 52 OE1 GLU A 150 49.929 32.076 21.434 1.00 66.99 O ATOM 53 OE2 GLU A 150 47.776 31.794 21.797 1.00 59.94 O ATOM 0 H GLU A 150 51.809 28.950 18.469 1.00 20.94 H new ATOM 0 HA GLU A 150 51.154 29.343 20.962 1.00 24.34 H new ATOM 0 HB2 GLU A 150 50.526 30.687 19.085 1.00 31.41 H new ATOM 0 HB3 GLU A 150 49.660 29.512 18.535 1.00 31.41 H new ATOM 0 HG2 GLU A 150 48.238 31.076 19.268 1.00 47.90 H new ATOM 0 HG3 GLU A 150 48.108 29.861 20.236 1.00 47.90 H new ATOM 55 N TRP A 151 49.754 26.836 19.703 1.00 12.71 N ATOM 56 CA TRP A 151 48.946 25.673 19.949 1.00 10.59 C ATOM 57 C TRP A 151 49.751 24.510 20.455 1.00 9.99 C ATOM 58 O TRP A 151 49.155 23.498 20.808 1.00 13.82 O ATOM 59 CB TRP A 151 48.207 25.275 18.649 1.00 11.12 C ATOM 60 CG TRP A 151 49.017 25.277 17.344 1.00 10.60 C ATOM 61 CD1 TRP A 151 48.868 26.311 16.450 1.00 13.21 C ATOM 62 CD2 TRP A 151 49.930 24.338 16.905 1.00 13.92 C ATOM 63 NE1 TRP A 151 49.695 26.047 15.456 1.00 12.12 N ATOM 64 CE2 TRP A 151 50.347 24.896 15.686 1.00 13.16 C ATOM 65 CE3 TRP A 151 50.494 23.139 17.346 1.00 16.57 C ATOM 66 CZ2 TRP A 151 51.299 24.276 14.895 1.00 14.40 C ATOM 67 CZ3 TRP A 151 51.454 22.509 16.564 1.00 17.79 C ATOM 68 CH2 TRP A 151 51.853 23.075 15.338 1.00 20.93 C ATOM 0 H TRP A 151 50.076 26.881 18.907 1.00 12.71 H new ATOM 0 HA TRP A 151 48.308 25.902 20.643 1.00 10.59 H new ATOM 0 HB2 TRP A 151 47.841 24.385 18.773 1.00 11.12 H new ATOM 0 HB3 TRP A 151 47.455 25.877 18.536 1.00 11.12 H new ATOM 0 HD1 TRP A 151 48.302 27.044 16.529 1.00 13.21 H new ATOM 0 HE1 TRP A 151 49.801 26.541 14.760 1.00 12.12 H new ATOM 0 HE3 TRP A 151 50.229 22.766 18.156 1.00 16.57 H new ATOM 0 HZ2 TRP A 151 51.563 24.652 14.086 1.00 14.40 H new ATOM 0 HZ3 TRP A 151 51.835 21.711 16.851 1.00 17.79 H new ATOM 0 HH2 TRP A 151 52.492 22.644 14.818 1.00 20.93 H new ATOM 71 N TYR A 152 51.091 24.570 20.490 1.00 8.62 N ATOM 72 CA TYR A 152 51.871 23.412 20.877 1.00 6.78 C ATOM 73 C TYR A 152 52.148 23.504 22.357 1.00 9.55 C ATOM 74 O TYR A 152 52.683 24.521 22.821 1.00 10.78 O ATOM 75 CB TYR A 152 53.167 23.386 20.121 1.00 8.15 C ATOM 76 CG TYR A 152 53.973 22.120 20.355 1.00 7.23 C ATOM 77 CD1 TYR A 152 53.413 20.886 20.012 1.00 11.92 C ATOM 78 CD2 TYR A 152 55.214 22.168 20.971 1.00 5.53 C ATOM 79 CE1 TYR A 152 54.083 19.693 20.299 1.00 8.86 C ATOM 80 CE2 TYR A 152 55.878 20.973 21.267 1.00 7.44 C ATOM 81 CZ TYR A 152 55.302 19.746 20.930 1.00 9.17 C ATOM 82 OH TYR A 152 55.952 18.580 21.262 1.00 12.35 O ATOM 0 H TYR A 152 51.553 25.269 20.294 1.00 8.62 H new ATOM 0 HA TYR A 152 51.381 22.600 20.674 1.00 6.78 H new ATOM 0 HB2 TYR A 152 52.983 23.474 19.173 1.00 8.15 H new ATOM 0 HB3 TYR A 152 53.700 24.154 20.379 1.00 8.15 H new ATOM 0 HD1 TYR A 152 52.586 20.858 19.588 1.00 11.92 H new ATOM 0 HD2 TYR A 152 55.601 22.986 21.185 1.00 5.53 H new ATOM 0 HE1 TYR A 152 53.708 18.874 20.066 1.00 8.86 H new ATOM 0 HE2 TYR A 152 56.706 20.996 21.690 1.00 7.44 H new ATOM 0 HH TYR A 152 55.387 17.977 21.414 1.00 12.35 H new ATOM 85 N PHE A 153 51.801 22.442 23.106 1.00 8.46 N ATOM 86 CA PHE A 153 52.011 22.464 24.537 1.00 9.58 C ATOM 87 C PHE A 153 53.012 21.470 25.084 1.00 8.23 C ATOM 88 O PHE A 153 53.035 21.162 26.271 1.00 7.55 O ATOM 89 CB PHE A 153 50.680 22.287 25.245 1.00 9.67 C ATOM 90 CG PHE A 153 49.865 23.570 25.299 1.00 5.55 C ATOM 91 CD1 PHE A 153 49.314 24.134 24.139 1.00 9.14 C ATOM 92 CD2 PHE A 153 49.625 24.148 26.539 1.00 8.37 C ATOM 93 CE1 PHE A 153 48.513 25.282 24.232 1.00 5.91 C ATOM 94 CE2 PHE A 153 48.831 25.288 26.624 1.00 5.61 C ATOM 95 CZ PHE A 153 48.278 25.847 25.478 1.00 7.46 C ATOM 0 H PHE A 153 51.450 21.719 22.799 1.00 8.46 H new ATOM 0 HA PHE A 153 52.407 23.331 24.714 1.00 9.58 H new ATOM 0 HB2 PHE A 153 50.166 21.601 24.791 1.00 9.67 H new ATOM 0 HB3 PHE A 153 50.839 21.971 26.148 1.00 9.67 H new ATOM 0 HD1 PHE A 153 49.479 23.748 23.309 1.00 9.14 H new ATOM 0 HD2 PHE A 153 49.993 23.776 27.308 1.00 8.37 H new ATOM 0 HE1 PHE A 153 48.143 25.660 23.467 1.00 5.91 H new ATOM 0 HE2 PHE A 153 48.670 25.678 27.453 1.00 5.61 H new ATOM 0 HZ PHE A 153 47.746 26.606 25.547 1.00 7.46 H new ATOM 97 N GLY A 154 53.877 20.949 24.234 1.00 8.61 N ATOM 98 CA GLY A 154 55.024 20.188 24.683 1.00 8.22 C ATOM 99 C GLY A 154 54.659 18.936 25.444 1.00 11.71 C ATOM 100 O GLY A 154 53.823 18.138 25.018 1.00 9.81 O ATOM 0 H GLY A 154 53.816 21.027 23.380 1.00 8.61 H new ATOM 0 HA2 GLY A 154 55.562 19.944 23.914 1.00 8.22 H new ATOM 0 HA3 GLY A 154 55.575 20.752 25.248 1.00 8.22 H new ATOM 102 N LYS A 155 55.279 18.799 26.613 1.00 14.77 N ATOM 103 CA LYS A 155 55.122 17.615 27.464 1.00 15.36 C ATOM 104 C LYS A 155 54.075 17.684 28.555 1.00 13.11 C ATOM 105 O LYS A 155 54.204 16.972 29.531 1.00 11.92 O ATOM 106 CB LYS A 155 56.468 17.273 28.111 1.00 17.64 C ATOM 107 CG LYS A 155 57.401 16.609 27.121 1.00 20.12 C ATOM 108 CD LYS A 155 58.819 16.653 27.650 1.00 25.94 C ATOM 109 CE LYS A 155 59.833 16.152 26.599 1.00 34.67 C ATOM 110 NZ LYS A 155 59.703 16.817 25.298 1.00 44.30 N ATOM 0 H LYS A 155 55.807 19.394 26.940 1.00 14.77 H new ATOM 0 HA LYS A 155 54.803 16.932 26.854 1.00 15.36 H new ATOM 0 HB2 LYS A 155 56.879 18.082 28.454 1.00 17.64 H new ATOM 0 HB3 LYS A 155 56.325 16.684 28.869 1.00 17.64 H new ATOM 0 HG2 LYS A 155 57.130 15.689 26.974 1.00 20.12 H new ATOM 0 HG3 LYS A 155 57.352 17.060 26.264 1.00 20.12 H new ATOM 0 HD2 LYS A 155 59.041 17.561 27.908 1.00 25.94 H new ATOM 0 HD3 LYS A 155 58.884 16.107 28.449 1.00 25.94 H new ATOM 0 HE2 LYS A 155 60.732 16.289 26.936 1.00 34.67 H new ATOM 0 HE3 LYS A 155 59.718 15.196 26.479 1.00 34.67 H new ATOM 0 HZ1 LYS A 155 60.409 16.622 24.793 1.00 44.30 H new ATOM 0 HZ2 LYS A 155 58.962 16.535 24.893 1.00 44.30 H new ATOM 0 HZ3 LYS A 155 59.659 17.698 25.418 1.00 44.30 H new ATOM 115 N ILE A 156 53.036 18.510 28.490 1.00 14.92 N ATOM 116 CA ILE A 156 51.972 18.479 29.501 1.00 12.63 C ATOM 117 C ILE A 156 51.252 17.150 29.459 1.00 13.05 C ATOM 118 O ILE A 156 51.103 16.545 28.389 1.00 11.28 O ATOM 119 CB ILE A 156 50.931 19.553 29.301 1.00 12.48 C ATOM 120 CG1 ILE A 156 50.258 19.470 27.942 1.00 13.31 C ATOM 121 CG2 ILE A 156 51.633 20.866 29.500 1.00 17.12 C ATOM 122 CD1 ILE A 156 49.044 20.370 28.054 1.00 22.00 C ATOM 0 H ILE A 156 52.924 19.097 27.871 1.00 14.92 H new ATOM 0 HA ILE A 156 52.414 18.625 30.352 1.00 12.63 H new ATOM 0 HB ILE A 156 50.208 19.444 29.939 1.00 12.48 H new ATOM 0 HG12 ILE A 156 50.853 19.768 27.236 1.00 13.31 H new ATOM 0 HG13 ILE A 156 50.002 18.558 27.731 1.00 13.31 H new ATOM 0 HG21 ILE A 156 51.001 21.592 29.381 1.00 17.12 H new ATOM 0 HG22 ILE A 156 52.002 20.903 30.396 1.00 17.12 H new ATOM 0 HG23 ILE A 156 52.349 20.952 28.852 1.00 17.12 H new ATOM 0 HD11 ILE A 156 48.560 20.367 27.214 1.00 22.00 H new ATOM 0 HD12 ILE A 156 48.465 20.046 28.762 1.00 22.00 H new ATOM 0 HD13 ILE A 156 49.329 21.274 28.259 1.00 22.00 H new ATOM 124 N THR A 157 50.794 16.697 30.637 1.00 11.53 N ATOM 125 CA THR A 157 50.216 15.373 30.762 1.00 10.59 C ATOM 126 C THR A 157 48.829 15.365 30.206 1.00 8.15 C ATOM 127 O THR A 157 48.268 16.432 29.948 1.00 9.29 O ATOM 128 CB THR A 157 50.173 14.955 32.221 1.00 10.27 C ATOM 129 OG1 THR A 157 49.383 15.962 32.868 1.00 12.08 O ATOM 130 CG2 THR A 157 51.568 14.802 32.842 1.00 5.41 C ATOM 0 H THR A 157 50.814 17.149 31.368 1.00 11.53 H new ATOM 0 HA THR A 157 50.767 14.748 30.265 1.00 10.59 H new ATOM 0 HB THR A 157 49.784 14.073 32.327 1.00 10.27 H new ATOM 0 HG1 THR A 157 49.290 15.767 33.680 1.00 12.08 H new ATOM 0 HG21 THR A 157 51.482 14.535 33.771 1.00 5.41 H new ATOM 0 HG22 THR A 157 52.066 14.126 32.357 1.00 5.41 H new ATOM 0 HG23 THR A 157 52.039 15.648 32.792 1.00 5.41 H new ATOM 133 N ARG A 158 48.250 14.165 30.035 1.00 11.02 N ATOM 134 CA ARG A 158 46.874 14.007 29.614 1.00 9.50 C ATOM 135 C ARG A 158 45.953 14.757 30.585 1.00 10.39 C ATOM 136 O ARG A 158 45.124 15.571 30.152 1.00 12.62 O ATOM 137 CB ARG A 158 46.548 12.499 29.555 1.00 7.88 C ATOM 138 CG ARG A 158 45.072 12.366 29.236 1.00 9.38 C ATOM 139 CD ARG A 158 44.531 10.987 29.478 1.00 14.57 C ATOM 140 NE ARG A 158 44.662 10.348 28.214 1.00 18.80 N ATOM 141 CZ ARG A 158 43.630 9.982 27.468 1.00 16.82 C ATOM 142 NH1 ARG A 158 42.356 10.139 27.828 1.00 12.33 N ATOM 143 NH2 ARG A 158 43.942 9.567 26.258 1.00 17.72 N ATOM 0 H ARG A 158 48.660 13.421 30.165 1.00 11.02 H new ATOM 0 HA ARG A 158 46.735 14.384 28.731 1.00 9.50 H new ATOM 0 HB2 ARG A 158 47.085 12.060 28.877 1.00 7.88 H new ATOM 0 HB3 ARG A 158 46.754 12.072 30.401 1.00 7.88 H new ATOM 0 HG2 ARG A 158 44.573 13.001 29.774 1.00 9.38 H new ATOM 0 HG3 ARG A 158 44.926 12.605 28.307 1.00 9.38 H new ATOM 0 HD2 ARG A 158 45.033 10.523 30.166 1.00 14.57 H new ATOM 0 HD3 ARG A 158 43.606 11.013 29.770 1.00 14.57 H new ATOM 0 HE ARG A 158 45.454 10.191 27.918 1.00 18.80 H new ATOM 0 HH11 ARG A 158 42.164 10.497 28.586 1.00 12.33 H new ATOM 0 HH12 ARG A 158 41.726 9.882 27.302 1.00 12.33 H new ATOM 0 HH21 ARG A 158 44.765 9.550 26.008 1.00 17.72 H new ATOM 0 HH22 ARG A 158 43.323 9.313 25.717 1.00 17.72 H new ATOM 150 N ARG A 159 46.149 14.560 31.880 1.00 8.35 N ATOM 151 CA ARG A 159 45.406 15.245 32.910 1.00 10.21 C ATOM 152 C ARG A 159 45.442 16.797 32.835 1.00 14.21 C ATOM 153 O ARG A 159 44.417 17.480 32.832 1.00 16.04 O ATOM 154 CB ARG A 159 45.934 14.724 34.221 1.00 9.25 C ATOM 155 CG ARG A 159 45.137 15.308 35.364 1.00 14.46 C ATOM 156 CD ARG A 159 45.900 15.064 36.611 1.00 17.56 C ATOM 157 NE ARG A 159 45.422 15.957 37.653 1.00 23.91 N ATOM 158 CZ ARG A 159 46.025 16.114 38.828 1.00 25.15 C ATOM 159 NH1 ARG A 159 47.143 15.403 39.087 1.00 19.43 N ATOM 160 NH2 ARG A 159 45.463 16.989 39.708 1.00 25.41 N ATOM 0 H ARG A 159 46.734 14.009 32.187 1.00 8.35 H new ATOM 0 HA ARG A 159 44.462 15.056 32.795 1.00 10.21 H new ATOM 0 HB2 ARG A 159 45.879 13.756 34.239 1.00 9.25 H new ATOM 0 HB3 ARG A 159 46.871 14.957 34.317 1.00 9.25 H new ATOM 0 HG2 ARG A 159 44.996 16.258 35.231 1.00 14.46 H new ATOM 0 HG3 ARG A 159 44.260 14.896 35.414 1.00 14.46 H new ATOM 0 HD2 ARG A 159 45.796 14.141 36.890 1.00 17.56 H new ATOM 0 HD3 ARG A 159 46.847 15.209 36.456 1.00 17.56 H new ATOM 0 HE ARG A 159 44.707 16.411 37.501 1.00 23.91 H new ATOM 0 HH11 ARG A 159 47.454 14.860 38.497 1.00 19.43 H new ATOM 0 HH12 ARG A 159 47.545 15.493 39.842 1.00 19.43 H new ATOM 0 HH21 ARG A 159 44.746 17.414 39.494 1.00 25.41 H new ATOM 0 HH22 ARG A 159 45.825 17.117 40.478 1.00 25.41 H new ATOM 167 N GLU A 160 46.649 17.385 32.693 1.00 17.22 N ATOM 168 CA GLU A 160 46.798 18.830 32.545 1.00 17.10 C ATOM 169 C GLU A 160 46.095 19.340 31.336 1.00 15.38 C ATOM 170 O GLU A 160 45.446 20.389 31.418 1.00 16.61 O ATOM 171 CB GLU A 160 48.282 19.200 32.444 1.00 20.55 C ATOM 172 CG GLU A 160 48.795 19.534 33.802 1.00 34.04 C ATOM 173 CD GLU A 160 48.191 20.809 34.399 1.00 44.55 C ATOM 174 OE1 GLU A 160 47.936 21.784 33.678 1.00 47.15 O ATOM 175 OE2 GLU A 160 48.029 20.874 35.620 1.00 50.36 O ATOM 0 H GLU A 160 47.392 16.952 32.681 1.00 17.22 H new ATOM 0 HA GLU A 160 46.400 19.240 33.329 1.00 17.10 H new ATOM 0 HB2 GLU A 160 48.786 18.461 32.068 1.00 20.55 H new ATOM 0 HB3 GLU A 160 48.399 19.956 31.847 1.00 20.55 H new ATOM 0 HG2 GLU A 160 48.613 18.791 34.398 1.00 34.04 H new ATOM 0 HG3 GLU A 160 49.759 19.633 33.758 1.00 34.04 H new ATOM 177 N SER A 161 46.125 18.615 30.215 1.00 12.80 N ATOM 178 CA SER A 161 45.441 19.120 29.033 1.00 14.24 C ATOM 179 C SER A 161 43.927 19.194 29.258 1.00 11.50 C ATOM 180 O SER A 161 43.258 20.167 28.904 1.00 9.14 O ATOM 181 CB SER A 161 45.789 18.220 27.827 1.00 13.10 C ATOM 182 OG SER A 161 45.252 16.911 27.902 1.00 12.17 O ATOM 0 H SER A 161 46.521 17.857 30.122 1.00 12.80 H new ATOM 0 HA SER A 161 45.741 20.024 28.851 1.00 14.24 H new ATOM 0 HB2 SER A 161 45.467 18.644 27.017 1.00 13.10 H new ATOM 0 HB3 SER A 161 46.754 18.158 27.751 1.00 13.10 H new ATOM 0 HG SER A 161 45.402 16.590 28.663 1.00 12.17 H new ATOM 185 N GLU A 162 43.389 18.198 29.940 1.00 10.75 N ATOM 186 CA GLU A 162 41.980 18.197 30.220 1.00 12.71 C ATOM 187 C GLU A 162 41.653 19.320 31.159 1.00 15.02 C ATOM 188 O GLU A 162 40.669 20.007 30.923 1.00 17.23 O ATOM 189 CB GLU A 162 41.531 16.914 30.839 1.00 10.05 C ATOM 190 CG GLU A 162 41.478 15.832 29.781 1.00 18.42 C ATOM 191 CD GLU A 162 40.883 14.485 30.200 1.00 19.95 C ATOM 192 OE1 GLU A 162 40.303 14.376 31.271 1.00 24.74 O ATOM 193 OE2 GLU A 162 40.998 13.528 29.425 1.00 21.36 O ATOM 0 H GLU A 162 43.823 17.521 30.245 1.00 10.75 H new ATOM 0 HA GLU A 162 41.518 18.307 29.374 1.00 12.71 H new ATOM 0 HB2 GLU A 162 42.140 16.656 31.549 1.00 10.05 H new ATOM 0 HB3 GLU A 162 40.656 17.028 31.243 1.00 10.05 H new ATOM 0 HG2 GLU A 162 40.965 16.169 29.030 1.00 18.42 H new ATOM 0 HG3 GLU A 162 42.381 15.677 29.461 1.00 18.42 H new ATOM 195 N ARG A 163 42.519 19.617 32.150 1.00 19.48 N ATOM 196 CA ARG A 163 42.302 20.714 33.080 1.00 18.66 C ATOM 197 C ARG A 163 42.317 22.021 32.289 1.00 20.35 C ATOM 198 O ARG A 163 41.526 22.924 32.582 1.00 22.36 O ATOM 199 CB ARG A 163 43.397 20.751 34.164 1.00 19.08 C ATOM 200 CG ARG A 163 42.922 21.654 35.314 1.00 26.25 C ATOM 201 CD ARG A 163 43.833 21.743 36.541 1.00 31.17 C ATOM 202 NE ARG A 163 45.157 22.242 36.159 1.00 44.98 N ATOM 203 CZ ARG A 163 45.429 23.486 35.682 1.00 46.20 C ATOM 204 NH1 ARG A 163 44.450 24.412 35.529 1.00 47.70 N ATOM 205 NH2 ARG A 163 46.675 23.757 35.266 1.00 46.83 N ATOM 0 H ARG A 163 43.246 19.179 32.291 1.00 19.48 H new ATOM 0 HA ARG A 163 41.449 20.591 33.525 1.00 18.66 H new ATOM 0 HB2 ARG A 163 43.576 19.856 34.492 1.00 19.08 H new ATOM 0 HB3 ARG A 163 44.227 21.089 33.792 1.00 19.08 H new ATOM 0 HG2 ARG A 163 42.798 22.550 34.964 1.00 26.25 H new ATOM 0 HG3 ARG A 163 42.052 21.340 35.605 1.00 26.25 H new ATOM 0 HD2 ARG A 163 43.438 22.332 37.203 1.00 31.17 H new ATOM 0 HD3 ARG A 163 43.917 20.869 36.953 1.00 31.17 H new ATOM 0 HE ARG A 163 45.820 21.701 36.244 1.00 44.98 H new ATOM 0 HH11 ARG A 163 43.638 24.217 35.735 1.00 47.70 H new ATOM 0 HH12 ARG A 163 44.641 25.194 35.226 1.00 47.70 H new ATOM 0 HH21 ARG A 163 47.283 23.150 35.304 1.00 46.83 H new ATOM 0 HH22 ARG A 163 46.866 24.538 34.961 1.00 46.83 H new ATOM 212 N LEU A 164 43.174 22.171 31.274 1.00 17.16 N ATOM 213 CA LEU A 164 43.153 23.384 30.475 1.00 16.45 C ATOM 214 C LEU A 164 41.906 23.526 29.618 1.00 16.70 C ATOM 215 O LEU A 164 41.291 24.598 29.469 1.00 12.80 O ATOM 216 CB LEU A 164 44.366 23.400 29.590 1.00 17.57 C ATOM 217 CG LEU A 164 45.636 23.789 30.282 1.00 20.91 C ATOM 218 CD1 LEU A 164 46.876 23.288 29.514 1.00 22.87 C ATOM 219 CD2 LEU A 164 45.597 25.300 30.421 1.00 24.48 C ATOM 0 H LEU A 164 43.763 21.590 31.040 1.00 17.16 H new ATOM 0 HA LEU A 164 43.151 24.132 31.092 1.00 16.45 H new ATOM 0 HB2 LEU A 164 44.480 22.519 29.201 1.00 17.57 H new ATOM 0 HB3 LEU A 164 44.209 24.015 28.857 1.00 17.57 H new ATOM 0 HG LEU A 164 45.706 23.375 31.157 1.00 20.91 H new ATOM 0 HD11 LEU A 164 47.680 23.555 29.987 1.00 22.87 H new ATOM 0 HD12 LEU A 164 46.847 22.321 29.448 1.00 22.87 H new ATOM 0 HD13 LEU A 164 46.882 23.672 28.623 1.00 22.87 H new ATOM 0 HD21 LEU A 164 46.403 25.605 30.866 1.00 24.48 H new ATOM 0 HD22 LEU A 164 45.541 25.705 29.541 1.00 24.48 H new ATOM 0 HD23 LEU A 164 44.822 25.557 30.944 1.00 24.48 H new ATOM 221 N LEU A 165 41.526 22.399 29.029 1.00 16.92 N ATOM 222 CA LEU A 165 40.460 22.441 28.067 1.00 17.34 C ATOM 223 C LEU A 165 39.067 22.416 28.655 1.00 16.63 C ATOM 224 O LEU A 165 38.165 22.983 28.040 1.00 17.20 O ATOM 225 CB LEU A 165 40.636 21.290 27.096 1.00 15.53 C ATOM 226 CG LEU A 165 41.835 21.389 26.220 1.00 17.08 C ATOM 227 CD1 LEU A 165 41.921 20.128 25.436 1.00 14.82 C ATOM 228 CD2 LEU A 165 41.724 22.553 25.257 1.00 18.24 C ATOM 0 H LEU A 165 41.868 21.623 29.173 1.00 16.92 H new ATOM 0 HA LEU A 165 40.527 23.300 27.621 1.00 17.34 H new ATOM 0 HB2 LEU A 165 40.687 20.463 27.600 1.00 15.53 H new ATOM 0 HB3 LEU A 165 39.846 21.232 26.536 1.00 15.53 H new ATOM 0 HG LEU A 165 42.622 21.529 26.770 1.00 17.08 H new ATOM 0 HD11 LEU A 165 42.695 20.161 24.853 1.00 14.82 H new ATOM 0 HD12 LEU A 165 42.005 19.375 26.042 1.00 14.82 H new ATOM 0 HD13 LEU A 165 41.118 20.024 24.901 1.00 14.82 H new ATOM 0 HD21 LEU A 165 42.518 22.591 24.702 1.00 18.24 H new ATOM 0 HD22 LEU A 165 40.942 22.435 24.695 1.00 18.24 H new ATOM 0 HD23 LEU A 165 41.640 23.380 25.757 1.00 18.24 H new ATOM 230 N LEU A 166 38.813 21.802 29.817 1.00 18.94 N ATOM 231 CA LEU A 166 37.452 21.694 30.360 1.00 22.68 C ATOM 232 C LEU A 166 37.103 22.959 31.105 1.00 25.99 C ATOM 233 O LEU A 166 37.223 23.075 32.331 1.00 28.51 O ATOM 234 CB LEU A 166 37.327 20.546 31.340 1.00 23.72 C ATOM 235 CG LEU A 166 37.310 19.156 30.820 1.00 24.92 C ATOM 236 CD1 LEU A 166 37.454 18.170 31.978 1.00 27.54 C ATOM 237 CD2 LEU A 166 36.039 18.976 30.031 1.00 24.21 C ATOM 0 H LEU A 166 39.419 21.440 30.308 1.00 18.94 H new ATOM 0 HA LEU A 166 36.856 21.544 29.610 1.00 22.68 H new ATOM 0 HB2 LEU A 166 38.063 20.615 31.968 1.00 23.72 H new ATOM 0 HB3 LEU A 166 36.510 20.680 31.845 1.00 23.72 H new ATOM 0 HG LEU A 166 38.058 18.982 30.227 1.00 24.92 H new ATOM 0 HD11 LEU A 166 37.442 17.263 31.634 1.00 27.54 H new ATOM 0 HD12 LEU A 166 38.293 18.331 32.438 1.00 27.54 H new ATOM 0 HD13 LEU A 166 36.718 18.290 32.598 1.00 27.54 H new ATOM 0 HD21 LEU A 166 36.002 18.073 29.678 1.00 24.21 H new ATOM 0 HD22 LEU A 166 35.275 19.129 30.609 1.00 24.21 H new ATOM 0 HD23 LEU A 166 36.021 19.610 29.297 1.00 24.21 H new ATOM 239 N ASN A 167 36.659 23.952 30.388 1.00 28.98 N ATOM 240 CA ASN A 167 36.454 25.209 31.030 1.00 29.06 C ATOM 241 C ASN A 167 35.402 25.883 30.233 1.00 31.21 C ATOM 242 O ASN A 167 35.541 25.971 29.011 1.00 31.55 O ATOM 243 CB ASN A 167 37.715 26.019 30.985 1.00 30.84 C ATOM 244 CG ASN A 167 37.582 27.296 31.775 1.00 35.93 C ATOM 245 OD1 ASN A 167 36.852 28.232 31.428 1.00 37.16 O ATOM 246 ND2 ASN A 167 38.266 27.333 32.903 1.00 40.24 N ATOM 0 H ASN A 167 36.474 23.922 29.549 1.00 28.98 H new ATOM 0 HA ASN A 167 36.203 25.105 31.961 1.00 29.06 H new ATOM 0 HB2 ASN A 167 38.450 25.494 31.338 1.00 30.84 H new ATOM 0 HB3 ASN A 167 37.933 26.229 30.063 1.00 30.84 H new ATOM 0 HD21 ASN A 167 38.210 28.020 33.417 1.00 40.24 H new ATOM 0 HD22 ASN A 167 38.767 26.670 33.124 1.00 40.24 H new ATOM 250 N ALA A 168 34.395 26.366 30.961 1.00 29.60 N ATOM 251 CA ALA A 168 33.279 27.105 30.433 1.00 27.62 C ATOM 252 C ALA A 168 33.619 28.223 29.478 1.00 29.05 C ATOM 253 O ALA A 168 32.804 28.550 28.623 1.00 31.88 O ATOM 254 CB ALA A 168 32.529 27.724 31.554 1.00 30.45 C ATOM 0 H ALA A 168 34.353 26.261 31.813 1.00 29.60 H new ATOM 0 HA ALA A 168 32.772 26.446 29.933 1.00 27.62 H new ATOM 0 HB1 ALA A 168 31.775 28.223 31.203 1.00 30.45 H new ATOM 0 HB2 ALA A 168 32.207 27.030 32.150 1.00 30.45 H new ATOM 0 HB3 ALA A 168 33.114 28.324 32.043 1.00 30.45 H new ATOM 256 N GLU A 169 34.765 28.895 29.609 1.00 30.07 N ATOM 257 CA GLU A 169 35.154 29.954 28.662 1.00 30.75 C ATOM 258 C GLU A 169 35.565 29.464 27.252 1.00 34.26 C ATOM 259 O GLU A 169 35.626 30.258 26.292 1.00 36.30 O ATOM 260 CB GLU A 169 36.325 30.746 29.210 1.00 31.51 C ATOM 0 H GLU A 169 35.334 28.755 30.239 1.00 30.07 H new ATOM 0 HA GLU A 169 34.350 30.487 28.565 1.00 30.75 H new ATOM 262 N ASN A 170 35.796 28.138 27.055 1.00 30.65 N ATOM 263 CA ASN A 170 36.269 27.620 25.779 1.00 26.77 C ATOM 264 C ASN A 170 35.167 27.167 24.847 1.00 26.50 C ATOM 265 O ASN A 170 34.277 26.427 25.287 1.00 28.74 O ATOM 266 CB ASN A 170 37.184 26.450 26.013 1.00 24.75 C ATOM 267 CG ASN A 170 38.490 26.834 26.665 1.00 25.20 C ATOM 268 OD1 ASN A 170 39.034 27.922 26.465 1.00 26.00 O ATOM 269 ND2 ASN A 170 39.010 25.936 27.476 1.00 26.80 N ATOM 0 H ASN A 170 35.679 27.537 27.659 1.00 30.65 H new ATOM 0 HA ASN A 170 36.726 28.361 25.352 1.00 26.77 H new ATOM 0 HB2 ASN A 170 36.730 25.799 26.571 1.00 24.75 H new ATOM 0 HB3 ASN A 170 37.368 26.017 25.165 1.00 24.75 H new ATOM 0 HD21 ASN A 170 39.749 26.101 27.883 1.00 26.80 H new ATOM 0 HD22 ASN A 170 38.610 25.184 27.598 1.00 26.80 H new ATOM 273 N PRO A 171 35.121 27.641 23.589 1.00 24.10 N ATOM 274 CA PRO A 171 34.198 27.162 22.567 1.00 24.83 C ATOM 275 C PRO A 171 34.372 25.654 22.300 1.00 26.45 C ATOM 276 O PRO A 171 35.432 25.085 22.561 1.00 29.17 O ATOM 277 CB PRO A 171 34.502 28.005 21.334 1.00 20.99 C ATOM 278 CG PRO A 171 35.226 29.235 21.813 1.00 23.87 C ATOM 279 CD PRO A 171 35.907 28.772 23.096 1.00 24.43 C ATOM 0 HA PRO A 171 33.273 27.257 22.842 1.00 24.83 H new ATOM 0 HB2 PRO A 171 35.048 27.508 20.704 1.00 20.99 H new ATOM 0 HB3 PRO A 171 33.684 28.246 20.872 1.00 20.99 H new ATOM 0 HG2 PRO A 171 35.871 29.547 21.159 1.00 23.87 H new ATOM 0 HG3 PRO A 171 34.613 29.968 21.979 1.00 23.87 H new ATOM 0 HD2 PRO A 171 36.825 28.508 22.925 1.00 24.43 H new ATOM 0 HD3 PRO A 171 35.934 29.487 23.751 1.00 24.43 H new ATOM 280 N ARG A 172 33.376 24.980 21.717 1.00 25.29 N ATOM 281 CA ARG A 172 33.553 23.594 21.313 1.00 21.52 C ATOM 282 C ARG A 172 34.605 23.668 20.230 1.00 19.20 C ATOM 283 O ARG A 172 34.530 24.570 19.398 1.00 19.95 O ATOM 284 CB ARG A 172 32.262 23.003 20.705 1.00 22.69 C ATOM 0 H ARG A 172 32.599 25.309 21.550 1.00 25.29 H new ATOM 0 HA ARG A 172 33.790 23.033 22.068 1.00 21.52 H new ATOM 286 N GLY A 173 35.602 22.794 20.187 1.00 18.50 N ATOM 287 CA GLY A 173 36.610 22.943 19.161 1.00 15.89 C ATOM 288 C GLY A 173 37.863 23.621 19.686 1.00 14.05 C ATOM 289 O GLY A 173 38.750 23.848 18.888 1.00 11.48 O ATOM 0 H GLY A 173 35.709 22.131 20.724 1.00 18.50 H new ATOM 0 HA2 GLY A 173 36.840 22.070 18.806 1.00 15.89 H new ATOM 0 HA3 GLY A 173 36.247 23.461 18.426 1.00 15.89 H new ATOM 291 N THR A 174 37.973 24.041 20.946 1.00 12.29 N ATOM 292 CA THR A 174 39.226 24.521 21.486 1.00 14.03 C ATOM 293 C THR A 174 40.202 23.330 21.499 1.00 16.06 C ATOM 294 O THR A 174 39.797 22.199 21.818 1.00 16.22 O ATOM 295 CB THR A 174 39.012 25.063 22.926 1.00 15.61 C ATOM 296 OG1 THR A 174 37.944 26.001 22.843 1.00 17.09 O ATOM 297 CG2 THR A 174 40.254 25.756 23.500 1.00 13.63 C ATOM 0 H THR A 174 37.320 24.053 21.505 1.00 12.29 H new ATOM 0 HA THR A 174 39.581 25.246 20.948 1.00 14.03 H new ATOM 0 HB THR A 174 38.820 24.321 23.521 1.00 15.61 H new ATOM 0 HG1 THR A 174 37.211 25.591 22.838 1.00 17.09 H new ATOM 0 HG21 THR A 174 40.063 26.073 24.397 1.00 13.63 H new ATOM 0 HG22 THR A 174 40.991 25.126 23.530 1.00 13.63 H new ATOM 0 HG23 THR A 174 40.495 26.508 22.937 1.00 13.63 H new ATOM 300 N PHE A 175 41.474 23.527 21.142 1.00 11.79 N ATOM 301 CA PHE A 175 42.426 22.421 21.058 1.00 11.89 C ATOM 302 C PHE A 175 43.828 22.829 21.455 1.00 11.29 C ATOM 303 O PHE A 175 44.152 24.024 21.668 1.00 11.69 O ATOM 304 CB PHE A 175 42.482 21.863 19.639 1.00 5.42 C ATOM 305 CG PHE A 175 43.074 22.891 18.698 1.00 12.42 C ATOM 306 CD1 PHE A 175 42.324 24.011 18.321 1.00 12.74 C ATOM 307 CD2 PHE A 175 44.385 22.729 18.245 1.00 8.71 C ATOM 308 CE1 PHE A 175 42.904 24.964 17.502 1.00 14.24 C ATOM 309 CE2 PHE A 175 44.947 23.680 17.433 1.00 10.47 C ATOM 310 CZ PHE A 175 44.211 24.798 17.059 1.00 11.89 C ATOM 0 H PHE A 175 41.804 24.296 20.944 1.00 11.79 H new ATOM 0 HA PHE A 175 42.108 21.748 21.680 1.00 11.89 H new ATOM 0 HB2 PHE A 175 43.017 21.054 19.623 1.00 5.42 H new ATOM 0 HB3 PHE A 175 41.590 21.620 19.344 1.00 5.42 H new ATOM 0 HD1 PHE A 175 41.448 24.113 18.617 1.00 12.74 H new ATOM 0 HD2 PHE A 175 44.875 21.979 18.493 1.00 8.71 H new ATOM 0 HE1 PHE A 175 42.419 25.716 17.248 1.00 14.24 H new ATOM 0 HE2 PHE A 175 45.821 23.577 17.132 1.00 10.47 H new ATOM 0 HZ PHE A 175 44.596 25.440 16.508 1.00 11.89 H new ATOM 312 N LEU A 176 44.658 21.794 21.523 1.00 9.74 N ATOM 313 CA LEU A 176 46.076 21.943 21.732 1.00 8.39 C ATOM 314 C LEU A 176 46.730 20.693 21.196 1.00 9.67 C ATOM 315 O LEU A 176 46.053 19.682 21.031 1.00 12.06 O ATOM 316 CB LEU A 176 46.407 22.142 23.234 1.00 3.31 C ATOM 317 CG LEU A 176 46.031 21.184 24.320 1.00 5.66 C ATOM 318 CD1 LEU A 176 47.020 20.034 24.376 1.00 7.09 C ATOM 319 CD2 LEU A 176 46.021 21.938 25.654 1.00 2.00 C ATOM 0 H LEU A 176 44.402 20.977 21.447 1.00 9.74 H new ATOM 0 HA LEU A 176 46.407 22.731 21.273 1.00 8.39 H new ATOM 0 HB2 LEU A 176 47.371 22.241 23.286 1.00 3.31 H new ATOM 0 HB3 LEU A 176 46.020 22.996 23.483 1.00 3.31 H new ATOM 0 HG LEU A 176 45.151 20.816 24.142 1.00 5.66 H new ATOM 0 HD11 LEU A 176 46.765 19.421 25.083 1.00 7.09 H new ATOM 0 HD12 LEU A 176 47.020 19.565 23.527 1.00 7.09 H new ATOM 0 HD13 LEU A 176 47.909 20.380 24.553 1.00 7.09 H new ATOM 0 HD21 LEU A 176 45.778 21.329 26.369 1.00 2.00 H new ATOM 0 HD22 LEU A 176 46.903 22.303 25.826 1.00 2.00 H new ATOM 0 HD23 LEU A 176 45.375 22.660 25.613 1.00 2.00 H new ATOM 321 N VAL A 177 47.998 20.756 20.814 1.00 11.17 N ATOM 322 CA VAL A 177 48.763 19.594 20.390 1.00 10.51 C ATOM 323 C VAL A 177 49.826 19.354 21.463 1.00 9.21 C ATOM 324 O VAL A 177 50.391 20.296 22.026 1.00 9.24 O ATOM 325 CB VAL A 177 49.409 19.857 19.003 1.00 9.90 C ATOM 326 CG1 VAL A 177 50.258 18.666 18.554 1.00 8.12 C ATOM 327 CG2 VAL A 177 48.296 20.101 17.982 1.00 10.42 C ATOM 0 H VAL A 177 48.446 21.490 20.794 1.00 11.17 H new ATOM 0 HA VAL A 177 48.198 18.811 20.294 1.00 10.51 H new ATOM 0 HB VAL A 177 49.988 20.632 19.069 1.00 9.90 H new ATOM 0 HG11 VAL A 177 50.649 18.856 17.687 1.00 8.12 H new ATOM 0 HG12 VAL A 177 50.965 18.510 19.200 1.00 8.12 H new ATOM 0 HG13 VAL A 177 49.699 17.876 18.490 1.00 8.12 H new ATOM 0 HG21 VAL A 177 48.687 20.267 17.110 1.00 10.42 H new ATOM 0 HG22 VAL A 177 47.722 19.320 17.935 1.00 10.42 H new ATOM 0 HG23 VAL A 177 47.772 20.871 18.252 1.00 10.42 H new ATOM 329 N ARG A 178 50.115 18.121 21.839 1.00 10.23 N ATOM 330 CA ARG A 178 51.131 17.838 22.855 1.00 7.83 C ATOM 331 C ARG A 178 51.807 16.502 22.498 1.00 10.27 C ATOM 332 O ARG A 178 51.433 15.861 21.492 1.00 11.53 O ATOM 333 CB ARG A 178 50.461 17.762 24.249 1.00 7.99 C ATOM 334 CG ARG A 178 49.475 16.616 24.405 1.00 8.47 C ATOM 335 CD ARG A 178 48.788 16.640 25.750 1.00 9.13 C ATOM 336 NE ARG A 178 47.613 15.740 25.756 1.00 7.65 N ATOM 337 CZ ARG A 178 47.723 14.423 25.979 1.00 8.71 C ATOM 338 NH1 ARG A 178 48.928 13.866 26.208 1.00 4.58 N ATOM 339 NH2 ARG A 178 46.602 13.665 25.902 1.00 8.15 N ATOM 0 H ARG A 178 49.733 17.421 21.517 1.00 10.23 H new ATOM 0 HA ARG A 178 51.799 18.541 22.880 1.00 7.83 H new ATOM 0 HB2 ARG A 178 51.152 17.675 24.924 1.00 7.99 H new ATOM 0 HB3 ARG A 178 50.000 18.598 24.421 1.00 7.99 H new ATOM 0 HG2 ARG A 178 48.809 16.665 23.702 1.00 8.47 H new ATOM 0 HG3 ARG A 178 49.941 15.772 24.296 1.00 8.47 H new ATOM 0 HD2 ARG A 178 49.412 16.369 26.441 1.00 9.13 H new ATOM 0 HD3 ARG A 178 48.509 17.545 25.959 1.00 9.13 H new ATOM 0 HE ARG A 178 46.833 16.073 25.612 1.00 7.65 H new ATOM 0 HH11 ARG A 178 49.635 14.356 26.212 1.00 4.58 H new ATOM 0 HH12 ARG A 178 48.991 13.020 26.350 1.00 4.58 H new ATOM 0 HH21 ARG A 178 45.847 14.032 25.714 1.00 8.15 H new ATOM 0 HH22 ARG A 178 46.646 12.817 26.041 1.00 8.15 H new ATOM 346 N GLU A 179 52.836 16.081 23.232 1.00 9.52 N ATOM 347 CA GLU A 179 53.374 14.750 23.085 1.00 12.07 C ATOM 348 C GLU A 179 52.446 13.771 23.776 1.00 13.54 C ATOM 349 O GLU A 179 51.715 14.091 24.728 1.00 14.20 O ATOM 350 CB GLU A 179 54.719 14.619 23.738 1.00 13.98 C ATOM 351 CG GLU A 179 55.846 15.223 22.958 1.00 19.15 C ATOM 352 CD GLU A 179 57.186 15.141 23.671 1.00 27.28 C ATOM 353 OE1 GLU A 179 57.519 14.180 24.374 1.00 27.97 O ATOM 354 OE2 GLU A 179 57.940 16.082 23.526 1.00 29.94 O ATOM 0 H GLU A 179 53.234 16.562 23.823 1.00 9.52 H new ATOM 0 HA GLU A 179 53.459 14.569 22.136 1.00 12.07 H new ATOM 0 HB2 GLU A 179 54.684 15.038 24.612 1.00 13.98 H new ATOM 0 HB3 GLU A 179 54.907 13.678 23.881 1.00 13.98 H new ATOM 0 HG2 GLU A 179 55.915 14.773 22.101 1.00 19.15 H new ATOM 0 HG3 GLU A 179 55.641 16.153 22.774 1.00 19.15 H new ATOM 356 N SER A 180 52.378 12.575 23.228 1.00 15.48 N ATOM 357 CA SER A 180 51.653 11.497 23.852 1.00 13.34 C ATOM 358 C SER A 180 52.564 11.010 24.985 1.00 15.14 C ATOM 359 O SER A 180 53.766 10.848 24.793 1.00 15.75 O ATOM 360 CB SER A 180 51.419 10.376 22.843 1.00 8.73 C ATOM 361 OG SER A 180 50.941 9.189 23.485 1.00 9.82 O ATOM 0 H SER A 180 52.752 12.367 22.482 1.00 15.48 H new ATOM 0 HA SER A 180 50.784 11.777 24.179 1.00 13.34 H new ATOM 0 HB2 SER A 180 50.777 10.667 22.177 1.00 8.73 H new ATOM 0 HB3 SER A 180 52.246 10.182 22.374 1.00 8.73 H new ATOM 0 HG SER A 180 50.160 9.318 23.767 1.00 9.82 H new ATOM 364 N GLU A 181 52.029 10.761 26.187 1.00 17.10 N ATOM 365 CA GLU A 181 52.818 10.211 27.303 1.00 18.97 C ATOM 366 C GLU A 181 52.980 8.700 27.179 1.00 19.76 C ATOM 367 O GLU A 181 53.892 8.090 27.714 1.00 19.78 O ATOM 368 CB GLU A 181 52.148 10.435 28.651 1.00 18.56 C ATOM 369 CG GLU A 181 51.552 11.772 28.980 1.00 17.21 C ATOM 370 CD GLU A 181 51.121 11.799 30.442 1.00 15.58 C ATOM 371 OE1 GLU A 181 51.948 11.544 31.310 1.00 15.52 O ATOM 372 OE2 GLU A 181 49.961 12.045 30.719 1.00 12.66 O ATOM 0 H GLU A 181 51.203 10.905 26.379 1.00 17.10 H new ATOM 0 HA GLU A 181 53.670 10.672 27.257 1.00 18.97 H new ATOM 0 HB2 GLU A 181 51.441 9.776 28.735 1.00 18.56 H new ATOM 0 HB3 GLU A 181 52.805 10.236 29.336 1.00 18.56 H new ATOM 0 HG2 GLU A 181 52.200 12.474 28.812 1.00 17.21 H new ATOM 0 HG3 GLU A 181 50.790 11.946 28.406 1.00 17.21 H new ATOM 374 N THR A 182 51.991 8.122 26.503 1.00 20.35 N ATOM 375 CA THR A 182 51.804 6.696 26.370 1.00 19.68 C ATOM 376 C THR A 182 52.494 6.026 25.172 1.00 19.65 C ATOM 377 O THR A 182 52.806 4.839 25.225 1.00 21.75 O ATOM 378 CB THR A 182 50.253 6.626 26.412 1.00 18.14 C ATOM 379 OG1 THR A 182 50.055 6.465 27.808 1.00 23.97 O ATOM 380 CG2 THR A 182 49.535 5.648 25.514 1.00 19.25 C ATOM 0 H THR A 182 51.387 8.578 26.094 1.00 20.35 H new ATOM 0 HA THR A 182 52.241 6.169 27.057 1.00 19.68 H new ATOM 0 HB THR A 182 49.835 7.407 26.017 1.00 18.14 H new ATOM 0 HG1 THR A 182 49.232 6.414 27.970 1.00 23.97 H new ATOM 0 HG21 THR A 182 48.578 5.722 25.654 1.00 19.25 H new ATOM 0 HG22 THR A 182 49.742 5.847 24.587 1.00 19.25 H new ATOM 0 HG23 THR A 182 49.823 4.745 25.723 1.00 19.25 H new ATOM 383 N THR A 183 52.664 6.714 24.051 1.00 18.37 N ATOM 384 CA THR A 183 53.320 6.201 22.854 1.00 16.58 C ATOM 385 C THR A 183 54.432 7.206 22.566 1.00 17.64 C ATOM 386 O THR A 183 54.155 8.370 22.266 1.00 18.94 O ATOM 387 CB THR A 183 52.348 6.187 21.698 1.00 14.21 C ATOM 388 OG1 THR A 183 51.259 5.397 22.105 1.00 14.63 O ATOM 389 CG2 THR A 183 52.928 5.632 20.435 1.00 12.80 C ATOM 0 H THR A 183 52.390 7.524 23.962 1.00 18.37 H new ATOM 0 HA THR A 183 53.650 5.297 22.974 1.00 16.58 H new ATOM 0 HB THR A 183 52.095 7.100 21.490 1.00 14.21 H new ATOM 0 HG1 THR A 183 51.339 4.624 21.787 1.00 14.63 H new ATOM 0 HG21 THR A 183 52.257 5.651 19.735 1.00 12.80 H new ATOM 0 HG22 THR A 183 53.690 6.168 20.166 1.00 12.80 H new ATOM 0 HG23 THR A 183 53.213 4.717 20.584 1.00 12.80 H new ATOM 392 N LYS A 184 55.693 6.839 22.732 1.00 18.65 N ATOM 393 CA LYS A 184 56.759 7.790 22.485 1.00 21.44 C ATOM 394 C LYS A 184 56.940 7.919 21.000 1.00 18.71 C ATOM 395 O LYS A 184 56.753 6.982 20.223 1.00 18.15 O ATOM 396 CB LYS A 184 58.106 7.337 23.084 1.00 30.22 C ATOM 0 H LYS A 184 55.949 6.057 22.983 1.00 18.65 H new ATOM 0 HA LYS A 184 56.508 8.629 22.903 1.00 21.44 H new ATOM 398 N GLY A 185 57.223 9.144 20.634 1.00 17.61 N ATOM 399 CA GLY A 185 57.298 9.482 19.250 1.00 18.46 C ATOM 400 C GLY A 185 55.955 9.964 18.730 1.00 18.31 C ATOM 401 O GLY A 185 55.893 10.564 17.648 1.00 21.39 O ATOM 0 H GLY A 185 57.375 9.794 21.176 1.00 17.61 H new ATOM 0 HA2 GLY A 185 57.966 10.173 19.119 1.00 18.46 H new ATOM 0 HA3 GLY A 185 57.587 8.709 18.741 1.00 18.46 H new ATOM 403 N ALA A 186 54.868 9.751 19.457 1.00 16.64 N ATOM 404 CA ALA A 186 53.580 10.177 18.929 1.00 15.06 C ATOM 405 C ALA A 186 53.147 11.485 19.559 1.00 10.33 C ATOM 406 O ALA A 186 53.558 11.783 20.678 1.00 8.37 O ATOM 407 CB ALA A 186 52.496 9.116 19.208 1.00 15.39 C ATOM 0 H ALA A 186 54.850 9.376 20.231 1.00 16.64 H new ATOM 0 HA ALA A 186 53.684 10.294 17.972 1.00 15.06 H new ATOM 0 HB1 ALA A 186 51.647 9.418 18.849 1.00 15.39 H new ATOM 0 HB2 ALA A 186 52.746 8.279 18.786 1.00 15.39 H new ATOM 0 HB3 ALA A 186 52.413 8.982 20.165 1.00 15.39 H new ATOM 409 N TYR A 187 52.346 12.273 18.859 1.00 7.36 N ATOM 410 CA TYR A 187 51.768 13.473 19.426 1.00 6.90 C ATOM 411 C TYR A 187 50.299 13.267 19.714 1.00 5.16 C ATOM 412 O TYR A 187 49.740 12.196 19.507 1.00 6.14 O ATOM 413 CB TYR A 187 51.875 14.631 18.491 1.00 8.20 C ATOM 414 CG TYR A 187 53.304 14.988 18.266 1.00 12.72 C ATOM 415 CD1 TYR A 187 53.930 15.881 19.144 1.00 9.94 C ATOM 416 CD2 TYR A 187 53.996 14.378 17.217 1.00 15.71 C ATOM 417 CE1 TYR A 187 55.277 16.164 18.973 1.00 12.15 C ATOM 418 CE2 TYR A 187 55.347 14.664 17.037 1.00 20.28 C ATOM 419 CZ TYR A 187 55.968 15.552 17.917 1.00 20.27 C ATOM 420 OH TYR A 187 57.295 15.843 17.722 1.00 28.48 O ATOM 0 H TYR A 187 52.123 12.125 18.042 1.00 7.36 H new ATOM 0 HA TYR A 187 52.261 13.659 20.240 1.00 6.90 H new ATOM 0 HB2 TYR A 187 51.454 14.411 17.645 1.00 8.20 H new ATOM 0 HB3 TYR A 187 51.399 15.393 18.856 1.00 8.20 H new ATOM 0 HD1 TYR A 187 53.449 16.279 19.833 1.00 9.94 H new ATOM 0 HD2 TYR A 187 53.560 13.788 16.646 1.00 15.71 H new ATOM 0 HE1 TYR A 187 55.714 16.749 19.548 1.00 12.15 H new ATOM 0 HE2 TYR A 187 55.826 14.271 16.344 1.00 20.28 H new ATOM 0 HH TYR A 187 57.583 15.411 17.062 1.00 28.48 H new ATOM 423 N CYS A 188 49.617 14.285 20.158 1.00 6.87 N ATOM 424 CA CYS A 188 48.231 14.122 20.470 1.00 8.23 C ATOM 425 C CYS A 188 47.508 15.441 20.302 1.00 7.84 C ATOM 426 O CYS A 188 48.061 16.477 20.670 1.00 9.31 O ATOM 427 CB CYS A 188 48.152 13.594 21.891 1.00 11.03 C ATOM 428 SG CYS A 188 46.450 13.628 22.509 1.00 13.84 S ATOM 0 H CYS A 188 49.934 15.074 20.286 1.00 6.87 H new ATOM 0 HA CYS A 188 47.798 13.493 19.872 1.00 8.23 H new ATOM 0 HB2 CYS A 188 48.491 12.686 21.921 1.00 11.03 H new ATOM 0 HB3 CYS A 188 48.719 14.128 22.469 1.00 11.03 H new ATOM 0 HG CYS A 188 46.345 12.872 23.435 1.00 13.84 H new ATOM 430 N LEU A 189 46.337 15.416 19.652 1.00 7.18 N ATOM 431 CA LEU A 189 45.459 16.568 19.492 1.00 6.26 C ATOM 432 C LEU A 189 44.352 16.426 20.504 1.00 6.62 C ATOM 433 O LEU A 189 43.624 15.438 20.447 1.00 5.57 O ATOM 434 CB LEU A 189 44.851 16.575 18.113 1.00 5.14 C ATOM 435 CG LEU A 189 43.865 17.640 17.698 1.00 6.00 C ATOM 436 CD1 LEU A 189 44.438 19.049 17.775 1.00 7.51 C ATOM 437 CD2 LEU A 189 43.546 17.378 16.211 1.00 10.67 C ATOM 0 H LEU A 189 46.028 14.703 19.283 1.00 7.18 H new ATOM 0 HA LEU A 189 45.959 17.390 19.617 1.00 6.26 H new ATOM 0 HB2 LEU A 189 45.585 16.607 17.480 1.00 5.14 H new ATOM 0 HB3 LEU A 189 44.410 15.719 17.993 1.00 5.14 H new ATOM 0 HG LEU A 189 43.099 17.594 18.292 1.00 6.00 H new ATOM 0 HD11 LEU A 189 43.763 19.689 17.498 1.00 7.51 H new ATOM 0 HD12 LEU A 189 44.708 19.239 18.687 1.00 7.51 H new ATOM 0 HD13 LEU A 189 45.208 19.118 17.189 1.00 7.51 H new ATOM 0 HD21 LEU A 189 42.912 18.040 15.894 1.00 10.67 H new ATOM 0 HD22 LEU A 189 44.362 17.437 15.690 1.00 10.67 H new ATOM 0 HD23 LEU A 189 43.163 16.492 16.113 1.00 10.67 H new ATOM 439 N SER A 190 44.249 17.304 21.489 1.00 4.04 N ATOM 440 CA SER A 190 43.188 17.222 22.462 1.00 5.42 C ATOM 441 C SER A 190 42.215 18.344 22.137 1.00 8.58 C ATOM 442 O SER A 190 42.652 19.484 21.909 1.00 7.35 O ATOM 443 CB SER A 190 43.750 17.414 23.853 1.00 6.52 C ATOM 444 OG SER A 190 44.924 16.625 24.083 1.00 10.04 O ATOM 0 H SER A 190 44.792 17.960 21.608 1.00 4.04 H new ATOM 0 HA SER A 190 42.750 16.357 22.433 1.00 5.42 H new ATOM 0 HB2 SER A 190 43.962 18.351 23.987 1.00 6.52 H new ATOM 0 HB3 SER A 190 43.073 17.180 24.507 1.00 6.52 H new ATOM 0 HG SER A 190 44.705 15.889 24.423 1.00 10.04 H new ATOM 447 N VAL A 191 40.912 18.025 22.147 1.00 10.19 N ATOM 448 CA VAL A 191 39.835 18.900 21.663 1.00 11.31 C ATOM 449 C VAL A 191 38.689 18.947 22.688 1.00 13.08 C ATOM 450 O VAL A 191 38.307 17.898 23.232 1.00 12.64 O ATOM 451 CB VAL A 191 39.243 18.383 20.279 1.00 8.20 C ATOM 452 CG1 VAL A 191 38.436 19.507 19.621 1.00 5.86 C ATOM 453 CG2 VAL A 191 40.335 17.968 19.301 1.00 3.97 C ATOM 0 H VAL A 191 40.624 17.271 22.445 1.00 10.19 H new ATOM 0 HA VAL A 191 40.216 19.783 21.538 1.00 11.31 H new ATOM 0 HB VAL A 191 38.691 17.611 20.477 1.00 8.20 H new ATOM 0 HG11 VAL A 191 38.074 19.194 18.777 1.00 5.86 H new ATOM 0 HG12 VAL A 191 37.709 19.769 20.207 1.00 5.86 H new ATOM 0 HG13 VAL A 191 39.014 20.270 19.462 1.00 5.86 H new ATOM 0 HG21 VAL A 191 39.930 17.661 18.475 1.00 3.97 H new ATOM 0 HG22 VAL A 191 40.910 18.727 19.116 1.00 3.97 H new ATOM 0 HG23 VAL A 191 40.861 17.251 19.688 1.00 3.97 H new ATOM 455 N SER A 192 38.196 20.132 23.076 1.00 14.02 N ATOM 456 CA SER A 192 37.052 20.220 23.976 1.00 19.14 C ATOM 457 C SER A 192 35.776 20.026 23.136 1.00 23.87 C ATOM 458 O SER A 192 35.675 20.499 21.977 1.00 24.94 O ATOM 459 CB SER A 192 37.010 21.582 24.659 1.00 13.85 C ATOM 460 OG SER A 192 37.049 22.580 23.661 1.00 14.70 O ATOM 0 H SER A 192 38.513 20.891 22.826 1.00 14.02 H new ATOM 0 HA SER A 192 37.121 19.539 24.664 1.00 19.14 H new ATOM 0 HB2 SER A 192 36.204 21.668 25.192 1.00 13.85 H new ATOM 0 HB3 SER A 192 37.762 21.680 25.264 1.00 13.85 H new ATOM 0 HG SER A 192 36.757 23.302 23.975 1.00 14.70 H new ATOM 463 N ASP A 193 34.786 19.373 23.723 1.00 26.74 N ATOM 464 CA ASP A 193 33.553 19.069 23.035 1.00 33.31 C ATOM 465 C ASP A 193 32.434 19.225 24.063 1.00 39.09 C ATOM 466 O ASP A 193 32.667 19.304 25.285 1.00 38.64 O ATOM 467 CB ASP A 193 33.642 17.621 22.516 1.00 32.55 C ATOM 468 CG ASP A 193 32.528 17.157 21.582 1.00 32.70 C ATOM 469 OD1 ASP A 193 31.895 17.995 20.933 1.00 32.49 O ATOM 470 OD2 ASP A 193 32.332 15.931 21.499 1.00 30.26 O ATOM 0 H ASP A 193 34.814 19.094 24.536 1.00 26.74 H new ATOM 0 HA ASP A 193 33.386 19.653 22.279 1.00 33.31 H new ATOM 0 HB2 ASP A 193 34.488 17.517 22.053 1.00 32.55 H new ATOM 0 HB3 ASP A 193 33.663 17.026 23.282 1.00 32.55 H new ATOM 472 N PHE A 194 31.197 19.298 23.630 1.00 45.63 N ATOM 473 CA PHE A 194 30.092 19.341 24.573 1.00 53.34 C ATOM 474 C PHE A 194 28.961 18.520 23.984 1.00 56.46 C ATOM 475 O PHE A 194 28.517 18.744 22.840 1.00 55.48 O ATOM 476 CB PHE A 194 29.605 20.813 24.852 1.00 55.77 C ATOM 477 CG PHE A 194 28.157 20.891 25.343 1.00 59.80 C ATOM 478 CD1 PHE A 194 27.762 20.267 26.536 1.00 62.78 C ATOM 479 CD2 PHE A 194 27.188 21.487 24.528 1.00 60.31 C ATOM 480 CE1 PHE A 194 26.411 20.209 26.892 1.00 61.53 C ATOM 481 CE2 PHE A 194 25.838 21.425 24.892 1.00 61.26 C ATOM 482 CZ PHE A 194 25.446 20.789 26.071 1.00 62.48 C ATOM 0 H PHE A 194 30.970 19.324 22.801 1.00 45.63 H new ATOM 0 HA PHE A 194 30.384 18.981 25.425 1.00 53.34 H new ATOM 0 HB2 PHE A 194 30.186 21.219 25.514 1.00 55.77 H new ATOM 0 HB3 PHE A 194 29.693 21.335 24.039 1.00 55.77 H new ATOM 0 HD1 PHE A 194 28.403 19.889 27.094 1.00 62.78 H new ATOM 0 HD2 PHE A 194 27.440 21.923 23.746 1.00 60.31 H new ATOM 0 HE1 PHE A 194 26.156 19.783 27.678 1.00 61.53 H new ATOM 0 HE2 PHE A 194 25.195 21.812 24.342 1.00 61.26 H new ATOM 0 HZ PHE A 194 24.547 20.753 26.307 1.00 62.48 H new ATOM 484 N ASP A 195 28.506 17.575 24.809 1.00 60.27 N ATOM 485 CA ASP A 195 27.322 16.814 24.473 1.00 64.65 C ATOM 486 C ASP A 195 26.355 16.956 25.628 1.00 64.83 C ATOM 487 O ASP A 195 26.716 17.095 26.798 1.00 61.40 O ATOM 488 CB ASP A 195 27.640 15.319 24.212 1.00 67.27 C ATOM 489 CG ASP A 195 27.775 14.391 25.412 1.00 70.26 C ATOM 490 OD1 ASP A 195 26.743 13.985 25.946 1.00 71.87 O ATOM 491 OD2 ASP A 195 28.901 14.073 25.804 1.00 72.15 O ATOM 0 H ASP A 195 28.870 17.367 25.560 1.00 60.27 H new ATOM 0 HA ASP A 195 26.940 17.157 23.650 1.00 64.65 H new ATOM 0 HB2 ASP A 195 26.942 14.963 23.640 1.00 67.27 H new ATOM 0 HB3 ASP A 195 28.469 15.276 23.710 1.00 67.27 H new ATOM 493 N ASN A 196 25.083 16.979 25.233 1.00 69.00 N ATOM 494 CA ASN A 196 23.961 17.214 26.143 1.00 71.09 C ATOM 495 C ASN A 196 23.963 16.350 27.403 1.00 70.80 C ATOM 496 O ASN A 196 23.617 16.848 28.470 1.00 69.77 O ATOM 497 CB ASN A 196 22.660 16.973 25.390 1.00 73.25 C ATOM 0 H ASN A 196 24.843 16.857 24.416 1.00 69.00 H new ATOM 0 HA ASN A 196 24.051 18.131 26.445 1.00 71.09 H new ATOM 499 N ALA A 197 24.399 15.083 27.288 1.00 70.14 N ATOM 500 CA ALA A 197 24.435 14.156 28.410 1.00 68.43 C ATOM 501 C ALA A 197 25.608 14.378 29.352 1.00 67.07 C ATOM 502 O ALA A 197 25.430 14.457 30.572 1.00 68.39 O ATOM 503 CB ALA A 197 24.531 12.705 27.922 1.00 69.50 C ATOM 0 H ALA A 197 24.681 14.746 26.549 1.00 70.14 H new ATOM 0 HA ALA A 197 23.608 14.323 28.889 1.00 68.43 H new ATOM 0 HB1 ALA A 197 24.554 12.107 28.686 1.00 69.50 H new ATOM 0 HB2 ALA A 197 23.760 12.497 27.372 1.00 69.50 H new ATOM 0 HB3 ALA A 197 25.340 12.592 27.400 1.00 69.50 H new ATOM 505 N LYS A 198 26.828 14.442 28.820 1.00 63.86 N ATOM 506 CA LYS A 198 28.010 14.580 29.649 1.00 59.44 C ATOM 507 C LYS A 198 28.510 16.023 29.779 1.00 55.62 C ATOM 508 O LYS A 198 29.496 16.256 30.477 1.00 58.37 O ATOM 509 CB LYS A 198 29.140 13.708 29.080 1.00 57.60 C ATOM 0 H LYS A 198 26.987 14.407 27.976 1.00 63.86 H new ATOM 0 HA LYS A 198 27.754 14.291 30.539 1.00 59.44 H new ATOM 511 N GLY A 199 27.861 17.051 29.219 1.00 48.85 N ATOM 512 CA GLY A 199 28.378 18.402 29.325 1.00 41.08 C ATOM 513 C GLY A 199 29.713 18.524 28.617 1.00 34.58 C ATOM 514 O GLY A 199 29.880 18.056 27.492 1.00 31.77 O ATOM 0 H GLY A 199 27.126 16.979 28.778 1.00 48.85 H new ATOM 0 HA2 GLY A 199 27.744 19.027 28.939 1.00 41.08 H new ATOM 0 HA3 GLY A 199 28.479 18.642 30.259 1.00 41.08 H new ATOM 516 N LEU A 200 30.677 19.133 29.282 1.00 29.54 N ATOM 517 CA LEU A 200 31.940 19.427 28.645 1.00 25.61 C ATOM 518 C LEU A 200 32.806 18.228 28.783 1.00 22.54 C ATOM 519 O LEU A 200 32.886 17.685 29.872 1.00 23.48 O ATOM 520 CB LEU A 200 32.643 20.603 29.304 1.00 23.33 C ATOM 521 CG LEU A 200 32.070 22.017 29.057 1.00 23.53 C ATOM 522 CD1 LEU A 200 32.843 23.086 29.848 1.00 25.88 C ATOM 523 CD2 LEU A 200 32.148 22.312 27.578 1.00 24.57 C ATOM 0 H LEU A 200 30.619 19.384 30.103 1.00 29.54 H new ATOM 0 HA LEU A 200 31.776 19.655 27.717 1.00 25.61 H new ATOM 0 HB2 LEU A 200 32.650 20.447 30.261 1.00 23.33 H new ATOM 0 HB3 LEU A 200 33.567 20.601 29.010 1.00 23.33 H new ATOM 0 HG LEU A 200 31.149 22.041 29.361 1.00 23.53 H new ATOM 0 HD11 LEU A 200 32.460 23.959 29.672 1.00 25.88 H new ATOM 0 HD12 LEU A 200 32.784 22.893 30.797 1.00 25.88 H new ATOM 0 HD13 LEU A 200 33.774 23.081 29.575 1.00 25.88 H new ATOM 0 HD21 LEU A 200 31.792 23.197 27.405 1.00 24.57 H new ATOM 0 HD22 LEU A 200 33.073 22.274 27.289 1.00 24.57 H new ATOM 0 HD23 LEU A 200 31.629 21.654 27.089 1.00 24.57 H new ATOM 525 N ASN A 201 33.432 17.769 27.710 1.00 20.40 N ATOM 526 CA ASN A 201 34.349 16.626 27.787 1.00 19.92 C ATOM 527 C ASN A 201 35.507 16.859 26.822 1.00 16.60 C ATOM 528 O ASN A 201 35.479 17.791 26.025 1.00 16.76 O ATOM 529 CB ASN A 201 33.620 15.316 27.421 1.00 19.53 C ATOM 530 CG ASN A 201 33.032 15.341 26.037 1.00 18.65 C ATOM 531 OD1 ASN A 201 33.647 14.887 25.081 1.00 29.03 O ATOM 532 ND2 ASN A 201 31.842 15.852 25.845 1.00 22.38 N ATOM 0 H ASN A 201 33.343 18.102 26.922 1.00 20.40 H new ATOM 0 HA ASN A 201 34.682 16.545 28.695 1.00 19.92 H new ATOM 0 HB2 ASN A 201 34.242 14.575 27.490 1.00 19.53 H new ATOM 0 HB3 ASN A 201 32.913 15.154 28.065 1.00 19.53 H new ATOM 0 HD21 ASN A 201 31.502 15.866 25.055 1.00 22.38 H new ATOM 0 HD22 ASN A 201 31.400 16.174 26.509 1.00 22.38 H new ATOM 536 N VAL A 202 36.577 16.093 26.880 1.00 16.83 N ATOM 537 CA VAL A 202 37.729 16.314 26.023 1.00 12.61 C ATOM 538 C VAL A 202 37.914 15.032 25.216 1.00 11.71 C ATOM 539 O VAL A 202 37.793 13.943 25.773 1.00 14.49 O ATOM 540 CB VAL A 202 38.941 16.614 26.931 1.00 11.27 C ATOM 541 CG1 VAL A 202 40.181 16.752 26.086 1.00 10.88 C ATOM 542 CG2 VAL A 202 38.741 17.920 27.697 1.00 6.32 C ATOM 0 H VAL A 202 36.660 15.427 27.418 1.00 16.83 H new ATOM 0 HA VAL A 202 37.623 17.062 25.414 1.00 12.61 H new ATOM 0 HB VAL A 202 39.032 15.882 27.561 1.00 11.27 H new ATOM 0 HG11 VAL A 202 40.942 16.941 26.657 1.00 10.88 H new ATOM 0 HG12 VAL A 202 40.337 15.926 25.602 1.00 10.88 H new ATOM 0 HG13 VAL A 202 40.063 17.479 25.454 1.00 10.88 H new ATOM 0 HG21 VAL A 202 39.513 18.087 28.259 1.00 6.32 H new ATOM 0 HG22 VAL A 202 38.635 18.651 27.068 1.00 6.32 H new ATOM 0 HG23 VAL A 202 37.947 17.852 28.250 1.00 6.32 H new ATOM 544 N LYS A 203 38.168 15.095 23.926 1.00 8.73 N ATOM 545 CA LYS A 203 38.465 13.909 23.128 1.00 10.59 C ATOM 546 C LYS A 203 39.966 13.933 22.804 1.00 10.98 C ATOM 547 O LYS A 203 40.501 15.024 22.687 1.00 12.93 O ATOM 548 CB LYS A 203 37.732 13.920 21.804 1.00 11.48 C ATOM 549 CG LYS A 203 36.219 13.969 21.759 1.00 14.89 C ATOM 550 CD LYS A 203 35.614 12.736 22.304 1.00 18.45 C ATOM 551 CE LYS A 203 34.088 12.696 22.035 1.00 22.22 C ATOM 552 NZ LYS A 203 33.338 13.797 22.638 1.00 20.61 N ATOM 0 H LYS A 203 38.175 15.829 23.478 1.00 8.73 H new ATOM 0 HA LYS A 203 38.194 13.127 23.633 1.00 10.59 H new ATOM 0 HB2 LYS A 203 38.057 14.685 21.304 1.00 11.48 H new ATOM 0 HB3 LYS A 203 38.007 13.126 21.319 1.00 11.48 H new ATOM 0 HG2 LYS A 203 35.905 14.735 22.265 1.00 14.89 H new ATOM 0 HG3 LYS A 203 35.926 14.095 20.843 1.00 14.89 H new ATOM 0 HD2 LYS A 203 36.036 11.960 21.903 1.00 18.45 H new ATOM 0 HD3 LYS A 203 35.778 12.686 23.259 1.00 18.45 H new ATOM 0 HE2 LYS A 203 33.940 12.705 21.076 1.00 22.22 H new ATOM 0 HE3 LYS A 203 33.734 11.857 22.369 1.00 22.22 H new ATOM 0 HZ1 LYS A 203 32.501 13.536 22.794 1.00 20.61 H new ATOM 0 HZ2 LYS A 203 33.722 14.033 23.405 1.00 20.61 H new ATOM 0 HZ3 LYS A 203 33.333 14.492 22.083 1.00 20.61 H new ATOM 557 N HIS A 204 40.725 12.852 22.647 1.00 8.11 N ATOM 558 CA HIS A 204 42.132 12.905 22.384 1.00 4.22 C ATOM 559 C HIS A 204 42.368 12.011 21.214 1.00 7.89 C ATOM 560 O HIS A 204 41.914 10.872 21.195 1.00 8.10 O ATOM 561 CB HIS A 204 42.918 12.367 23.511 1.00 5.21 C ATOM 562 CG HIS A 204 42.748 13.133 24.803 1.00 7.38 C ATOM 563 ND1 HIS A 204 43.464 14.153 25.288 1.00 7.78 N ATOM 564 CD2 HIS A 204 41.804 12.816 25.750 1.00 8.01 C ATOM 565 CE1 HIS A 204 42.988 14.429 26.501 1.00 5.88 C ATOM 566 NE2 HIS A 204 41.994 13.634 26.750 1.00 8.71 N ATOM 0 H HIS A 204 40.415 12.051 22.694 1.00 8.11 H new ATOM 0 HA HIS A 204 42.400 13.825 22.234 1.00 4.22 H new ATOM 0 HB2 HIS A 204 42.663 11.443 23.658 1.00 5.21 H new ATOM 0 HB3 HIS A 204 43.857 12.367 23.267 1.00 5.21 H new ATOM 0 HD2 HIS A 204 41.157 12.150 25.690 1.00 8.01 H new ATOM 0 HE1 HIS A 204 43.315 15.084 27.075 1.00 5.88 H new ATOM 0 HE2 HIS A 204 41.526 13.644 27.472 1.00 8.71 H new ATOM 570 N TYR A 205 43.062 12.512 20.213 1.00 8.76 N ATOM 571 CA TYR A 205 43.336 11.791 18.988 1.00 10.13 C ATOM 572 C TYR A 205 44.864 11.610 18.833 1.00 11.52 C ATOM 573 O TYR A 205 45.603 12.607 18.817 1.00 15.36 O ATOM 574 CB TYR A 205 42.786 12.591 17.814 1.00 5.44 C ATOM 575 CG TYR A 205 41.288 12.837 17.846 1.00 8.44 C ATOM 576 CD1 TYR A 205 40.806 13.947 18.541 1.00 12.39 C ATOM 577 CD2 TYR A 205 40.388 11.961 17.204 1.00 10.86 C ATOM 578 CE1 TYR A 205 39.436 14.193 18.609 1.00 10.80 C ATOM 579 CE2 TYR A 205 39.008 12.199 17.269 1.00 8.23 C ATOM 580 CZ TYR A 205 38.551 13.319 17.977 1.00 12.99 C ATOM 581 OH TYR A 205 37.204 13.605 18.071 1.00 13.83 O ATOM 0 H TYR A 205 43.397 13.304 20.227 1.00 8.76 H new ATOM 0 HA TYR A 205 42.914 10.918 19.012 1.00 10.13 H new ATOM 0 HB2 TYR A 205 43.240 13.448 17.784 1.00 5.44 H new ATOM 0 HB3 TYR A 205 43.005 12.125 16.992 1.00 5.44 H new ATOM 0 HD1 TYR A 205 41.402 14.525 18.961 1.00 12.39 H new ATOM 0 HD2 TYR A 205 40.711 11.224 16.737 1.00 10.86 H new ATOM 0 HE1 TYR A 205 39.115 14.933 19.071 1.00 10.80 H new ATOM 0 HE2 TYR A 205 38.408 11.625 16.851 1.00 8.23 H new ATOM 0 HH TYR A 205 37.094 14.282 18.556 1.00 13.83 H new ATOM 584 N LYS A 206 45.427 10.419 18.732 1.00 8.50 N ATOM 585 CA LYS A 206 46.860 10.275 18.634 1.00 9.99 C ATOM 586 C LYS A 206 47.303 10.782 17.276 1.00 7.68 C ATOM 587 O LYS A 206 46.533 10.671 16.339 1.00 9.30 O ATOM 588 CB LYS A 206 47.222 8.800 18.802 1.00 14.34 C ATOM 589 CG LYS A 206 48.704 8.478 19.027 1.00 15.93 C ATOM 590 CD LYS A 206 48.840 7.013 19.451 1.00 17.58 C ATOM 591 CE LYS A 206 48.489 6.805 20.923 1.00 20.26 C ATOM 592 NZ LYS A 206 48.813 5.475 21.449 1.00 25.11 N ATOM 0 H LYS A 206 44.991 9.678 18.719 1.00 8.50 H new ATOM 0 HA LYS A 206 47.307 10.787 19.326 1.00 9.99 H new ATOM 0 HB2 LYS A 206 46.718 8.448 19.552 1.00 14.34 H new ATOM 0 HB3 LYS A 206 46.925 8.323 18.011 1.00 14.34 H new ATOM 0 HG2 LYS A 206 49.209 8.639 18.214 1.00 15.93 H new ATOM 0 HG3 LYS A 206 49.073 9.060 19.710 1.00 15.93 H new ATOM 0 HD2 LYS A 206 48.260 6.463 18.901 1.00 17.58 H new ATOM 0 HD3 LYS A 206 49.749 6.715 19.291 1.00 17.58 H new ATOM 0 HE2 LYS A 206 48.956 7.471 21.451 1.00 20.26 H new ATOM 0 HE3 LYS A 206 47.540 6.964 21.042 1.00 20.26 H new ATOM 0 HZ1 LYS A 206 48.568 5.425 22.303 1.00 25.11 H new ATOM 0 HZ2 LYS A 206 48.379 4.856 20.980 1.00 25.11 H new ATOM 0 HZ3 LYS A 206 49.690 5.335 21.384 1.00 25.11 H new ATOM 597 N ILE A 207 48.479 11.353 17.098 1.00 8.52 N ATOM 598 CA ILE A 207 48.951 11.788 15.781 1.00 9.14 C ATOM 599 C ILE A 207 50.198 10.958 15.518 1.00 11.36 C ATOM 600 O ILE A 207 51.142 10.985 16.319 1.00 10.28 O ATOM 601 CB ILE A 207 49.285 13.295 15.807 1.00 10.18 C ATOM 602 CG1 ILE A 207 48.023 14.109 16.090 1.00 7.37 C ATOM 603 CG2 ILE A 207 49.861 13.715 14.446 1.00 9.71 C ATOM 604 CD1 ILE A 207 48.213 15.630 16.268 1.00 2.00 C ATOM 0 H ILE A 207 49.035 11.504 17.736 1.00 8.52 H new ATOM 0 HA ILE A 207 48.284 11.663 15.088 1.00 9.14 H new ATOM 0 HB ILE A 207 49.936 13.461 16.507 1.00 10.18 H new ATOM 0 HG12 ILE A 207 47.398 13.964 15.362 1.00 7.37 H new ATOM 0 HG13 ILE A 207 47.609 13.758 16.894 1.00 7.37 H new ATOM 0 HG21 ILE A 207 50.071 14.662 14.462 1.00 9.71 H new ATOM 0 HG22 ILE A 207 50.668 13.208 14.266 1.00 9.71 H new ATOM 0 HG23 ILE A 207 49.208 13.541 13.750 1.00 9.71 H new ATOM 0 HD11 ILE A 207 47.354 16.045 16.442 1.00 2.00 H new ATOM 0 HD12 ILE A 207 48.809 15.797 17.015 1.00 2.00 H new ATOM 0 HD13 ILE A 207 48.595 16.005 15.459 1.00 2.00 H new ATOM 606 N ARG A 208 50.205 10.117 14.484 1.00 12.19 N ATOM 607 CA ARG A 208 51.366 9.294 14.258 1.00 14.75 C ATOM 608 C ARG A 208 52.291 9.953 13.253 1.00 15.98 C ATOM 609 O ARG A 208 51.872 10.630 12.327 1.00 16.10 O ATOM 610 CB ARG A 208 50.982 7.948 13.727 1.00 12.71 C ATOM 611 CG ARG A 208 50.166 7.172 14.688 1.00 15.18 C ATOM 612 CD ARG A 208 50.949 6.249 15.577 1.00 12.99 C ATOM 613 NE ARG A 208 49.961 5.406 16.276 1.00 14.76 N ATOM 614 CZ ARG A 208 50.286 4.444 17.173 1.00 14.52 C ATOM 615 NH1 ARG A 208 51.556 4.191 17.458 1.00 9.96 N ATOM 616 NH2 ARG A 208 49.324 3.766 17.800 1.00 10.31 N ATOM 0 H ARG A 208 49.562 10.016 13.922 1.00 12.19 H new ATOM 0 HA ARG A 208 51.815 9.188 15.112 1.00 14.75 H new ATOM 0 HB2 ARG A 208 50.486 8.059 12.901 1.00 12.71 H new ATOM 0 HB3 ARG A 208 51.784 7.448 13.511 1.00 12.71 H new ATOM 0 HG2 ARG A 208 49.668 7.791 15.244 1.00 15.18 H new ATOM 0 HG3 ARG A 208 49.516 6.650 14.193 1.00 15.18 H new ATOM 0 HD2 ARG A 208 51.561 5.705 15.057 1.00 12.99 H new ATOM 0 HD3 ARG A 208 51.485 6.751 16.211 1.00 12.99 H new ATOM 0 HE ARG A 208 49.128 5.533 16.104 1.00 14.76 H new ATOM 0 HH11 ARG A 208 52.181 4.639 17.072 1.00 9.96 H new ATOM 0 HH12 ARG A 208 51.755 3.579 18.028 1.00 9.96 H new ATOM 0 HH21 ARG A 208 48.498 3.939 17.635 1.00 10.31 H new ATOM 0 HH22 ARG A 208 49.530 3.155 18.369 1.00 10.31 H new ATOM 623 N LYS A 209 53.570 9.715 13.411 1.00 21.33 N ATOM 624 CA LYS A 209 54.584 10.285 12.572 1.00 24.70 C ATOM 625 C LYS A 209 55.014 9.249 11.550 1.00 25.44 C ATOM 626 O LYS A 209 55.380 8.116 11.876 1.00 24.34 O ATOM 627 CB LYS A 209 55.727 10.709 13.501 1.00 27.53 C ATOM 628 CG LYS A 209 56.981 11.178 12.798 1.00 34.81 C ATOM 629 CD LYS A 209 56.740 12.504 12.122 1.00 38.58 C ATOM 630 CE LYS A 209 57.908 12.952 11.231 1.00 44.08 C ATOM 631 NZ LYS A 209 59.189 12.976 11.916 1.00 43.53 N ATOM 0 H LYS A 209 53.880 9.202 14.028 1.00 21.33 H new ATOM 0 HA LYS A 209 54.274 11.058 12.074 1.00 24.70 H new ATOM 0 HB2 LYS A 209 55.410 11.422 14.078 1.00 27.53 H new ATOM 0 HB3 LYS A 209 55.955 9.960 14.074 1.00 27.53 H new ATOM 0 HG2 LYS A 209 57.705 11.261 13.438 1.00 34.81 H new ATOM 0 HG3 LYS A 209 57.257 10.519 12.142 1.00 34.81 H new ATOM 0 HD2 LYS A 209 55.935 12.444 11.584 1.00 38.58 H new ATOM 0 HD3 LYS A 209 56.579 13.180 12.798 1.00 38.58 H new ATOM 0 HE2 LYS A 209 57.969 12.356 10.468 1.00 44.08 H new ATOM 0 HE3 LYS A 209 57.719 13.838 10.885 1.00 44.08 H new ATOM 0 HZ1 LYS A 209 59.801 13.351 11.389 1.00 43.53 H new ATOM 0 HZ2 LYS A 209 59.116 13.448 12.667 1.00 43.53 H new ATOM 0 HZ3 LYS A 209 59.437 12.144 12.112 1.00 43.53 H new ATOM 636 N LEU A 210 54.909 9.546 10.283 1.00 28.27 N ATOM 637 CA LEU A 210 55.436 8.631 9.287 1.00 34.83 C ATOM 638 C LEU A 210 56.952 8.776 9.328 1.00 39.94 C ATOM 639 O LEU A 210 57.492 9.896 9.407 1.00 40.70 O ATOM 640 CB LEU A 210 54.935 8.983 7.900 1.00 32.32 C ATOM 641 CG LEU A 210 53.446 8.856 7.706 1.00 35.65 C ATOM 642 CD1 LEU A 210 52.971 9.707 6.542 1.00 32.79 C ATOM 643 CD2 LEU A 210 53.126 7.386 7.512 1.00 36.76 C ATOM 0 H LEU A 210 54.543 10.259 9.972 1.00 28.27 H new ATOM 0 HA LEU A 210 55.150 7.724 9.478 1.00 34.83 H new ATOM 0 HB2 LEU A 210 55.197 9.895 7.699 1.00 32.32 H new ATOM 0 HB3 LEU A 210 55.381 8.411 7.256 1.00 32.32 H new ATOM 0 HG LEU A 210 52.973 9.186 8.486 1.00 35.65 H new ATOM 0 HD11 LEU A 210 52.012 9.608 6.439 1.00 32.79 H new ATOM 0 HD12 LEU A 210 53.183 10.638 6.714 1.00 32.79 H new ATOM 0 HD13 LEU A 210 53.415 9.420 5.729 1.00 32.79 H new ATOM 0 HD21 LEU A 210 52.171 7.277 7.385 1.00 36.76 H new ATOM 0 HD22 LEU A 210 53.596 7.053 6.732 1.00 36.76 H new ATOM 0 HD23 LEU A 210 53.406 6.887 8.295 1.00 36.76 H new ATOM 645 N ASP A 211 57.667 7.665 9.350 1.00 46.26 N ATOM 646 CA ASP A 211 59.130 7.663 9.330 1.00 53.73 C ATOM 647 C ASP A 211 59.656 8.352 8.071 1.00 53.90 C ATOM 648 O ASP A 211 60.684 9.036 8.079 1.00 53.81 O ATOM 649 CB ASP A 211 59.668 6.209 9.419 1.00 58.76 C ATOM 650 CG ASP A 211 59.002 5.121 8.566 1.00 65.14 C ATOM 651 OD1 ASP A 211 57.769 5.117 8.445 1.00 69.17 O ATOM 652 OD2 ASP A 211 59.731 4.250 8.082 1.00 69.74 O ATOM 0 H ASP A 211 57.319 6.879 9.377 1.00 46.26 H new ATOM 0 HA ASP A 211 59.447 8.159 10.101 1.00 53.73 H new ATOM 0 HB2 ASP A 211 60.609 6.229 9.186 1.00 58.76 H new ATOM 0 HB3 ASP A 211 59.611 5.931 10.347 1.00 58.76 H new ATOM 654 N SER A 212 58.880 8.262 7.001 1.00 53.47 N ATOM 655 CA SER A 212 59.158 9.028 5.820 1.00 54.58 C ATOM 656 C SER A 212 59.013 10.550 6.046 1.00 54.66 C ATOM 657 O SER A 212 59.529 11.335 5.246 1.00 58.10 O ATOM 658 CB SER A 212 58.216 8.518 4.693 1.00 57.32 C ATOM 659 OG SER A 212 56.812 8.445 4.988 1.00 58.81 O ATOM 0 H SER A 212 58.186 7.758 6.947 1.00 53.47 H new ATOM 0 HA SER A 212 60.085 8.900 5.566 1.00 54.58 H new ATOM 0 HB2 SER A 212 58.331 9.096 3.922 1.00 57.32 H new ATOM 0 HB3 SER A 212 58.514 7.633 4.431 1.00 57.32 H new ATOM 0 HG SER A 212 56.398 8.161 4.315 1.00 58.81 H new ATOM 662 N GLY A 213 58.315 11.061 7.076 1.00 51.22 N ATOM 663 CA GLY A 213 58.189 12.509 7.270 1.00 46.97 C ATOM 664 C GLY A 213 56.785 13.009 7.670 1.00 41.95 C ATOM 665 O GLY A 213 56.664 13.837 8.577 1.00 42.74 O ATOM 0 H GLY A 213 57.911 10.585 7.668 1.00 51.22 H new ATOM 0 HA2 GLY A 213 58.819 12.783 7.954 1.00 46.97 H new ATOM 0 HA3 GLY A 213 58.451 12.953 6.448 1.00 46.97 H new ATOM 667 N GLY A 214 55.704 12.530 7.062 1.00 35.56 N ATOM 668 CA GLY A 214 54.389 13.050 7.379 1.00 28.06 C ATOM 669 C GLY A 214 53.803 12.725 8.754 1.00 23.05 C ATOM 670 O GLY A 214 54.432 12.126 9.628 1.00 22.29 O ATOM 0 H GLY A 214 55.714 11.908 6.468 1.00 35.56 H new ATOM 0 HA2 GLY A 214 54.421 14.015 7.290 1.00 28.06 H new ATOM 0 HA3 GLY A 214 53.770 12.724 6.707 1.00 28.06 H new ATOM 672 N PHE A 215 52.549 13.121 8.922 1.00 16.67 N ATOM 673 CA PHE A 215 51.823 12.986 10.156 1.00 10.88 C ATOM 674 C PHE A 215 50.425 12.554 9.762 1.00 11.66 C ATOM 675 O PHE A 215 49.947 12.978 8.707 1.00 11.85 O ATOM 676 CB PHE A 215 51.718 14.312 10.864 1.00 5.37 C ATOM 677 CG PHE A 215 53.027 14.750 11.466 1.00 7.72 C ATOM 678 CD1 PHE A 215 53.367 14.355 12.753 1.00 8.11 C ATOM 679 CD2 PHE A 215 53.895 15.559 10.727 1.00 10.70 C ATOM 680 CE1 PHE A 215 54.576 14.780 13.288 1.00 10.60 C ATOM 681 CE2 PHE A 215 55.109 15.981 11.268 1.00 6.43 C ATOM 682 CZ PHE A 215 55.450 15.595 12.553 1.00 6.96 C ATOM 0 H PHE A 215 52.089 13.487 8.295 1.00 16.67 H new ATOM 0 HA PHE A 215 52.267 12.358 10.747 1.00 10.88 H new ATOM 0 HB2 PHE A 215 51.412 14.986 10.238 1.00 5.37 H new ATOM 0 HB3 PHE A 215 51.049 14.250 11.563 1.00 5.37 H new ATOM 0 HD1 PHE A 215 52.795 13.815 13.248 1.00 8.11 H new ATOM 0 HD2 PHE A 215 53.660 15.819 9.865 1.00 10.70 H new ATOM 0 HE1 PHE A 215 54.811 14.520 14.149 1.00 10.60 H new ATOM 0 HE2 PHE A 215 55.684 16.517 10.770 1.00 6.43 H new ATOM 0 HZ PHE A 215 56.254 15.874 12.927 1.00 6.96 H new ATOM 684 N TYR A 216 49.729 11.730 10.558 1.00 11.91 N ATOM 685 CA TYR A 216 48.343 11.410 10.253 1.00 11.32 C ATOM 686 C TYR A 216 47.548 11.067 11.517 1.00 8.07 C ATOM 687 O TYR A 216 48.070 10.601 12.534 1.00 11.10 O ATOM 688 CB TYR A 216 48.267 10.217 9.265 1.00 8.20 C ATOM 689 CG TYR A 216 48.718 8.883 9.854 1.00 8.65 C ATOM 690 CD1 TYR A 216 47.811 8.119 10.584 1.00 8.67 C ATOM 691 CD2 TYR A 216 50.039 8.418 9.708 1.00 12.67 C ATOM 692 CE1 TYR A 216 48.199 6.927 11.153 1.00 9.53 C ATOM 693 CE2 TYR A 216 50.435 7.200 10.281 1.00 10.40 C ATOM 694 CZ TYR A 216 49.499 6.471 10.994 1.00 12.20 C ATOM 695 OH TYR A 216 49.854 5.275 11.597 1.00 17.02 O ATOM 0 H TYR A 216 50.042 11.355 11.266 1.00 11.91 H new ATOM 0 HA TYR A 216 47.950 12.199 9.847 1.00 11.32 H new ATOM 0 HB2 TYR A 216 47.353 10.128 8.952 1.00 8.20 H new ATOM 0 HB3 TYR A 216 48.814 10.418 8.490 1.00 8.20 H new ATOM 0 HD1 TYR A 216 46.936 8.416 10.688 1.00 8.67 H new ATOM 0 HD2 TYR A 216 50.655 8.923 9.227 1.00 12.67 H new ATOM 0 HE1 TYR A 216 47.588 6.427 11.645 1.00 9.53 H new ATOM 0 HE2 TYR A 216 51.306 6.890 10.184 1.00 10.40 H new ATOM 0 HH TYR A 216 50.659 5.105 11.430 1.00 17.02 H new ATOM 698 N ILE A 217 46.239 11.300 11.424 1.00 11.24 N ATOM 699 CA ILE A 217 45.254 10.806 12.378 1.00 8.89 C ATOM 700 C ILE A 217 44.446 9.687 11.657 1.00 8.86 C ATOM 701 O ILE A 217 44.209 8.636 12.252 1.00 8.64 O ATOM 702 CB ILE A 217 44.288 11.978 12.878 1.00 7.70 C ATOM 703 CG1 ILE A 217 45.145 13.087 13.542 1.00 10.21 C ATOM 704 CG2 ILE A 217 43.295 11.475 13.949 1.00 2.00 C ATOM 705 CD1 ILE A 217 44.447 14.166 14.413 1.00 11.77 C ATOM 0 H ILE A 217 45.893 11.762 10.787 1.00 11.24 H new ATOM 0 HA ILE A 217 45.694 10.459 13.170 1.00 8.89 H new ATOM 0 HB ILE A 217 43.798 12.305 12.107 1.00 7.70 H new ATOM 0 HG12 ILE A 217 45.809 12.649 14.097 1.00 10.21 H new ATOM 0 HG13 ILE A 217 45.624 13.548 12.836 1.00 10.21 H new ATOM 0 HG21 ILE A 217 42.725 12.207 14.231 1.00 2.00 H new ATOM 0 HG22 ILE A 217 42.749 10.765 13.576 1.00 2.00 H new ATOM 0 HG23 ILE A 217 43.787 11.136 14.713 1.00 2.00 H new ATOM 0 HD11 ILE A 217 45.111 14.784 14.756 1.00 11.77 H new ATOM 0 HD12 ILE A 217 43.803 14.650 13.874 1.00 11.77 H new ATOM 0 HD13 ILE A 217 43.991 13.738 15.154 1.00 11.77 H new ATOM 707 N THR A 218 43.983 9.819 10.401 1.00 10.49 N ATOM 708 CA THR A 218 43.217 8.757 9.707 1.00 9.76 C ATOM 709 C THR A 218 43.867 8.469 8.364 1.00 10.51 C ATOM 710 O THR A 218 44.713 9.259 7.929 1.00 11.42 O ATOM 711 CB THR A 218 41.732 9.173 9.457 1.00 6.10 C ATOM 712 OG1 THR A 218 41.686 10.249 8.546 1.00 9.97 O ATOM 713 CG2 THR A 218 41.079 9.648 10.745 1.00 6.10 C ATOM 0 H THR A 218 44.103 10.526 9.926 1.00 10.49 H new ATOM 0 HA THR A 218 43.223 7.972 10.277 1.00 9.76 H new ATOM 0 HB THR A 218 41.264 8.397 9.110 1.00 6.10 H new ATOM 0 HG1 THR A 218 41.317 10.910 8.911 1.00 9.97 H new ATOM 0 HG21 THR A 218 40.159 9.901 10.568 1.00 6.10 H new ATOM 0 HG22 THR A 218 41.097 8.933 11.400 1.00 6.10 H new ATOM 0 HG23 THR A 218 41.564 10.414 11.090 1.00 6.10 H new ATOM 716 N SER A 219 43.427 7.415 7.664 1.00 10.68 N ATOM 717 CA SER A 219 43.886 7.079 6.314 1.00 10.96 C ATOM 718 C SER A 219 43.373 8.042 5.255 1.00 11.27 C ATOM 719 O SER A 219 43.799 8.039 4.109 1.00 13.10 O ATOM 720 CB SER A 219 43.403 5.686 5.948 1.00 7.10 C ATOM 721 OG SER A 219 42.011 5.580 6.219 1.00 8.81 O ATOM 0 H SER A 219 42.841 6.865 7.970 1.00 10.68 H new ATOM 0 HA SER A 219 44.854 7.133 6.330 1.00 10.96 H new ATOM 0 HB2 SER A 219 43.574 5.510 5.009 1.00 7.10 H new ATOM 0 HB3 SER A 219 43.893 5.020 6.455 1.00 7.10 H new ATOM 0 HG SER A 219 41.743 4.810 6.015 1.00 8.81 H new ATOM 724 N ARG A 220 42.362 8.844 5.562 1.00 16.32 N ATOM 725 CA ARG A 220 41.795 9.760 4.574 1.00 17.49 C ATOM 726 C ARG A 220 42.774 10.835 4.104 1.00 18.40 C ATOM 727 O ARG A 220 42.823 11.080 2.904 1.00 19.09 O ATOM 728 CB ARG A 220 40.574 10.385 5.174 1.00 15.53 C ATOM 729 CG ARG A 220 39.722 11.031 4.158 1.00 20.38 C ATOM 730 CD ARG A 220 38.626 11.698 4.931 1.00 26.25 C ATOM 731 NE ARG A 220 37.443 11.770 4.091 1.00 35.49 N ATOM 732 CZ ARG A 220 37.183 12.785 3.268 1.00 37.01 C ATOM 733 NH1 ARG A 220 38.020 13.820 3.160 1.00 38.31 N ATOM 734 NH2 ARG A 220 36.015 12.761 2.604 1.00 41.94 N ATOM 0 H ARG A 220 41.988 8.875 6.336 1.00 16.32 H new ATOM 0 HA ARG A 220 41.575 9.249 3.779 1.00 17.49 H new ATOM 0 HB2 ARG A 220 40.061 9.706 5.640 1.00 15.53 H new ATOM 0 HB3 ARG A 220 40.841 11.042 5.835 1.00 15.53 H new ATOM 0 HG2 ARG A 220 40.226 11.676 3.637 1.00 20.38 H new ATOM 0 HG3 ARG A 220 39.365 10.379 3.535 1.00 20.38 H new ATOM 0 HD2 ARG A 220 38.434 11.200 5.741 1.00 26.25 H new ATOM 0 HD3 ARG A 220 38.900 12.588 5.204 1.00 26.25 H new ATOM 0 HE ARG A 220 36.879 11.122 4.127 1.00 35.49 H new ATOM 0 HH11 ARG A 220 38.742 13.840 3.627 1.00 38.31 H new ATOM 0 HH12 ARG A 220 37.837 14.467 2.624 1.00 38.31 H new ATOM 0 HH21 ARG A 220 35.469 12.107 2.719 1.00 41.94 H new ATOM 0 HH22 ARG A 220 35.814 13.400 2.064 1.00 41.94 H new ATOM 741 N THR A 221 43.649 11.408 4.952 1.00 20.50 N ATOM 742 CA THR A 221 44.563 12.483 4.579 1.00 19.69 C ATOM 743 C THR A 221 45.825 12.352 5.432 1.00 18.33 C ATOM 744 O THR A 221 45.752 11.946 6.600 1.00 20.17 O ATOM 745 CB THR A 221 43.913 13.890 4.838 1.00 21.65 C ATOM 746 OG1 THR A 221 42.537 13.877 4.460 1.00 27.71 O ATOM 747 CG2 THR A 221 44.618 14.957 4.005 1.00 22.84 C ATOM 0 H THR A 221 43.722 11.171 5.775 1.00 20.50 H new ATOM 0 HA THR A 221 44.770 12.412 3.634 1.00 19.69 H new ATOM 0 HB THR A 221 43.999 14.089 5.783 1.00 21.65 H new ATOM 0 HG1 THR A 221 42.058 13.807 5.147 1.00 27.71 H new ATOM 0 HG21 THR A 221 44.209 15.821 4.172 1.00 22.84 H new ATOM 0 HG22 THR A 221 45.556 14.991 4.249 1.00 22.84 H new ATOM 0 HG23 THR A 221 44.537 14.738 3.063 1.00 22.84 H new ATOM 750 N GLN A 222 46.986 12.652 4.847 1.00 18.42 N ATOM 751 CA GLN A 222 48.271 12.645 5.577 1.00 18.40 C ATOM 752 C GLN A 222 48.860 14.045 5.466 1.00 20.16 C ATOM 753 O GLN A 222 48.458 14.782 4.566 1.00 21.53 O ATOM 754 CB GLN A 222 49.259 11.694 4.935 1.00 19.43 C ATOM 0 H GLN A 222 47.057 12.866 4.017 1.00 18.42 H new ATOM 0 HA GLN A 222 48.114 12.371 6.494 1.00 18.40 H new ATOM 756 N PHE A 223 49.805 14.496 6.270 1.00 20.17 N ATOM 757 CA PHE A 223 50.286 15.863 6.167 1.00 21.05 C ATOM 758 C PHE A 223 51.762 15.902 6.322 1.00 21.94 C ATOM 759 O PHE A 223 52.322 15.077 7.037 1.00 22.24 O ATOM 760 CB PHE A 223 49.756 16.743 7.263 1.00 21.98 C ATOM 761 CG PHE A 223 48.265 16.685 7.323 1.00 18.35 C ATOM 762 CD1 PHE A 223 47.519 17.536 6.518 1.00 16.95 C ATOM 763 CD2 PHE A 223 47.647 15.761 8.179 1.00 19.89 C ATOM 764 CE1 PHE A 223 46.123 17.461 6.579 1.00 17.38 C ATOM 765 CE2 PHE A 223 46.251 15.701 8.223 1.00 17.39 C ATOM 766 CZ PHE A 223 45.489 16.545 7.429 1.00 12.99 C ATOM 0 H PHE A 223 50.183 14.027 6.884 1.00 20.17 H new ATOM 0 HA PHE A 223 49.988 16.178 5.299 1.00 21.05 H new ATOM 0 HB2 PHE A 223 50.128 16.465 8.114 1.00 21.98 H new ATOM 0 HB3 PHE A 223 50.042 17.658 7.114 1.00 21.98 H new ATOM 0 HD1 PHE A 223 47.938 18.142 5.951 1.00 16.95 H new ATOM 0 HD2 PHE A 223 48.160 15.196 8.710 1.00 19.89 H new ATOM 0 HE1 PHE A 223 45.609 18.026 6.049 1.00 17.38 H new ATOM 0 HE2 PHE A 223 45.831 15.092 8.787 1.00 17.39 H new ATOM 0 HZ PHE A 223 44.560 16.503 7.461 1.00 12.99 H new ATOM 768 N ASN A 224 52.413 16.906 5.762 1.00 22.88 N ATOM 769 CA ASN A 224 53.853 17.007 5.893 1.00 24.50 C ATOM 770 C ASN A 224 54.311 17.778 7.104 1.00 22.85 C ATOM 771 O ASN A 224 55.510 17.777 7.392 1.00 24.07 O ATOM 772 CB ASN A 224 54.463 17.646 4.658 1.00 32.87 C ATOM 773 CG ASN A 224 54.100 16.839 3.428 1.00 39.41 C ATOM 774 OD1 ASN A 224 53.341 17.325 2.595 1.00 45.90 O ATOM 775 ND2 ASN A 224 54.517 15.572 3.288 1.00 42.57 N ATOM 0 H ASN A 224 52.044 17.534 5.306 1.00 22.88 H new ATOM 0 HA ASN A 224 54.158 16.092 5.999 1.00 24.50 H new ATOM 0 HB2 ASN A 224 54.143 18.557 4.563 1.00 32.87 H new ATOM 0 HB3 ASN A 224 55.427 17.693 4.751 1.00 32.87 H new ATOM 0 HD21 ASN A 224 54.253 15.104 2.617 1.00 42.57 H new ATOM 0 HD22 ASN A 224 55.049 15.228 3.869 1.00 42.57 H new ATOM 779 N SER A 225 53.416 18.430 7.846 1.00 20.54 N ATOM 780 CA SER A 225 53.802 19.072 9.095 1.00 19.68 C ATOM 781 C SER A 225 52.594 19.132 10.027 1.00 18.39 C ATOM 782 O SER A 225 51.440 18.960 9.586 1.00 18.05 O ATOM 783 CB SER A 225 54.315 20.490 8.839 1.00 18.18 C ATOM 784 OG SER A 225 53.351 21.329 8.191 1.00 23.46 O ATOM 0 H SER A 225 52.584 18.510 7.642 1.00 20.54 H new ATOM 0 HA SER A 225 54.513 18.554 9.504 1.00 19.68 H new ATOM 0 HB2 SER A 225 54.570 20.893 9.684 1.00 18.18 H new ATOM 0 HB3 SER A 225 55.115 20.445 8.293 1.00 18.18 H new ATOM 0 HG SER A 225 53.440 21.267 7.358 1.00 23.46 H new ATOM 787 N LEU A 226 52.835 19.412 11.321 1.00 17.01 N ATOM 788 CA LEU A 226 51.769 19.545 12.298 1.00 16.36 C ATOM 789 C LEU A 226 51.071 20.845 11.987 1.00 20.50 C ATOM 790 O LEU A 226 49.846 20.884 12.074 1.00 23.47 O ATOM 791 CB LEU A 226 52.359 19.549 13.719 1.00 13.72 C ATOM 792 CG LEU A 226 52.815 18.175 14.149 1.00 16.36 C ATOM 793 CD1 LEU A 226 53.605 18.255 15.392 1.00 13.67 C ATOM 794 CD2 LEU A 226 51.611 17.293 14.412 1.00 17.17 C ATOM 0 H LEU A 226 53.624 19.528 11.644 1.00 17.01 H new ATOM 0 HA LEU A 226 51.143 18.805 12.255 1.00 16.36 H new ATOM 0 HB2 LEU A 226 53.109 20.163 13.755 1.00 13.72 H new ATOM 0 HB3 LEU A 226 51.693 19.878 14.343 1.00 13.72 H new ATOM 0 HG LEU A 226 53.360 17.804 13.438 1.00 16.36 H new ATOM 0 HD11 LEU A 226 53.889 17.365 15.653 1.00 13.67 H new ATOM 0 HD12 LEU A 226 54.385 18.813 15.245 1.00 13.67 H new ATOM 0 HD13 LEU A 226 53.061 18.640 16.097 1.00 13.67 H new ATOM 0 HD21 LEU A 226 51.909 16.412 14.688 1.00 17.17 H new ATOM 0 HD22 LEU A 226 51.070 17.685 15.115 1.00 17.17 H new ATOM 0 HD23 LEU A 226 51.083 17.216 13.602 1.00 17.17 H new ATOM 796 N GLN A 227 51.754 21.911 11.524 1.00 19.89 N ATOM 797 CA GLN A 227 51.064 23.153 11.151 1.00 19.57 C ATOM 798 C GLN A 227 50.015 22.903 10.054 1.00 19.85 C ATOM 799 O GLN A 227 48.876 23.365 10.078 1.00 20.36 O ATOM 800 CB GLN A 227 52.080 24.174 10.664 1.00 21.71 C ATOM 801 CG GLN A 227 53.152 24.583 11.707 1.00 29.68 C ATOM 802 CD GLN A 227 54.356 23.646 11.907 1.00 33.30 C ATOM 803 OE1 GLN A 227 54.471 22.546 11.343 1.00 35.33 O ATOM 804 NE2 GLN A 227 55.295 24.039 12.750 1.00 34.31 N ATOM 0 H GLN A 227 52.608 21.931 11.421 1.00 19.89 H new ATOM 0 HA GLN A 227 50.605 23.492 11.936 1.00 19.57 H new ATOM 0 HB2 GLN A 227 52.529 23.816 9.883 1.00 21.71 H new ATOM 0 HB3 GLN A 227 51.606 24.971 10.378 1.00 21.71 H new ATOM 0 HG2 GLN A 227 53.493 25.456 11.457 1.00 29.68 H new ATOM 0 HG3 GLN A 227 52.709 24.686 12.564 1.00 29.68 H new ATOM 0 HE21 GLN A 227 55.226 24.799 13.147 1.00 34.31 H new ATOM 0 HE22 GLN A 227 55.975 23.535 12.902 1.00 34.31 H new ATOM 808 N GLN A 228 50.361 22.033 9.128 1.00 19.91 N ATOM 809 CA GLN A 228 49.493 21.648 8.034 1.00 23.05 C ATOM 810 C GLN A 228 48.312 20.836 8.557 1.00 20.39 C ATOM 811 O GLN A 228 47.162 21.053 8.179 1.00 19.13 O ATOM 812 CB GLN A 228 50.346 20.856 7.094 1.00 29.00 C ATOM 813 CG GLN A 228 49.838 20.645 5.686 1.00 43.84 C ATOM 814 CD GLN A 228 50.786 19.789 4.838 1.00 49.97 C ATOM 815 OE1 GLN A 228 52.014 19.820 5.005 1.00 57.45 O ATOM 816 NE2 GLN A 228 50.277 18.941 3.950 1.00 50.85 N ATOM 0 H GLN A 228 51.125 21.639 9.116 1.00 19.91 H new ATOM 0 HA GLN A 228 49.112 22.416 7.581 1.00 23.05 H new ATOM 0 HB2 GLN A 228 51.210 21.293 7.036 1.00 29.00 H new ATOM 0 HB3 GLN A 228 50.495 19.983 7.491 1.00 29.00 H new ATOM 0 HG2 GLN A 228 48.967 20.219 5.721 1.00 43.84 H new ATOM 0 HG3 GLN A 228 49.716 21.507 5.258 1.00 43.84 H new ATOM 0 HE21 GLN A 228 49.427 18.909 3.824 1.00 50.85 H new ATOM 0 HE22 GLN A 228 50.798 18.424 3.501 1.00 50.85 H new ATOM 820 N LEU A 229 48.572 19.878 9.441 1.00 19.58 N ATOM 821 CA LEU A 229 47.494 19.097 10.046 1.00 17.91 C ATOM 822 C LEU A 229 46.576 20.049 10.819 1.00 16.10 C ATOM 823 O LEU A 229 45.357 20.009 10.659 1.00 18.34 O ATOM 824 CB LEU A 229 48.123 17.971 10.977 1.00 14.36 C ATOM 825 CG LEU A 229 47.239 16.977 11.757 1.00 13.33 C ATOM 826 CD1 LEU A 229 48.024 15.746 12.062 1.00 8.05 C ATOM 827 CD2 LEU A 229 46.718 17.604 13.046 1.00 8.81 C ATOM 0 H LEU A 229 49.362 19.664 9.704 1.00 19.58 H new ATOM 0 HA LEU A 229 46.961 18.650 9.370 1.00 17.91 H new ATOM 0 HB2 LEU A 229 48.714 17.443 10.418 1.00 14.36 H new ATOM 0 HB3 LEU A 229 48.679 18.424 11.630 1.00 14.36 H new ATOM 0 HG LEU A 229 46.474 16.744 11.208 1.00 13.33 H new ATOM 0 HD11 LEU A 229 47.468 15.121 12.553 1.00 8.05 H new ATOM 0 HD12 LEU A 229 48.318 15.336 11.234 1.00 8.05 H new ATOM 0 HD13 LEU A 229 48.798 15.980 12.598 1.00 8.05 H new ATOM 0 HD21 LEU A 229 46.166 16.962 13.518 1.00 8.81 H new ATOM 0 HD22 LEU A 229 47.467 17.861 13.607 1.00 8.81 H new ATOM 0 HD23 LEU A 229 46.190 18.389 12.834 1.00 8.81 H new ATOM 829 N VAL A 230 47.104 20.975 11.616 1.00 17.00 N ATOM 830 CA VAL A 230 46.263 21.864 12.412 1.00 17.13 C ATOM 831 C VAL A 230 45.429 22.743 11.465 1.00 18.57 C ATOM 832 O VAL A 230 44.226 22.932 11.647 1.00 18.31 O ATOM 833 CB VAL A 230 47.187 22.725 13.378 1.00 15.42 C ATOM 834 CG1 VAL A 230 46.430 23.927 13.896 1.00 9.68 C ATOM 835 CG2 VAL A 230 47.594 21.909 14.596 1.00 13.17 C ATOM 0 H VAL A 230 47.949 21.105 11.710 1.00 17.00 H new ATOM 0 HA VAL A 230 45.647 21.359 12.966 1.00 17.13 H new ATOM 0 HB VAL A 230 47.965 22.995 12.866 1.00 15.42 H new ATOM 0 HG11 VAL A 230 47.004 24.443 14.483 1.00 9.68 H new ATOM 0 HG12 VAL A 230 46.151 24.480 13.150 1.00 9.68 H new ATOM 0 HG13 VAL A 230 45.648 23.630 14.388 1.00 9.68 H new ATOM 0 HG21 VAL A 230 48.156 22.448 15.174 1.00 13.17 H new ATOM 0 HG22 VAL A 230 46.801 21.635 15.082 1.00 13.17 H new ATOM 0 HG23 VAL A 230 48.085 21.123 14.310 1.00 13.17 H new ATOM 837 N ALA A 231 46.036 23.225 10.383 1.00 19.37 N ATOM 838 CA ALA A 231 45.314 24.075 9.456 1.00 19.83 C ATOM 839 C ALA A 231 44.179 23.340 8.767 1.00 20.31 C ATOM 840 O ALA A 231 43.072 23.858 8.576 1.00 21.17 O ATOM 841 CB ALA A 231 46.278 24.587 8.411 1.00 16.76 C ATOM 0 H ALA A 231 46.856 23.071 10.173 1.00 19.37 H new ATOM 0 HA ALA A 231 44.926 24.806 9.962 1.00 19.83 H new ATOM 0 HB1 ALA A 231 45.804 25.157 7.785 1.00 16.76 H new ATOM 0 HB2 ALA A 231 46.983 25.096 8.842 1.00 16.76 H new ATOM 0 HB3 ALA A 231 46.667 23.837 7.934 1.00 16.76 H new ATOM 843 N TYR A 232 44.421 22.105 8.346 1.00 21.67 N ATOM 844 CA TYR A 232 43.397 21.355 7.656 1.00 19.78 C ATOM 845 C TYR A 232 42.170 21.121 8.530 1.00 19.79 C ATOM 846 O TYR A 232 41.028 21.382 8.087 1.00 20.64 O ATOM 847 CB TYR A 232 43.994 20.038 7.209 1.00 22.59 C ATOM 848 CG TYR A 232 42.980 19.158 6.527 1.00 23.94 C ATOM 849 CD1 TYR A 232 42.753 19.353 5.180 1.00 32.68 C ATOM 850 CD2 TYR A 232 42.262 18.183 7.226 1.00 27.41 C ATOM 851 CE1 TYR A 232 41.808 18.576 4.508 1.00 34.53 C ATOM 852 CE2 TYR A 232 41.311 17.404 6.564 1.00 29.81 C ATOM 853 CZ TYR A 232 41.093 17.607 5.199 1.00 34.98 C ATOM 854 OH TYR A 232 40.154 16.876 4.495 1.00 37.57 O ATOM 0 H TYR A 232 45.167 21.690 8.451 1.00 21.67 H new ATOM 0 HA TYR A 232 43.094 21.867 6.890 1.00 19.78 H new ATOM 0 HB2 TYR A 232 44.732 20.208 6.603 1.00 22.59 H new ATOM 0 HB3 TYR A 232 44.359 19.573 7.978 1.00 22.59 H new ATOM 0 HD1 TYR A 232 43.231 20.004 4.719 1.00 32.68 H new ATOM 0 HD2 TYR A 232 42.418 18.053 8.134 1.00 27.41 H new ATOM 0 HE1 TYR A 232 41.658 18.707 3.600 1.00 34.53 H new ATOM 0 HE2 TYR A 232 40.828 16.757 7.026 1.00 29.81 H new ATOM 0 HH TYR A 232 39.757 16.352 5.018 1.00 37.57 H new ATOM 857 N TYR A 233 42.385 20.650 9.762 1.00 18.06 N ATOM 858 CA TYR A 233 41.261 20.316 10.620 1.00 16.96 C ATOM 859 C TYR A 233 40.570 21.536 11.187 1.00 16.06 C ATOM 860 O TYR A 233 39.520 21.428 11.811 1.00 16.90 O ATOM 861 CB TYR A 233 41.708 19.400 11.758 1.00 15.34 C ATOM 862 CG TYR A 233 41.933 17.981 11.286 1.00 14.93 C ATOM 863 CD1 TYR A 233 40.848 17.156 10.923 1.00 16.19 C ATOM 864 CD2 TYR A 233 43.231 17.522 11.192 1.00 13.02 C ATOM 865 CE1 TYR A 233 41.079 15.862 10.451 1.00 14.99 C ATOM 866 CE2 TYR A 233 43.467 16.242 10.727 1.00 11.12 C ATOM 867 CZ TYR A 233 42.398 15.422 10.358 1.00 14.67 C ATOM 868 OH TYR A 233 42.700 14.154 9.924 1.00 10.70 O ATOM 0 H TYR A 233 43.161 20.521 10.109 1.00 18.06 H new ATOM 0 HA TYR A 233 40.617 19.854 10.061 1.00 16.96 H new ATOM 0 HB2 TYR A 233 42.527 19.745 12.147 1.00 15.34 H new ATOM 0 HB3 TYR A 233 41.037 19.405 12.459 1.00 15.34 H new ATOM 0 HD1 TYR A 233 39.977 17.474 10.998 1.00 16.19 H new ATOM 0 HD2 TYR A 233 43.941 18.069 11.439 1.00 13.02 H new ATOM 0 HE1 TYR A 233 40.372 15.309 10.206 1.00 14.99 H new ATOM 0 HE2 TYR A 233 44.339 15.926 10.660 1.00 11.12 H new ATOM 0 HH TYR A 233 42.008 13.790 9.618 1.00 10.70 H new ATOM 871 N SER A 234 41.138 22.720 10.982 1.00 17.88 N ATOM 872 CA SER A 234 40.457 23.955 11.340 1.00 22.43 C ATOM 873 C SER A 234 39.412 24.289 10.278 1.00 25.33 C ATOM 874 O SER A 234 38.442 25.006 10.544 1.00 27.23 O ATOM 875 CB SER A 234 41.495 25.082 11.468 1.00 19.04 C ATOM 876 OG SER A 234 42.382 24.970 12.609 1.00 22.45 O ATOM 0 H SER A 234 41.918 22.828 10.636 1.00 17.88 H new ATOM 0 HA SER A 234 40.002 23.853 12.191 1.00 22.43 H new ATOM 0 HB2 SER A 234 42.031 25.104 10.660 1.00 19.04 H new ATOM 0 HB3 SER A 234 41.027 25.930 11.521 1.00 19.04 H new ATOM 0 HG SER A 234 42.965 24.385 12.455 1.00 22.45 H new ATOM 879 N LYS A 235 39.591 23.747 9.062 1.00 28.97 N ATOM 880 CA LYS A 235 38.629 23.886 7.966 1.00 31.11 C ATOM 881 C LYS A 235 37.700 22.700 7.925 1.00 31.38 C ATOM 882 O LYS A 235 36.538 22.875 7.582 1.00 34.86 O ATOM 883 CB LYS A 235 39.272 23.919 6.612 1.00 32.75 C ATOM 884 CG LYS A 235 40.329 24.984 6.505 1.00 41.43 C ATOM 885 CD LYS A 235 40.776 25.106 5.051 1.00 51.27 C ATOM 886 CE LYS A 235 41.548 23.893 4.494 1.00 57.10 C ATOM 887 NZ LYS A 235 42.919 23.822 4.992 1.00 61.20 N ATOM 0 H LYS A 235 40.285 23.284 8.853 1.00 28.97 H new ATOM 0 HA LYS A 235 38.172 24.723 8.143 1.00 31.11 H new ATOM 0 HB2 LYS A 235 39.668 23.054 6.424 1.00 32.75 H new ATOM 0 HB3 LYS A 235 38.592 24.073 5.937 1.00 32.75 H new ATOM 0 HG2 LYS A 235 39.981 25.833 6.820 1.00 41.43 H new ATOM 0 HG3 LYS A 235 41.086 24.761 7.069 1.00 41.43 H new ATOM 0 HD2 LYS A 235 39.992 25.253 4.499 1.00 51.27 H new ATOM 0 HD3 LYS A 235 41.335 25.894 4.965 1.00 51.27 H new ATOM 0 HE2 LYS A 235 41.079 23.078 4.732 1.00 57.10 H new ATOM 0 HE3 LYS A 235 41.562 23.940 3.525 1.00 57.10 H new ATOM 0 HZ1 LYS A 235 43.282 23.046 4.753 1.00 61.20 H new ATOM 0 HZ2 LYS A 235 43.395 24.490 4.648 1.00 61.20 H new ATOM 0 HZ3 LYS A 235 42.916 23.887 5.880 1.00 61.20 H new ATOM 892 N HIS A 236 38.131 21.460 8.185 1.00 31.31 N ATOM 893 CA HIS A 236 37.247 20.296 8.057 1.00 29.66 C ATOM 894 C HIS A 236 37.407 19.351 9.221 1.00 28.17 C ATOM 895 O HIS A 236 38.544 18.958 9.488 1.00 28.90 O ATOM 896 CB HIS A 236 37.578 19.491 6.827 1.00 33.81 C ATOM 897 CG HIS A 236 37.615 20.299 5.555 1.00 39.39 C ATOM 898 ND1 HIS A 236 36.564 20.744 4.855 1.00 41.04 N ATOM 899 CD2 HIS A 236 38.774 20.727 4.949 1.00 41.21 C ATOM 900 CE1 HIS A 236 37.044 21.430 3.843 1.00 42.64 C ATOM 901 NE2 HIS A 236 38.369 21.421 3.910 1.00 43.93 N ATOM 0 H HIS A 236 38.932 21.273 8.437 1.00 31.31 H new ATOM 0 HA HIS A 236 36.346 20.653 8.015 1.00 29.66 H new ATOM 0 HB2 HIS A 236 38.440 19.065 6.953 1.00 33.81 H new ATOM 0 HB3 HIS A 236 36.923 18.782 6.730 1.00 33.81 H new ATOM 0 HD2 HIS A 236 39.649 20.562 5.216 1.00 41.21 H new ATOM 0 HE1 HIS A 236 36.538 21.853 3.187 1.00 42.64 H new ATOM 0 HE2 HIS A 236 38.890 21.815 3.351 1.00 43.93 H new ATOM 905 N ALA A 237 36.315 18.947 9.897 1.00 25.32 N ATOM 906 CA ALA A 237 36.415 18.000 11.012 1.00 24.84 C ATOM 907 C ALA A 237 36.899 16.615 10.569 1.00 24.64 C ATOM 908 O ALA A 237 37.732 16.027 11.256 1.00 25.77 O ATOM 909 CB ALA A 237 35.073 17.803 11.706 1.00 16.97 C ATOM 0 H ALA A 237 35.515 19.211 9.723 1.00 25.32 H new ATOM 0 HA ALA A 237 37.061 18.395 11.618 1.00 24.84 H new ATOM 0 HB1 ALA A 237 35.175 17.173 12.436 1.00 16.97 H new ATOM 0 HB2 ALA A 237 34.761 18.653 12.055 1.00 16.97 H new ATOM 0 HB3 ALA A 237 34.427 17.458 11.070 1.00 16.97 H new ATOM 911 N ASP A 238 36.351 16.081 9.443 1.00 25.25 N ATOM 912 CA ASP A 238 36.720 14.805 8.820 1.00 20.34 C ATOM 913 C ASP A 238 36.895 13.678 9.767 1.00 18.61 C ATOM 914 O ASP A 238 37.924 13.016 9.803 1.00 17.75 O ATOM 915 CB ASP A 238 38.005 14.939 8.023 1.00 25.72 C ATOM 916 CG ASP A 238 37.727 15.318 6.603 1.00 32.99 C ATOM 917 OD1 ASP A 238 36.748 16.035 6.331 1.00 39.34 O ATOM 918 OD2 ASP A 238 38.452 14.859 5.741 1.00 35.57 O ATOM 0 H ASP A 238 35.725 16.484 9.012 1.00 25.25 H new ATOM 0 HA ASP A 238 35.964 14.595 8.249 1.00 20.34 H new ATOM 0 HB2 ASP A 238 38.574 15.609 8.433 1.00 25.72 H new ATOM 0 HB3 ASP A 238 38.492 14.100 8.047 1.00 25.72 H new ATOM 920 N GLY A 239 35.881 13.492 10.608 1.00 16.98 N ATOM 921 CA GLY A 239 35.932 12.439 11.605 1.00 17.14 C ATOM 922 C GLY A 239 36.164 12.949 13.013 1.00 17.31 C ATOM 923 O GLY A 239 35.818 12.263 13.965 1.00 19.77 O ATOM 0 H GLY A 239 35.161 13.963 10.615 1.00 16.98 H new ATOM 0 HA2 GLY A 239 35.100 11.941 11.582 1.00 17.14 H new ATOM 0 HA3 GLY A 239 36.640 11.818 11.373 1.00 17.14 H new ATOM 925 N LEU A 240 36.791 14.109 13.215 1.00 19.07 N ATOM 926 CA LEU A 240 36.986 14.626 14.559 1.00 15.35 C ATOM 927 C LEU A 240 35.648 15.003 15.107 1.00 16.10 C ATOM 928 O LEU A 240 34.744 15.319 14.338 1.00 16.69 O ATOM 929 CB LEU A 240 37.800 15.885 14.582 1.00 13.40 C ATOM 930 CG LEU A 240 39.144 15.864 13.957 1.00 17.94 C ATOM 931 CD1 LEU A 240 39.827 17.140 14.395 1.00 16.11 C ATOM 932 CD2 LEU A 240 39.944 14.625 14.353 1.00 17.47 C ATOM 0 H LEU A 240 37.107 14.605 12.588 1.00 19.07 H new ATOM 0 HA LEU A 240 37.442 13.937 15.067 1.00 15.35 H new ATOM 0 HB2 LEU A 240 37.282 16.580 14.147 1.00 13.40 H new ATOM 0 HB3 LEU A 240 37.909 16.150 15.509 1.00 13.40 H new ATOM 0 HG LEU A 240 39.075 15.818 12.991 1.00 17.94 H new ATOM 0 HD11 LEU A 240 40.717 17.179 14.012 1.00 16.11 H new ATOM 0 HD12 LEU A 240 39.312 17.904 14.092 1.00 16.11 H new ATOM 0 HD13 LEU A 240 39.891 17.157 15.363 1.00 16.11 H new ATOM 0 HD21 LEU A 240 40.814 14.650 13.924 1.00 17.47 H new ATOM 0 HD22 LEU A 240 40.059 14.608 15.316 1.00 17.47 H new ATOM 0 HD23 LEU A 240 39.468 13.828 14.071 1.00 17.47 H new ATOM 934 N CYS A 241 35.569 15.129 16.422 1.00 14.78 N ATOM 935 CA CYS A 241 34.341 15.504 17.069 1.00 15.44 C ATOM 936 C CYS A 241 33.926 16.903 16.640 1.00 18.74 C ATOM 937 O CYS A 241 32.751 17.214 16.497 1.00 21.56 O ATOM 938 CB CYS A 241 34.512 15.458 18.586 1.00 18.09 C ATOM 939 SG CYS A 241 35.786 16.573 19.234 1.00 16.32 S ATOM 0 H CYS A 241 36.229 14.998 16.958 1.00 14.78 H new ATOM 0 HA CYS A 241 33.649 14.876 16.808 1.00 15.44 H new ATOM 0 HB2 CYS A 241 33.664 15.678 19.002 1.00 18.09 H new ATOM 0 HB3 CYS A 241 34.730 14.550 18.848 1.00 18.09 H new ATOM 0 HG CYS A 241 35.843 16.466 20.428 1.00 16.32 H new ATOM 941 N HIS A 242 34.846 17.799 16.345 1.00 19.30 N ATOM 942 CA HIS A 242 34.456 19.111 15.914 1.00 19.61 C ATOM 943 C HIS A 242 35.680 19.674 15.198 1.00 21.70 C ATOM 944 O HIS A 242 36.800 19.213 15.383 1.00 23.53 O ATOM 945 CB HIS A 242 34.059 19.905 17.174 1.00 22.02 C ATOM 946 CG HIS A 242 33.419 21.252 16.886 1.00 25.02 C ATOM 947 ND1 HIS A 242 34.095 22.412 16.604 1.00 29.70 N flip ATOM 948 CD2 HIS A 242 32.133 21.546 16.871 1.00 28.69 C flip ATOM 949 CE1 HIS A 242 33.193 23.337 16.424 1.00 27.63 C flip ATOM 950 NE2 HIS A 242 32.001 22.828 16.602 1.00 31.45 N flip ATOM 0 H HIS A 242 35.694 17.665 16.389 1.00 19.30 H new ATOM 0 HA HIS A 242 33.697 19.139 15.311 1.00 19.61 H new ATOM 0 HB2 HIS A 242 33.443 19.371 17.699 1.00 22.02 H new ATOM 0 HB3 HIS A 242 34.849 20.044 17.719 1.00 22.02 H new ATOM 0 HD1 HIS A 242 34.948 22.510 16.555 1.00 29.70 H new ATOM 0 HD2 HIS A 242 31.437 20.948 17.025 1.00 28.69 H new ATOM 0 HE1 HIS A 242 33.370 24.223 16.203 1.00 27.63 H new ATOM 954 N ARG A 243 35.424 20.582 14.269 1.00 19.93 N ATOM 955 CA ARG A 243 36.420 21.388 13.592 1.00 20.94 C ATOM 956 C ARG A 243 37.226 22.145 14.650 1.00 19.70 C ATOM 957 O ARG A 243 36.676 22.542 15.677 1.00 19.08 O ATOM 958 CB ARG A 243 35.685 22.362 12.737 1.00 25.51 C ATOM 959 CG ARG A 243 36.295 22.804 11.444 1.00 37.58 C ATOM 960 CD ARG A 243 35.440 23.943 10.886 1.00 46.35 C ATOM 961 NE ARG A 243 35.845 25.192 11.534 1.00 57.55 N ATOM 962 CZ ARG A 243 35.065 25.890 12.378 1.00 64.53 C ATOM 963 NH1 ARG A 243 33.807 25.458 12.668 1.00 65.91 N ATOM 964 NH2 ARG A 243 35.569 27.002 12.956 1.00 67.75 N ATOM 0 H ARG A 243 34.624 20.752 14.004 1.00 19.93 H new ATOM 0 HA ARG A 243 37.019 20.845 13.056 1.00 20.94 H new ATOM 0 HB2 ARG A 243 34.818 21.977 12.534 1.00 25.51 H new ATOM 0 HB3 ARG A 243 35.525 23.156 13.271 1.00 25.51 H new ATOM 0 HG2 ARG A 243 37.208 23.101 11.583 1.00 37.58 H new ATOM 0 HG3 ARG A 243 36.330 22.066 10.815 1.00 37.58 H new ATOM 0 HD2 ARG A 243 35.554 24.010 9.925 1.00 46.35 H new ATOM 0 HD3 ARG A 243 34.500 23.769 11.049 1.00 46.35 H new ATOM 0 HE ARG A 243 36.631 25.498 11.364 1.00 57.55 H new ATOM 0 HH11 ARG A 243 33.508 24.735 12.311 1.00 65.91 H new ATOM 0 HH12 ARG A 243 33.312 25.908 13.208 1.00 65.91 H new ATOM 0 HH21 ARG A 243 36.374 27.250 12.781 1.00 67.75 H new ATOM 0 HH22 ARG A 243 35.085 27.462 13.499 1.00 67.75 H new ATOM 971 N LEU A 244 38.489 22.425 14.416 1.00 17.59 N ATOM 972 CA LEU A 244 39.300 23.106 15.407 1.00 17.65 C ATOM 973 C LEU A 244 38.968 24.589 15.273 1.00 17.88 C ATOM 974 O LEU A 244 38.989 25.178 14.190 1.00 19.99 O ATOM 975 CB LEU A 244 40.801 22.841 15.131 1.00 9.43 C ATOM 976 CG LEU A 244 41.285 21.385 14.996 1.00 4.02 C ATOM 977 CD1 LEU A 244 42.812 21.347 14.822 1.00 4.61 C ATOM 978 CD2 LEU A 244 40.939 20.616 16.232 1.00 2.00 C ATOM 0 H LEU A 244 38.901 22.230 13.687 1.00 17.59 H new ATOM 0 HA LEU A 244 39.118 22.792 16.306 1.00 17.65 H new ATOM 0 HB2 LEU A 244 41.036 23.306 14.312 1.00 9.43 H new ATOM 0 HB3 LEU A 244 41.309 23.254 15.847 1.00 9.43 H new ATOM 0 HG LEU A 244 40.852 20.992 14.222 1.00 4.02 H new ATOM 0 HD11 LEU A 244 43.106 20.426 14.738 1.00 4.61 H new ATOM 0 HD12 LEU A 244 43.059 21.839 14.023 1.00 4.61 H new ATOM 0 HD13 LEU A 244 43.236 21.752 15.595 1.00 4.61 H new ATOM 0 HD21 LEU A 244 41.246 19.701 16.140 1.00 2.00 H new ATOM 0 HD22 LEU A 244 41.369 21.026 16.999 1.00 2.00 H new ATOM 0 HD23 LEU A 244 39.977 20.623 16.359 1.00 2.00 H new ATOM 980 N THR A 245 38.519 25.176 16.358 1.00 19.86 N ATOM 981 CA THR A 245 38.170 26.575 16.331 1.00 22.95 C ATOM 982 C THR A 245 39.193 27.493 17.041 1.00 25.21 C ATOM 983 O THR A 245 39.886 28.310 16.421 1.00 32.04 O ATOM 984 CB THR A 245 36.732 26.681 16.931 1.00 17.85 C ATOM 985 OG1 THR A 245 36.731 26.127 18.244 1.00 18.74 O ATOM 986 CG2 THR A 245 35.740 25.963 16.065 1.00 12.49 C ATOM 0 H THR A 245 38.409 24.786 17.117 1.00 19.86 H new ATOM 0 HA THR A 245 38.189 26.902 15.418 1.00 22.95 H new ATOM 0 HB THR A 245 36.474 27.615 16.971 1.00 17.85 H new ATOM 0 HG1 THR A 245 36.008 25.721 18.376 1.00 18.74 H new ATOM 0 HG21 THR A 245 34.855 26.040 16.454 1.00 12.49 H new ATOM 0 HG22 THR A 245 35.739 26.357 15.179 1.00 12.49 H new ATOM 0 HG23 THR A 245 35.984 25.026 16.001 1.00 12.49 H new ATOM 989 N THR A 246 39.417 27.264 18.324 1.00 23.44 N ATOM 990 CA THR A 246 40.166 28.182 19.164 1.00 22.39 C ATOM 991 C THR A 246 41.456 27.529 19.649 1.00 18.85 C ATOM 992 O THR A 246 41.406 26.399 20.149 1.00 17.20 O ATOM 993 CB THR A 246 39.248 28.548 20.371 1.00 24.43 C ATOM 994 OG1 THR A 246 37.926 28.685 19.847 1.00 29.58 O ATOM 995 CG2 THR A 246 39.677 29.787 21.100 1.00 17.67 C ATOM 0 H THR A 246 39.136 26.564 18.737 1.00 23.44 H new ATOM 0 HA THR A 246 40.415 28.978 18.669 1.00 22.39 H new ATOM 0 HB THR A 246 39.300 27.847 21.039 1.00 24.43 H new ATOM 0 HG1 THR A 246 37.418 28.130 20.220 1.00 29.58 H new ATOM 0 HG21 THR A 246 39.067 29.958 21.835 1.00 17.67 H new ATOM 0 HG22 THR A 246 40.575 29.664 21.447 1.00 17.67 H new ATOM 0 HG23 THR A 246 39.667 30.541 20.490 1.00 17.67 H new ATOM 998 N VAL A 247 42.610 28.165 19.536 1.00 19.13 N ATOM 999 CA VAL A 247 43.800 27.632 20.203 1.00 17.57 C ATOM 1000 C VAL A 247 43.625 27.762 21.723 1.00 18.05 C ATOM 1001 O VAL A 247 43.176 28.793 22.218 1.00 19.36 O ATOM 1002 CB VAL A 247 45.038 28.390 19.781 1.00 13.18 C ATOM 1003 CG1 VAL A 247 46.201 27.883 20.633 1.00 13.99 C ATOM 1004 CG2 VAL A 247 45.289 28.217 18.289 1.00 9.49 C ATOM 0 H VAL A 247 42.731 28.890 19.090 1.00 19.13 H new ATOM 0 HA VAL A 247 43.905 26.701 19.953 1.00 17.57 H new ATOM 0 HB VAL A 247 44.930 29.343 19.925 1.00 13.18 H new ATOM 0 HG11 VAL A 247 47.013 28.352 20.385 1.00 13.99 H new ATOM 0 HG12 VAL A 247 46.009 28.043 21.570 1.00 13.99 H new ATOM 0 HG13 VAL A 247 46.320 26.932 20.485 1.00 13.99 H new ATOM 0 HG21 VAL A 247 46.086 28.709 18.035 1.00 9.49 H new ATOM 0 HG22 VAL A 247 45.413 27.276 18.088 1.00 9.49 H new ATOM 0 HG23 VAL A 247 44.528 28.556 17.791 1.00 9.49 H new ATOM 1006 N CYS A 248 43.865 26.688 22.452 1.00 16.12 N ATOM 1007 CA CYS A 248 43.779 26.727 23.889 1.00 16.79 C ATOM 1008 C CYS A 248 44.655 27.870 24.427 1.00 22.71 C ATOM 1009 O CYS A 248 45.810 28.029 24.024 1.00 20.56 O ATOM 1010 CB CYS A 248 44.255 25.404 24.439 1.00 16.76 C ATOM 1011 SG CYS A 248 44.022 25.236 26.219 1.00 15.79 S ATOM 0 H CYS A 248 44.081 25.922 22.127 1.00 16.12 H new ATOM 0 HA CYS A 248 42.862 26.882 24.164 1.00 16.79 H new ATOM 0 HB2 CYS A 248 43.782 24.686 23.989 1.00 16.76 H new ATOM 0 HB3 CYS A 248 45.197 25.296 24.232 1.00 16.76 H new ATOM 0 HG CYS A 248 44.976 24.688 26.698 1.00 15.79 H new ATOM 1013 N PRO A 249 44.067 28.773 25.218 1.00 27.45 N ATOM 1014 CA PRO A 249 44.770 29.918 25.811 1.00 28.35 C ATOM 1015 C PRO A 249 46.035 29.598 26.615 1.00 28.59 C ATOM 1016 O PRO A 249 45.992 28.683 27.423 1.00 27.63 O ATOM 1017 CB PRO A 249 43.676 30.589 26.624 1.00 29.74 C ATOM 1018 CG PRO A 249 42.475 29.638 26.657 1.00 27.43 C ATOM 1019 CD PRO A 249 42.606 28.880 25.369 1.00 25.12 C ATOM 1020 OXT PRO A 249 47.053 30.265 26.415 1.00 32.13 O ATOM 0 HA PRO A 249 45.159 30.487 25.128 1.00 28.35 H new ATOM 0 HB2 PRO A 249 43.987 30.777 27.523 1.00 29.74 H new ATOM 0 HB3 PRO A 249 43.428 31.438 26.226 1.00 29.74 H new ATOM 0 HG2 PRO A 249 42.506 29.047 27.426 1.00 27.43 H new ATOM 0 HG3 PRO A 249 41.636 30.122 26.705 1.00 27.43 H new ATOM 0 HD2 PRO A 249 42.182 28.009 25.417 1.00 25.12 H new ATOM 0 HD3 PRO A 249 42.199 29.354 24.627 1.00 25.12 H new TER 1021 PRO A 249 HETATM 1022 C ACE C 100 41.878 7.648 24.755 1.00 11.07 C HETATM 1023 O ACE C 100 41.686 8.868 24.882 1.00 9.03 O HETATM 1024 CH3 ACE C 100 41.895 6.703 25.944 1.00 9.74 C HETATM 0 H1 ACE C 100 41.199 6.035 25.837 1.00 9.74 H new HETATM 0 H2 ACE C 100 42.758 6.264 25.997 1.00 9.74 H new HETATM 0 H3 ACE C 100 41.738 7.205 26.759 1.00 9.74 H new HETATM 1025 N PTR C 101 42.274 7.076 23.630 1.00 13.52 N HETATM 1026 CA PTR C 101 42.318 7.763 22.362 1.00 13.67 C HETATM 1027 C PTR C 101 41.180 7.245 21.519 1.00 13.24 C HETATM 1028 O PTR C 101 40.831 6.049 21.567 1.00 14.58 O HETATM 1029 CB PTR C 101 43.649 7.496 21.625 1.00 11.31 C HETATM 1030 CG PTR C 101 44.846 8.089 22.368 1.00 9.42 C HETATM 1031 CD1 PTR C 101 45.530 7.318 23.292 1.00 7.94 C HETATM 1032 CD2 PTR C 101 45.221 9.411 22.144 1.00 9.08 C HETATM 1033 CE1 PTR C 101 46.583 7.874 24.021 1.00 11.95 C HETATM 1034 CE2 PTR C 101 46.272 9.973 22.863 1.00 11.11 C HETATM 1035 CZ PTR C 101 46.959 9.201 23.806 1.00 14.83 C HETATM 1036 OH PTR C 101 48.070 9.771 24.535 1.00 8.73 O HETATM 1037 P PTR C 101 48.055 10.105 26.062 1.00 10.70 P HETATM 1038 O1P PTR C 101 48.228 8.811 26.710 1.00 11.08 O HETATM 1039 O2P PTR C 101 49.189 11.028 26.202 1.00 9.89 O HETATM 1040 O3P PTR C 101 46.723 10.750 26.273 1.00 14.63 O HETATM 0 HE2 PTR C 101 46.527 10.896 22.711 1.00 11.11 H new HETATM 0 HE1 PTR C 101 47.054 7.337 24.678 1.00 11.95 H new HETATM 0 HD2 PTR C 101 44.748 9.942 21.484 1.00 9.08 H new HETATM 0 HD1 PTR C 101 45.278 6.392 23.433 1.00 7.94 H new HETATM 0 HB3 PTR C 101 43.775 6.540 21.523 1.00 11.31 H new HETATM 0 HB2 PTR C 101 43.605 7.873 20.732 1.00 11.31 H new HETATM 0 HA PTR C 101 42.244 8.718 22.513 1.00 13.67 H new ATOM 1042 N GLU C 102 40.643 8.212 20.792 1.00 12.54 N ATOM 1043 CA GLU C 102 39.579 8.034 19.823 1.00 15.31 C ATOM 1044 C GLU C 102 40.005 7.273 18.546 1.00 15.09 C ATOM 1045 O GLU C 102 41.185 7.334 18.179 1.00 15.00 O ATOM 1046 CB GLU C 102 39.051 9.407 19.416 1.00 12.71 C ATOM 1047 CG GLU C 102 38.433 10.202 20.507 1.00 14.84 C ATOM 1048 CD GLU C 102 37.324 9.443 21.224 1.00 18.28 C ATOM 1049 OE1 GLU C 102 36.341 9.059 20.586 1.00 21.10 O ATOM 1050 OE2 GLU C 102 37.456 9.233 22.426 1.00 19.15 O ATOM 0 H GLU C 102 40.903 9.029 20.854 1.00 12.54 H new ATOM 0 HA GLU C 102 38.901 7.492 20.256 1.00 15.31 H new ATOM 0 HB2 GLU C 102 39.783 9.919 19.038 1.00 12.71 H new ATOM 0 HB3 GLU C 102 38.395 9.288 18.712 1.00 12.71 H new ATOM 0 HG2 GLU C 102 39.117 10.452 21.148 1.00 14.84 H new ATOM 0 HG3 GLU C 102 38.073 11.025 20.140 1.00 14.84 H new HETATM 1052 N DIP C 103 39.099 6.561 17.824 1.00 15.88 N HETATM 1053 C1 DIP C 103 37.745 6.363 18.316 1.00 14.12 C HETATM 1054 C2 DIP C 103 37.906 5.094 19.130 1.00 16.81 C HETATM 1055 C3 DIP C 103 36.584 4.715 19.730 1.00 23.48 C HETATM 1056 C4 DIP C 103 36.766 3.489 20.593 1.00 28.43 C HETATM 1057 C5 DIP C 103 35.411 2.732 20.673 1.00 37.40 C HETATM 1058 C1' DIP C 103 39.452 5.958 16.534 1.00 12.71 C HETATM 1059 C2' DIP C 103 38.690 6.727 15.431 1.00 13.41 C HETATM 1060 C3' DIP C 103 39.233 8.157 15.195 1.00 15.05 C HETATM 1061 C4' DIP C 103 38.478 8.895 14.109 1.00 17.80 C HETATM 1062 C5' DIP C 103 39.180 10.201 13.711 1.00 17.52 C HETATM 0 H5'3 DIP C 103 39.245 10.783 14.485 1.00 17.52 H new HETATM 0 H5'2 DIP C 103 40.070 10.002 13.381 1.00 17.52 H new HETATM 0 H5'1 DIP C 103 38.669 10.644 13.016 1.00 17.52 H new HETATM 0 H4'2 DIP C 103 38.392 8.324 13.330 1.00 17.80 H new HETATM 0 H4'1 DIP C 103 37.579 9.092 14.417 1.00 17.80 H new HETATM 0 H3'2 DIP C 103 39.178 8.661 16.022 1.00 15.05 H new HETATM 0 H3'1 DIP C 103 40.172 8.107 14.955 1.00 15.05 H new HETATM 0 H2'2 DIP C 103 38.743 6.227 14.602 1.00 13.41 H new HETATM 0 H2'1 DIP C 103 37.752 6.780 15.671 1.00 13.41 H new HETATM 0 H1'2 DIP C 103 40.409 6.009 16.385 1.00 12.71 H new HETATM 0 H1'1 DIP C 103 39.213 5.018 16.521 1.00 12.71 H new HETATM 0 H53 DIP C 103 34.738 3.312 21.062 1.00 37.40 H new HETATM 0 H52 DIP C 103 35.134 2.469 19.781 1.00 37.40 H new HETATM 0 H51 DIP C 103 35.514 1.941 21.225 1.00 37.40 H new HETATM 0 H42 DIP C 103 37.451 2.913 20.219 1.00 28.43 H new HETATM 0 H41 DIP C 103 37.062 3.743 21.481 1.00 28.43 H new HETATM 0 H32 DIP C 103 36.235 5.448 20.260 1.00 23.48 H new HETATM 0 H31 DIP C 103 35.937 4.538 19.029 1.00 23.48 H new HETATM 0 H22 DIP C 103 38.234 4.376 18.567 1.00 16.81 H new HETATM 0 H21 DIP C 103 38.564 5.228 19.830 1.00 16.81 H new HETATM 0 H12 DIP C 103 37.440 7.108 18.857 1.00 14.12 H new HETATM 0 H11 DIP C 103 37.106 6.256 17.594 1.00 14.12 H new TER 1063 DIP C 103 ATOM 1064 N ILE B 146 31.325 13.245 36.956 1.00 48.26 N ATOM 1065 CA ILE B 146 32.581 12.587 37.281 1.00 46.29 C ATOM 1066 C ILE B 146 33.685 12.895 36.277 1.00 46.07 C ATOM 1067 O ILE B 146 34.844 12.860 36.651 1.00 43.79 O ATOM 1068 CB ILE B 146 32.316 11.069 37.385 1.00 43.58 C ATOM 1069 CG1 ILE B 146 33.434 10.445 38.180 1.00 45.18 C ATOM 1070 CG2 ILE B 146 32.198 10.423 36.015 1.00 43.94 C ATOM 1071 CD1 ILE B 146 33.364 8.925 38.168 1.00 43.66 C ATOM 0 HA ILE B 146 32.904 12.929 38.129 1.00 46.29 H new ATOM 0 HB ILE B 146 31.468 10.923 37.833 1.00 43.58 H new ATOM 0 HG12 ILE B 146 34.287 10.731 37.817 1.00 45.18 H new ATOM 0 HG13 ILE B 146 33.395 10.762 39.096 1.00 45.18 H new ATOM 0 HG21 ILE B 146 32.032 9.473 36.118 1.00 43.94 H new ATOM 0 HG22 ILE B 146 31.463 10.828 35.528 1.00 43.94 H new ATOM 0 HG23 ILE B 146 33.023 10.555 35.523 1.00 43.94 H new ATOM 0 HD11 ILE B 146 34.098 8.563 38.689 1.00 43.66 H new ATOM 0 HD12 ILE B 146 32.522 8.637 38.553 1.00 43.66 H new ATOM 0 HD13 ILE B 146 33.428 8.605 37.254 1.00 43.66 H new ATOM 1072 N GLN B 147 33.339 13.273 35.028 1.00 47.71 N ATOM 1073 CA GLN B 147 34.322 13.606 33.998 1.00 46.98 C ATOM 1074 C GLN B 147 35.286 14.713 34.389 1.00 44.92 C ATOM 1075 O GLN B 147 36.369 14.815 33.838 1.00 45.87 O ATOM 1076 CB GLN B 147 33.589 14.031 32.704 1.00 48.38 C ATOM 0 H GLN B 147 32.523 13.340 34.764 1.00 47.71 H new ATOM 0 HA GLN B 147 34.851 12.803 33.868 1.00 46.98 H new ATOM 1078 N ALA B 148 34.822 15.587 35.302 1.00 43.87 N ATOM 1079 CA ALA B 148 35.622 16.698 35.837 1.00 42.98 C ATOM 1080 C ALA B 148 36.345 16.467 37.191 1.00 43.12 C ATOM 1081 O ALA B 148 36.879 17.390 37.831 1.00 43.27 O ATOM 1082 CB ALA B 148 34.733 17.930 35.991 1.00 42.72 C ATOM 0 H ALA B 148 34.027 15.547 35.628 1.00 43.87 H new ATOM 0 HA ALA B 148 36.331 16.803 35.183 1.00 42.98 H new ATOM 0 HB1 ALA B 148 35.257 18.666 36.344 1.00 42.72 H new ATOM 0 HB2 ALA B 148 34.370 18.178 35.126 1.00 42.72 H new ATOM 0 HB3 ALA B 148 34.006 17.730 36.601 1.00 42.72 H new ATOM 1084 N GLU B 149 36.361 15.214 37.656 1.00 39.00 N ATOM 1085 CA GLU B 149 37.103 14.837 38.831 1.00 30.34 C ATOM 1086 C GLU B 149 38.548 14.717 38.486 1.00 26.47 C ATOM 1087 O GLU B 149 38.855 13.972 37.565 1.00 24.55 O ATOM 1088 CB GLU B 149 36.606 13.520 39.333 1.00 32.36 C ATOM 1089 CG GLU B 149 35.351 13.773 40.101 1.00 33.83 C ATOM 1090 CD GLU B 149 35.579 14.485 41.428 1.00 34.74 C ATOM 1091 OE1 GLU B 149 36.597 15.159 41.651 1.00 40.72 O ATOM 1092 OE2 GLU B 149 34.717 14.348 42.279 1.00 43.00 O ATOM 0 H GLU B 149 35.935 14.564 37.287 1.00 39.00 H new ATOM 0 HA GLU B 149 36.986 15.512 39.517 1.00 30.34 H new ATOM 0 HB2 GLU B 149 36.437 12.916 38.594 1.00 32.36 H new ATOM 0 HB3 GLU B 149 37.272 13.098 39.898 1.00 32.36 H new ATOM 0 HG2 GLU B 149 34.750 14.305 39.557 1.00 33.83 H new ATOM 0 HG3 GLU B 149 34.908 12.927 40.269 1.00 33.83 H new ATOM 1094 N GLU B 150 39.487 15.352 39.158 1.00 25.27 N ATOM 1095 CA GLU B 150 40.896 15.264 38.755 1.00 25.84 C ATOM 1096 C GLU B 150 41.391 13.836 38.598 1.00 23.02 C ATOM 1097 O GLU B 150 42.214 13.531 37.754 1.00 21.27 O ATOM 1098 CB GLU B 150 41.819 15.921 39.773 1.00 34.62 C ATOM 1099 CG GLU B 150 41.733 17.455 39.876 1.00 47.64 C ATOM 1100 CD GLU B 150 42.650 18.279 38.965 1.00 55.05 C ATOM 1101 OE1 GLU B 150 43.277 17.738 38.048 1.00 57.69 O ATOM 1102 OE2 GLU B 150 42.813 19.468 39.232 1.00 61.13 O ATOM 0 H GLU B 150 39.341 15.841 39.850 1.00 25.27 H new ATOM 0 HA GLU B 150 40.924 15.721 37.900 1.00 25.84 H new ATOM 0 HB2 GLU B 150 41.627 15.545 40.646 1.00 34.62 H new ATOM 0 HB3 GLU B 150 42.733 15.681 39.556 1.00 34.62 H new ATOM 0 HG2 GLU B 150 40.817 17.716 39.693 1.00 47.64 H new ATOM 0 HG3 GLU B 150 41.921 17.704 40.794 1.00 47.64 H new ATOM 1104 N TRP B 151 40.919 12.921 39.442 1.00 18.43 N ATOM 1105 CA TRP B 151 41.406 11.556 39.402 1.00 15.87 C ATOM 1106 C TRP B 151 40.692 10.648 38.384 1.00 14.60 C ATOM 1107 O TRP B 151 41.036 9.468 38.248 1.00 13.38 O ATOM 1108 CB TRP B 151 41.304 10.988 40.835 1.00 14.24 C ATOM 1109 CG TRP B 151 39.968 11.232 41.569 1.00 14.46 C ATOM 1110 CD1 TRP B 151 39.937 12.091 42.619 1.00 12.15 C ATOM 1111 CD2 TRP B 151 38.720 10.677 41.291 1.00 12.86 C ATOM 1112 NE1 TRP B 151 38.694 12.087 43.029 1.00 15.10 N ATOM 1113 CE2 TRP B 151 37.940 11.251 42.293 1.00 13.14 C ATOM 1114 CE3 TRP B 151 38.139 9.772 40.396 1.00 7.42 C ATOM 1115 CZ2 TRP B 151 36.573 10.960 42.401 1.00 14.82 C ATOM 1116 CZ3 TRP B 151 36.787 9.469 40.504 1.00 8.13 C ATOM 1117 CH2 TRP B 151 35.997 10.072 41.482 1.00 13.62 C ATOM 0 H TRP B 151 40.320 13.074 40.040 1.00 18.43 H new ATOM 0 HA TRP B 151 42.324 11.573 39.090 1.00 15.87 H new ATOM 0 HB2 TRP B 151 41.461 10.032 40.796 1.00 14.24 H new ATOM 0 HB3 TRP B 151 42.019 11.371 41.367 1.00 14.24 H new ATOM 0 HD1 TRP B 151 40.647 12.578 42.972 1.00 12.15 H new ATOM 0 HE1 TRP B 151 38.398 12.558 43.685 1.00 15.10 H new ATOM 0 HE3 TRP B 151 38.655 9.375 39.732 1.00 7.42 H new ATOM 0 HZ2 TRP B 151 36.058 11.349 43.070 1.00 14.82 H new ATOM 0 HZ3 TRP B 151 36.405 8.857 39.917 1.00 8.13 H new ATOM 0 HH2 TRP B 151 35.087 9.885 41.525 1.00 13.62 H new ATOM 1120 N TYR B 152 39.665 11.106 37.665 1.00 14.47 N ATOM 1121 CA TYR B 152 38.945 10.216 36.769 1.00 15.49 C ATOM 1122 C TYR B 152 39.572 10.303 35.398 1.00 15.07 C ATOM 1123 O TYR B 152 39.618 11.359 34.791 1.00 16.63 O ATOM 1124 CB TYR B 152 37.451 10.604 36.722 1.00 18.60 C ATOM 1125 CG TYR B 152 36.620 9.638 35.876 1.00 24.05 C ATOM 1126 CD1 TYR B 152 36.468 8.291 36.256 1.00 25.95 C ATOM 1127 CD2 TYR B 152 36.028 10.090 34.697 1.00 22.85 C ATOM 1128 CE1 TYR B 152 35.755 7.394 35.452 1.00 24.22 C ATOM 1129 CE2 TYR B 152 35.321 9.197 33.900 1.00 25.94 C ATOM 1130 CZ TYR B 152 35.198 7.864 34.278 1.00 25.20 C ATOM 1131 OH TYR B 152 34.529 7.036 33.423 1.00 30.05 O ATOM 0 H TYR B 152 39.377 11.916 37.684 1.00 14.47 H new ATOM 0 HA TYR B 152 39.002 9.302 37.089 1.00 15.49 H new ATOM 0 HB2 TYR B 152 37.097 10.625 37.625 1.00 18.60 H new ATOM 0 HB3 TYR B 152 37.364 11.501 36.362 1.00 18.60 H new ATOM 0 HD1 TYR B 152 36.846 7.993 37.052 1.00 25.95 H new ATOM 0 HD2 TYR B 152 36.106 10.982 34.446 1.00 22.85 H new ATOM 0 HE1 TYR B 152 35.659 6.503 35.702 1.00 24.22 H new ATOM 0 HE2 TYR B 152 34.928 9.492 33.110 1.00 25.94 H new ATOM 0 HH TYR B 152 34.255 7.477 32.763 1.00 30.05 H new ATOM 1134 N PHE B 153 40.144 9.224 34.887 1.00 15.42 N ATOM 1135 CA PHE B 153 40.804 9.282 33.601 1.00 15.16 C ATOM 1136 C PHE B 153 39.980 8.608 32.509 1.00 16.77 C ATOM 1137 O PHE B 153 40.455 8.354 31.399 1.00 21.91 O ATOM 1138 CB PHE B 153 42.214 8.639 33.712 1.00 11.44 C ATOM 1139 CG PHE B 153 43.316 9.554 34.266 1.00 10.78 C ATOM 1140 CD1 PHE B 153 43.206 10.153 35.534 1.00 10.91 C ATOM 1141 CD2 PHE B 153 44.481 9.756 33.512 1.00 13.70 C ATOM 1142 CE1 PHE B 153 44.253 10.928 36.042 1.00 6.22 C ATOM 1143 CE2 PHE B 153 45.524 10.528 34.032 1.00 10.97 C ATOM 1144 CZ PHE B 153 45.406 11.112 35.287 1.00 9.00 C ATOM 0 H PHE B 153 40.160 8.453 35.269 1.00 15.42 H new ATOM 0 HA PHE B 153 40.897 10.214 33.347 1.00 15.16 H new ATOM 0 HB2 PHE B 153 42.151 7.855 34.279 1.00 11.44 H new ATOM 0 HB3 PHE B 153 42.482 8.332 32.832 1.00 11.44 H new ATOM 0 HD1 PHE B 153 42.433 10.033 36.037 1.00 10.91 H new ATOM 0 HD2 PHE B 153 44.560 9.377 32.667 1.00 13.70 H new ATOM 0 HE1 PHE B 153 44.178 11.319 36.882 1.00 6.22 H new ATOM 0 HE2 PHE B 153 46.301 10.651 33.535 1.00 10.97 H new ATOM 0 HZ PHE B 153 46.102 11.629 35.624 1.00 9.00 H new ATOM 1146 N GLY B 154 38.729 8.268 32.805 1.00 19.07 N ATOM 1147 CA GLY B 154 37.770 7.789 31.805 1.00 20.43 C ATOM 1148 C GLY B 154 38.097 6.436 31.251 1.00 20.03 C ATOM 1149 O GLY B 154 38.425 5.519 31.999 1.00 22.05 O ATOM 0 H GLY B 154 38.406 8.308 33.601 1.00 19.07 H new ATOM 0 HA2 GLY B 154 36.887 7.760 32.204 1.00 20.43 H new ATOM 0 HA3 GLY B 154 37.731 8.427 31.075 1.00 20.43 H new ATOM 1151 N LYS B 155 38.152 6.389 29.921 1.00 22.24 N ATOM 1152 CA LYS B 155 38.354 5.156 29.154 1.00 22.63 C ATOM 1153 C LYS B 155 39.762 4.755 28.755 1.00 21.51 C ATOM 1154 O LYS B 155 39.960 4.109 27.726 1.00 25.60 O ATOM 1155 CB LYS B 155 37.517 5.215 27.865 1.00 26.21 C ATOM 0 H LYS B 155 38.071 7.088 29.427 1.00 22.24 H new ATOM 0 HA LYS B 155 38.083 4.477 29.792 1.00 22.63 H new ATOM 1157 N ILE B 156 40.805 5.132 29.487 1.00 22.82 N ATOM 1158 CA ILE B 156 42.129 4.629 29.164 1.00 20.75 C ATOM 1159 C ILE B 156 42.199 3.119 29.442 1.00 22.30 C ATOM 1160 O ILE B 156 41.465 2.571 30.284 1.00 21.10 O ATOM 1161 CB ILE B 156 43.196 5.379 29.994 1.00 19.87 C ATOM 1162 CG1 ILE B 156 42.950 5.269 31.490 1.00 15.60 C ATOM 1163 CG2 ILE B 156 43.195 6.828 29.527 1.00 20.25 C ATOM 1164 CD1 ILE B 156 44.050 5.891 32.320 1.00 10.74 C ATOM 0 H ILE B 156 40.768 5.666 30.160 1.00 22.82 H new ATOM 0 HA ILE B 156 42.305 4.780 28.222 1.00 20.75 H new ATOM 0 HB ILE B 156 44.067 4.976 29.851 1.00 19.87 H new ATOM 0 HG12 ILE B 156 42.107 5.698 31.706 1.00 15.60 H new ATOM 0 HG13 ILE B 156 42.861 4.333 31.730 1.00 15.60 H new ATOM 0 HG21 ILE B 156 43.856 7.330 30.029 1.00 20.25 H new ATOM 0 HG22 ILE B 156 43.411 6.864 28.582 1.00 20.25 H new ATOM 0 HG23 ILE B 156 42.317 7.214 29.672 1.00 20.25 H new ATOM 0 HD11 ILE B 156 43.841 5.792 33.262 1.00 10.74 H new ATOM 0 HD12 ILE B 156 44.891 5.447 32.128 1.00 10.74 H new ATOM 0 HD13 ILE B 156 44.125 6.834 32.104 1.00 10.74 H new ATOM 1166 N THR B 157 43.085 2.404 28.774 1.00 22.17 N ATOM 1167 CA THR B 157 43.185 0.976 28.995 1.00 18.14 C ATOM 1168 C THR B 157 44.080 0.632 30.196 1.00 19.21 C ATOM 1169 O THR B 157 44.859 1.467 30.679 1.00 19.28 O ATOM 1170 CB THR B 157 43.736 0.367 27.713 1.00 17.89 C ATOM 1171 OG1 THR B 157 45.079 0.824 27.564 1.00 18.70 O ATOM 1172 CG2 THR B 157 42.971 0.794 26.479 1.00 19.78 C ATOM 0 H THR B 157 43.633 2.723 28.193 1.00 22.17 H new ATOM 0 HA THR B 157 42.311 0.614 29.208 1.00 18.14 H new ATOM 0 HB THR B 157 43.665 -0.597 27.788 1.00 17.89 H new ATOM 0 HG1 THR B 157 45.409 0.501 26.862 1.00 18.70 H new ATOM 0 HG21 THR B 157 43.363 0.379 25.695 1.00 19.78 H new ATOM 0 HG22 THR B 157 42.044 0.519 26.561 1.00 19.78 H new ATOM 0 HG23 THR B 157 43.014 1.759 26.389 1.00 19.78 H new ATOM 1175 N ARG B 158 44.123 -0.638 30.617 1.00 18.46 N ATOM 1176 CA ARG B 158 44.993 -1.099 31.686 1.00 17.56 C ATOM 1177 C ARG B 158 46.439 -0.809 31.380 1.00 17.31 C ATOM 1178 O ARG B 158 47.186 -0.343 32.231 1.00 16.48 O ATOM 1179 CB ARG B 158 44.841 -2.585 31.889 1.00 16.25 C ATOM 1180 CG ARG B 158 45.956 -3.150 32.773 1.00 21.35 C ATOM 1181 CD ARG B 158 45.909 -4.656 32.852 1.00 24.63 C ATOM 1182 NE ARG B 158 44.786 -5.049 33.695 1.00 28.91 N ATOM 1183 CZ ARG B 158 44.975 -5.686 34.866 1.00 33.00 C ATOM 1184 NH1 ARG B 158 46.194 -6.000 35.289 1.00 34.89 N ATOM 1185 NH2 ARG B 158 43.923 -5.933 35.640 1.00 38.69 N ATOM 0 H ARG B 158 43.636 -1.260 30.278 1.00 18.46 H new ATOM 0 HA ARG B 158 44.732 -0.623 32.490 1.00 17.56 H new ATOM 0 HB2 ARG B 158 43.980 -2.770 32.295 1.00 16.25 H new ATOM 0 HB3 ARG B 158 44.851 -3.033 31.028 1.00 16.25 H new ATOM 0 HG2 ARG B 158 46.817 -2.872 32.423 1.00 21.35 H new ATOM 0 HG3 ARG B 158 45.879 -2.778 33.666 1.00 21.35 H new ATOM 0 HD2 ARG B 158 45.812 -5.036 31.965 1.00 24.63 H new ATOM 0 HD3 ARG B 158 46.739 -4.999 33.218 1.00 24.63 H new ATOM 0 HE ARG B 158 43.985 -4.870 33.438 1.00 28.91 H new ATOM 0 HH11 ARG B 158 46.880 -5.796 34.812 1.00 34.89 H new ATOM 0 HH12 ARG B 158 46.297 -6.407 36.040 1.00 34.89 H new ATOM 0 HH21 ARG B 158 43.138 -5.687 35.390 1.00 38.69 H new ATOM 0 HH22 ARG B 158 44.027 -6.339 36.391 1.00 38.69 H new ATOM 1192 N ARG B 159 46.826 -0.996 30.118 1.00 15.40 N ATOM 1193 CA ARG B 159 48.220 -0.766 29.765 1.00 14.18 C ATOM 1194 C ARG B 159 48.455 0.728 29.704 1.00 14.38 C ATOM 1195 O ARG B 159 49.517 1.171 30.165 1.00 14.50 O ATOM 1196 CB ARG B 159 48.529 -1.379 28.405 1.00 15.78 C ATOM 0 H ARG B 159 46.315 -1.247 29.473 1.00 15.40 H new ATOM 0 HA ARG B 159 48.796 -1.176 30.429 1.00 14.18 H new ATOM 1198 N GLU B 160 47.553 1.573 29.196 1.00 17.73 N ATOM 1199 CA GLU B 160 47.793 3.007 29.289 1.00 16.69 C ATOM 1200 C GLU B 160 47.944 3.393 30.751 1.00 18.20 C ATOM 1201 O GLU B 160 48.965 3.958 31.113 1.00 19.18 O ATOM 1202 CB GLU B 160 46.644 3.736 28.633 1.00 14.96 C ATOM 1203 CG GLU B 160 46.811 3.428 27.181 1.00 16.07 C ATOM 1204 CD GLU B 160 45.657 4.004 26.334 1.00 20.37 C ATOM 1205 OE1 GLU B 160 44.502 4.110 26.809 1.00 19.70 O ATOM 1206 OE2 GLU B 160 45.873 4.311 25.136 1.00 26.33 O ATOM 0 H GLU B 160 46.821 1.343 28.807 1.00 17.73 H new ATOM 0 HA GLU B 160 48.611 3.252 28.829 1.00 16.69 H new ATOM 0 HB2 GLU B 160 45.788 3.425 28.967 1.00 14.96 H new ATOM 0 HB3 GLU B 160 46.685 4.690 28.802 1.00 14.96 H new ATOM 0 HG2 GLU B 160 47.654 3.792 26.868 1.00 16.07 H new ATOM 0 HG3 GLU B 160 46.854 2.467 27.057 1.00 16.07 H new ATOM 1208 N SER B 161 47.087 2.953 31.660 1.00 16.45 N ATOM 1209 CA SER B 161 47.187 3.379 33.035 1.00 14.41 C ATOM 1210 C SER B 161 48.505 2.931 33.654 1.00 14.29 C ATOM 1211 O SER B 161 49.067 3.688 34.444 1.00 12.42 O ATOM 1212 CB SER B 161 46.003 2.821 33.826 1.00 14.14 C ATOM 1213 OG SER B 161 46.111 1.443 34.154 1.00 10.10 O ATOM 0 H SER B 161 46.442 2.408 31.497 1.00 16.45 H new ATOM 0 HA SER B 161 47.165 4.348 33.065 1.00 14.41 H new ATOM 0 HB2 SER B 161 45.907 3.330 34.646 1.00 14.14 H new ATOM 0 HB3 SER B 161 45.192 2.957 33.311 1.00 14.14 H new ATOM 0 HG SER B 161 46.453 1.027 33.509 1.00 10.10 H new ATOM 1216 N GLU B 162 49.078 1.771 33.263 1.00 14.23 N ATOM 1217 CA GLU B 162 50.351 1.377 33.842 1.00 18.33 C ATOM 1218 C GLU B 162 51.403 2.294 33.286 1.00 20.59 C ATOM 1219 O GLU B 162 52.234 2.741 34.061 1.00 22.80 O ATOM 1220 CB GLU B 162 50.659 -0.045 33.506 1.00 18.67 C ATOM 1221 CG GLU B 162 49.770 -0.953 34.336 1.00 25.77 C ATOM 1222 CD GLU B 162 49.856 -2.442 34.020 1.00 32.19 C ATOM 1223 OE1 GLU B 162 50.870 -2.889 33.491 1.00 39.44 O ATOM 1224 OE2 GLU B 162 48.896 -3.169 34.299 1.00 36.72 O ATOM 0 H GLU B 162 48.749 1.226 32.685 1.00 14.23 H new ATOM 0 HA GLU B 162 50.321 1.446 34.809 1.00 18.33 H new ATOM 0 HB2 GLU B 162 50.512 -0.205 32.561 1.00 18.67 H new ATOM 0 HB3 GLU B 162 51.593 -0.237 33.684 1.00 18.67 H new ATOM 0 HG2 GLU B 162 49.991 -0.826 35.272 1.00 25.77 H new ATOM 0 HG3 GLU B 162 48.850 -0.669 34.221 1.00 25.77 H new ATOM 1226 N ARG B 163 51.345 2.707 32.010 1.00 22.43 N ATOM 1227 CA ARG B 163 52.309 3.668 31.506 1.00 22.35 C ATOM 1228 C ARG B 163 52.153 5.034 32.169 1.00 19.72 C ATOM 1229 O ARG B 163 53.138 5.652 32.549 1.00 15.64 O ATOM 1230 CB ARG B 163 52.165 3.817 30.010 1.00 28.39 C ATOM 1231 CG ARG B 163 52.685 2.549 29.345 1.00 36.35 C ATOM 1232 CD ARG B 163 52.412 2.611 27.852 1.00 47.58 C ATOM 1233 NE ARG B 163 52.735 1.389 27.117 1.00 55.10 N ATOM 1234 CZ ARG B 163 52.204 1.085 25.916 1.00 58.84 C ATOM 1235 NH1 ARG B 163 51.320 1.929 25.326 1.00 58.80 N ATOM 1236 NH2 ARG B 163 52.627 -0.008 25.234 1.00 60.94 N ATOM 0 H ARG B 163 50.761 2.442 31.437 1.00 22.43 H new ATOM 0 HA ARG B 163 53.192 3.328 31.720 1.00 22.35 H new ATOM 0 HB2 ARG B 163 51.236 3.965 29.774 1.00 28.39 H new ATOM 0 HB3 ARG B 163 52.663 4.589 29.699 1.00 28.39 H new ATOM 0 HG2 ARG B 163 53.637 2.455 29.506 1.00 36.35 H new ATOM 0 HG3 ARG B 163 52.254 1.770 29.730 1.00 36.35 H new ATOM 0 HD2 ARG B 163 51.474 2.816 27.716 1.00 47.58 H new ATOM 0 HD3 ARG B 163 52.921 3.345 27.473 1.00 47.58 H new ATOM 0 HE ARG B 163 53.292 0.836 27.469 1.00 55.10 H new ATOM 0 HH11 ARG B 163 51.097 2.661 25.718 1.00 58.80 H new ATOM 0 HH12 ARG B 163 50.983 1.732 24.560 1.00 58.80 H new ATOM 0 HH21 ARG B 163 53.238 -0.513 25.567 1.00 60.94 H new ATOM 0 HH22 ARG B 163 52.284 -0.196 24.468 1.00 60.94 H new ATOM 1243 N LEU B 164 50.946 5.527 32.387 1.00 17.31 N ATOM 1244 CA LEU B 164 50.776 6.792 33.062 1.00 18.56 C ATOM 1245 C LEU B 164 51.254 6.813 34.502 1.00 22.05 C ATOM 1246 O LEU B 164 51.647 7.856 35.015 1.00 24.58 O ATOM 1247 CB LEU B 164 49.336 7.156 33.048 1.00 17.08 C ATOM 1248 CG LEU B 164 48.840 7.483 31.681 1.00 19.91 C ATOM 1249 CD1 LEU B 164 47.331 7.449 31.680 1.00 17.58 C ATOM 1250 CD2 LEU B 164 49.391 8.839 31.256 1.00 19.25 C ATOM 0 H LEU B 164 50.214 5.142 32.151 1.00 17.31 H new ATOM 0 HA LEU B 164 51.327 7.426 32.577 1.00 18.56 H new ATOM 0 HB2 LEU B 164 48.817 6.421 33.409 1.00 17.08 H new ATOM 0 HB3 LEU B 164 49.193 7.918 33.631 1.00 17.08 H new ATOM 0 HG LEU B 164 49.149 6.828 31.036 1.00 19.91 H new ATOM 0 HD11 LEU B 164 47.003 7.661 30.792 1.00 17.58 H new ATOM 0 HD12 LEU B 164 47.027 6.563 31.933 1.00 17.58 H new ATOM 0 HD13 LEU B 164 46.992 8.100 32.314 1.00 17.58 H new ATOM 0 HD21 LEU B 164 49.070 9.055 30.366 1.00 19.25 H new ATOM 0 HD22 LEU B 164 49.094 9.519 31.880 1.00 19.25 H new ATOM 0 HD23 LEU B 164 50.360 8.807 31.250 1.00 19.25 H new ATOM 1252 N LEU B 165 51.199 5.684 35.185 1.00 22.96 N ATOM 1253 CA LEU B 165 51.487 5.659 36.590 1.00 26.22 C ATOM 1254 C LEU B 165 52.916 5.353 36.920 1.00 31.80 C ATOM 1255 O LEU B 165 53.461 5.869 37.918 1.00 32.46 O ATOM 1256 CB LEU B 165 50.595 4.630 37.295 1.00 21.42 C ATOM 1257 CG LEU B 165 49.170 5.045 37.561 1.00 19.38 C ATOM 1258 CD1 LEU B 165 48.376 3.851 38.017 1.00 17.16 C ATOM 1259 CD2 LEU B 165 49.144 6.135 38.602 1.00 14.94 C ATOM 0 H LEU B 165 50.995 4.921 34.845 1.00 22.96 H new ATOM 0 HA LEU B 165 51.307 6.559 36.904 1.00 26.22 H new ATOM 0 HB2 LEU B 165 50.581 3.822 36.758 1.00 21.42 H new ATOM 0 HB3 LEU B 165 51.008 4.400 38.142 1.00 21.42 H new ATOM 0 HG LEU B 165 48.771 5.390 36.747 1.00 19.38 H new ATOM 0 HD11 LEU B 165 47.459 4.118 38.188 1.00 17.16 H new ATOM 0 HD12 LEU B 165 48.390 3.170 37.327 1.00 17.16 H new ATOM 0 HD13 LEU B 165 48.766 3.495 38.831 1.00 17.16 H new ATOM 0 HD21 LEU B 165 48.226 6.400 38.771 1.00 14.94 H new ATOM 0 HD22 LEU B 165 49.542 5.807 39.424 1.00 14.94 H new ATOM 0 HD23 LEU B 165 49.647 6.900 38.282 1.00 14.94 H new ATOM 1261 N LEU B 166 53.488 4.417 36.143 1.00 37.39 N ATOM 1262 CA LEU B 166 54.811 3.934 36.422 1.00 40.31 C ATOM 1263 C LEU B 166 55.747 4.973 35.920 1.00 44.25 C ATOM 1264 O LEU B 166 55.920 5.354 34.763 1.00 45.46 O ATOM 1265 CB LEU B 166 55.099 2.623 35.754 1.00 38.69 C ATOM 1266 CG LEU B 166 54.421 1.470 36.461 1.00 41.45 C ATOM 1267 CD1 LEU B 166 54.724 0.188 35.707 1.00 42.92 C ATOM 1268 CD2 LEU B 166 54.872 1.395 37.920 1.00 45.49 C ATOM 0 H LEU B 166 53.112 4.062 35.456 1.00 37.39 H new ATOM 0 HA LEU B 166 54.908 3.777 37.374 1.00 40.31 H new ATOM 0 HB2 LEU B 166 54.800 2.658 34.832 1.00 38.69 H new ATOM 0 HB3 LEU B 166 56.057 2.473 35.736 1.00 38.69 H new ATOM 0 HG LEU B 166 53.460 1.604 36.471 1.00 41.45 H new ATOM 0 HD11 LEU B 166 54.294 -0.559 36.152 1.00 42.92 H new ATOM 0 HD12 LEU B 166 54.389 0.259 34.799 1.00 42.92 H new ATOM 0 HD13 LEU B 166 55.683 0.043 35.687 1.00 42.92 H new ATOM 0 HD21 LEU B 166 54.429 0.652 38.358 1.00 45.49 H new ATOM 0 HD22 LEU B 166 55.833 1.265 37.956 1.00 45.49 H new ATOM 0 HD23 LEU B 166 54.641 2.221 38.373 1.00 45.49 H new ATOM 1270 N ASN B 167 56.084 5.600 37.006 1.00 48.84 N ATOM 1271 CA ASN B 167 56.946 6.731 36.974 1.00 49.52 C ATOM 1272 C ASN B 167 57.557 6.601 38.351 1.00 49.88 C ATOM 1273 O ASN B 167 56.888 6.442 39.398 1.00 46.84 O ATOM 1274 CB ASN B 167 56.094 7.974 36.800 1.00 46.71 C ATOM 1275 CG ASN B 167 56.882 9.248 36.729 1.00 42.13 C ATOM 1276 OD1 ASN B 167 57.694 9.535 37.599 1.00 38.28 O ATOM 1277 ND2 ASN B 167 56.676 10.024 35.681 1.00 38.38 N ATOM 0 H ASN B 167 55.816 5.379 37.792 1.00 48.84 H new ATOM 0 HA ASN B 167 57.607 6.784 36.266 1.00 49.52 H new ATOM 0 HB2 ASN B 167 55.568 7.884 35.990 1.00 46.71 H new ATOM 0 HB3 ASN B 167 55.468 8.032 37.539 1.00 46.71 H new ATOM 0 HD21 ASN B 167 57.119 10.756 35.594 1.00 38.38 H new ATOM 0 HD22 ASN B 167 56.099 9.797 35.085 1.00 38.38 H new ATOM 1281 N ALA B 168 58.889 6.486 38.160 1.00 49.80 N ATOM 1282 CA ALA B 168 59.877 6.325 39.210 1.00 48.77 C ATOM 1283 C ALA B 168 60.143 7.597 39.979 1.00 45.66 C ATOM 1284 O ALA B 168 61.021 7.630 40.829 1.00 46.42 O ATOM 1285 CB ALA B 168 61.209 5.861 38.641 1.00 51.19 C ATOM 0 H ALA B 168 59.240 6.502 37.375 1.00 49.80 H new ATOM 0 HA ALA B 168 59.499 5.664 39.810 1.00 48.77 H new ATOM 0 HB1 ALA B 168 61.851 5.761 39.361 1.00 51.19 H new ATOM 0 HB2 ALA B 168 61.091 5.009 38.193 1.00 51.19 H new ATOM 0 HB3 ALA B 168 61.536 6.517 38.006 1.00 51.19 H new ATOM 1287 N GLU B 169 59.322 8.608 39.712 1.00 41.37 N ATOM 1288 CA GLU B 169 59.345 9.860 40.404 1.00 36.09 C ATOM 1289 C GLU B 169 57.940 10.118 40.989 1.00 29.52 C ATOM 1290 O GLU B 169 57.597 11.238 41.399 1.00 26.48 O ATOM 1291 CB GLU B 169 59.758 10.932 39.386 1.00 41.24 C ATOM 0 H GLU B 169 58.720 8.569 39.099 1.00 41.37 H new ATOM 0 HA GLU B 169 59.976 9.869 41.141 1.00 36.09 H new ATOM 1293 N ASN B 170 57.098 9.077 41.096 1.00 22.19 N ATOM 1294 CA ASN B 170 55.795 9.261 41.721 1.00 22.01 C ATOM 1295 C ASN B 170 55.735 8.561 43.060 1.00 17.96 C ATOM 1296 O ASN B 170 56.244 7.443 43.162 1.00 18.93 O ATOM 1297 CB ASN B 170 54.671 8.689 40.884 1.00 22.53 C ATOM 1298 CG ASN B 170 54.270 9.543 39.707 1.00 22.62 C ATOM 1299 OD1 ASN B 170 54.354 10.774 39.685 1.00 21.45 O ATOM 1300 ND2 ASN B 170 53.785 8.855 38.700 1.00 21.29 N ATOM 0 H ASN B 170 57.263 8.280 40.819 1.00 22.19 H new ATOM 0 HA ASN B 170 55.684 10.220 41.817 1.00 22.01 H new ATOM 0 HB2 ASN B 170 54.938 7.815 40.559 1.00 22.53 H new ATOM 0 HB3 ASN B 170 53.896 8.556 41.452 1.00 22.53 H new ATOM 0 HD21 ASN B 170 53.512 9.262 37.993 1.00 21.29 H new ATOM 0 HD22 ASN B 170 53.740 7.997 38.747 1.00 21.29 H new ATOM 1304 N PRO B 171 55.170 9.121 44.124 1.00 14.48 N ATOM 1305 CA PRO B 171 55.067 8.430 45.384 1.00 16.53 C ATOM 1306 C PRO B 171 54.231 7.146 45.311 1.00 22.08 C ATOM 1307 O PRO B 171 53.366 6.994 44.427 1.00 23.30 O ATOM 1308 CB PRO B 171 54.490 9.458 46.315 1.00 15.25 C ATOM 1309 CG PRO B 171 53.844 10.497 45.462 1.00 15.22 C ATOM 1310 CD PRO B 171 54.532 10.430 44.128 1.00 12.15 C ATOM 0 HA PRO B 171 55.928 8.102 45.688 1.00 16.53 H new ATOM 0 HB2 PRO B 171 53.843 9.055 46.915 1.00 15.25 H new ATOM 0 HB3 PRO B 171 55.184 9.850 46.868 1.00 15.25 H new ATOM 0 HG2 PRO B 171 52.893 10.328 45.370 1.00 15.22 H new ATOM 0 HG3 PRO B 171 53.939 11.378 45.857 1.00 15.22 H new ATOM 0 HD2 PRO B 171 53.900 10.519 43.398 1.00 12.15 H new ATOM 0 HD3 PRO B 171 55.183 11.142 44.028 1.00 12.15 H new ATOM 1311 N ARG B 172 54.557 6.181 46.186 1.00 21.52 N ATOM 1312 CA ARG B 172 53.720 5.001 46.394 1.00 20.87 C ATOM 1313 C ARG B 172 52.289 5.461 46.688 1.00 17.05 C ATOM 1314 O ARG B 172 52.054 6.360 47.497 1.00 14.94 O ATOM 1315 CB ARG B 172 54.159 4.133 47.614 1.00 26.07 C ATOM 1316 CG ARG B 172 55.444 3.325 47.504 1.00 33.69 C ATOM 1317 CD ARG B 172 55.576 2.375 48.701 1.00 42.59 C ATOM 1318 NE ARG B 172 54.660 1.205 48.672 1.00 53.49 N ATOM 1319 CZ ARG B 172 54.383 0.439 49.765 1.00 58.65 C ATOM 1320 NH1 ARG B 172 54.930 0.731 50.957 1.00 61.78 N ATOM 1321 NH2 ARG B 172 53.625 -0.659 49.662 1.00 58.54 N ATOM 0 H ARG B 172 55.267 6.198 46.670 1.00 21.52 H new ATOM 0 HA ARG B 172 53.798 4.467 45.588 1.00 20.87 H new ATOM 0 HB2 ARG B 172 54.245 4.722 48.380 1.00 26.07 H new ATOM 0 HB3 ARG B 172 53.438 3.515 47.812 1.00 26.07 H new ATOM 0 HG2 ARG B 172 55.445 2.817 46.678 1.00 33.69 H new ATOM 0 HG3 ARG B 172 56.208 3.922 47.471 1.00 33.69 H new ATOM 0 HD2 ARG B 172 56.490 2.053 48.743 1.00 42.59 H new ATOM 0 HD3 ARG B 172 55.414 2.877 49.515 1.00 42.59 H new ATOM 0 HE ARG B 172 54.285 1.000 47.926 1.00 53.49 H new ATOM 0 HH11 ARG B 172 55.459 1.405 51.034 1.00 61.78 H new ATOM 0 HH12 ARG B 172 54.751 0.244 51.643 1.00 61.78 H new ATOM 0 HH21 ARG B 172 53.305 -0.890 48.898 1.00 58.54 H new ATOM 0 HH22 ARG B 172 53.458 -1.133 50.360 1.00 58.54 H new ATOM 1328 N GLY B 173 51.296 4.837 46.080 1.00 14.04 N ATOM 1329 CA GLY B 173 49.950 5.256 46.356 1.00 11.73 C ATOM 1330 C GLY B 173 49.482 6.251 45.340 1.00 10.19 C ATOM 1331 O GLY B 173 48.391 6.798 45.547 1.00 12.62 O ATOM 0 H GLY B 173 51.380 4.189 45.521 1.00 14.04 H new ATOM 0 HA2 GLY B 173 49.361 4.486 46.355 1.00 11.73 H new ATOM 0 HA3 GLY B 173 49.904 5.647 47.242 1.00 11.73 H new ATOM 1333 N THR B 174 50.243 6.592 44.294 1.00 8.34 N ATOM 1334 CA THR B 174 49.675 7.410 43.227 1.00 10.11 C ATOM 1335 C THR B 174 48.644 6.558 42.447 1.00 9.04 C ATOM 1336 O THR B 174 48.842 5.373 42.140 1.00 8.94 O ATOM 1337 CB THR B 174 50.848 7.920 42.340 1.00 10.65 C ATOM 1338 OG1 THR B 174 51.514 8.878 43.168 1.00 11.69 O ATOM 1339 CG2 THR B 174 50.433 8.544 41.002 1.00 4.52 C ATOM 0 H THR B 174 51.066 6.366 44.188 1.00 8.34 H new ATOM 0 HA THR B 174 49.202 8.186 43.567 1.00 10.11 H new ATOM 0 HB THR B 174 51.404 7.174 42.065 1.00 10.65 H new ATOM 0 HG1 THR B 174 52.106 8.492 43.622 1.00 11.69 H new ATOM 0 HG21 THR B 174 51.224 8.832 40.520 1.00 4.52 H new ATOM 0 HG22 THR B 174 49.953 7.887 40.473 1.00 4.52 H new ATOM 0 HG23 THR B 174 49.859 9.309 41.166 1.00 4.52 H new ATOM 1342 N PHE B 175 47.544 7.167 42.064 1.00 7.52 N ATOM 1343 CA PHE B 175 46.413 6.398 41.597 1.00 8.21 C ATOM 1344 C PHE B 175 45.643 7.126 40.513 1.00 10.16 C ATOM 1345 O PHE B 175 45.897 8.306 40.233 1.00 10.00 O ATOM 1346 CB PHE B 175 45.475 6.106 42.841 1.00 7.38 C ATOM 1347 CG PHE B 175 44.639 7.301 43.357 1.00 6.16 C ATOM 1348 CD1 PHE B 175 45.184 8.220 44.288 1.00 7.11 C ATOM 1349 CD2 PHE B 175 43.330 7.517 42.854 1.00 2.85 C ATOM 1350 CE1 PHE B 175 44.445 9.336 44.704 1.00 4.15 C ATOM 1351 CE2 PHE B 175 42.615 8.632 43.271 1.00 3.03 C ATOM 1352 CZ PHE B 175 43.166 9.543 44.179 1.00 6.56 C ATOM 0 H PHE B 175 47.430 8.019 42.066 1.00 7.52 H new ATOM 0 HA PHE B 175 46.730 5.570 41.204 1.00 8.21 H new ATOM 0 HB2 PHE B 175 44.867 5.388 42.604 1.00 7.38 H new ATOM 0 HB3 PHE B 175 46.027 5.782 43.570 1.00 7.38 H new ATOM 0 HD1 PHE B 175 46.039 8.081 44.626 1.00 7.11 H new ATOM 0 HD2 PHE B 175 42.954 6.917 42.251 1.00 2.85 H new ATOM 0 HE1 PHE B 175 44.802 9.932 45.322 1.00 4.15 H new ATOM 0 HE2 PHE B 175 41.757 8.775 42.942 1.00 3.03 H new ATOM 0 HZ PHE B 175 42.678 10.292 44.435 1.00 6.56 H new ATOM 1354 N LEU B 176 44.654 6.422 39.952 1.00 10.60 N ATOM 1355 CA LEU B 176 43.621 6.995 39.077 1.00 11.87 C ATOM 1356 C LEU B 176 42.439 6.019 39.049 1.00 11.42 C ATOM 1357 O LEU B 176 42.598 4.833 39.387 1.00 7.27 O ATOM 1358 CB LEU B 176 44.117 7.183 37.633 1.00 11.46 C ATOM 1359 CG LEU B 176 44.804 6.026 36.883 1.00 15.25 C ATOM 1360 CD1 LEU B 176 43.788 5.118 36.195 1.00 12.91 C ATOM 1361 CD2 LEU B 176 45.707 6.620 35.807 1.00 13.80 C ATOM 0 H LEU B 176 44.563 5.575 40.073 1.00 10.60 H new ATOM 0 HA LEU B 176 43.376 7.866 39.426 1.00 11.87 H new ATOM 0 HB2 LEU B 176 43.353 7.454 37.101 1.00 11.46 H new ATOM 0 HB3 LEU B 176 44.738 7.928 37.639 1.00 11.46 H new ATOM 0 HG LEU B 176 45.304 5.501 37.527 1.00 15.25 H new ATOM 0 HD11 LEU B 176 44.253 4.403 35.734 1.00 12.91 H new ATOM 0 HD12 LEU B 176 43.190 4.739 36.859 1.00 12.91 H new ATOM 0 HD13 LEU B 176 43.274 5.634 35.555 1.00 12.91 H new ATOM 0 HD21 LEU B 176 46.149 5.904 35.324 1.00 13.80 H new ATOM 0 HD22 LEU B 176 45.173 7.145 35.190 1.00 13.80 H new ATOM 0 HD23 LEU B 176 46.374 7.189 36.222 1.00 13.80 H new ATOM 1363 N VAL B 177 41.251 6.511 38.672 1.00 13.23 N ATOM 1364 CA VAL B 177 40.038 5.703 38.489 1.00 12.49 C ATOM 1365 C VAL B 177 39.733 5.829 36.989 1.00 15.17 C ATOM 1366 O VAL B 177 39.781 6.911 36.378 1.00 18.95 O ATOM 1367 CB VAL B 177 38.856 6.246 39.386 1.00 9.29 C ATOM 1368 CG1 VAL B 177 37.570 5.474 39.193 1.00 6.06 C ATOM 1369 CG2 VAL B 177 39.218 6.036 40.842 1.00 4.86 C ATOM 0 H VAL B 177 41.127 7.347 38.512 1.00 13.23 H new ATOM 0 HA VAL B 177 40.153 4.778 38.758 1.00 12.49 H new ATOM 0 HB VAL B 177 38.728 7.175 39.137 1.00 9.29 H new ATOM 0 HG11 VAL B 177 36.880 5.846 39.764 1.00 6.06 H new ATOM 0 HG12 VAL B 177 37.291 5.537 38.266 1.00 6.06 H new ATOM 0 HG13 VAL B 177 37.713 4.543 39.425 1.00 6.06 H new ATOM 0 HG21 VAL B 177 38.500 6.365 41.405 1.00 4.86 H new ATOM 0 HG22 VAL B 177 39.351 5.090 41.009 1.00 4.86 H new ATOM 0 HG23 VAL B 177 40.035 6.518 41.045 1.00 4.86 H new ATOM 1371 N ARG B 178 39.492 4.710 36.333 1.00 14.83 N ATOM 1372 CA ARG B 178 39.200 4.657 34.923 1.00 10.70 C ATOM 1373 C ARG B 178 38.084 3.614 34.768 1.00 15.27 C ATOM 1374 O ARG B 178 37.708 2.959 35.745 1.00 15.08 O ATOM 1375 CB ARG B 178 40.463 4.225 34.216 1.00 9.17 C ATOM 1376 CG ARG B 178 41.035 2.953 34.796 1.00 5.66 C ATOM 1377 CD ARG B 178 41.974 2.298 33.828 1.00 10.43 C ATOM 1378 NE ARG B 178 42.609 1.090 34.359 1.00 15.18 N ATOM 1379 CZ ARG B 178 42.182 -0.143 34.004 1.00 18.84 C ATOM 1380 NH1 ARG B 178 41.147 -0.309 33.152 1.00 19.88 N ATOM 1381 NH2 ARG B 178 42.819 -1.201 34.513 1.00 13.83 N ATOM 0 H ARG B 178 39.495 3.937 36.711 1.00 14.83 H new ATOM 0 HA ARG B 178 38.915 5.505 34.549 1.00 10.70 H new ATOM 0 HB2 ARG B 178 40.275 4.093 33.274 1.00 9.17 H new ATOM 0 HB3 ARG B 178 41.124 4.932 34.277 1.00 9.17 H new ATOM 0 HG2 ARG B 178 41.503 3.152 35.622 1.00 5.66 H new ATOM 0 HG3 ARG B 178 40.315 2.342 35.018 1.00 5.66 H new ATOM 0 HD2 ARG B 178 41.488 2.071 33.020 1.00 10.43 H new ATOM 0 HD3 ARG B 178 42.663 2.933 33.576 1.00 10.43 H new ATOM 0 HE ARG B 178 43.267 1.166 34.908 1.00 15.18 H new ATOM 0 HH11 ARG B 178 40.746 0.377 32.824 1.00 19.88 H new ATOM 0 HH12 ARG B 178 40.889 -1.101 32.938 1.00 19.88 H new ATOM 0 HH21 ARG B 178 43.481 -1.087 35.050 1.00 13.83 H new ATOM 0 HH22 ARG B 178 42.567 -1.996 34.303 1.00 13.83 H new ATOM 1388 N GLU B 179 37.520 3.393 33.594 1.00 16.45 N ATOM 1389 CA GLU B 179 36.539 2.343 33.371 1.00 20.12 C ATOM 1390 C GLU B 179 37.126 0.938 33.222 1.00 21.19 C ATOM 1391 O GLU B 179 38.267 0.779 32.780 1.00 21.32 O ATOM 1392 CB GLU B 179 35.782 2.644 32.130 1.00 24.74 C ATOM 1393 CG GLU B 179 34.779 3.749 32.293 1.00 27.15 C ATOM 1394 CD GLU B 179 33.962 4.000 31.041 1.00 32.76 C ATOM 1395 OE1 GLU B 179 34.030 3.235 30.078 1.00 32.65 O ATOM 1396 OE2 GLU B 179 33.238 4.981 31.038 1.00 38.21 O ATOM 0 H GLU B 179 37.698 3.856 32.891 1.00 16.45 H new ATOM 0 HA GLU B 179 35.981 2.336 34.165 1.00 20.12 H new ATOM 0 HB2 GLU B 179 36.407 2.885 31.429 1.00 24.74 H new ATOM 0 HB3 GLU B 179 35.323 1.841 31.837 1.00 24.74 H new ATOM 0 HG2 GLU B 179 34.181 3.530 33.025 1.00 27.15 H new ATOM 0 HG3 GLU B 179 35.242 4.565 32.540 1.00 27.15 H new ATOM 1398 N SER B 180 36.440 -0.139 33.638 1.00 21.95 N ATOM 1399 CA SER B 180 36.998 -1.458 33.424 1.00 25.19 C ATOM 1400 C SER B 180 36.777 -1.759 31.945 1.00 26.90 C ATOM 1401 O SER B 180 35.683 -1.523 31.449 1.00 30.73 O ATOM 1402 CB SER B 180 36.280 -2.529 34.258 1.00 21.62 C ATOM 1403 OG SER B 180 36.900 -3.816 34.088 1.00 22.94 O ATOM 0 H SER B 180 35.676 -0.118 34.032 1.00 21.95 H new ATOM 0 HA SER B 180 37.932 -1.473 33.685 1.00 25.19 H new ATOM 0 HB2 SER B 180 36.297 -2.279 35.195 1.00 21.62 H new ATOM 0 HB3 SER B 180 35.348 -2.578 33.994 1.00 21.62 H new ATOM 0 HG SER B 180 37.711 -3.767 34.301 1.00 22.94 H new ATOM 1406 N GLU B 181 37.783 -2.207 31.190 1.00 27.70 N ATOM 1407 CA GLU B 181 37.564 -2.660 29.812 1.00 31.59 C ATOM 1408 C GLU B 181 36.840 -4.015 29.802 1.00 33.96 C ATOM 1409 O GLU B 181 35.986 -4.357 28.986 1.00 35.17 O ATOM 1410 CB GLU B 181 38.874 -2.876 29.078 1.00 33.62 C ATOM 1411 CG GLU B 181 40.097 -2.038 29.394 1.00 37.86 C ATOM 1412 CD GLU B 181 41.379 -2.778 29.054 1.00 42.60 C ATOM 1413 OE1 GLU B 181 41.380 -3.971 28.796 1.00 50.66 O ATOM 1414 OE2 GLU B 181 42.427 -2.195 29.103 1.00 43.37 O ATOM 0 H GLU B 181 38.599 -2.257 31.456 1.00 27.70 H new ATOM 0 HA GLU B 181 37.041 -1.968 29.378 1.00 31.59 H new ATOM 0 HB2 GLU B 181 39.124 -3.804 29.211 1.00 33.62 H new ATOM 0 HB3 GLU B 181 38.691 -2.765 28.132 1.00 33.62 H new ATOM 0 HG2 GLU B 181 40.059 -1.207 28.895 1.00 37.86 H new ATOM 0 HG3 GLU B 181 40.096 -1.804 30.335 1.00 37.86 H new ATOM 1416 N THR B 182 37.299 -4.812 30.742 1.00 35.88 N ATOM 1417 CA THR B 182 36.884 -6.172 30.925 1.00 39.60 C ATOM 1418 C THR B 182 35.480 -6.327 31.462 1.00 39.86 C ATOM 1419 O THR B 182 34.788 -7.247 31.035 1.00 44.20 O ATOM 1420 CB THR B 182 37.948 -6.776 31.833 1.00 42.73 C ATOM 1421 OG1 THR B 182 39.038 -7.020 30.953 1.00 46.75 O ATOM 1422 CG2 THR B 182 37.554 -8.051 32.580 1.00 49.66 C ATOM 0 H THR B 182 37.888 -4.559 31.315 1.00 35.88 H new ATOM 0 HA THR B 182 36.823 -6.636 30.075 1.00 39.60 H new ATOM 0 HB THR B 182 38.138 -6.165 32.562 1.00 42.73 H new ATOM 0 HG1 THR B 182 39.710 -6.587 31.212 1.00 46.75 H new ATOM 0 HG21 THR B 182 38.298 -8.350 33.126 1.00 49.66 H new ATOM 0 HG22 THR B 182 36.789 -7.870 33.148 1.00 49.66 H new ATOM 0 HG23 THR B 182 37.324 -8.743 31.940 1.00 49.66 H new ATOM 1425 N THR B 183 34.988 -5.527 32.407 1.00 37.54 N ATOM 1426 CA THR B 183 33.631 -5.748 32.884 1.00 32.15 C ATOM 1427 C THR B 183 32.845 -4.502 32.600 1.00 32.98 C ATOM 1428 O THR B 183 33.122 -3.447 33.166 1.00 34.75 O ATOM 1429 CB THR B 183 33.655 -6.066 34.392 1.00 30.90 C ATOM 1430 OG1 THR B 183 34.474 -7.244 34.500 1.00 33.16 O ATOM 1431 CG2 THR B 183 32.291 -6.184 35.027 1.00 26.84 C ATOM 0 H THR B 183 35.409 -4.873 32.773 1.00 37.54 H new ATOM 0 HA THR B 183 33.219 -6.503 32.435 1.00 32.15 H new ATOM 0 HB THR B 183 34.027 -5.332 34.905 1.00 30.90 H new ATOM 0 HG1 THR B 183 34.025 -7.867 34.841 1.00 33.16 H new ATOM 0 HG21 THR B 183 32.390 -6.384 35.971 1.00 26.84 H new ATOM 0 HG22 THR B 183 31.812 -5.347 34.923 1.00 26.84 H new ATOM 0 HG23 THR B 183 31.794 -6.897 34.596 1.00 26.84 H new ATOM 1434 N LYS B 184 31.901 -4.579 31.685 1.00 31.91 N ATOM 1435 CA LYS B 184 31.072 -3.433 31.347 1.00 33.28 C ATOM 1436 C LYS B 184 30.324 -2.986 32.594 1.00 31.69 C ATOM 1437 O LYS B 184 29.880 -3.806 33.410 1.00 32.52 O ATOM 1438 CB LYS B 184 30.026 -3.793 30.258 1.00 36.10 C ATOM 0 H LYS B 184 31.719 -5.293 31.241 1.00 31.91 H new ATOM 0 HA LYS B 184 31.648 -2.730 31.008 1.00 33.28 H new ATOM 1440 N GLY B 185 30.271 -1.665 32.765 1.00 28.77 N ATOM 1441 CA GLY B 185 29.630 -1.057 33.923 1.00 28.94 C ATOM 1442 C GLY B 185 30.506 -0.890 35.186 1.00 25.13 C ATOM 1443 O GLY B 185 30.092 -0.170 36.102 1.00 25.31 O ATOM 0 H GLY B 185 30.607 -1.099 32.211 1.00 28.77 H new ATOM 0 HA2 GLY B 185 29.301 -0.182 33.664 1.00 28.94 H new ATOM 0 HA3 GLY B 185 28.856 -1.593 34.158 1.00 28.94 H new ATOM 1445 N ALA B 186 31.675 -1.556 35.286 1.00 22.71 N ATOM 1446 CA ALA B 186 32.523 -1.477 36.463 1.00 19.70 C ATOM 1447 C ALA B 186 33.613 -0.446 36.224 1.00 18.36 C ATOM 1448 O ALA B 186 33.900 -0.051 35.082 1.00 19.89 O ATOM 1449 CB ALA B 186 33.177 -2.840 36.745 1.00 14.11 C ATOM 0 H ALA B 186 31.986 -2.063 34.665 1.00 22.71 H new ATOM 0 HA ALA B 186 31.980 -1.222 37.225 1.00 19.70 H new ATOM 0 HB1 ALA B 186 33.740 -2.773 37.532 1.00 14.11 H new ATOM 0 HB2 ALA B 186 32.487 -3.505 36.897 1.00 14.11 H new ATOM 0 HB3 ALA B 186 33.717 -3.104 35.984 1.00 14.11 H new ATOM 1451 N TYR B 187 34.195 0.017 37.324 1.00 18.29 N ATOM 1452 CA TYR B 187 35.303 0.940 37.283 1.00 15.21 C ATOM 1453 C TYR B 187 36.519 0.245 37.804 1.00 15.01 C ATOM 1454 O TYR B 187 36.480 -0.946 38.130 1.00 13.40 O ATOM 1455 CB TYR B 187 35.033 2.162 38.118 1.00 15.89 C ATOM 1456 CG TYR B 187 33.939 2.985 37.482 1.00 18.65 C ATOM 1457 CD1 TYR B 187 34.248 3.918 36.493 1.00 19.55 C ATOM 1458 CD2 TYR B 187 32.623 2.786 37.887 1.00 18.62 C ATOM 1459 CE1 TYR B 187 33.238 4.670 35.912 1.00 19.99 C ATOM 1460 CE2 TYR B 187 31.609 3.541 37.311 1.00 22.71 C ATOM 1461 CZ TYR B 187 31.936 4.474 36.329 1.00 23.20 C ATOM 1462 OH TYR B 187 30.944 5.262 35.793 1.00 33.21 O ATOM 0 H TYR B 187 33.951 -0.202 38.119 1.00 18.29 H new ATOM 0 HA TYR B 187 35.435 1.228 36.366 1.00 15.21 H new ATOM 0 HB2 TYR B 187 34.772 1.900 39.015 1.00 15.89 H new ATOM 0 HB3 TYR B 187 35.841 2.692 38.201 1.00 15.89 H new ATOM 0 HD1 TYR B 187 35.130 4.036 36.223 1.00 19.55 H new ATOM 0 HD2 TYR B 187 32.424 2.153 38.538 1.00 18.62 H new ATOM 0 HE1 TYR B 187 33.434 5.296 35.253 1.00 19.99 H new ATOM 0 HE2 TYR B 187 30.725 3.425 37.577 1.00 22.71 H new ATOM 0 HH TYR B 187 30.203 5.045 36.125 1.00 33.21 H new ATOM 1465 N CYS B 188 37.631 0.933 37.850 1.00 13.18 N ATOM 1466 CA CYS B 188 38.833 0.283 38.285 1.00 13.97 C ATOM 1467 C CYS B 188 39.701 1.336 38.877 1.00 11.02 C ATOM 1468 O CYS B 188 39.820 2.418 38.294 1.00 12.80 O ATOM 1469 CB CYS B 188 39.533 -0.363 37.096 1.00 13.19 C ATOM 1470 SG CYS B 188 41.208 -0.919 37.529 1.00 24.64 S ATOM 0 H CYS B 188 37.712 1.763 37.638 1.00 13.18 H new ATOM 0 HA CYS B 188 38.640 -0.413 38.932 1.00 13.97 H new ATOM 0 HB2 CYS B 188 39.011 -1.118 36.783 1.00 13.19 H new ATOM 0 HB3 CYS B 188 39.581 0.271 36.364 1.00 13.19 H new ATOM 0 HG CYS B 188 41.139 -1.858 38.273 1.00 24.64 H new ATOM 1472 N LEU B 189 40.231 1.054 40.048 1.00 8.55 N ATOM 1473 CA LEU B 189 41.209 1.889 40.727 1.00 8.38 C ATOM 1474 C LEU B 189 42.604 1.295 40.468 1.00 9.56 C ATOM 1475 O LEU B 189 42.865 0.146 40.835 1.00 8.70 O ATOM 1476 CB LEU B 189 40.887 1.886 42.225 1.00 11.33 C ATOM 1477 CG LEU B 189 41.722 2.688 43.231 1.00 10.55 C ATOM 1478 CD1 LEU B 189 41.637 4.174 42.970 1.00 5.49 C ATOM 1479 CD2 LEU B 189 41.180 2.402 44.622 1.00 12.33 C ATOM 0 H LEU B 189 40.027 0.345 40.490 1.00 8.55 H new ATOM 0 HA LEU B 189 41.186 2.803 40.402 1.00 8.38 H new ATOM 0 HB2 LEU B 189 39.970 2.189 42.316 1.00 11.33 H new ATOM 0 HB3 LEU B 189 40.910 0.961 42.515 1.00 11.33 H new ATOM 0 HG LEU B 189 42.651 2.424 43.147 1.00 10.55 H new ATOM 0 HD11 LEU B 189 42.175 4.649 43.623 1.00 5.49 H new ATOM 0 HD12 LEU B 189 41.967 4.366 42.078 1.00 5.49 H new ATOM 0 HD13 LEU B 189 40.714 4.463 43.041 1.00 5.49 H new ATOM 0 HD21 LEU B 189 41.693 2.899 45.278 1.00 12.33 H new ATOM 0 HD22 LEU B 189 40.249 2.671 44.669 1.00 12.33 H new ATOM 0 HD23 LEU B 189 41.251 1.453 44.808 1.00 12.33 H new ATOM 1481 N SER B 190 43.514 2.014 39.803 1.00 10.15 N ATOM 1482 CA SER B 190 44.888 1.571 39.532 1.00 8.94 C ATOM 1483 C SER B 190 45.816 2.348 40.444 1.00 8.65 C ATOM 1484 O SER B 190 45.668 3.563 40.538 1.00 11.56 O ATOM 1485 CB SER B 190 45.162 1.847 38.072 1.00 5.61 C ATOM 1486 OG SER B 190 44.185 1.092 37.361 1.00 9.13 O ATOM 0 H SER B 190 43.344 2.796 39.488 1.00 10.15 H new ATOM 0 HA SER B 190 45.022 0.626 39.703 1.00 8.94 H new ATOM 0 HB2 SER B 190 45.086 2.794 37.874 1.00 5.61 H new ATOM 0 HB3 SER B 190 46.061 1.577 37.827 1.00 5.61 H new ATOM 0 HG SER B 190 44.416 0.285 37.339 1.00 9.13 H new ATOM 1489 N VAL B 191 46.684 1.659 41.181 1.00 9.98 N ATOM 1490 CA VAL B 191 47.499 2.229 42.263 1.00 10.88 C ATOM 1491 C VAL B 191 48.942 1.802 42.076 1.00 11.72 C ATOM 1492 O VAL B 191 49.212 0.608 41.888 1.00 7.54 O ATOM 1493 CB VAL B 191 47.090 1.718 43.725 1.00 10.17 C ATOM 1494 CG1 VAL B 191 47.755 2.535 44.839 1.00 4.65 C ATOM 1495 CG2 VAL B 191 45.608 1.885 43.941 1.00 11.17 C ATOM 0 H VAL B 191 46.822 0.818 41.064 1.00 9.98 H new ATOM 0 HA VAL B 191 47.362 3.188 42.211 1.00 10.88 H new ATOM 0 HB VAL B 191 47.373 0.791 43.766 1.00 10.17 H new ATOM 0 HG11 VAL B 191 47.479 2.190 45.702 1.00 4.65 H new ATOM 0 HG12 VAL B 191 48.719 2.468 44.758 1.00 4.65 H new ATOM 0 HG13 VAL B 191 47.488 3.464 44.762 1.00 4.65 H new ATOM 0 HG21 VAL B 191 45.373 1.572 44.829 1.00 11.17 H new ATOM 0 HG22 VAL B 191 45.372 2.822 43.855 1.00 11.17 H new ATOM 0 HG23 VAL B 191 45.124 1.368 43.278 1.00 11.17 H new ATOM 1497 N SER B 192 49.901 2.721 42.140 1.00 13.36 N ATOM 1498 CA SER B 192 51.291 2.342 42.041 1.00 15.95 C ATOM 1499 C SER B 192 51.771 1.808 43.404 1.00 16.81 C ATOM 1500 O SER B 192 51.359 2.240 44.499 1.00 16.80 O ATOM 1501 CB SER B 192 52.091 3.571 41.576 1.00 12.56 C ATOM 1502 OG SER B 192 52.020 4.625 42.535 1.00 15.37 O ATOM 0 H SER B 192 49.762 3.564 42.240 1.00 13.36 H new ATOM 0 HA SER B 192 51.421 1.631 41.394 1.00 15.95 H new ATOM 0 HB2 SER B 192 53.018 3.322 41.433 1.00 12.56 H new ATOM 0 HB3 SER B 192 51.746 3.881 40.724 1.00 12.56 H new ATOM 0 HG SER B 192 52.569 5.227 42.331 1.00 15.37 H new ATOM 1505 N ASP B 193 52.641 0.817 43.358 1.00 19.81 N ATOM 1506 CA ASP B 193 53.126 0.221 44.549 1.00 20.66 C ATOM 1507 C ASP B 193 54.597 -0.078 44.399 1.00 22.78 C ATOM 1508 O ASP B 193 55.178 0.022 43.320 1.00 20.06 O ATOM 1509 CB ASP B 193 52.332 -1.041 44.803 1.00 20.76 C ATOM 1510 CG ASP B 193 52.639 -1.630 46.171 1.00 24.41 C ATOM 1511 OD1 ASP B 193 52.863 -0.846 47.112 1.00 21.31 O ATOM 1512 OD2 ASP B 193 52.670 -2.869 46.279 1.00 24.40 O ATOM 0 H ASP B 193 52.957 0.482 42.632 1.00 19.81 H new ATOM 0 HA ASP B 193 53.020 0.820 45.304 1.00 20.66 H new ATOM 0 HB2 ASP B 193 51.384 -0.846 44.739 1.00 20.76 H new ATOM 0 HB3 ASP B 193 52.534 -1.695 44.116 1.00 20.76 H new ATOM 1514 N PHE B 194 55.248 -0.423 45.477 1.00 27.20 N ATOM 1515 CA PHE B 194 56.634 -0.790 45.436 1.00 32.89 C ATOM 1516 C PHE B 194 56.846 -1.838 46.504 1.00 37.28 C ATOM 1517 O PHE B 194 56.494 -1.633 47.679 1.00 37.13 O ATOM 1518 CB PHE B 194 57.542 0.395 45.738 1.00 33.50 C ATOM 1519 CG PHE B 194 58.992 -0.027 45.635 1.00 36.27 C ATOM 1520 CD1 PHE B 194 59.623 -0.002 44.390 1.00 38.61 C ATOM 1521 CD2 PHE B 194 59.667 -0.504 46.764 1.00 38.14 C ATOM 1522 CE1 PHE B 194 60.925 -0.487 44.270 1.00 37.59 C ATOM 1523 CE2 PHE B 194 60.965 -0.989 46.633 1.00 39.16 C ATOM 1524 CZ PHE B 194 61.593 -0.983 45.387 1.00 39.66 C ATOM 0 H PHE B 194 54.896 -0.452 46.261 1.00 27.20 H new ATOM 0 HA PHE B 194 56.853 -1.114 44.548 1.00 32.89 H new ATOM 0 HB2 PHE B 194 57.362 1.117 45.116 1.00 33.50 H new ATOM 0 HB3 PHE B 194 57.358 0.735 46.628 1.00 33.50 H new ATOM 0 HD1 PHE B 194 59.178 0.336 43.646 1.00 38.61 H new ATOM 0 HD2 PHE B 194 59.251 -0.497 47.596 1.00 38.14 H new ATOM 0 HE1 PHE B 194 61.348 -0.479 43.442 1.00 37.59 H new ATOM 0 HE2 PHE B 194 61.415 -1.318 47.378 1.00 39.16 H new ATOM 0 HZ PHE B 194 62.459 -1.311 45.302 1.00 39.66 H new ATOM 1526 N ASP B 195 57.447 -2.939 46.078 1.00 43.87 N ATOM 1527 CA ASP B 195 57.940 -3.932 47.004 1.00 50.84 C ATOM 1528 C ASP B 195 59.340 -4.303 46.533 1.00 52.83 C ATOM 1529 O ASP B 195 59.676 -4.180 45.348 1.00 51.22 O ATOM 1530 CB ASP B 195 57.063 -5.185 47.027 1.00 55.23 C ATOM 1531 CG ASP B 195 57.176 -6.035 45.786 1.00 58.26 C ATOM 1532 OD1 ASP B 195 58.074 -6.881 45.740 1.00 62.09 O ATOM 1533 OD2 ASP B 195 56.390 -5.824 44.870 1.00 63.04 O ATOM 0 H ASP B 195 57.578 -3.127 45.249 1.00 43.87 H new ATOM 0 HA ASP B 195 57.936 -3.571 47.904 1.00 50.84 H new ATOM 0 HB2 ASP B 195 57.302 -5.722 47.799 1.00 55.23 H new ATOM 0 HB3 ASP B 195 56.137 -4.919 47.142 1.00 55.23 H new ATOM 1535 N ASN B 196 60.134 -4.785 47.502 1.00 57.31 N ATOM 1536 CA ASN B 196 61.551 -5.099 47.317 1.00 60.03 C ATOM 1537 C ASN B 196 61.862 -5.865 46.040 1.00 62.00 C ATOM 1538 O ASN B 196 62.675 -5.435 45.204 1.00 62.60 O ATOM 1539 CB ASN B 196 62.054 -5.925 48.502 1.00 59.60 C ATOM 0 H ASN B 196 59.853 -4.940 48.300 1.00 57.31 H new ATOM 0 HA ASN B 196 62.001 -4.242 47.253 1.00 60.03 H new ATOM 1541 N ALA B 197 61.105 -6.951 45.871 1.00 61.62 N ATOM 1542 CA ALA B 197 61.352 -7.847 44.763 1.00 60.70 C ATOM 1543 C ALA B 197 60.894 -7.299 43.429 1.00 58.43 C ATOM 1544 O ALA B 197 61.720 -7.071 42.539 1.00 62.17 O ATOM 1545 CB ALA B 197 60.647 -9.190 45.001 1.00 62.42 C ATOM 0 H ALA B 197 60.453 -7.178 46.384 1.00 61.62 H new ATOM 0 HA ALA B 197 62.315 -7.957 44.722 1.00 60.70 H new ATOM 0 HB1 ALA B 197 60.819 -9.783 44.253 1.00 62.42 H new ATOM 0 HB2 ALA B 197 60.984 -9.593 45.816 1.00 62.42 H new ATOM 0 HB3 ALA B 197 59.692 -9.044 45.084 1.00 62.42 H new ATOM 1547 N LYS B 198 59.596 -7.034 43.290 1.00 52.59 N ATOM 1548 CA LYS B 198 59.074 -6.669 42.000 1.00 46.72 C ATOM 1549 C LYS B 198 59.375 -5.242 41.671 1.00 42.53 C ATOM 1550 O LYS B 198 59.321 -4.869 40.496 1.00 44.53 O ATOM 1551 CB LYS B 198 57.565 -6.851 41.940 1.00 46.92 C ATOM 0 H LYS B 198 59.017 -7.062 43.926 1.00 52.59 H new ATOM 0 HA LYS B 198 59.505 -7.255 41.358 1.00 46.72 H new ATOM 1553 N GLY B 199 59.743 -4.452 42.671 1.00 36.65 N ATOM 1554 CA GLY B 199 59.959 -3.049 42.435 1.00 34.69 C ATOM 1555 C GLY B 199 58.647 -2.314 42.175 1.00 29.92 C ATOM 1556 O GLY B 199 57.621 -2.617 42.774 1.00 30.82 O ATOM 0 H GLY B 199 59.870 -4.711 43.481 1.00 36.65 H new ATOM 0 HA2 GLY B 199 60.404 -2.656 43.202 1.00 34.69 H new ATOM 0 HA3 GLY B 199 60.550 -2.935 41.675 1.00 34.69 H new ATOM 1558 N LEU B 200 58.703 -1.252 41.379 1.00 27.74 N ATOM 1559 CA LEU B 200 57.524 -0.518 40.949 1.00 28.39 C ATOM 1560 C LEU B 200 56.587 -1.409 40.156 1.00 25.03 C ATOM 1561 O LEU B 200 57.014 -2.115 39.242 1.00 25.46 O ATOM 1562 CB LEU B 200 57.840 0.619 40.010 1.00 30.93 C ATOM 1563 CG LEU B 200 58.482 1.859 40.474 1.00 34.70 C ATOM 1564 CD1 LEU B 200 58.562 2.821 39.283 1.00 35.76 C ATOM 1565 CD2 LEU B 200 57.704 2.416 41.646 1.00 36.03 C ATOM 0 H LEU B 200 59.440 -0.934 41.070 1.00 27.74 H new ATOM 0 HA LEU B 200 57.133 -0.190 41.774 1.00 28.39 H new ATOM 0 HB2 LEU B 200 58.406 0.255 39.311 1.00 30.93 H new ATOM 0 HB3 LEU B 200 57.004 0.877 39.592 1.00 30.93 H new ATOM 0 HG LEU B 200 59.385 1.705 40.793 1.00 34.70 H new ATOM 0 HD11 LEU B 200 58.983 3.649 39.563 1.00 35.76 H new ATOM 0 HD12 LEU B 200 59.086 2.416 38.574 1.00 35.76 H new ATOM 0 HD13 LEU B 200 57.668 3.007 38.957 1.00 35.76 H new ATOM 0 HD21 LEU B 200 58.125 3.234 41.955 1.00 36.03 H new ATOM 0 HD22 LEU B 200 56.794 2.605 41.370 1.00 36.03 H new ATOM 0 HD23 LEU B 200 57.694 1.766 42.366 1.00 36.03 H new ATOM 1567 N ASN B 201 55.304 -1.357 40.471 1.00 20.94 N ATOM 1568 CA ASN B 201 54.291 -2.129 39.771 1.00 15.94 C ATOM 1569 C ASN B 201 52.992 -1.419 40.108 1.00 14.40 C ATOM 1570 O ASN B 201 52.922 -0.591 41.021 1.00 14.35 O ATOM 1571 CB ASN B 201 54.271 -3.653 40.252 1.00 14.06 C ATOM 1572 CG ASN B 201 53.911 -3.882 41.727 1.00 18.32 C ATOM 1573 OD1 ASN B 201 52.752 -4.230 42.061 1.00 21.80 O ATOM 1574 ND2 ASN B 201 54.871 -3.694 42.654 1.00 13.06 N ATOM 0 H ASN B 201 54.992 -0.867 41.105 1.00 20.94 H new ATOM 0 HA ASN B 201 54.454 -2.172 38.816 1.00 15.94 H new ATOM 0 HB2 ASN B 201 53.637 -4.140 39.702 1.00 14.06 H new ATOM 0 HB3 ASN B 201 55.145 -4.039 40.086 1.00 14.06 H new ATOM 0 HD21 ASN B 201 54.693 -3.812 43.487 1.00 13.06 H new ATOM 0 HD22 ASN B 201 55.661 -3.456 42.412 1.00 13.06 H new ATOM 1578 N VAL B 202 51.968 -1.666 39.320 1.00 14.97 N ATOM 1579 CA VAL B 202 50.681 -1.056 39.502 1.00 12.37 C ATOM 1580 C VAL B 202 49.746 -2.175 39.931 1.00 12.89 C ATOM 1581 O VAL B 202 49.824 -3.250 39.354 1.00 13.90 O ATOM 1582 CB VAL B 202 50.242 -0.428 38.132 1.00 13.17 C ATOM 1583 CG1 VAL B 202 48.833 0.151 38.206 1.00 5.15 C ATOM 1584 CG2 VAL B 202 51.137 0.725 37.776 1.00 11.51 C ATOM 0 H VAL B 202 52.006 -2.205 38.651 1.00 14.97 H new ATOM 0 HA VAL B 202 50.680 -0.350 40.167 1.00 12.37 H new ATOM 0 HB VAL B 202 50.288 -1.142 37.478 1.00 13.17 H new ATOM 0 HG11 VAL B 202 48.593 0.530 37.346 1.00 5.15 H new ATOM 0 HG12 VAL B 202 48.206 -0.552 38.435 1.00 5.15 H new ATOM 0 HG13 VAL B 202 48.803 0.844 38.884 1.00 5.15 H new ATOM 0 HG21 VAL B 202 50.856 1.104 36.929 1.00 11.51 H new ATOM 0 HG22 VAL B 202 51.082 1.403 38.467 1.00 11.51 H new ATOM 0 HG23 VAL B 202 52.053 0.413 37.702 1.00 11.51 H new ATOM 1586 N LYS B 203 48.894 -2.019 40.928 1.00 13.80 N ATOM 1587 CA LYS B 203 47.867 -3.000 41.289 1.00 12.75 C ATOM 1588 C LYS B 203 46.516 -2.499 40.725 1.00 9.91 C ATOM 1589 O LYS B 203 46.291 -1.282 40.651 1.00 10.16 O ATOM 1590 CB LYS B 203 47.774 -3.078 42.784 1.00 13.06 C ATOM 1591 CG LYS B 203 49.060 -3.312 43.532 1.00 15.82 C ATOM 1592 CD LYS B 203 49.148 -4.786 43.816 1.00 21.28 C ATOM 1593 CE LYS B 203 50.146 -5.146 44.929 1.00 23.14 C ATOM 1594 NZ LYS B 203 51.516 -4.817 44.562 1.00 29.77 N ATOM 0 H LYS B 203 48.891 -1.322 41.432 1.00 13.80 H new ATOM 0 HA LYS B 203 48.085 -3.875 40.930 1.00 12.75 H new ATOM 0 HB2 LYS B 203 47.383 -2.251 43.106 1.00 13.06 H new ATOM 0 HB3 LYS B 203 47.157 -3.791 43.012 1.00 13.06 H new ATOM 0 HG2 LYS B 203 49.820 -3.019 43.006 1.00 15.82 H new ATOM 0 HG3 LYS B 203 49.073 -2.803 44.358 1.00 15.82 H new ATOM 0 HD2 LYS B 203 48.269 -5.112 44.064 1.00 21.28 H new ATOM 0 HD3 LYS B 203 49.403 -5.249 43.003 1.00 21.28 H new ATOM 0 HE2 LYS B 203 49.907 -4.673 45.741 1.00 23.14 H new ATOM 0 HE3 LYS B 203 50.083 -6.094 45.124 1.00 23.14 H new ATOM 0 HZ1 LYS B 203 52.043 -5.516 44.722 1.00 29.77 H new ATOM 0 HZ2 LYS B 203 51.551 -4.612 43.697 1.00 29.77 H new ATOM 0 HZ3 LYS B 203 51.793 -4.121 45.042 1.00 29.77 H new ATOM 1599 N HIS B 204 45.560 -3.326 40.304 1.00 9.75 N ATOM 1600 CA HIS B 204 44.293 -2.839 39.743 1.00 8.31 C ATOM 1601 C HIS B 204 43.194 -3.446 40.583 1.00 9.59 C ATOM 1602 O HIS B 204 43.223 -4.648 40.840 1.00 10.71 O ATOM 1603 CB HIS B 204 44.099 -3.263 38.262 1.00 5.81 C ATOM 1604 CG HIS B 204 45.162 -2.646 37.346 1.00 11.30 C ATOM 1605 ND1 HIS B 204 45.174 -1.445 36.759 1.00 8.72 N ATOM 1606 CD2 HIS B 204 46.345 -3.269 37.008 1.00 9.50 C ATOM 1607 CE1 HIS B 204 46.316 -1.342 36.098 1.00 8.65 C ATOM 1608 NE2 HIS B 204 46.997 -2.439 36.241 1.00 7.45 N ATOM 0 H HIS B 204 45.624 -4.183 40.334 1.00 9.75 H new ATOM 0 HA HIS B 204 44.283 -1.869 39.758 1.00 8.31 H new ATOM 0 HB2 HIS B 204 44.137 -4.230 38.195 1.00 5.81 H new ATOM 0 HB3 HIS B 204 43.217 -2.992 37.961 1.00 5.81 H new ATOM 0 HD2 HIS B 204 46.624 -4.115 37.275 1.00 9.50 H new ATOM 0 HE1 HIS B 204 46.588 -0.600 35.608 1.00 8.65 H new ATOM 0 HE2 HIS B 204 47.763 -2.595 35.883 1.00 7.45 H new ATOM 1612 N TYR B 205 42.246 -2.638 41.055 1.00 7.91 N ATOM 1613 CA TYR B 205 41.156 -3.092 41.915 1.00 11.40 C ATOM 1614 C TYR B 205 39.865 -2.732 41.209 1.00 12.90 C ATOM 1615 O TYR B 205 39.643 -1.564 40.852 1.00 13.53 O ATOM 1616 CB TYR B 205 41.132 -2.386 43.277 1.00 8.33 C ATOM 1617 CG TYR B 205 42.420 -2.632 44.058 1.00 12.89 C ATOM 1618 CD1 TYR B 205 42.523 -3.748 44.891 1.00 9.92 C ATOM 1619 CD2 TYR B 205 43.492 -1.732 43.937 1.00 13.49 C ATOM 1620 CE1 TYR B 205 43.694 -3.958 45.619 1.00 14.72 C ATOM 1621 CE2 TYR B 205 44.676 -1.950 44.658 1.00 13.19 C ATOM 1622 CZ TYR B 205 44.755 -3.060 45.494 1.00 14.85 C ATOM 1623 OH TYR B 205 45.901 -3.295 46.205 1.00 15.09 O ATOM 0 H TYR B 205 42.218 -1.796 40.881 1.00 7.91 H new ATOM 0 HA TYR B 205 41.271 -4.042 42.072 1.00 11.40 H new ATOM 0 HB2 TYR B 205 41.009 -1.433 43.146 1.00 8.33 H new ATOM 0 HB3 TYR B 205 40.374 -2.702 43.793 1.00 8.33 H new ATOM 0 HD1 TYR B 205 41.815 -4.347 44.960 1.00 9.92 H new ATOM 0 HD2 TYR B 205 43.417 -0.992 43.379 1.00 13.49 H new ATOM 0 HE1 TYR B 205 43.767 -4.693 46.185 1.00 14.72 H new ATOM 0 HE2 TYR B 205 45.394 -1.364 44.579 1.00 13.19 H new ATOM 0 HH TYR B 205 46.523 -2.821 45.899 1.00 15.09 H new ATOM 1626 N LYS B 206 39.026 -3.737 40.953 1.00 12.50 N ATOM 1627 CA LYS B 206 37.789 -3.521 40.257 1.00 11.66 C ATOM 1628 C LYS B 206 36.810 -2.863 41.254 1.00 9.95 C ATOM 1629 O LYS B 206 36.876 -3.097 42.453 1.00 9.26 O ATOM 1630 CB LYS B 206 37.325 -4.864 39.740 1.00 10.86 C ATOM 1631 CG LYS B 206 36.091 -4.648 38.917 1.00 16.72 C ATOM 1632 CD LYS B 206 35.727 -5.924 38.259 1.00 21.77 C ATOM 1633 CE LYS B 206 36.637 -6.187 37.085 1.00 31.89 C ATOM 1634 NZ LYS B 206 36.189 -7.408 36.490 1.00 31.15 N ATOM 0 H LYS B 206 39.169 -4.554 41.182 1.00 12.50 H new ATOM 0 HA LYS B 206 37.866 -2.928 39.493 1.00 11.66 H new ATOM 0 HB2 LYS B 206 38.020 -5.279 39.205 1.00 10.86 H new ATOM 0 HB3 LYS B 206 37.138 -5.465 40.478 1.00 10.86 H new ATOM 0 HG2 LYS B 206 35.363 -4.340 39.478 1.00 16.72 H new ATOM 0 HG3 LYS B 206 36.247 -3.960 38.252 1.00 16.72 H new ATOM 0 HD2 LYS B 206 35.791 -6.653 38.896 1.00 21.77 H new ATOM 0 HD3 LYS B 206 34.805 -5.889 37.960 1.00 21.77 H new ATOM 0 HE2 LYS B 206 36.597 -5.457 36.447 1.00 31.89 H new ATOM 0 HE3 LYS B 206 37.560 -6.262 37.374 1.00 31.89 H new ATOM 0 HZ1 LYS B 206 36.802 -7.701 35.916 1.00 31.15 H new ATOM 0 HZ2 LYS B 206 36.062 -8.019 37.125 1.00 31.15 H new ATOM 0 HZ3 LYS B 206 35.424 -7.265 36.059 1.00 31.15 H new ATOM 1639 N ILE B 207 36.003 -1.906 40.813 1.00 10.38 N ATOM 1640 CA ILE B 207 35.043 -1.225 41.666 1.00 9.04 C ATOM 1641 C ILE B 207 33.706 -1.571 41.036 1.00 10.57 C ATOM 1642 O ILE B 207 33.472 -1.278 39.866 1.00 8.30 O ATOM 1643 CB ILE B 207 35.249 0.312 41.620 1.00 11.34 C ATOM 1644 CG1 ILE B 207 36.640 0.696 42.159 1.00 9.99 C ATOM 1645 CG2 ILE B 207 34.102 0.977 42.387 1.00 10.04 C ATOM 1646 CD1 ILE B 207 37.021 2.149 41.820 1.00 7.13 C ATOM 0 H ILE B 207 35.999 -1.631 39.998 1.00 10.38 H new ATOM 0 HA ILE B 207 35.122 -1.490 42.596 1.00 9.04 H new ATOM 0 HB ILE B 207 35.227 0.632 40.704 1.00 11.34 H new ATOM 0 HG12 ILE B 207 36.655 0.577 43.121 1.00 9.99 H new ATOM 0 HG13 ILE B 207 37.305 0.095 41.788 1.00 9.99 H new ATOM 0 HG21 ILE B 207 34.215 1.940 42.368 1.00 10.04 H new ATOM 0 HG22 ILE B 207 33.257 0.743 41.972 1.00 10.04 H new ATOM 0 HG23 ILE B 207 34.106 0.669 43.307 1.00 10.04 H new ATOM 0 HD11 ILE B 207 37.901 2.345 42.178 1.00 7.13 H new ATOM 0 HD12 ILE B 207 37.031 2.265 40.857 1.00 7.13 H new ATOM 0 HD13 ILE B 207 36.371 2.754 42.211 1.00 7.13 H new ATOM 1648 N ARG B 208 32.783 -2.161 41.750 1.00 11.66 N ATOM 1649 CA ARG B 208 31.513 -2.545 41.174 1.00 13.40 C ATOM 1650 C ARG B 208 30.433 -1.621 41.691 1.00 15.76 C ATOM 1651 O ARG B 208 30.480 -1.128 42.829 1.00 13.52 O ATOM 1652 CB ARG B 208 31.159 -3.954 41.579 1.00 17.31 C ATOM 1653 CG ARG B 208 32.208 -4.989 41.309 1.00 17.95 C ATOM 1654 CD ARG B 208 31.805 -5.845 40.180 1.00 18.90 C ATOM 1655 NE ARG B 208 32.568 -7.076 40.178 1.00 25.75 N ATOM 1656 CZ ARG B 208 32.469 -7.918 39.152 1.00 33.36 C ATOM 1657 NH1 ARG B 208 31.656 -7.608 38.130 1.00 34.90 N ATOM 1658 NH2 ARG B 208 33.273 -8.995 39.069 1.00 34.62 N ATOM 0 H ARG B 208 32.869 -2.353 42.584 1.00 11.66 H new ATOM 0 HA ARG B 208 31.581 -2.490 40.208 1.00 13.40 H new ATOM 0 HB2 ARG B 208 30.959 -3.960 42.528 1.00 17.31 H new ATOM 0 HB3 ARG B 208 30.347 -4.212 41.116 1.00 17.31 H new ATOM 0 HG2 ARG B 208 33.053 -4.557 41.110 1.00 17.95 H new ATOM 0 HG3 ARG B 208 32.347 -5.532 42.101 1.00 17.95 H new ATOM 0 HD2 ARG B 208 30.858 -6.045 40.241 1.00 18.90 H new ATOM 0 HD3 ARG B 208 31.941 -5.372 39.344 1.00 18.90 H new ATOM 0 HE ARG B 208 33.085 -7.263 40.839 1.00 25.75 H new ATOM 0 HH11 ARG B 208 31.208 -6.874 38.144 1.00 34.90 H new ATOM 0 HH12 ARG B 208 31.583 -8.143 37.461 1.00 34.90 H new ATOM 0 HH21 ARG B 208 33.857 -9.144 39.682 1.00 34.62 H new ATOM 0 HH22 ARG B 208 33.202 -9.534 38.403 1.00 34.62 H new ATOM 1665 N LYS B 209 29.423 -1.423 40.867 1.00 18.87 N ATOM 1666 CA LYS B 209 28.330 -0.559 41.195 1.00 22.22 C ATOM 1667 C LYS B 209 27.163 -1.452 41.496 1.00 25.21 C ATOM 1668 O LYS B 209 26.845 -2.383 40.760 1.00 23.55 O ATOM 1669 CB LYS B 209 28.049 0.282 40.020 1.00 25.82 C ATOM 1670 CG LYS B 209 26.992 1.315 40.222 1.00 33.83 C ATOM 1671 CD LYS B 209 27.004 1.937 38.848 1.00 41.77 C ATOM 1672 CE LYS B 209 26.041 3.096 38.714 1.00 48.55 C ATOM 1673 NZ LYS B 209 26.145 3.601 37.349 1.00 54.45 N ATOM 0 H LYS B 209 29.359 -1.794 40.094 1.00 18.87 H new ATOM 0 HA LYS B 209 28.518 0.016 41.953 1.00 22.22 H new ATOM 0 HB2 LYS B 209 28.869 0.726 39.753 1.00 25.82 H new ATOM 0 HB3 LYS B 209 27.785 -0.292 39.284 1.00 25.82 H new ATOM 0 HG2 LYS B 209 26.132 0.931 40.452 1.00 33.83 H new ATOM 0 HG3 LYS B 209 27.216 1.948 40.922 1.00 33.83 H new ATOM 0 HD2 LYS B 209 27.902 2.244 38.646 1.00 41.77 H new ATOM 0 HD3 LYS B 209 26.781 1.260 38.190 1.00 41.77 H new ATOM 0 HE2 LYS B 209 25.134 2.809 38.903 1.00 48.55 H new ATOM 0 HE3 LYS B 209 26.256 3.794 39.353 1.00 48.55 H new ATOM 0 HZ1 LYS B 209 25.587 4.286 37.242 1.00 54.45 H new ATOM 0 HZ2 LYS B 209 26.979 3.871 37.195 1.00 54.45 H new ATOM 0 HZ3 LYS B 209 25.933 2.954 36.776 1.00 54.45 H new ATOM 1678 N LEU B 210 26.614 -1.255 42.673 1.00 28.45 N ATOM 1679 CA LEU B 210 25.401 -1.919 43.069 1.00 31.75 C ATOM 1680 C LEU B 210 24.268 -1.254 42.297 1.00 32.39 C ATOM 1681 O LEU B 210 24.274 -0.072 41.973 1.00 31.54 O ATOM 1682 CB LEU B 210 25.230 -1.751 44.550 1.00 28.59 C ATOM 1683 CG LEU B 210 26.324 -2.489 45.330 1.00 31.74 C ATOM 1684 CD1 LEU B 210 26.655 -1.764 46.636 1.00 32.60 C ATOM 1685 CD2 LEU B 210 25.862 -3.923 45.576 1.00 30.42 C ATOM 0 H LEU B 210 26.938 -0.727 43.269 1.00 28.45 H new ATOM 0 HA LEU B 210 25.414 -2.869 42.876 1.00 31.75 H new ATOM 0 HB2 LEU B 210 25.252 -0.808 44.774 1.00 28.59 H new ATOM 0 HB3 LEU B 210 24.359 -2.086 44.816 1.00 28.59 H new ATOM 0 HG LEU B 210 27.144 -2.505 44.812 1.00 31.74 H new ATOM 0 HD11 LEU B 210 27.348 -2.250 47.109 1.00 32.60 H new ATOM 0 HD12 LEU B 210 26.967 -0.867 46.438 1.00 32.60 H new ATOM 0 HD13 LEU B 210 25.860 -1.715 47.189 1.00 32.60 H new ATOM 0 HD21 LEU B 210 26.545 -4.403 46.069 1.00 30.42 H new ATOM 0 HD22 LEU B 210 25.039 -3.914 46.089 1.00 30.42 H new ATOM 0 HD23 LEU B 210 25.708 -4.364 44.726 1.00 30.42 H new ATOM 1687 N ASP B 211 23.304 -2.032 41.937 1.00 38.40 N ATOM 1688 CA ASP B 211 22.134 -1.616 41.156 1.00 44.80 C ATOM 1689 C ASP B 211 21.290 -0.585 41.865 1.00 41.84 C ATOM 1690 O ASP B 211 20.632 0.230 41.207 1.00 40.71 O ATOM 1691 CB ASP B 211 21.258 -2.834 40.835 1.00 53.28 C ATOM 1692 CG ASP B 211 21.117 -3.837 41.993 1.00 61.01 C ATOM 1693 OD1 ASP B 211 21.738 -3.655 43.049 1.00 64.65 O ATOM 1694 OD2 ASP B 211 20.493 -4.882 41.791 1.00 67.50 O ATOM 0 H ASP B 211 23.289 -2.868 42.140 1.00 38.40 H new ATOM 0 HA ASP B 211 22.475 -1.212 40.343 1.00 44.80 H new ATOM 0 HB2 ASP B 211 20.375 -2.525 40.579 1.00 53.28 H new ATOM 0 HB3 ASP B 211 21.631 -3.294 40.067 1.00 53.28 H new ATOM 1696 N SER B 212 21.265 -0.640 43.196 1.00 39.03 N ATOM 1697 CA SER B 212 20.680 0.457 43.949 1.00 37.93 C ATOM 1698 C SER B 212 21.525 1.748 43.864 1.00 37.53 C ATOM 1699 O SER B 212 21.064 2.832 44.204 1.00 40.69 O ATOM 1700 CB SER B 212 20.543 0.008 45.360 1.00 37.38 C ATOM 1701 OG SER B 212 21.736 -0.666 45.733 1.00 41.49 O ATOM 0 H SER B 212 21.574 -1.288 43.669 1.00 39.03 H new ATOM 0 HA SER B 212 19.815 0.680 43.570 1.00 37.93 H new ATOM 0 HB2 SER B 212 20.388 0.768 45.943 1.00 37.38 H new ATOM 0 HB3 SER B 212 19.779 -0.582 45.454 1.00 37.38 H new ATOM 0 HG SER B 212 21.606 -1.496 45.716 1.00 41.49 H new ATOM 1704 N GLY B 213 22.805 1.679 43.455 1.00 36.26 N ATOM 1705 CA GLY B 213 23.611 2.886 43.255 1.00 34.86 C ATOM 1706 C GLY B 213 25.071 2.855 43.744 1.00 30.76 C ATOM 1707 O GLY B 213 25.980 3.273 43.008 1.00 34.60 O ATOM 0 H GLY B 213 23.218 0.943 43.290 1.00 36.26 H new ATOM 0 HA2 GLY B 213 23.617 3.088 42.306 1.00 34.86 H new ATOM 0 HA3 GLY B 213 23.162 3.623 43.699 1.00 34.86 H new ATOM 1709 N GLY B 214 25.284 2.406 44.985 1.00 25.40 N ATOM 1710 CA GLY B 214 26.592 2.441 45.644 1.00 18.00 C ATOM 1711 C GLY B 214 27.721 1.707 44.937 1.00 16.39 C ATOM 1712 O GLY B 214 27.519 1.012 43.939 1.00 16.75 O ATOM 0 H GLY B 214 24.662 2.068 45.474 1.00 25.40 H new ATOM 0 HA2 GLY B 214 26.853 3.369 45.754 1.00 18.00 H new ATOM 0 HA3 GLY B 214 26.495 2.067 46.534 1.00 18.00 H new ATOM 1714 N PHE B 215 28.915 1.814 45.516 1.00 13.36 N ATOM 1715 CA PHE B 215 30.132 1.285 44.935 1.00 10.50 C ATOM 1716 C PHE B 215 30.908 0.455 45.930 1.00 8.72 C ATOM 1717 O PHE B 215 30.904 0.767 47.112 1.00 10.98 O ATOM 1718 CB PHE B 215 30.997 2.442 44.494 1.00 9.86 C ATOM 1719 CG PHE B 215 30.412 3.184 43.314 1.00 7.36 C ATOM 1720 CD1 PHE B 215 30.659 2.745 42.016 1.00 10.64 C ATOM 1721 CD2 PHE B 215 29.612 4.285 43.538 1.00 8.95 C ATOM 1722 CE1 PHE B 215 30.087 3.393 40.942 1.00 8.76 C ATOM 1723 CE2 PHE B 215 29.040 4.926 42.450 1.00 7.45 C ATOM 1724 CZ PHE B 215 29.280 4.480 41.164 1.00 7.54 C ATOM 0 H PHE B 215 29.036 2.205 46.272 1.00 13.36 H new ATOM 0 HA PHE B 215 29.892 0.718 44.186 1.00 10.50 H new ATOM 0 HB2 PHE B 215 31.111 3.057 45.235 1.00 9.86 H new ATOM 0 HB3 PHE B 215 31.879 2.112 44.260 1.00 9.86 H new ATOM 0 HD1 PHE B 215 31.212 2.011 41.873 1.00 10.64 H new ATOM 0 HD2 PHE B 215 29.459 4.592 44.403 1.00 8.95 H new ATOM 0 HE1 PHE B 215 30.247 3.096 40.075 1.00 8.76 H new ATOM 0 HE2 PHE B 215 28.490 5.663 42.587 1.00 7.45 H new ATOM 0 HZ PHE B 215 28.891 4.920 40.443 1.00 7.54 H new ATOM 1726 N TYR B 216 31.593 -0.606 45.543 1.00 9.57 N ATOM 1727 CA TYR B 216 32.412 -1.320 46.519 1.00 8.75 C ATOM 1728 C TYR B 216 33.632 -1.970 45.852 1.00 10.45 C ATOM 1729 O TYR B 216 33.601 -2.298 44.654 1.00 7.53 O ATOM 1730 CB TYR B 216 31.593 -2.420 47.235 1.00 5.80 C ATOM 1731 CG TYR B 216 31.203 -3.584 46.324 1.00 8.33 C ATOM 1732 CD1 TYR B 216 30.006 -3.522 45.602 1.00 11.00 C ATOM 1733 CD2 TYR B 216 32.033 -4.712 46.226 1.00 6.95 C ATOM 1734 CE1 TYR B 216 29.621 -4.586 44.792 1.00 8.24 C ATOM 1735 CE2 TYR B 216 31.663 -5.770 45.416 1.00 8.11 C ATOM 1736 CZ TYR B 216 30.455 -5.695 44.717 1.00 10.08 C ATOM 1737 OH TYR B 216 30.072 -6.762 43.957 1.00 11.10 O ATOM 0 H TYR B 216 31.603 -0.926 44.745 1.00 9.57 H new ATOM 0 HA TYR B 216 32.712 -0.665 47.168 1.00 8.75 H new ATOM 0 HB2 TYR B 216 32.109 -2.762 47.982 1.00 5.80 H new ATOM 0 HB3 TYR B 216 30.788 -2.024 47.604 1.00 5.80 H new ATOM 0 HD1 TYR B 216 29.466 -2.767 45.664 1.00 11.00 H new ATOM 0 HD2 TYR B 216 32.830 -4.748 46.705 1.00 6.95 H new ATOM 0 HE1 TYR B 216 28.825 -4.556 44.312 1.00 8.24 H new ATOM 0 HE2 TYR B 216 32.209 -6.519 45.338 1.00 8.11 H new ATOM 0 HH TYR B 216 29.597 -6.495 43.318 1.00 11.10 H new ATOM 1740 N ILE B 217 34.664 -2.183 46.674 1.00 8.04 N ATOM 1741 CA ILE B 217 35.819 -2.967 46.292 1.00 6.40 C ATOM 1742 C ILE B 217 35.757 -4.191 47.195 1.00 7.60 C ATOM 1743 O ILE B 217 36.068 -5.258 46.696 1.00 9.71 O ATOM 1744 CB ILE B 217 37.183 -2.223 46.504 1.00 7.43 C ATOM 1745 CG1 ILE B 217 37.283 -1.022 45.569 1.00 5.59 C ATOM 1746 CG2 ILE B 217 38.350 -3.185 46.223 1.00 5.31 C ATOM 1747 CD1 ILE B 217 38.553 -0.159 45.685 1.00 2.00 C ATOM 0 H ILE B 217 34.705 -1.870 47.474 1.00 8.04 H new ATOM 0 HA ILE B 217 35.789 -3.170 45.344 1.00 6.40 H new ATOM 0 HB ILE B 217 37.228 -1.915 47.423 1.00 7.43 H new ATOM 0 HG12 ILE B 217 37.217 -1.343 44.656 1.00 5.59 H new ATOM 0 HG13 ILE B 217 36.514 -0.452 45.725 1.00 5.59 H new ATOM 0 HG21 ILE B 217 39.191 -2.721 46.355 1.00 5.31 H new ATOM 0 HG22 ILE B 217 38.300 -3.941 46.829 1.00 5.31 H new ATOM 0 HG23 ILE B 217 38.296 -3.501 45.307 1.00 5.31 H new ATOM 0 HD11 ILE B 217 38.508 0.571 45.047 1.00 2.00 H new ATOM 0 HD12 ILE B 217 38.619 0.201 46.583 1.00 2.00 H new ATOM 0 HD13 ILE B 217 39.333 -0.704 45.497 1.00 2.00 H new ATOM 1749 N THR B 218 35.442 -4.125 48.513 1.00 8.45 N ATOM 1750 CA THR B 218 35.328 -5.315 49.352 1.00 8.26 C ATOM 1751 C THR B 218 34.030 -5.294 50.145 1.00 13.27 C ATOM 1752 O THR B 218 33.322 -4.293 50.090 1.00 14.87 O ATOM 1753 CB THR B 218 36.504 -5.436 50.338 1.00 11.49 C ATOM 1754 OG1 THR B 218 36.303 -4.518 51.411 1.00 9.06 O ATOM 1755 CG2 THR B 218 37.854 -5.223 49.636 1.00 9.79 C ATOM 0 H THR B 218 35.292 -3.388 48.929 1.00 8.45 H new ATOM 0 HA THR B 218 35.339 -6.079 48.754 1.00 8.26 H new ATOM 0 HB THR B 218 36.531 -6.336 50.699 1.00 11.49 H new ATOM 0 HG1 THR B 218 36.947 -3.979 51.443 1.00 9.06 H new ATOM 0 HG21 THR B 218 38.572 -5.305 50.283 1.00 9.79 H new ATOM 0 HG22 THR B 218 37.967 -5.891 48.942 1.00 9.79 H new ATOM 0 HG23 THR B 218 37.877 -4.338 49.240 1.00 9.79 H new ATOM 1758 N SER B 219 33.704 -6.331 50.922 1.00 13.63 N ATOM 1759 CA SER B 219 32.468 -6.387 51.700 1.00 13.62 C ATOM 1760 C SER B 219 32.510 -5.596 52.999 1.00 14.89 C ATOM 1761 O SER B 219 31.526 -5.464 53.751 1.00 13.04 O ATOM 1762 CB SER B 219 32.182 -7.805 52.016 1.00 11.14 C ATOM 1763 OG SER B 219 33.309 -8.339 52.711 1.00 12.70 O ATOM 0 H SER B 219 34.201 -7.027 51.011 1.00 13.63 H new ATOM 0 HA SER B 219 31.776 -5.980 51.156 1.00 13.62 H new ATOM 0 HB2 SER B 219 31.383 -7.876 52.561 1.00 11.14 H new ATOM 0 HB3 SER B 219 32.016 -8.307 51.203 1.00 11.14 H new ATOM 0 HG SER B 219 33.165 -9.145 52.901 1.00 12.70 H new ATOM 1766 N ARG B 220 33.694 -5.040 53.276 1.00 15.73 N ATOM 1767 CA ARG B 220 33.875 -4.276 54.474 1.00 11.90 C ATOM 1768 C ARG B 220 33.108 -2.948 54.430 1.00 12.28 C ATOM 1769 O ARG B 220 32.394 -2.606 55.375 1.00 12.54 O ATOM 1770 CB ARG B 220 35.368 -4.083 54.635 1.00 16.78 C ATOM 1771 CG ARG B 220 35.742 -3.865 56.074 1.00 14.22 C ATOM 1772 CD ARG B 220 37.197 -3.474 56.138 1.00 22.55 C ATOM 1773 NE ARG B 220 37.580 -3.656 57.522 1.00 27.64 N ATOM 1774 CZ ARG B 220 37.631 -2.688 58.434 1.00 29.92 C ATOM 1775 NH1 ARG B 220 37.359 -1.417 58.115 1.00 31.42 N ATOM 1776 NH2 ARG B 220 37.892 -3.077 59.687 1.00 34.79 N ATOM 0 H ARG B 220 34.391 -5.102 52.776 1.00 15.73 H new ATOM 0 HA ARG B 220 33.510 -4.742 55.243 1.00 11.90 H new ATOM 0 HB2 ARG B 220 35.835 -4.861 54.292 1.00 16.78 H new ATOM 0 HB3 ARG B 220 35.656 -3.323 54.106 1.00 16.78 H new ATOM 0 HG2 ARG B 220 35.189 -3.170 56.464 1.00 14.22 H new ATOM 0 HG3 ARG B 220 35.587 -4.673 56.588 1.00 14.22 H new ATOM 0 HD2 ARG B 220 37.735 -4.028 55.550 1.00 22.55 H new ATOM 0 HD3 ARG B 220 37.325 -2.554 55.857 1.00 22.55 H new ATOM 0 HE ARG B 220 37.791 -4.451 57.774 1.00 27.64 H new ATOM 0 HH11 ARG B 220 37.146 -1.213 57.307 1.00 31.42 H new ATOM 0 HH12 ARG B 220 37.397 -0.805 58.718 1.00 31.42 H new ATOM 0 HH21 ARG B 220 38.015 -3.910 59.862 1.00 34.79 H new ATOM 0 HH22 ARG B 220 37.937 -2.494 60.318 1.00 34.79 H new ATOM 1783 N THR B 221 33.092 -2.225 53.317 1.00 13.11 N ATOM 1784 CA THR B 221 32.546 -0.874 53.260 1.00 12.31 C ATOM 1785 C THR B 221 31.935 -0.721 51.866 1.00 12.90 C ATOM 1786 O THR B 221 32.466 -1.265 50.891 1.00 12.28 O ATOM 1787 CB THR B 221 33.738 0.109 53.484 1.00 15.18 C ATOM 1788 OG1 THR B 221 34.317 -0.091 54.748 1.00 21.91 O ATOM 1789 CG2 THR B 221 33.272 1.473 53.641 1.00 22.07 C ATOM 0 H THR B 221 33.401 -2.507 52.566 1.00 13.11 H new ATOM 0 HA THR B 221 31.868 -0.693 53.929 1.00 12.31 H new ATOM 0 HB THR B 221 34.327 -0.039 52.727 1.00 15.18 H new ATOM 0 HG1 THR B 221 35.094 -0.397 54.655 1.00 21.91 H new ATOM 0 HG21 THR B 221 34.031 2.061 53.778 1.00 22.07 H new ATOM 0 HG22 THR B 221 32.793 1.745 52.843 1.00 22.07 H new ATOM 0 HG23 THR B 221 32.680 1.527 54.407 1.00 22.07 H new ATOM 1792 N GLN B 222 30.886 0.097 51.745 1.00 12.05 N ATOM 1793 CA GLN B 222 30.209 0.395 50.480 1.00 14.43 C ATOM 1794 C GLN B 222 30.064 1.888 50.495 1.00 11.85 C ATOM 1795 O GLN B 222 30.049 2.465 51.571 1.00 5.56 O ATOM 1796 CB GLN B 222 28.818 -0.129 50.394 1.00 26.89 C ATOM 1797 CG GLN B 222 28.865 -1.625 50.410 1.00 46.13 C ATOM 1798 CD GLN B 222 27.543 -2.242 50.762 1.00 57.37 C ATOM 1799 OE1 GLN B 222 27.545 -3.440 51.049 1.00 69.64 O ATOM 1800 NE2 GLN B 222 26.366 -1.577 50.765 1.00 61.07 N ATOM 0 H GLN B 222 30.539 0.506 52.417 1.00 12.05 H new ATOM 0 HA GLN B 222 30.717 0.002 49.752 1.00 14.43 H new ATOM 0 HB2 GLN B 222 28.289 0.198 51.138 1.00 26.89 H new ATOM 0 HB3 GLN B 222 28.390 0.185 49.582 1.00 26.89 H new ATOM 0 HG2 GLN B 222 29.145 -1.945 49.538 1.00 46.13 H new ATOM 0 HG3 GLN B 222 29.534 -1.917 51.048 1.00 46.13 H new ATOM 0 HE21 GLN B 222 26.344 -0.740 50.567 1.00 61.07 H new ATOM 0 HE22 GLN B 222 25.639 -1.991 50.965 1.00 61.07 H new ATOM 1804 N PHE B 223 29.946 2.542 49.359 1.00 8.28 N ATOM 1805 CA PHE B 223 29.994 3.983 49.341 1.00 11.15 C ATOM 1806 C PHE B 223 28.903 4.468 48.442 1.00 11.48 C ATOM 1807 O PHE B 223 28.696 3.882 47.372 1.00 12.37 O ATOM 1808 CB PHE B 223 31.311 4.454 48.769 1.00 5.72 C ATOM 1809 CG PHE B 223 32.451 3.997 49.631 1.00 5.87 C ATOM 1810 CD1 PHE B 223 32.779 4.737 50.759 1.00 4.17 C ATOM 1811 CD2 PHE B 223 33.181 2.849 49.298 1.00 6.67 C ATOM 1812 CE1 PHE B 223 33.834 4.336 51.566 1.00 6.39 C ATOM 1813 CE2 PHE B 223 34.250 2.451 50.121 1.00 6.80 C ATOM 1814 CZ PHE B 223 34.580 3.197 51.246 1.00 7.75 C ATOM 0 H PHE B 223 29.838 2.172 48.590 1.00 8.28 H new ATOM 0 HA PHE B 223 29.893 4.322 50.244 1.00 11.15 H new ATOM 0 HB2 PHE B 223 31.421 4.110 47.869 1.00 5.72 H new ATOM 0 HB3 PHE B 223 31.314 5.422 48.705 1.00 5.72 H new ATOM 0 HD1 PHE B 223 32.292 5.500 50.973 1.00 4.17 H new ATOM 0 HD2 PHE B 223 32.961 2.355 48.541 1.00 6.67 H new ATOM 0 HE1 PHE B 223 34.047 4.828 52.326 1.00 6.39 H new ATOM 0 HE2 PHE B 223 34.737 1.687 49.912 1.00 6.80 H new ATOM 0 HZ PHE B 223 35.294 2.940 51.784 1.00 7.75 H new ATOM 1816 N ASN B 224 28.245 5.567 48.780 1.00 12.42 N ATOM 1817 CA ASN B 224 27.173 6.045 47.935 1.00 11.00 C ATOM 1818 C ASN B 224 27.697 6.750 46.727 1.00 10.43 C ATOM 1819 O ASN B 224 26.919 6.991 45.801 1.00 13.12 O ATOM 1820 CB ASN B 224 26.214 6.975 48.668 1.00 9.24 C ATOM 1821 CG ASN B 224 25.327 6.178 49.584 1.00 8.01 C ATOM 1822 OD1 ASN B 224 25.278 6.458 50.758 1.00 11.97 O ATOM 1823 ND2 ASN B 224 24.603 5.167 49.154 1.00 8.94 N ATOM 0 H ASN B 224 28.401 6.040 49.481 1.00 12.42 H new ATOM 0 HA ASN B 224 26.685 5.252 47.664 1.00 11.00 H new ATOM 0 HB2 ASN B 224 26.714 7.631 49.179 1.00 9.24 H new ATOM 0 HB3 ASN B 224 25.674 7.465 48.028 1.00 9.24 H new ATOM 0 HD21 ASN B 224 24.112 4.725 49.704 1.00 8.94 H new ATOM 0 HD22 ASN B 224 24.621 4.948 48.322 1.00 8.94 H new ATOM 1827 N SER B 225 28.987 7.051 46.651 1.00 8.72 N ATOM 1828 CA SER B 225 29.472 7.628 45.430 1.00 11.42 C ATOM 1829 C SER B 225 30.918 7.282 45.284 1.00 13.03 C ATOM 1830 O SER B 225 31.587 6.973 46.275 1.00 14.22 O ATOM 1831 CB SER B 225 29.351 9.140 45.430 1.00 11.56 C ATOM 1832 OG SER B 225 30.092 9.804 46.445 1.00 13.75 O ATOM 0 H SER B 225 29.570 6.932 47.272 1.00 8.72 H new ATOM 0 HA SER B 225 28.939 7.276 44.700 1.00 11.42 H new ATOM 0 HB2 SER B 225 29.641 9.474 44.567 1.00 11.56 H new ATOM 0 HB3 SER B 225 28.415 9.376 45.526 1.00 11.56 H new ATOM 0 HG SER B 225 29.684 9.742 47.176 1.00 13.75 H new ATOM 1835 N LEU B 226 31.461 7.496 44.084 1.00 14.63 N ATOM 1836 CA LEU B 226 32.862 7.216 43.813 1.00 13.23 C ATOM 1837 C LEU B 226 33.793 8.171 44.505 1.00 13.18 C ATOM 1838 O LEU B 226 34.888 7.794 44.941 1.00 16.64 O ATOM 1839 CB LEU B 226 33.156 7.291 42.343 1.00 16.09 C ATOM 1840 CG LEU B 226 32.998 6.054 41.523 1.00 19.73 C ATOM 1841 CD1 LEU B 226 33.386 6.338 40.114 1.00 19.88 C ATOM 1842 CD2 LEU B 226 33.937 4.982 42.013 1.00 17.90 C ATOM 0 H LEU B 226 31.026 7.806 43.410 1.00 14.63 H new ATOM 0 HA LEU B 226 33.013 6.320 44.152 1.00 13.23 H new ATOM 0 HB2 LEU B 226 32.582 7.974 41.961 1.00 16.09 H new ATOM 0 HB3 LEU B 226 34.070 7.599 42.240 1.00 16.09 H new ATOM 0 HG LEU B 226 32.074 5.766 41.590 1.00 19.73 H new ATOM 0 HD11 LEU B 226 33.283 5.534 39.581 1.00 19.88 H new ATOM 0 HD12 LEU B 226 32.817 7.037 39.756 1.00 19.88 H new ATOM 0 HD13 LEU B 226 34.311 6.628 40.085 1.00 19.88 H new ATOM 0 HD21 LEU B 226 33.826 4.183 41.474 1.00 17.90 H new ATOM 0 HD22 LEU B 226 34.852 5.296 41.941 1.00 17.90 H new ATOM 0 HD23 LEU B 226 33.738 4.776 42.940 1.00 17.90 H new ATOM 1844 N GLN B 227 33.396 9.420 44.640 1.00 12.61 N ATOM 1845 CA GLN B 227 34.240 10.356 45.342 1.00 15.09 C ATOM 1846 C GLN B 227 34.318 9.983 46.834 1.00 13.25 C ATOM 1847 O GLN B 227 35.366 10.204 47.472 1.00 10.86 O ATOM 1848 CB GLN B 227 33.658 11.743 45.082 1.00 18.15 C ATOM 1849 CG GLN B 227 34.464 12.927 45.632 1.00 27.15 C ATOM 1850 CD GLN B 227 34.135 13.230 47.092 1.00 30.89 C ATOM 1851 OE1 GLN B 227 32.984 13.096 47.521 1.00 34.78 O ATOM 1852 NE2 GLN B 227 35.095 13.683 47.894 1.00 32.78 N ATOM 0 H GLN B 227 32.657 9.740 44.339 1.00 12.61 H new ATOM 0 HA GLN B 227 35.158 10.338 45.029 1.00 15.09 H new ATOM 0 HB2 GLN B 227 33.561 11.859 44.124 1.00 18.15 H new ATOM 0 HB3 GLN B 227 32.767 11.777 45.464 1.00 18.15 H new ATOM 0 HG2 GLN B 227 35.411 12.736 45.550 1.00 27.15 H new ATOM 0 HG3 GLN B 227 34.286 13.714 45.093 1.00 27.15 H new ATOM 0 HE21 GLN B 227 35.896 13.776 47.596 1.00 32.78 H new ATOM 0 HE22 GLN B 227 34.914 13.882 48.711 1.00 32.78 H new ATOM 1856 N GLN B 228 33.248 9.368 47.394 1.00 10.74 N ATOM 1857 CA GLN B 228 33.313 8.906 48.765 1.00 7.93 C ATOM 1858 C GLN B 228 34.266 7.749 48.912 1.00 8.10 C ATOM 1859 O GLN B 228 34.987 7.640 49.913 1.00 5.82 O ATOM 1860 CB GLN B 228 31.957 8.487 49.227 1.00 11.49 C ATOM 1861 CG GLN B 228 31.128 9.719 49.510 1.00 11.08 C ATOM 1862 CD GLN B 228 29.672 9.405 49.736 1.00 10.24 C ATOM 1863 OE1 GLN B 228 28.846 9.601 48.862 1.00 12.44 O ATOM 1864 NE2 GLN B 228 29.281 8.855 50.862 1.00 8.92 N ATOM 0 H GLN B 228 32.502 9.220 46.993 1.00 10.74 H new ATOM 0 HA GLN B 228 33.636 9.641 49.309 1.00 7.93 H new ATOM 0 HB2 GLN B 228 31.526 7.942 48.550 1.00 11.49 H new ATOM 0 HB3 GLN B 228 32.029 7.942 50.026 1.00 11.49 H new ATOM 0 HG2 GLN B 228 31.483 10.169 50.293 1.00 11.08 H new ATOM 0 HG3 GLN B 228 31.210 10.336 48.766 1.00 11.08 H new ATOM 0 HE21 GLN B 228 29.850 8.709 51.490 1.00 8.92 H new ATOM 0 HE22 GLN B 228 28.455 8.640 50.972 1.00 8.92 H new ATOM 1868 N LEU B 229 34.306 6.868 47.901 1.00 8.45 N ATOM 1869 CA LEU B 229 35.263 5.775 47.910 1.00 10.28 C ATOM 1870 C LEU B 229 36.696 6.316 47.841 1.00 12.66 C ATOM 1871 O LEU B 229 37.542 5.956 48.674 1.00 12.37 O ATOM 1872 CB LEU B 229 34.966 4.832 46.719 1.00 9.87 C ATOM 1873 CG LEU B 229 35.701 3.474 46.553 1.00 12.10 C ATOM 1874 CD1 LEU B 229 34.771 2.480 45.847 1.00 3.74 C ATOM 1875 CD2 LEU B 229 37.003 3.660 45.729 1.00 9.16 C ATOM 0 H LEU B 229 33.791 6.892 47.213 1.00 8.45 H new ATOM 0 HA LEU B 229 35.178 5.275 48.737 1.00 10.28 H new ATOM 0 HB2 LEU B 229 34.016 4.637 46.745 1.00 9.87 H new ATOM 0 HB3 LEU B 229 35.129 5.341 45.910 1.00 9.87 H new ATOM 0 HG LEU B 229 35.939 3.131 47.429 1.00 12.10 H new ATOM 0 HD11 LEU B 229 35.226 1.630 45.741 1.00 3.74 H new ATOM 0 HD12 LEU B 229 33.969 2.353 46.378 1.00 3.74 H new ATOM 0 HD13 LEU B 229 34.528 2.827 44.974 1.00 3.74 H new ATOM 0 HD21 LEU B 229 37.451 2.805 45.634 1.00 9.16 H new ATOM 0 HD22 LEU B 229 36.783 4.009 44.851 1.00 9.16 H new ATOM 0 HD23 LEU B 229 37.590 4.282 46.187 1.00 9.16 H new ATOM 1877 N VAL B 230 37.001 7.202 46.875 1.00 9.98 N ATOM 1878 CA VAL B 230 38.323 7.777 46.793 1.00 10.82 C ATOM 1879 C VAL B 230 38.710 8.464 48.098 1.00 11.04 C ATOM 1880 O VAL B 230 39.777 8.207 48.670 1.00 12.16 O ATOM 1881 CB VAL B 230 38.338 8.739 45.617 1.00 9.33 C ATOM 1882 CG1 VAL B 230 39.628 9.463 45.559 1.00 11.94 C ATOM 1883 CG2 VAL B 230 38.254 7.967 44.339 1.00 6.94 C ATOM 0 H VAL B 230 36.452 7.471 46.271 1.00 9.98 H new ATOM 0 HA VAL B 230 38.984 7.082 46.652 1.00 10.82 H new ATOM 0 HB VAL B 230 37.593 9.350 45.728 1.00 9.33 H new ATOM 0 HG11 VAL B 230 39.623 10.073 44.805 1.00 11.94 H new ATOM 0 HG12 VAL B 230 39.755 9.965 46.379 1.00 11.94 H new ATOM 0 HG13 VAL B 230 40.352 8.826 45.455 1.00 11.94 H new ATOM 0 HG21 VAL B 230 38.264 8.581 43.588 1.00 6.94 H new ATOM 0 HG22 VAL B 230 39.012 7.365 44.274 1.00 6.94 H new ATOM 0 HG23 VAL B 230 37.432 7.453 44.325 1.00 6.94 H new ATOM 1885 N ALA B 231 37.814 9.289 48.646 1.00 14.16 N ATOM 1886 CA ALA B 231 38.066 9.982 49.910 1.00 12.89 C ATOM 1887 C ALA B 231 38.346 9.029 51.081 1.00 13.70 C ATOM 1888 O ALA B 231 39.261 9.243 51.887 1.00 16.27 O ATOM 1889 CB ALA B 231 36.856 10.843 50.243 1.00 10.72 C ATOM 0 H ALA B 231 37.047 9.461 48.297 1.00 14.16 H new ATOM 0 HA ALA B 231 38.864 10.520 49.790 1.00 12.89 H new ATOM 0 HB1 ALA B 231 37.010 11.308 51.080 1.00 10.72 H new ATOM 0 HB2 ALA B 231 36.715 11.490 49.535 1.00 10.72 H new ATOM 0 HB3 ALA B 231 36.071 10.280 50.327 1.00 10.72 H new ATOM 1891 N TYR B 232 37.615 7.926 51.182 1.00 10.12 N ATOM 1892 CA TYR B 232 37.811 6.982 52.251 1.00 6.73 C ATOM 1893 C TYR B 232 39.171 6.319 52.103 1.00 5.13 C ATOM 1894 O TYR B 232 39.938 6.210 53.060 1.00 6.63 O ATOM 1895 CB TYR B 232 36.697 5.956 52.160 1.00 7.66 C ATOM 1896 CG TYR B 232 36.758 4.954 53.282 1.00 8.48 C ATOM 1897 CD1 TYR B 232 36.258 5.308 54.553 1.00 11.95 C ATOM 1898 CD2 TYR B 232 37.382 3.710 53.074 1.00 7.11 C ATOM 1899 CE1 TYR B 232 36.381 4.403 55.626 1.00 11.17 C ATOM 1900 CE2 TYR B 232 37.528 2.806 54.143 1.00 6.38 C ATOM 1901 CZ TYR B 232 37.022 3.173 55.408 1.00 10.06 C ATOM 1902 OH TYR B 232 37.211 2.358 56.478 1.00 12.25 O ATOM 0 H TYR B 232 36.993 7.711 50.628 1.00 10.12 H new ATOM 0 HA TYR B 232 37.788 7.421 53.116 1.00 6.73 H new ATOM 0 HB2 TYR B 232 35.839 6.409 52.178 1.00 7.66 H new ATOM 0 HB3 TYR B 232 36.755 5.492 51.310 1.00 7.66 H new ATOM 0 HD1 TYR B 232 35.850 6.134 54.682 1.00 11.95 H new ATOM 0 HD2 TYR B 232 37.698 3.485 52.229 1.00 7.11 H new ATOM 0 HE1 TYR B 232 36.043 4.617 56.465 1.00 11.17 H new ATOM 0 HE2 TYR B 232 37.948 1.986 54.018 1.00 6.38 H new ATOM 0 HH TYR B 232 37.674 1.696 56.248 1.00 12.25 H new ATOM 1905 N TYR B 233 39.539 5.866 50.918 1.00 5.44 N ATOM 1906 CA TYR B 233 40.787 5.098 50.811 1.00 8.30 C ATOM 1907 C TYR B 233 42.038 5.932 50.805 1.00 9.13 C ATOM 1908 O TYR B 233 43.139 5.401 50.824 1.00 6.83 O ATOM 1909 CB TYR B 233 40.787 4.211 49.572 1.00 3.78 C ATOM 1910 CG TYR B 233 39.872 3.018 49.776 1.00 8.59 C ATOM 1911 CD1 TYR B 233 40.252 1.971 50.616 1.00 4.81 C ATOM 1912 CD2 TYR B 233 38.661 2.944 49.099 1.00 8.14 C ATOM 1913 CE1 TYR B 233 39.433 0.859 50.770 1.00 8.26 C ATOM 1914 CE2 TYR B 233 37.837 1.823 49.252 1.00 6.78 C ATOM 1915 CZ TYR B 233 38.234 0.791 50.083 1.00 9.66 C ATOM 1916 OH TYR B 233 37.440 -0.341 50.195 1.00 10.40 O ATOM 0 H TYR B 233 39.106 5.981 50.184 1.00 5.44 H new ATOM 0 HA TYR B 233 40.806 4.561 51.618 1.00 8.30 H new ATOM 0 HB2 TYR B 233 40.495 4.722 48.801 1.00 3.78 H new ATOM 0 HB3 TYR B 233 41.689 3.906 49.385 1.00 3.78 H new ATOM 0 HD1 TYR B 233 41.059 2.018 51.076 1.00 4.81 H new ATOM 0 HD2 TYR B 233 38.397 3.641 48.543 1.00 8.14 H new ATOM 0 HE1 TYR B 233 39.690 0.164 51.332 1.00 8.26 H new ATOM 0 HE2 TYR B 233 37.027 1.772 48.798 1.00 6.78 H new ATOM 0 HH TYR B 233 37.768 -0.857 50.771 1.00 10.40 H new ATOM 1919 N SER B 234 41.859 7.245 50.747 1.00 9.76 N ATOM 1920 CA SER B 234 42.930 8.174 50.944 1.00 11.29 C ATOM 1921 C SER B 234 43.250 8.186 52.427 1.00 12.82 C ATOM 1922 O SER B 234 44.392 8.444 52.802 1.00 15.48 O ATOM 1923 CB SER B 234 42.495 9.556 50.513 1.00 12.43 C ATOM 1924 OG SER B 234 42.240 9.553 49.121 1.00 21.03 O ATOM 0 H SER B 234 41.099 7.615 50.590 1.00 9.76 H new ATOM 0 HA SER B 234 43.706 7.917 50.422 1.00 11.29 H new ATOM 0 HB2 SER B 234 41.698 9.821 50.998 1.00 12.43 H new ATOM 0 HB3 SER B 234 43.185 10.204 50.725 1.00 12.43 H new ATOM 0 HG SER B 234 41.515 9.157 48.970 1.00 21.03 H new ATOM 1927 N LYS B 235 42.290 7.968 53.331 1.00 12.50 N ATOM 1928 CA LYS B 235 42.608 7.920 54.737 1.00 12.45 C ATOM 1929 C LYS B 235 42.763 6.474 55.196 1.00 15.53 C ATOM 1930 O LYS B 235 43.515 6.214 56.128 1.00 22.22 O ATOM 1931 CB LYS B 235 41.512 8.624 55.570 1.00 10.79 C ATOM 0 H LYS B 235 41.460 7.848 53.142 1.00 12.50 H new ATOM 0 HA LYS B 235 43.448 8.386 54.874 1.00 12.45 H new ATOM 1933 N HIS B 236 42.185 5.435 54.601 1.00 18.30 N ATOM 1934 CA HIS B 236 42.326 4.064 55.138 1.00 14.19 C ATOM 1935 C HIS B 236 42.542 3.096 54.019 1.00 15.00 C ATOM 1936 O HIS B 236 41.641 2.903 53.207 1.00 16.28 O ATOM 1937 CB HIS B 236 41.098 3.559 55.816 1.00 14.92 C ATOM 1938 CG HIS B 236 40.623 4.519 56.841 1.00 15.39 C ATOM 1939 ND1 HIS B 236 41.142 4.770 58.044 1.00 19.75 N ATOM 1940 CD2 HIS B 236 39.565 5.341 56.636 1.00 17.03 C ATOM 1941 CE1 HIS B 236 40.425 5.729 58.578 1.00 19.44 C ATOM 1942 NE2 HIS B 236 39.477 6.061 57.719 1.00 21.38 N ATOM 0 H HIS B 236 41.707 5.492 53.888 1.00 18.30 H new ATOM 0 HA HIS B 236 43.065 4.120 55.764 1.00 14.19 H new ATOM 0 HB2 HIS B 236 40.400 3.411 55.159 1.00 14.92 H new ATOM 0 HB3 HIS B 236 41.283 2.702 56.232 1.00 14.92 H new ATOM 0 HD2 HIS B 236 39.019 5.382 55.884 1.00 17.03 H new ATOM 0 HE1 HIS B 236 40.560 6.110 59.416 1.00 19.44 H new ATOM 0 HE2 HIS B 236 38.884 6.668 57.856 1.00 21.38 H new ATOM 1946 N ALA B 237 43.708 2.453 53.978 1.00 15.07 N ATOM 1947 CA ALA B 237 43.991 1.467 52.952 1.00 14.98 C ATOM 1948 C ALA B 237 43.055 0.259 53.003 1.00 14.29 C ATOM 1949 O ALA B 237 42.657 -0.203 51.942 1.00 16.34 O ATOM 1950 CB ALA B 237 45.404 0.955 53.076 1.00 14.62 C ATOM 0 H ALA B 237 44.347 2.578 54.540 1.00 15.07 H new ATOM 0 HA ALA B 237 43.858 1.928 52.109 1.00 14.98 H new ATOM 0 HB1 ALA B 237 45.572 0.298 52.382 1.00 14.62 H new ATOM 0 HB2 ALA B 237 46.026 1.693 52.979 1.00 14.62 H new ATOM 0 HB3 ALA B 237 45.524 0.544 53.946 1.00 14.62 H new ATOM 1952 N ASP B 238 42.692 -0.278 54.191 1.00 12.65 N ATOM 1953 CA ASP B 238 41.783 -1.415 54.361 1.00 11.66 C ATOM 1954 C ASP B 238 41.872 -2.516 53.339 1.00 10.92 C ATOM 1955 O ASP B 238 40.865 -2.913 52.738 1.00 12.52 O ATOM 1956 CB ASP B 238 40.316 -0.941 54.417 1.00 11.24 C ATOM 1957 CG ASP B 238 39.933 -0.202 55.692 1.00 11.68 C ATOM 1958 OD1 ASP B 238 40.758 0.002 56.564 1.00 17.18 O ATOM 1959 OD2 ASP B 238 38.768 0.117 55.860 1.00 16.97 O ATOM 0 H ASP B 238 42.984 0.028 54.940 1.00 12.65 H new ATOM 0 HA ASP B 238 42.083 -1.803 55.198 1.00 11.66 H new ATOM 0 HB2 ASP B 238 40.148 -0.360 53.658 1.00 11.24 H new ATOM 0 HB3 ASP B 238 39.736 -1.712 54.318 1.00 11.24 H new ATOM 1961 N GLY B 239 43.094 -3.017 53.138 1.00 10.57 N ATOM 1962 CA GLY B 239 43.309 -4.147 52.263 1.00 8.14 C ATOM 1963 C GLY B 239 43.956 -3.777 50.952 1.00 12.43 C ATOM 1964 O GLY B 239 44.461 -4.649 50.229 1.00 16.20 O ATOM 0 H GLY B 239 43.808 -2.708 53.505 1.00 10.57 H new ATOM 0 HA2 GLY B 239 43.866 -4.798 52.718 1.00 8.14 H new ATOM 0 HA3 GLY B 239 42.458 -4.576 52.086 1.00 8.14 H new ATOM 1966 N LEU B 240 43.859 -2.513 50.540 1.00 12.95 N ATOM 1967 CA LEU B 240 44.603 -2.072 49.378 1.00 13.35 C ATOM 1968 C LEU B 240 46.088 -2.120 49.741 1.00 10.54 C ATOM 1969 O LEU B 240 46.454 -2.019 50.912 1.00 12.09 O ATOM 1970 CB LEU B 240 44.258 -0.634 49.003 1.00 12.60 C ATOM 1971 CG LEU B 240 42.815 -0.245 48.821 1.00 13.78 C ATOM 1972 CD1 LEU B 240 42.820 1.070 48.116 1.00 11.54 C ATOM 1973 CD2 LEU B 240 42.038 -1.208 47.960 1.00 13.13 C ATOM 0 H LEU B 240 43.375 -1.910 50.916 1.00 12.95 H new ATOM 0 HA LEU B 240 44.384 -2.646 48.627 1.00 13.35 H new ATOM 0 HB2 LEU B 240 44.631 -0.057 49.687 1.00 12.60 H new ATOM 0 HB3 LEU B 240 44.721 -0.429 48.176 1.00 12.60 H new ATOM 0 HG LEU B 240 42.393 -0.230 49.694 1.00 13.78 H new ATOM 0 HD11 LEU B 240 41.907 1.365 47.975 1.00 11.54 H new ATOM 0 HD12 LEU B 240 43.291 1.725 48.655 1.00 11.54 H new ATOM 0 HD13 LEU B 240 43.265 0.976 47.259 1.00 11.54 H new ATOM 0 HD21 LEU B 240 41.120 -0.904 47.881 1.00 13.13 H new ATOM 0 HD22 LEU B 240 42.441 -1.252 47.079 1.00 13.13 H new ATOM 0 HD23 LEU B 240 42.052 -2.089 48.365 1.00 13.13 H new ATOM 1975 N CYS B 241 46.935 -2.198 48.734 1.00 12.57 N ATOM 1976 CA CYS B 241 48.384 -2.173 48.878 1.00 11.98 C ATOM 1977 C CYS B 241 48.877 -0.940 49.564 1.00 12.44 C ATOM 1978 O CYS B 241 49.930 -0.983 50.179 1.00 18.26 O ATOM 1979 CB CYS B 241 49.118 -2.223 47.525 1.00 8.76 C ATOM 1980 SG CYS B 241 48.711 -0.893 46.362 1.00 14.86 S ATOM 0 H CYS B 241 46.678 -2.270 47.917 1.00 12.57 H new ATOM 0 HA CYS B 241 48.576 -2.963 49.406 1.00 11.98 H new ATOM 0 HB2 CYS B 241 50.073 -2.203 47.693 1.00 8.76 H new ATOM 0 HB3 CYS B 241 48.922 -3.073 47.100 1.00 8.76 H new ATOM 0 HG CYS B 241 49.651 -0.155 46.252 1.00 14.86 H new ATOM 1982 N HIS B 242 48.228 0.205 49.463 1.00 14.42 N ATOM 1983 CA HIS B 242 48.710 1.436 50.084 1.00 14.80 C ATOM 1984 C HIS B 242 47.532 2.397 50.089 1.00 15.41 C ATOM 1985 O HIS B 242 46.674 2.293 49.230 1.00 14.01 O ATOM 1986 CB HIS B 242 49.860 2.024 49.236 1.00 17.00 C ATOM 1987 CG HIS B 242 50.681 3.128 49.917 1.00 19.53 C ATOM 1988 ND1 HIS B 242 50.269 4.418 50.109 1.00 21.90 N flip ATOM 1989 CD2 HIS B 242 51.877 3.032 50.490 1.00 17.79 C flip ATOM 1990 CE1 HIS B 242 51.202 5.014 50.797 1.00 18.04 C flip ATOM 1991 NE2 HIS B 242 52.189 4.196 51.022 1.00 19.94 N flip ATOM 0 H HIS B 242 47.490 0.296 49.031 1.00 14.42 H new ATOM 0 HA HIS B 242 49.043 1.279 50.981 1.00 14.80 H new ATOM 0 HB2 HIS B 242 50.459 1.303 48.987 1.00 17.00 H new ATOM 0 HB3 HIS B 242 49.487 2.379 48.414 1.00 17.00 H new ATOM 0 HD1 HIS B 242 49.535 4.769 49.829 1.00 21.90 H new ATOM 0 HD2 HIS B 242 52.407 2.268 50.512 1.00 17.79 H new ATOM 0 HE1 HIS B 242 51.167 5.897 51.086 1.00 18.04 H new ATOM 1995 N ARG B 243 47.403 3.286 51.073 1.00 15.65 N ATOM 1996 CA ARG B 243 46.451 4.386 51.029 1.00 18.24 C ATOM 1997 C ARG B 243 46.687 5.171 49.758 1.00 16.53 C ATOM 1998 O ARG B 243 47.822 5.216 49.277 1.00 14.78 O ATOM 1999 CB ARG B 243 46.678 5.348 52.135 1.00 23.25 C ATOM 2000 CG ARG B 243 46.529 4.728 53.470 1.00 38.49 C ATOM 2001 CD ARG B 243 47.418 5.443 54.467 1.00 51.53 C ATOM 2002 NE ARG B 243 46.932 6.793 54.712 1.00 62.73 N ATOM 2003 CZ ARG B 243 47.556 7.893 54.257 1.00 68.77 C ATOM 2004 NH1 ARG B 243 48.713 7.815 53.570 1.00 69.04 N ATOM 2005 NH2 ARG B 243 46.957 9.072 54.461 1.00 74.09 N ATOM 0 H ARG B 243 47.873 3.264 51.793 1.00 15.65 H new ATOM 0 HA ARG B 243 45.561 4.005 51.089 1.00 18.24 H new ATOM 0 HB2 ARG B 243 47.569 5.723 52.054 1.00 23.25 H new ATOM 0 HB3 ARG B 243 46.051 6.084 52.052 1.00 23.25 H new ATOM 0 HG2 ARG B 243 45.604 4.775 53.757 1.00 38.49 H new ATOM 0 HG3 ARG B 243 46.766 3.788 53.428 1.00 38.49 H new ATOM 0 HD2 ARG B 243 47.442 4.947 55.300 1.00 51.53 H new ATOM 0 HD3 ARG B 243 48.327 5.477 54.131 1.00 51.53 H new ATOM 0 HE ARG B 243 46.211 6.892 55.170 1.00 62.73 H new ATOM 0 HH11 ARG B 243 49.069 7.048 53.413 1.00 69.04 H new ATOM 0 HH12 ARG B 243 49.095 8.532 53.288 1.00 69.04 H new ATOM 0 HH21 ARG B 243 46.201 9.105 54.870 1.00 74.09 H new ATOM 0 HH22 ARG B 243 47.328 9.796 54.183 1.00 74.09 H new ATOM 2012 N LEU B 244 45.668 5.841 49.248 1.00 12.90 N ATOM 2013 CA LEU B 244 45.797 6.649 48.057 1.00 14.75 C ATOM 2014 C LEU B 244 46.494 7.973 48.439 1.00 16.47 C ATOM 2015 O LEU B 244 46.128 8.604 49.437 1.00 19.39 O ATOM 2016 CB LEU B 244 44.416 6.864 47.520 1.00 6.92 C ATOM 2017 CG LEU B 244 43.578 5.617 47.240 1.00 9.46 C ATOM 2018 CD1 LEU B 244 42.246 6.050 46.672 1.00 8.39 C ATOM 2019 CD2 LEU B 244 44.260 4.699 46.234 1.00 8.88 C ATOM 0 H LEU B 244 44.878 5.838 49.587 1.00 12.90 H new ATOM 0 HA LEU B 244 46.336 6.224 47.371 1.00 14.75 H new ATOM 0 HB2 LEU B 244 43.930 7.418 48.151 1.00 6.92 H new ATOM 0 HB3 LEU B 244 44.489 7.370 46.695 1.00 6.92 H new ATOM 0 HG LEU B 244 43.466 5.130 48.071 1.00 9.46 H new ATOM 0 HD11 LEU B 244 41.702 5.268 46.489 1.00 8.39 H new ATOM 0 HD12 LEU B 244 41.790 6.618 47.313 1.00 8.39 H new ATOM 0 HD13 LEU B 244 42.390 6.543 45.849 1.00 8.39 H new ATOM 0 HD21 LEU B 244 43.704 3.919 46.079 1.00 8.88 H new ATOM 0 HD22 LEU B 244 44.391 5.174 45.399 1.00 8.88 H new ATOM 0 HD23 LEU B 244 45.120 4.418 46.583 1.00 8.88 H new ATOM 2021 N THR B 245 47.594 8.353 47.772 1.00 18.22 N ATOM 2022 CA THR B 245 48.321 9.553 48.155 1.00 18.00 C ATOM 2023 C THR B 245 48.184 10.594 47.063 1.00 21.79 C ATOM 2024 O THR B 245 47.495 11.572 47.283 1.00 27.64 O ATOM 2025 CB THR B 245 49.829 9.202 48.453 1.00 13.40 C ATOM 2026 OG1 THR B 245 50.419 8.560 47.338 1.00 16.28 O ATOM 2027 CG2 THR B 245 49.929 8.212 49.562 1.00 11.47 C ATOM 0 H THR B 245 47.926 7.928 47.102 1.00 18.22 H new ATOM 0 HA THR B 245 47.946 9.922 48.970 1.00 18.00 H new ATOM 0 HB THR B 245 50.270 10.038 48.670 1.00 13.40 H new ATOM 0 HG1 THR B 245 50.871 7.902 47.600 1.00 16.28 H new ATOM 0 HG21 THR B 245 50.862 8.008 49.731 1.00 11.47 H new ATOM 0 HG22 THR B 245 49.529 8.583 50.364 1.00 11.47 H new ATOM 0 HG23 THR B 245 49.461 7.399 49.314 1.00 11.47 H new ATOM 2030 N THR B 246 48.702 10.463 45.850 1.00 21.72 N ATOM 2031 CA THR B 246 48.657 11.561 44.876 1.00 21.36 C ATOM 2032 C THR B 246 47.803 11.137 43.678 1.00 14.02 C ATOM 2033 O THR B 246 47.776 9.956 43.328 1.00 10.46 O ATOM 2034 CB THR B 246 50.140 11.912 44.391 1.00 25.61 C ATOM 2035 OG1 THR B 246 50.914 12.082 45.542 1.00 35.16 O ATOM 2036 CG2 THR B 246 50.298 13.237 43.665 1.00 33.38 C ATOM 0 H THR B 246 49.086 9.748 45.565 1.00 21.72 H new ATOM 0 HA THR B 246 48.266 12.347 45.288 1.00 21.36 H new ATOM 0 HB THR B 246 50.390 11.194 43.789 1.00 25.61 H new ATOM 0 HG1 THR B 246 51.704 12.267 45.324 1.00 35.16 H new ATOM 0 HG21 THR B 246 51.227 13.359 43.412 1.00 33.38 H new ATOM 0 HG22 THR B 246 49.744 13.238 42.869 1.00 33.38 H new ATOM 0 HG23 THR B 246 50.024 13.961 44.250 1.00 33.38 H new ATOM 2039 N VAL B 247 47.077 12.052 43.044 1.00 12.44 N ATOM 2040 CA VAL B 247 46.406 11.720 41.797 1.00 11.10 C ATOM 2041 C VAL B 247 47.511 11.647 40.755 1.00 11.94 C ATOM 2042 O VAL B 247 48.501 12.385 40.825 1.00 14.80 O ATOM 2043 CB VAL B 247 45.403 12.810 41.421 1.00 9.29 C ATOM 2044 CG1 VAL B 247 44.738 12.528 40.071 1.00 6.06 C ATOM 2045 CG2 VAL B 247 44.361 12.875 42.547 1.00 10.49 C ATOM 0 H VAL B 247 46.962 12.860 43.316 1.00 12.44 H new ATOM 0 HA VAL B 247 45.911 10.889 41.866 1.00 11.10 H new ATOM 0 HB VAL B 247 45.858 13.661 41.324 1.00 9.29 H new ATOM 0 HG11 VAL B 247 44.110 13.238 39.865 1.00 6.06 H new ATOM 0 HG12 VAL B 247 45.416 12.486 39.379 1.00 6.06 H new ATOM 0 HG13 VAL B 247 44.266 11.681 40.113 1.00 6.06 H new ATOM 0 HG21 VAL B 247 43.705 13.559 42.342 1.00 10.49 H new ATOM 0 HG22 VAL B 247 43.917 12.016 42.628 1.00 10.49 H new ATOM 0 HG23 VAL B 247 44.802 13.091 43.384 1.00 10.49 H new ATOM 2047 N CYS B 248 47.367 10.728 39.809 1.00 13.59 N ATOM 2048 CA CYS B 248 48.266 10.594 38.679 1.00 13.18 C ATOM 2049 C CYS B 248 48.448 11.989 38.068 1.00 14.31 C ATOM 2050 O CYS B 248 47.468 12.703 37.852 1.00 12.94 O ATOM 2051 CB CYS B 248 47.648 9.660 37.649 1.00 9.16 C ATOM 2052 SG CYS B 248 48.845 9.279 36.361 1.00 15.22 S ATOM 0 H CYS B 248 46.728 10.153 39.809 1.00 13.59 H new ATOM 0 HA CYS B 248 49.120 10.229 38.958 1.00 13.18 H new ATOM 0 HB2 CYS B 248 47.354 8.842 38.079 1.00 9.16 H new ATOM 0 HB3 CYS B 248 46.862 10.073 37.258 1.00 9.16 H new ATOM 0 HG CYS B 248 48.515 8.275 35.792 1.00 15.22 H new ATOM 2054 N PRO B 249 49.689 12.452 37.940 1.00 16.15 N ATOM 2055 CA PRO B 249 50.011 13.753 37.373 1.00 16.05 C ATOM 2056 C PRO B 249 49.528 13.980 35.921 1.00 18.74 C ATOM 2057 O PRO B 249 49.443 13.016 35.160 1.00 15.55 O ATOM 2058 CB PRO B 249 51.526 13.831 37.531 1.00 17.76 C ATOM 2059 CG PRO B 249 52.035 12.420 37.727 1.00 17.22 C ATOM 2060 CD PRO B 249 50.880 11.698 38.372 1.00 14.57 C ATOM 2061 OXT PRO B 249 49.195 15.120 35.573 1.00 18.39 O ATOM 0 HA PRO B 249 49.539 14.467 37.830 1.00 16.05 H new ATOM 0 HB2 PRO B 249 51.931 14.234 36.747 1.00 17.76 H new ATOM 0 HB3 PRO B 249 51.762 14.387 38.290 1.00 17.76 H new ATOM 0 HG2 PRO B 249 52.281 12.011 36.882 1.00 17.22 H new ATOM 0 HG3 PRO B 249 52.824 12.403 38.291 1.00 17.22 H new ATOM 0 HD2 PRO B 249 50.836 10.773 38.084 1.00 14.57 H new ATOM 0 HD3 PRO B 249 50.963 11.691 39.338 1.00 14.57 H new TER 2062 PRO B 249 HETATM 2063 C ACE D 100 44.236 -8.199 37.673 1.00 25.97 C HETATM 2064 O ACE D 100 44.890 -7.168 37.791 1.00 27.05 O HETATM 2065 CH3 ACE D 100 44.558 -9.195 36.567 1.00 26.12 C HETATM 0 H1 ACE D 100 44.790 -10.051 36.960 1.00 26.12 H new HETATM 0 H2 ACE D 100 43.784 -9.302 35.992 1.00 26.12 H new HETATM 0 H3 ACE D 100 45.306 -8.867 36.043 1.00 26.12 H new HETATM 2066 N PTR D 101 43.107 -8.404 38.333 1.00 23.22 N HETATM 2067 CA PTR D 101 42.642 -7.561 39.403 1.00 21.35 C HETATM 2068 C PTR D 101 42.986 -8.193 40.725 1.00 19.90 C HETATM 2069 O PTR D 101 43.038 -9.431 40.838 1.00 22.16 O HETATM 2070 CB PTR D 101 41.128 -7.386 39.267 1.00 16.62 C HETATM 2071 CG PTR D 101 40.802 -6.529 38.058 1.00 15.87 C HETATM 2072 CD1 PTR D 101 40.283 -7.119 36.933 1.00 21.00 C HETATM 2073 CD2 PTR D 101 41.025 -5.169 38.071 1.00 18.64 C HETATM 2074 CE1 PTR D 101 39.977 -6.357 35.825 1.00 21.64 C HETATM 2075 CE2 PTR D 101 40.729 -4.389 36.968 1.00 19.98 C HETATM 2076 CZ PTR D 101 40.188 -4.988 35.839 1.00 23.90 C HETATM 2077 OH PTR D 101 39.700 -4.185 34.738 1.00 24.03 O HETATM 2078 P PTR D 101 40.563 -3.972 33.406 1.00 26.13 P HETATM 2079 O1P PTR D 101 40.400 -5.252 32.707 1.00 29.05 O HETATM 2080 O2P PTR D 101 39.876 -2.804 32.815 1.00 29.04 O HETATM 2081 O3P PTR D 101 41.929 -3.698 33.955 1.00 34.48 O HETATM 0 HE2 PTR D 101 40.898 -3.434 36.983 1.00 19.98 H new HETATM 0 HE1 PTR D 101 39.613 -6.781 35.033 1.00 21.64 H new HETATM 0 HD2 PTR D 101 41.395 -4.753 38.865 1.00 18.64 H new HETATM 0 HD1 PTR D 101 40.131 -8.077 36.917 1.00 21.00 H new HETATM 0 HB3 PTR D 101 40.703 -8.253 39.180 1.00 16.62 H new HETATM 0 HB2 PTR D 101 40.771 -6.974 40.069 1.00 16.62 H new HETATM 0 HA PTR D 101 43.069 -6.691 39.358 1.00 21.35 H new ATOM 2083 N GLU D 102 43.201 -7.359 41.722 1.00 17.68 N ATOM 2084 CA GLU D 102 43.487 -7.845 43.063 1.00 17.46 C ATOM 2085 C GLU D 102 42.229 -8.370 43.789 1.00 17.29 C ATOM 2086 O GLU D 102 41.110 -7.985 43.411 1.00 16.80 O ATOM 2087 CB GLU D 102 44.059 -6.740 43.874 1.00 12.69 C ATOM 2088 CG GLU D 102 45.349 -6.189 43.363 1.00 18.83 C ATOM 2089 CD GLU D 102 46.450 -7.225 43.285 1.00 22.45 C ATOM 2090 OE1 GLU D 102 46.654 -7.968 44.248 1.00 24.76 O ATOM 2091 OE2 GLU D 102 47.112 -7.270 42.250 1.00 23.75 O ATOM 0 H GLU D 102 43.187 -6.502 41.647 1.00 17.68 H new ATOM 0 HA GLU D 102 44.111 -8.581 42.969 1.00 17.46 H new ATOM 0 HB2 GLU D 102 43.410 -6.020 43.920 1.00 12.69 H new ATOM 0 HB3 GLU D 102 44.194 -7.058 44.780 1.00 12.69 H new ATOM 0 HG2 GLU D 102 45.206 -5.811 42.481 1.00 18.83 H new ATOM 0 HG3 GLU D 102 45.635 -5.464 43.940 1.00 18.83 H new HETATM 2093 N DIP D 103 42.265 -9.225 44.829 1.00 18.18 N HETATM 2094 C1 DIP D 103 43.499 -9.906 45.239 1.00 12.94 C HETATM 2095 C2 DIP D 103 43.563 -11.069 44.268 1.00 19.03 C HETATM 2096 C3 DIP D 103 44.680 -11.995 44.660 1.00 23.49 C HETATM 2097 C4 DIP D 103 45.102 -12.765 43.425 1.00 26.31 C HETATM 2098 C5 DIP D 103 43.970 -13.601 42.819 1.00 33.90 C HETATM 2099 C1' DIP D 103 41.024 -9.428 45.594 1.00 17.23 C HETATM 2100 C2' DIP D 103 41.189 -8.777 46.982 1.00 17.31 C HETATM 2101 C3' DIP D 103 41.017 -7.249 47.037 1.00 15.24 C HETATM 2102 C4' DIP D 103 41.518 -6.854 48.399 1.00 13.47 C HETATM 2103 C5' DIP D 103 41.547 -5.345 48.491 1.00 14.37 C HETATM 0 H5'3 DIP D 103 42.138 -4.990 47.809 1.00 14.37 H new HETATM 0 H5'2 DIP D 103 40.652 -4.995 48.357 1.00 14.37 H new HETATM 0 H5'1 DIP D 103 41.869 -5.080 49.367 1.00 14.37 H new HETATM 0 H4'2 DIP D 103 40.942 -7.221 49.088 1.00 13.47 H new HETATM 0 H4'1 DIP D 103 42.405 -7.216 48.548 1.00 13.47 H new HETATM 0 H3'2 DIP D 103 41.524 -6.812 46.335 1.00 15.24 H new HETATM 0 H3'1 DIP D 103 40.089 -6.995 46.916 1.00 15.24 H new HETATM 0 H2'2 DIP D 103 40.545 -9.179 47.586 1.00 17.31 H new HETATM 0 H2'1 DIP D 103 42.071 -8.997 47.320 1.00 17.31 H new HETATM 0 H1'2 DIP D 103 40.271 -9.035 45.125 1.00 17.23 H new HETATM 0 H1'1 DIP D 103 40.837 -10.375 45.687 1.00 17.23 H new HETATM 0 H53 DIP D 103 43.657 -14.245 43.473 1.00 33.90 H new HETATM 0 H52 DIP D 103 43.238 -13.018 42.564 1.00 33.90 H new HETATM 0 H51 DIP D 103 44.297 -14.069 42.035 1.00 33.90 H new HETATM 0 H42 DIP D 103 45.428 -12.141 42.758 1.00 26.31 H new HETATM 0 H41 DIP D 103 45.842 -13.350 43.653 1.00 26.31 H new HETATM 0 H32 DIP D 103 45.428 -11.492 45.019 1.00 23.49 H new HETATM 0 H31 DIP D 103 44.388 -12.604 45.356 1.00 23.49 H new HETATM 0 H22 DIP D 103 42.719 -11.548 44.267 1.00 19.03 H new HETATM 0 H21 DIP D 103 43.704 -10.741 43.366 1.00 19.03 H new HETATM 0 H12 DIP D 103 44.274 -9.328 45.163 1.00 12.94 H new HETATM 0 H11 DIP D 103 43.458 -10.206 46.161 1.00 12.94 H new TER 2104 DIP D 103 HETATM 2105 O HOH A 502 48.028 12.475 32.683 1.00 9.92 O HETATM 2106 O HOH A 503 35.410 11.549 17.074 1.00 56.97 O HETATM 2107 O HOH A 504 55.171 3.679 18.544 1.00 39.62 O HETATM 2108 O HOH A 508 44.927 12.444 9.232 1.00 10.35 O HETATM 2109 O HOH A 509 40.691 12.679 8.912 1.00 18.53 O HETATM 2110 O HOH A 510 48.319 29.304 23.933 1.00 24.94 O HETATM 2111 O HOH A 511 50.749 34.925 20.686 1.00 73.27 O HETATM 2112 O HOH A 515 54.655 27.491 22.818 1.00 7.61 O HETATM 2113 O HOH A 516 58.261 18.581 22.825 1.00 26.09 O HETATM 2114 O HOH A 517 56.405 20.946 28.127 1.00 22.31 O HETATM 2115 O HOH A 518 52.831 14.807 27.087 1.00 15.42 O HETATM 2116 O HOH A 519 51.551 18.497 32.966 1.00 33.72 O HETATM 2117 O HOH A 520 51.586 11.103 34.078 1.00 24.80 O HETATM 2118 O HOH A 521 51.879 30.278 16.954 1.00 51.90 O HETATM 2119 O HOH A 522 54.412 8.243 15.715 1.00 20.51 O HETATM 2120 O HOH A 524 46.570 4.519 20.514 1.00 26.14 O HETATM 2121 O HOH A 527 32.247 21.328 13.596 1.00 31.98 O HETATM 2122 O HOH A 538 55.541 19.679 11.949 1.00 26.09 O HETATM 2123 O HOH A 541 40.725 13.659 6.526 1.00 29.09 O HETATM 2124 O HOH A 542 46.570 19.081 36.944 1.00 40.02 O HETATM 2125 O HOH A 548 54.246 12.901 34.376 1.00 34.49 O HETATM 2126 O HOH A 550 48.802 25.738 11.443 1.00 38.12 O HETATM 2127 O HOH A 552 59.016 20.606 24.385 1.00 23.36 O HETATM 2128 O HOH A 553 55.513 13.378 28.300 1.00 45.88 O HETATM 2129 O HOH C 500 39.731 10.431 24.005 1.00 14.76 O HETATM 2130 O HOH C 501 43.812 8.028 17.959 1.00 15.34 O HETATM 2131 O HOH C 526 46.443 7.826 28.421 1.00 64.97 O HETATM 2132 O HOH C 549 38.782 5.864 23.955 1.00 37.01 O HETATM 2133 O HOH B 505 39.977 3.342 24.849 1.00 47.06 O HETATM 2134 O HOH B 512 29.534 -3.004 38.337 1.00 20.04 O HETATM 2135 O HOH B 513 34.811 -1.278 49.332 1.00 4.88 O HETATM 2136 O HOH B 514 38.159 -2.407 52.052 1.00 15.73 O HETATM 2137 O HOH B 523 44.472 3.342 22.460 1.00 35.29 O HETATM 2138 O HOH B 525 48.961 2.897 24.036 1.00 45.03 O HETATM 2139 O HOH B 528 57.124 7.279 47.718 1.00 49.43 O HETATM 2140 O HOH B 529 37.098 -9.273 37.750 1.00 35.93 O HETATM 2141 O HOH B 532 31.607 -0.195 56.935 1.00 47.83 O HETATM 2142 O HOH B 533 29.437 0.818 54.446 1.00 39.40 O HETATM 2143 O HOH B 534 36.982 -1.088 54.030 1.00 20.33 O HETATM 2144 O HOH B 535 23.616 3.581 46.916 1.00 43.10 O HETATM 2145 O HOH B 536 48.697 17.435 37.057 1.00 33.09 O HETATM 2146 O HOH B 537 29.616 -5.749 38.191 1.00 42.81 O HETATM 2147 O HOH B 539 31.671 10.659 42.845 1.00 17.27 O HETATM 2148 O HOH B 540 29.903 8.625 42.049 1.00 25.13 O HETATM 2149 O HOH B 543 49.684 -4.915 37.084 1.00 52.79 O HETATM 2150 O HOH B 544 49.392 3.102 53.496 1.00 43.87 O HETATM 2151 O HOH B 545 46.119 -5.506 47.767 1.00 44.91 O HETATM 2152 O HOH B 546 55.062 5.075 42.005 1.00 41.48 O HETATM 2153 O HOH B 547 55.811 13.049 42.985 1.00 30.97 O HETATM 2154 O HOH B 551 30.431 -3.976 50.655 1.00 15.18 O HETATM 2155 O HOH B 554 39.995 1.522 58.947 1.00 45.19 O HETATM 2156 O HOH B 555 31.753 -8.692 43.052 1.00 18.77 O HETATM 2157 O HOH B 556 53.423 9.641 35.923 1.00 35.57 O HETATM 2158 O HOH B 557 32.620 -10.340 35.652 1.00 24.51 O HETATM 2159 O HOH D 506 46.610 -5.879 39.899 1.00 23.46 O HETATM 2160 O HOH D 507 39.321 -6.240 42.317 1.00 18.23 O HETATM 2161 O HOH D 530 42.655 -4.613 31.212 1.00 48.23 O HETATM 2162 O HOH D 531 40.763 -11.089 36.612 1.00 55.10 O CONECT 1022 1023 1024 1025 CONECT 1023 1022 CONECT 1024 1022 CONECT 1025 1022 1026 1041 CONECT 1026 1025 1027 1029 CONECT 1027 1026 1028 1042 CONECT 1028 1027 CONECT 1029 1026 1030 CONECT 1030 1029 1031 1032 CONECT 1031 1030 1033 CONECT 1032 1030 1034 CONECT 1033 1031 1035 CONECT 1034 1032 1035 CONECT 1035 1033 1034 1036 CONECT 1036 1035 1037 CONECT 1037 1036 1038 1039 1040 CONECT 1038 1037 CONECT 1039 1037 CONECT 1040 1037 CONECT 1041 1025 CONECT 1042 1027 CONECT 1044 1052 CONECT 1052 1044 1053 1058 CONECT 1053 1052 1054 CONECT 1054 1053 1055 CONECT 1055 1054 1056 CONECT 1056 1055 1057 CONECT 1057 1056 CONECT 1058 1052 1059 CONECT 1059 1058 1060 CONECT 1060 1059 1061 CONECT 1061 1060 1062 CONECT 1062 1061 CONECT 2063 2064 2065 2066 CONECT 2064 2063 CONECT 2065 2063 CONECT 2066 2063 2067 2082 CONECT 2067 2066 2068 2070 CONECT 2068 2067 2069 2083 CONECT 2069 2068 CONECT 2070 2067 2071 CONECT 2071 2070 2072 2073 CONECT 2072 2071 2074 CONECT 2073 2071 2075 CONECT 2074 2072 2076 CONECT 2075 2073 2076 CONECT 2076 2074 2075 2077 CONECT 2077 2076 2078 CONECT 2078 2077 2079 2080 2081 CONECT 2079 2078 CONECT 2080 2078 CONECT 2081 2078 CONECT 2082 2066 CONECT 2083 2068 CONECT 2085 2093 CONECT 2093 2085 2094 2099 CONECT 2094 2093 2095 CONECT 2095 2094 2096 CONECT 2096 2095 2097 CONECT 2097 2096 2098 CONECT 2098 2097 CONECT 2099 2093 2100 CONECT 2100 2099 2101 CONECT 2101 2100 2102 CONECT 2102 2101 2103 CONECT 2103 2102 END