USER MOD reduce.3.24.130724 H: found=0, std=0, add=2185, rem=0, adj=65 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER TRANSCRIPTION/TRANSFERASE 12-FEB-09 3G8I TITLE ALEGLITAZAR, A NEW, POTENT, AND BALANCED PPAR ALPHA/GAMMA TITLE 2 AGONIST FOR THE TREATMENT OF TYPE II DIABETES COMPND MOL_ID: 1; COMPND 2 MOLECULE: PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR ALPHA; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: LIGAND BIND DOMAIN; COMPND 5 SYNONYM: PPAR-ALPHA, NUCLEAR RECEPTOR SUBFAMILY 1 GROUP C COMPND 6 MEMBER 1; COMPND 7 ENGINEERED: YES; COMPND 8 MOL_ID: 2; COMPND 9 MOLECULE: NUCLEAR RECEPTOR COACTIVATOR 1; COMPND 0 CHAIN: Z; COMPND 1 FRAGMENT: MOTIF 5; COMPND 2 SYNONYM: COACTIVATOR PEPTIDE SRC-1, NCOA-1, STEROID COMPND 3 RECEPTOR COACTIVATOR 1, SRC-1, RIP160, PROTEIN HIN-2, RENAL COMPND 4 CARCINOMA ANTIGEN NY-REN-52; COMPND 5 EC: 2.3.1.48; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: PPARA, NR1C1, PPAR; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET15B; SOURCE 0 MOL_ID: 2; SOURCE 1 SYNTHETIC: YES; SOURCE 2 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. THE SOURCE 3 SEQUENCE OF THE PEPTIDE IS NATURALLY FOUND IN HOMO SAPIENS SOURCE 4 (HUMAN) KEYWDS NUCLEAR HORMONE RECEPTOR, TRANSCRIPTION FACTOR, DIABETES, KEYWDS 2 ACTIVATOR, DNA-BINDING, METAL-BINDING, NUCLEUS, KEYWDS 3 POLYMORPHISM, RECEPTOR, TRANSCRIPTION, TRANSCRIPTION KEYWDS 4 REGULATION, ZINC, ZINC-FINGER, ACYLTRANSFERASE, ALTERNATIVE KEYWDS 5 SPLICING, CHROMOSOMAL REARRANGEMENT, PHOSPHOPROTEIN, PROTO- KEYWDS 6 ONCOGENE, TRANSFERASE, UBL CONJUGATION, KEYWDS 7 TRANSCRIPTION/TRANSFERASE COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR J.BENZ,A.BERNARDEAU,A.BINGGELI,D.BLUM,M.BOEHRINGER, AUTHOR 2 U.GRETHER,H.HILPERT,B.KUHN,H.P.MAERKI,M.MEYER,K.PUENTENER, AUTHOR 3 S.RAAB,A.RUF,D.SCHLATTER,B.GSELL,M.STIHLE,P.MOHR REVDAT 1 02-JUN-09 3G8I 0 JRNL AUTH A.BENARDEAU,J.BENZ,A.BINGGELI,D.BLUM,M.BOEHRINGER, JRNL AUTH 2 U.GRETHER,H.HILPERT,B.KUHN,H.P.MARKI,M.MEYER, JRNL AUTH 3 K.PUNTENER,S.RAAB,A.RUF,D.SCHLATTER,P.MOHR JRNL TITL ALEGLITAZAR, A NEW, POTENT, AND BALANCED DUAL JRNL TITL 2 PPARALPHA/GAMMA AGONIST FOR THE TREATMENT OF TYPE JRNL TITL 3 II DIABETES. JRNL REF BIOORG.MED.CHEM.LETT. V. 19 2468 2009 JRNL REFN ISSN 0960-894X JRNL PMID 19349176 JRNL DOI 10.1016/J.BMCL.2009.03.036 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 2.20 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.1.24 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.20 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 15.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 97.3 REMARK 3 NUMBER OF REFLECTIONS : 15390 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING + TEST SET) : 0.202 REMARK 3 R VALUE (WORKING SET) : 0.199 REMARK 3 FREE R VALUE : 0.261 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.100 REMARK 3 FREE R VALUE TEST SET COUNT : 823 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.20 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.26 REMARK 3 REFLECTION IN BIN (WORKING SET) : 994 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL REMARK 3 BIN R VALUE (WORKING SET) : 0.2320 REMARK 3 BIN FREE R VALUE SET COUNT : 55 REMARK 3 BIN FREE R VALUE : 0.2750 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2103 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 31 REMARK 3 SOLVENT ATOMS : 155 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 37.36 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 1.53000 REMARK 3 B22 (A**2) : -2.70000 REMARK 3 B33 (A**2) : 1.16000 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.273 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.228 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.159 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 6.210 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.942 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.908 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2176 ; 0.018 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 2929 ; 1.684 ; 1.993 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 258 ; 4.993 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): NULL ; NULL ; NULL REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 335 ; 0.101 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 1589 ; 0.004 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 1064 ; 0.249 ; 0.300 REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 229 ; 0.257 ; 0.500 REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): 23 ; 0.188 ; 0.300 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 3 ; 0.335 ; 0.500 REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 1309 ; 2.216 ; 2.000 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 2110 ; 3.531 ; 3.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 867 ; 2.660 ; 2.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 819 ; 3.969 ; 3.000 REMARK 3 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 NCS RESTRAINTS STATISTICS REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : BABINET MODEL WITH MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.40 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE REMARK 3 RIDING POSITIONS REMARK 4 REMARK 4 3G8I COMPLIES WITH FORMAT V. 3.20, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 23-FEB-09. REMARK 100 THE RCSB ID CODE IS RCSB051556. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 13-OCT-02 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 8.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N REMARK 200 RADIATION SOURCE : ROTATING ANODE REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : OTHER REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : IMAGE PLATE REMARK 200 DETECTOR MANUFACTURER : MAR SCANNER 300 MM PLATE REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 16293 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.200 REMARK 200 RESOLUTION RANGE LOW (A) : 20.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 97.5 REMARK 200 DATA REDUNDANCY : 4.700 REMARK 200 R MERGE (I) : 0.06000 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 19.2000 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) : 2.28 REMARK 200 COMPLETENESS FOR SHELL (%) : 92.5 REMARK 200 DATA REDUNDANCY IN SHELL : 4.70 REMARK 200 R MERGE FOR SHELL (I) : 0.33200 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 4.200 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: AMORE REMARK 200 STARTING MODEL: 1K71 REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 50.06 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.46 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 20-22% PEG 2000, 0.2M NACL, 5% REMARK 280 GLYCEROL, 0.1M TRIS-CL, PH 8.5, VAPOR DIFFUSION, TEMPERATURE REMARK 280 293K 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 21.20250 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 49.24750 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 38.01650 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 49.24750 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 21.20250 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 38.01650 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 1080 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 13250 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -10.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, Z 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 GLU A 199 REMARK 465 THR A 200 REMARK 465 ALA A 201 REMARK 465 GLY A 231 REMARK 465 LYS A 232 REMARK 465 ALA A 233 REMARK 465 SER A 234 REMARK 465 ASN A 235 REMARK 465 ASN A 236 REMARK 465 VAL A 259 REMARK 465 ALA A 260 REMARK 465 ASN A 261 REMARK 465 GLY A 262 REMARK 465 ILE A 263 REMARK 465 GLN A 264 REMARK 465 ASN A 265 REMARK 465 LYS Z 744 REMARK 465 ASP Z 745 REMARK 465 ASP Z 754 REMARK 465 LYS Z 755 REMARK 465 ASP Z 756 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 N TYR A 468 O HOH A 193 1.83 REMARK 500 OD1 ASN A 219 O HOH A 192 1.86 REMARK 500 O LEU Z 753 O HOH Z 143 2.07 REMARK 500 O HOH A 37 O HOH A 196 2.11 REMARK 500 O HOH A 110 O HOH A 188 2.13 REMARK 500 O HOH A 75 O HOH A 471 2.19 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 ASP A 360 CB - CG - OD2 ANGL. DEV. = 5.5 DEGREES REMARK 500 ARG A 434 NE - CZ - NH2 ANGL. DEV. = -3.0 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CHIRAL CENTERS REMARK 500 REMARK 500 UNEXPECTED CONFIGURATION OF THE FOLLOWING CHIRAL REMARK 500 CENTER(S) USING IMPROPER CA--C--CB--N CHIRALITY REMARK 500 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: (11X,I3,1X,A3,1X,A1,I4,A1,6X,F5.1,6X,A1,10X,A1,3X,A16) REMARK 500 REMARK 500 M RES CSSEQI IMPROPER EXPECTED FOUND DETAILS REMARK 500 MET A 467 24.4 L L OUTSIDE RANGE 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 RO7 A 1 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 3G9E RELATED DB: PDB DBREF 3G8I A 199 468 UNP Q07869 PPARA_HUMAN 199 468 DBREF 3G8I Z 744 756 UNP Q15788 NCOA1_HUMAN 744 756 SEQRES 1 A 270 GLU THR ALA ASP LEU LYS SER LEU ALA LYS ARG ILE TYR SEQRES 2 A 270 GLU ALA TYR LEU LYS ASN PHE ASN MET ASN LYS VAL LYS SEQRES 3 A 270 ALA ARG VAL ILE LEU SER GLY LYS ALA SER ASN ASN PRO SEQRES 4 A 270 PRO PHE VAL ILE HIS ASP MET GLU THR LEU CYS MET ALA SEQRES 5 A 270 GLU LYS THR LEU VAL ALA LYS LEU VAL ALA ASN GLY ILE SEQRES 6 A 270 GLN ASN LYS GLU ALA GLU VAL ARG ILE PHE HIS CYS CYS SEQRES 7 A 270 GLN CYS THR SER VAL GLU THR VAL THR GLU LEU THR GLU SEQRES 8 A 270 PHE ALA LYS ALA ILE PRO GLY PHE ALA ASN LEU ASP LEU SEQRES 9 A 270 ASN ASP GLN VAL THR LEU LEU LYS TYR GLY VAL TYR GLU SEQRES 10 A 270 ALA ILE PHE ALA MET LEU SER SER VAL MET ASN LYS ASP SEQRES 11 A 270 GLY MET LEU VAL ALA TYR GLY ASN GLY PHE ILE THR ARG SEQRES 12 A 270 GLU PHE LEU LYS SER LEU ARG LYS PRO PHE CYS ASP ILE SEQRES 13 A 270 MET GLU PRO LYS PHE ASP PHE ALA MET LYS PHE ASN ALA SEQRES 14 A 270 LEU GLU LEU ASP ASP SER ASP ILE SER LEU PHE VAL ALA SEQRES 15 A 270 ALA ILE ILE CYS CYS GLY ASP ARG PRO GLY LEU LEU ASN SEQRES 16 A 270 VAL GLY HIS ILE GLU LYS MET GLN GLU GLY ILE VAL HIS SEQRES 17 A 270 VAL LEU ARG LEU HIS LEU GLN SER ASN HIS PRO ASP ASP SEQRES 18 A 270 ILE PHE LEU PHE PRO LYS LEU LEU GLN LYS MET ALA ASP SEQRES 19 A 270 LEU ARG GLN LEU VAL THR GLU HIS ALA GLN LEU VAL GLN SEQRES 20 A 270 ILE ILE LYS LYS THR GLU SER ASP ALA ALA LEU HIS PRO SEQRES 21 A 270 LEU LEU GLN GLU ILE TYR ARG ASP MET TYR SEQRES 1 Z 13 LYS ASP HIS GLN LEU LEU ARG TYR LEU LEU ASP LYS ASP HET RO7 A 1 31 HETNAM RO7 (2S)-2-METHOXY-3-{4-[2-(5-METHYL-2-PHENYL-1,3-OXAZOL-4- HETNAM 2 RO7 YL)ETHOXY]-1-BENZOTHIOPHEN-7-YL}PROPANOIC ACID FORMUL 3 RO7 C24 H23 N O5 S FORMUL 4 HOH *155(H2 O) HELIX 1 1 SER A 205 PHE A 218 1 14 HELIX 2 2 ASN A 221 SER A 230 1 10 HELIX 3 3 ASP A 243 LEU A 254 1 12 HELIX 4 4 GLU A 267 ILE A 294 1 28 HELIX 5 5 GLY A 296 LEU A 300 5 5 HELIX 6 6 ASP A 301 SER A 322 1 22 HELIX 7 7 ARG A 341 LEU A 347 1 7 HELIX 8 8 PHE A 351 ALA A 367 1 17 HELIX 9 9 ASP A 371 CYS A 384 1 14 HELIX 10 10 ASN A 393 HIS A 416 1 24 HELIX 11 11 PHE A 421 GLU A 451 1 31 HELIX 12 12 HIS A 457 ARG A 465 1 9 HELIX 13 13 HIS Z 746 LEU Z 753 1 8 SHEET 1 A 4 PHE A 239 ILE A 241 0 SHEET 2 A 4 GLY A 337 THR A 340 1 O PHE A 338 N PHE A 239 SHEET 3 A 4 GLY A 329 VAL A 332 -1 N MET A 330 O ILE A 339 SHEET 4 A 4 MET A 325 ASN A 326 -1 N ASN A 326 O GLY A 329 CISPEP 1 LYS A 349 PRO A 350 0 6.41 SITE *** AC1 12 LEU A 247 VAL A 255 PHE A 273 CYS A 276 SITE *** AC1 12 SER A 280 TYR A 314 VAL A 332 ILE A 354 SITE *** AC1 12 MET A 355 HIS A 440 LEU A 460 TYR A 464 CRYST1 42.405 76.033 98.495 90.00 90.00 90.00 P 21 21 21 4 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.023582 0.000000 0.000000 0.00000 SCALE2 0.000000 0.013152 0.000000 0.00000 SCALE3 0.000000 0.000000 0.010153 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 1 RO7HO21 : A 1 RO7 O21 : A 1 RO7 C10 :(short bond) USER MOD Set 1.1: A 448 LYS NZ :NH3+ 171:sc= 0.763 (180deg=0) USER MOD Set 1.2: A 461 GLN : amide:sc= 0.689 K(o=1.5,f=-5.2!) USER MOD Set 2.1: A 393 ASN : amide:sc= -3.32! C(o=-2.4!,f=-6.4!) USER MOD Set 2.2: A 396 HIS : no HE2:sc= 0.873 K(o=-2.4,f=-14!) USER MOD Set 3.1: A 373 SER OG : rot 99:sc= 0.852 USER MOD Set 3.2: A 411 HIS : no HE2:sc= 0.831 K(o=1.7,f=-0.29) USER MOD Set 4.1: A 314 TYR OH : rot -17:sc= 1.08 USER MOD Set 4.2: A 358 LYS NZ :NH3+ -175:sc= 2.55 (180deg=1.4) USER MOD Set 4.3: A 440 HIS : no HD1:sc= 1.77 K(o=6.1,f=-8.9!) USER MOD Set 4.4: A 464 TYR OH : rot -169:sc= 0.687 USER MOD Set 5.1: A 310 LYS NZ :NH3+ 167:sc= 0.982 (180deg=0.517) USER MOD Set 5.2: Z 746 HIS : no HE2:sc= -0.756 K(o=0.23,f=-3!) USER MOD Set 6.1: A 276 CYS SG : rot 78:sc= -0.0033 USER MOD Set 6.2: A 355 MET CE :methyl -138:sc= 0 (180deg=-0.301) USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 SER OG : rot 180:sc= 0 USER MOD Single : A 208 LYS NZ :NH3+ 157:sc= 0.237 (180deg=0.0915) USER MOD Single : A 211 TYR OH : rot 180:sc= 1.03 USER MOD Single : A 214 TYR OH : rot 158:sc= 1.66 USER MOD Single : A 216 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 217 ASN :FLIP amide:sc= 1.29 F(o=0.65,f=1.3) USER MOD Single : A 219 ASN :FLIP amide:sc= 0.416 F(o=-0.77,f=0.42) USER MOD Single : A 220 MET CE :methyl 152:sc= -0.474 (180deg=-1.54!) USER MOD Single : A 221 ASN : amide:sc= 0.121 K(o=0.12,f=-3.3!) USER MOD Single : A 222 LYS NZ :NH3+ 162:sc= 2.85 (180deg=2.55) USER MOD Single : A 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 230 SER OG : rot 180:sc= 0 USER MOD Single : A 242 HIS :FLIP no HD1:sc= -0.0318 F(o=-0.57,f=-0.032) USER MOD Single : A 244 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 246 THR OG1 : rot -76:sc= 1.51 USER MOD Single : A 248 CYS SG : rot 75:sc= 0.476 USER MOD Single : A 249 MET CE :methyl 149:sc= -0.298 (180deg=-3.26!) USER MOD Single : A 252 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 253 THR OG1 : rot 180:sc= 0 USER MOD Single : A 257 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 266 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000105) USER MOD Single : A 274 HIS : no HD1:sc= -0.0314 K(o=-0.031,f=-0.53) USER MOD Single : A 275 CYS SG : rot 77:sc= -2.44! USER MOD Single : A 277 GLN : amide:sc= -1.52 K(o=-1.5,f=-13!) USER MOD Single : A 278 CYS SG : rot 71:sc= 0.309 USER MOD Single : A 279 THR OG1 : rot 174:sc= 0.00611 USER MOD Single : A 280 SER OG : rot 159:sc= 0.882 USER MOD Single : A 283 THR OG1 : rot 81:sc= 0.648 USER MOD Single : A 285 THR OG1 : rot 180:sc= 0 USER MOD Single : A 288 THR OG1 : rot 77:sc= 0.0344 USER MOD Single : A 292 LYS NZ :NH3+ -147:sc= 0.3 (180deg=0.0507) USER MOD Single : A 299 ASN : amide:sc= -0.0195 K(o=-0.019,f=-0.81) USER MOD Single : A 303 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 305 GLN : amide:sc= 0.746 K(o=0.75,f=-0.59) USER MOD Single : A 307 THR OG1 : rot 157:sc= 1.28 USER MOD Single : A 311 TYR OH : rot 180:sc= 0 USER MOD Single : A 320 MET CE :methyl -161:sc= -0.372 (180deg=-1.01) USER MOD Single : A 322 SER OG : rot 68:sc= -0.0108 USER MOD Single : A 323 SER OG : rot 138:sc= 2.39 USER MOD Single : A 325 MET CE :methyl 175:sc= -0.918 (180deg=-0.959) USER MOD Single : A 326 ASN : amide:sc= -0.0908 K(o=-0.091,f=-6.1!) USER MOD Single : A 327 LYS NZ :NH3+ -164:sc= 0.707 (180deg=0.622) USER MOD Single : A 330 MET CE :methyl -132:sc= -0.301 (180deg=-2.12) USER MOD Single : A 334 TYR OH : rot 26:sc= 0.904 USER MOD Single : A 336 ASN : amide:sc= -0.0802 K(o=-0.08,f=-0.72) USER MOD Single : A 340 THR OG1 : rot 180:sc= 0.147 USER MOD Single : A 345 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 346 SER OG : rot -65:sc= 0.3 USER MOD Single : A 349 LYS NZ :NH3+ -167:sc= -0.456 (180deg=-0.954!) USER MOD Single : A 352 CYS SG : rot 180:sc= -1.71! USER MOD Single : A 363 MET CE :methyl -152:sc= -0.201 (180deg=-0.76) USER MOD Single : A 364 LYS NZ :NH3+ -122:sc= 0.666 (180deg=-0.0433) USER MOD Single : A 366 ASN :FLIP amide:sc= 0.893 F(o=-2.3!,f=0.89) USER MOD Single : A 376 SER OG : rot -54:sc= 0.34 USER MOD Single : A 384 CYS SG : rot 180:sc= 0 USER MOD Single : A 385 CYS SG : rot 180:sc= 0 USER MOD Single : A 399 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 400 MET CE :methyl -157:sc= -9.88! (180deg=-11.4!) USER MOD Single : A 401 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 406 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 413 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 414 SER OG : rot 180:sc= 0 USER MOD Single : A 415 ASN : amide:sc= 1.35 K(o=1.3,f=-0.58) USER MOD Single : A 416 HIS : no HD1:sc= -0.102 K(o=-0.1,f=-5.7!) USER MOD Single : A 425 LYS NZ :NH3+ 145:sc= 0.0244 (180deg=0) USER MOD Single : A 428 GLN : amide:sc= -0.158 X(o=-0.16,f=-0.048) USER MOD Single : A 429 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 MET CE :methyl -105:sc= -0.258 (180deg=-2.45!) USER MOD Single : A 435 GLN : amide:sc= -0.198 K(o=-0.2,f=-0.77) USER MOD Single : A 438 THR OG1 : rot 180:sc= 0 USER MOD Single : A 442 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 445 GLN :FLIP amide:sc= -0.0301 F(o=-1.3,f=-0.03) USER MOD Single : A 449 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 450 THR OG1 : rot -65:sc= 0.962 USER MOD Single : A 452 SER OG : rot 180:sc= 0 USER MOD Single : A 457 HIS :FLIP no HD1:sc= -0.952 F(o=-5.2!,f=-0.95) USER MOD Single : A 467 MET CE :methyl 154:sc= 0 (180deg=-0.337) USER MOD Single : A 468 TYR OH : rot 180:sc= 0 USER MOD Single : Z 747 GLN : amide:sc= -0.126 K(o=-0.13,f=-1.4!) USER MOD Single : Z 751 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 202 34.788 19.635 -0.890 1.00 75.07 N ATOM 2 CA ASP A 202 34.180 20.613 0.079 1.00 74.70 C ATOM 3 C ASP A 202 34.371 20.310 1.601 1.00 71.86 C ATOM 4 O ASP A 202 35.477 19.989 2.062 1.00 70.10 O ATOM 5 CB ASP A 202 32.692 20.889 -0.264 1.00 75.97 C ATOM 6 CG ASP A 202 31.979 19.667 -0.849 1.00 77.63 C ATOM 7 OD1 ASP A 202 31.378 18.889 -0.066 1.00 78.16 O ATOM 8 OD2 ASP A 202 31.968 19.402 -2.077 1.00 78.06 O ATOM 0 HA ASP A 202 34.704 21.419 -0.052 1.00 74.70 H new ATOM 0 HB2 ASP A 202 32.228 21.175 0.538 1.00 75.97 H new ATOM 0 HB3 ASP A 202 32.641 21.621 -0.898 1.00 75.97 H new ATOM 9 N LEU A 203 33.272 20.402 2.351 1.00 67.99 N ATOM 10 CA LEU A 203 33.331 20.600 3.788 1.00 63.69 C ATOM 11 C LEU A 203 32.477 19.697 4.658 1.00 60.69 C ATOM 12 O LEU A 203 32.022 20.110 5.720 1.00 57.35 O ATOM 13 CB LEU A 203 32.925 22.050 4.077 1.00 65.49 C ATOM 14 CG LEU A 203 31.458 22.487 3.965 1.00 65.20 C ATOM 15 CD1 LEU A 203 31.363 24.024 4.091 1.00 64.14 C ATOM 16 CD2 LEU A 203 30.811 21.993 2.674 1.00 65.34 C ATOM 0 H LEU A 203 32.474 20.351 2.035 1.00 67.99 H new ATOM 0 HA LEU A 203 34.244 20.375 4.027 1.00 63.69 H new ATOM 0 HB2 LEU A 203 33.216 22.254 4.980 1.00 65.49 H new ATOM 0 HB3 LEU A 203 33.438 22.615 3.479 1.00 65.49 H new ATOM 0 HG LEU A 203 30.963 22.080 4.693 1.00 65.20 H new ATOM 0 HD11 LEU A 203 30.435 24.298 4.020 1.00 64.14 H new ATOM 0 HD12 LEU A 203 31.717 24.301 4.951 1.00 64.14 H new ATOM 0 HD13 LEU A 203 31.878 24.439 3.381 1.00 64.14 H new ATOM 0 HD21 LEU A 203 29.888 22.289 2.641 1.00 65.34 H new ATOM 0 HD22 LEU A 203 31.293 22.352 1.912 1.00 65.34 H new ATOM 0 HD23 LEU A 203 30.841 21.024 2.647 1.00 65.34 H new ATOM 17 N LYS A 204 32.252 18.463 4.232 1.00 58.86 N ATOM 18 CA LYS A 204 31.565 17.533 5.111 1.00 55.57 C ATOM 19 C LYS A 204 32.630 17.016 6.078 1.00 51.81 C ATOM 20 O LYS A 204 32.309 16.343 7.053 1.00 48.88 O ATOM 21 CB LYS A 204 30.861 16.391 4.344 1.00 58.71 C ATOM 22 CG LYS A 204 31.523 15.937 3.030 1.00 60.56 C ATOM 23 CD LYS A 204 30.905 14.615 2.476 1.00 63.11 C ATOM 24 CE LYS A 204 29.399 14.750 2.088 1.00 66.18 C ATOM 25 NZ LYS A 204 28.831 13.603 1.260 1.00 64.95 N ATOM 0 H LYS A 204 32.480 18.152 3.463 1.00 58.86 H new ATOM 0 HA LYS A 204 30.843 17.975 5.585 1.00 55.57 H new ATOM 0 HB2 LYS A 204 30.798 15.623 4.933 1.00 58.71 H new ATOM 0 HB3 LYS A 204 29.954 16.672 4.146 1.00 58.71 H new ATOM 0 HG2 LYS A 204 31.430 16.637 2.365 1.00 60.56 H new ATOM 0 HG3 LYS A 204 32.473 15.810 3.177 1.00 60.56 H new ATOM 0 HD2 LYS A 204 31.409 14.332 1.697 1.00 63.11 H new ATOM 0 HD3 LYS A 204 30.999 13.917 3.143 1.00 63.11 H new ATOM 0 HE2 LYS A 204 28.877 14.831 2.902 1.00 66.18 H new ATOM 0 HE3 LYS A 204 29.281 15.576 1.593 1.00 66.18 H new ATOM 0 HZ1 LYS A 204 27.973 13.760 1.084 1.00 64.95 H new ATOM 0 HZ2 LYS A 204 29.282 13.536 0.496 1.00 64.95 H new ATOM 0 HZ3 LYS A 204 28.906 12.842 1.716 1.00 64.95 H new ATOM 26 N SER A 205 33.893 17.357 5.787 1.00 45.43 N ATOM 27 CA SER A 205 35.022 16.957 6.618 1.00 43.08 C ATOM 28 C SER A 205 35.618 18.093 7.477 1.00 41.55 C ATOM 29 O SER A 205 36.491 17.838 8.298 1.00 40.94 O ATOM 30 CB SER A 205 36.113 16.295 5.776 1.00 38.88 C ATOM 31 OG SER A 205 36.874 17.267 5.085 1.00 38.95 O ATOM 0 H SER A 205 34.112 17.827 5.101 1.00 45.43 H new ATOM 0 HA SER A 205 34.660 16.314 7.247 1.00 43.08 H new ATOM 0 HB2 SER A 205 36.694 15.770 6.348 1.00 38.88 H new ATOM 0 HB3 SER A 205 35.710 15.682 5.141 1.00 38.88 H new ATOM 0 HG SER A 205 37.468 16.886 4.630 1.00 38.95 H new ATOM 32 N LEU A 206 35.128 19.322 7.306 1.00 37.81 N ATOM 33 CA LEU A 206 35.663 20.502 8.016 1.00 36.96 C ATOM 34 C LEU A 206 35.658 20.389 9.563 1.00 35.35 C ATOM 35 O LEU A 206 36.658 20.668 10.262 1.00 37.88 O ATOM 36 CB LEU A 206 34.898 21.772 7.578 1.00 35.22 C ATOM 37 CG LEU A 206 35.408 23.136 8.080 1.00 34.54 C ATOM 38 CD1 LEU A 206 36.852 23.368 7.694 1.00 35.17 C ATOM 39 CD2 LEU A 206 34.544 24.263 7.535 1.00 32.83 C ATOM 0 H LEU A 206 34.475 19.501 6.776 1.00 37.81 H new ATOM 0 HA LEU A 206 36.598 20.556 7.762 1.00 36.96 H new ATOM 0 HB2 LEU A 206 34.893 21.796 6.608 1.00 35.22 H new ATOM 0 HB3 LEU A 206 33.976 21.676 7.864 1.00 35.22 H new ATOM 0 HG LEU A 206 35.351 23.127 9.048 1.00 34.54 H new ATOM 0 HD11 LEU A 206 37.141 24.233 8.025 1.00 35.17 H new ATOM 0 HD12 LEU A 206 37.406 22.673 8.082 1.00 35.17 H new ATOM 0 HD13 LEU A 206 36.936 23.347 6.728 1.00 35.17 H new ATOM 0 HD21 LEU A 206 34.878 25.114 7.860 1.00 32.83 H new ATOM 0 HD22 LEU A 206 34.574 24.254 6.565 1.00 32.83 H new ATOM 0 HD23 LEU A 206 33.628 24.141 7.831 1.00 32.83 H new ATOM 40 N ALA A 207 34.516 19.993 10.074 1.00 32.29 N ATOM 41 CA ALA A 207 34.281 19.890 11.499 1.00 33.19 C ATOM 42 C ALA A 207 35.208 18.852 12.130 1.00 33.02 C ATOM 43 O ALA A 207 35.781 19.117 13.202 1.00 30.66 O ATOM 44 CB ALA A 207 32.802 19.558 11.779 1.00 30.52 C ATOM 0 H ALA A 207 33.838 19.771 9.595 1.00 32.29 H new ATOM 0 HA ALA A 207 34.480 20.748 11.905 1.00 33.19 H new ATOM 0 HB1 ALA A 207 32.661 19.492 12.736 1.00 30.52 H new ATOM 0 HB2 ALA A 207 32.238 20.259 11.417 1.00 30.52 H new ATOM 0 HB3 ALA A 207 32.575 18.713 11.360 1.00 30.52 H new ATOM 45 N LYS A 208 35.347 17.688 11.467 1.00 30.71 N ATOM 46 CA LYS A 208 36.291 16.665 11.913 1.00 31.11 C ATOM 47 C LYS A 208 37.729 17.169 11.900 1.00 30.20 C ATOM 48 O LYS A 208 38.499 16.899 12.803 1.00 30.22 O ATOM 49 CB LYS A 208 36.197 15.415 11.033 1.00 32.47 C ATOM 50 CG LYS A 208 37.156 14.278 11.405 1.00 30.49 C ATOM 51 CD LYS A 208 38.563 14.468 10.839 1.00 31.85 C ATOM 52 CE LYS A 208 39.191 13.172 10.363 1.00 34.65 C ATOM 53 NZ LYS A 208 40.562 13.377 9.758 1.00 32.91 N ATOM 0 H LYS A 208 34.902 17.480 10.761 1.00 30.71 H new ATOM 0 HA LYS A 208 36.048 16.445 12.826 1.00 31.11 H new ATOM 0 HB2 LYS A 208 35.288 15.078 11.072 1.00 32.47 H new ATOM 0 HB3 LYS A 208 36.365 15.672 10.113 1.00 32.47 H new ATOM 0 HG2 LYS A 208 37.209 14.210 12.371 1.00 30.49 H new ATOM 0 HG3 LYS A 208 36.794 13.438 11.081 1.00 30.49 H new ATOM 0 HD2 LYS A 208 38.527 15.095 10.099 1.00 31.85 H new ATOM 0 HD3 LYS A 208 39.129 14.865 11.519 1.00 31.85 H new ATOM 0 HE2 LYS A 208 39.260 12.557 11.110 1.00 34.65 H new ATOM 0 HE3 LYS A 208 38.610 12.757 9.706 1.00 34.65 H new ATOM 0 HZ1 LYS A 208 41.022 12.616 9.800 1.00 32.91 H new ATOM 0 HZ2 LYS A 208 40.477 13.625 8.907 1.00 32.91 H new ATOM 0 HZ3 LYS A 208 40.994 14.010 10.210 1.00 32.91 H new ATOM 54 N ARG A 209 38.111 17.896 10.868 1.00 30.13 N ATOM 55 CA ARG A 209 39.475 18.358 10.804 1.00 31.76 C ATOM 56 C ARG A 209 39.796 19.414 11.863 1.00 29.62 C ATOM 57 O ARG A 209 40.894 19.453 12.349 1.00 25.46 O ATOM 58 CB ARG A 209 39.751 18.916 9.417 1.00 38.43 C ATOM 59 CG ARG A 209 40.012 17.811 8.349 1.00 42.15 C ATOM 60 CD ARG A 209 40.365 18.379 7.006 1.00 47.56 C ATOM 61 NE ARG A 209 40.154 17.414 5.935 1.00 53.41 N ATOM 62 CZ ARG A 209 40.195 17.729 4.652 1.00 55.73 C ATOM 63 NH1 ARG A 209 40.438 18.998 4.308 1.00 57.73 N ATOM 64 NH2 ARG A 209 39.993 16.793 3.718 1.00 55.87 N ATOM 0 H ARG A 209 37.608 18.127 10.210 1.00 30.13 H new ATOM 0 HA ARG A 209 40.048 17.597 10.985 1.00 31.76 H new ATOM 0 HB2 ARG A 209 38.996 19.456 9.136 1.00 38.43 H new ATOM 0 HB3 ARG A 209 40.521 19.505 9.459 1.00 38.43 H new ATOM 0 HG2 ARG A 209 40.732 17.236 8.653 1.00 42.15 H new ATOM 0 HG3 ARG A 209 39.222 17.255 8.264 1.00 42.15 H new ATOM 0 HD2 ARG A 209 39.829 19.170 6.839 1.00 47.56 H new ATOM 0 HD3 ARG A 209 41.293 18.661 7.008 1.00 47.56 H new ATOM 0 HE ARG A 209 39.994 16.596 6.149 1.00 53.41 H new ATOM 0 HH11 ARG A 209 40.564 19.592 4.917 1.00 57.73 H new ATOM 0 HH12 ARG A 209 40.468 19.220 3.478 1.00 57.73 H new ATOM 0 HH21 ARG A 209 39.835 15.980 3.951 1.00 55.87 H new ATOM 0 HH22 ARG A 209 40.021 17.004 2.885 1.00 55.87 H new ATOM 65 N ILE A 210 38.825 20.270 12.208 1.00 27.95 N ATOM 66 CA ILE A 210 39.051 21.317 13.184 1.00 23.54 C ATOM 67 C ILE A 210 39.103 20.679 14.568 1.00 24.45 C ATOM 68 O ILE A 210 40.021 20.992 15.349 1.00 26.23 O ATOM 69 CB ILE A 210 38.000 22.469 13.060 1.00 25.72 C ATOM 70 CG1 ILE A 210 38.324 23.317 11.802 1.00 27.18 C ATOM 71 CG2 ILE A 210 37.978 23.347 14.300 1.00 20.03 C ATOM 72 CD1 ILE A 210 37.139 24.016 11.158 1.00 25.47 C ATOM 0 H ILE A 210 38.030 20.253 11.882 1.00 27.95 H new ATOM 0 HA ILE A 210 39.902 21.751 13.018 1.00 23.54 H new ATOM 0 HB ILE A 210 37.118 22.074 12.974 1.00 25.72 H new ATOM 0 HG12 ILE A 210 38.982 23.987 12.044 1.00 27.18 H new ATOM 0 HG13 ILE A 210 38.737 22.740 11.141 1.00 27.18 H new ATOM 0 HG21 ILE A 210 37.317 24.048 14.188 1.00 20.03 H new ATOM 0 HG22 ILE A 210 37.750 22.809 15.074 1.00 20.03 H new ATOM 0 HG23 ILE A 210 38.853 23.745 14.430 1.00 20.03 H new ATOM 0 HD11 ILE A 210 37.440 24.518 10.384 1.00 25.47 H new ATOM 0 HD12 ILE A 210 36.485 23.355 10.880 1.00 25.47 H new ATOM 0 HD13 ILE A 210 36.734 24.622 11.798 1.00 25.47 H new ATOM 73 N TYR A 211 38.166 19.763 14.837 1.00 20.43 N ATOM 74 CA TYR A 211 38.097 19.057 16.093 1.00 20.61 C ATOM 75 C TYR A 211 39.394 18.252 16.341 1.00 24.35 C ATOM 76 O TYR A 211 39.987 18.327 17.398 1.00 21.85 O ATOM 77 CB TYR A 211 36.860 18.158 16.171 1.00 19.39 C ATOM 78 CG TYR A 211 36.607 17.634 17.578 1.00 22.13 C ATOM 79 CD1 TYR A 211 37.156 18.271 18.684 1.00 20.31 C ATOM 80 CD2 TYR A 211 35.832 16.486 17.808 1.00 23.72 C ATOM 81 CE1 TYR A 211 36.948 17.797 19.965 1.00 21.77 C ATOM 82 CE2 TYR A 211 35.592 16.007 19.123 1.00 18.74 C ATOM 83 CZ TYR A 211 36.168 16.655 20.183 1.00 21.98 C ATOM 84 OH TYR A 211 35.958 16.193 21.509 1.00 24.17 O ATOM 0 H TYR A 211 37.550 19.540 14.280 1.00 20.43 H new ATOM 0 HA TYR A 211 38.013 19.718 16.798 1.00 20.61 H new ATOM 0 HB2 TYR A 211 36.083 18.655 15.870 1.00 19.39 H new ATOM 0 HB3 TYR A 211 36.970 17.409 15.565 1.00 19.39 H new ATOM 0 HD1 TYR A 211 37.675 19.033 18.559 1.00 20.31 H new ATOM 0 HD2 TYR A 211 35.468 16.030 17.084 1.00 23.72 H new ATOM 0 HE1 TYR A 211 37.329 18.240 20.688 1.00 21.77 H new ATOM 0 HE2 TYR A 211 35.051 15.263 19.262 1.00 18.74 H new ATOM 0 HH TYR A 211 35.475 15.506 21.493 1.00 24.17 H new ATOM 85 N GLU A 212 39.828 17.481 15.365 1.00 25.93 N ATOM 86 CA GLU A 212 41.078 16.733 15.496 1.00 26.09 C ATOM 87 C GLU A 212 42.264 17.689 15.736 1.00 22.37 C ATOM 88 O GLU A 212 43.097 17.446 16.593 1.00 23.49 O ATOM 89 CB GLU A 212 41.269 15.875 14.221 1.00 28.80 C ATOM 90 CG GLU A 212 42.579 15.112 14.081 1.00 35.95 C ATOM 91 CD GLU A 212 42.572 14.111 12.917 1.00 40.00 C ATOM 92 OE1 GLU A 212 43.558 14.032 12.171 1.00 43.51 O ATOM 93 OE2 GLU A 212 41.590 13.358 12.741 1.00 45.01 O ATOM 0 H GLU A 212 39.420 17.372 14.616 1.00 25.93 H new ATOM 0 HA GLU A 212 41.040 16.145 16.267 1.00 26.09 H new ATOM 0 HB2 GLU A 212 40.542 15.234 14.179 1.00 28.80 H new ATOM 0 HB3 GLU A 212 41.177 16.458 13.451 1.00 28.80 H new ATOM 0 HG2 GLU A 212 43.303 15.744 13.952 1.00 35.95 H new ATOM 0 HG3 GLU A 212 42.760 14.638 14.907 1.00 35.95 H new ATOM 94 N ALA A 213 42.335 18.787 14.994 1.00 24.59 N ATOM 95 CA ALA A 213 43.426 19.772 15.165 1.00 24.67 C ATOM 96 C ALA A 213 43.429 20.358 16.582 1.00 24.50 C ATOM 97 O ALA A 213 44.486 20.605 17.191 1.00 26.35 O ATOM 98 CB ALA A 213 43.327 20.914 14.106 1.00 20.17 C ATOM 0 H ALA A 213 41.766 18.990 14.382 1.00 24.59 H new ATOM 0 HA ALA A 213 44.263 19.302 15.029 1.00 24.67 H new ATOM 0 HB1 ALA A 213 44.052 21.544 14.241 1.00 20.17 H new ATOM 0 HB2 ALA A 213 43.389 20.536 13.215 1.00 20.17 H new ATOM 0 HB3 ALA A 213 42.478 21.373 14.203 1.00 20.17 H new ATOM 99 N TYR A 214 42.235 20.588 17.105 1.00 22.22 N ATOM 100 CA TYR A 214 42.095 21.091 18.454 1.00 23.79 C ATOM 101 C TYR A 214 42.585 20.069 19.469 1.00 23.86 C ATOM 102 O TYR A 214 43.349 20.407 20.360 1.00 24.11 O ATOM 103 CB TYR A 214 40.647 21.397 18.722 1.00 23.71 C ATOM 104 CG TYR A 214 40.195 21.776 20.125 1.00 26.39 C ATOM 105 CD1 TYR A 214 39.935 23.112 20.445 1.00 25.15 C ATOM 106 CD2 TYR A 214 39.958 20.808 21.101 1.00 26.03 C ATOM 107 CE1 TYR A 214 39.492 23.474 21.688 1.00 24.93 C ATOM 108 CE2 TYR A 214 39.516 21.170 22.367 1.00 26.77 C ATOM 109 CZ TYR A 214 39.275 22.508 22.649 1.00 27.29 C ATOM 110 OH TYR A 214 38.796 22.913 23.893 1.00 26.77 O ATOM 0 H TYR A 214 41.492 20.458 16.691 1.00 22.22 H new ATOM 0 HA TYR A 214 42.631 21.895 18.540 1.00 23.79 H new ATOM 0 HB2 TYR A 214 40.392 22.123 18.131 1.00 23.71 H new ATOM 0 HB3 TYR A 214 40.134 20.619 18.454 1.00 23.71 H new ATOM 0 HD1 TYR A 214 40.066 23.768 19.799 1.00 25.15 H new ATOM 0 HD2 TYR A 214 40.097 19.910 20.902 1.00 26.03 H new ATOM 0 HE1 TYR A 214 39.337 24.370 21.885 1.00 24.93 H new ATOM 0 HE2 TYR A 214 39.383 20.522 23.020 1.00 26.77 H new ATOM 0 HH TYR A 214 38.420 22.265 24.273 1.00 26.77 H new ATOM 111 N LEU A 215 42.147 18.827 19.377 1.00 24.23 N ATOM 112 CA LEU A 215 42.573 17.886 20.426 1.00 27.28 C ATOM 113 C LEU A 215 44.073 17.629 20.307 1.00 25.76 C ATOM 114 O LEU A 215 44.713 17.364 21.280 1.00 27.09 O ATOM 115 CB LEU A 215 41.823 16.569 20.337 1.00 27.51 C ATOM 116 CG LEU A 215 40.335 16.613 20.717 1.00 28.65 C ATOM 117 CD1 LEU A 215 39.693 15.323 20.322 1.00 25.24 C ATOM 118 CD2 LEU A 215 40.147 16.864 22.233 1.00 26.11 C ATOM 0 H LEU A 215 41.635 18.512 18.762 1.00 24.23 H new ATOM 0 HA LEU A 215 42.371 18.288 21.286 1.00 27.28 H new ATOM 0 HB2 LEU A 215 41.897 16.236 19.429 1.00 27.51 H new ATOM 0 HB3 LEU A 215 42.266 15.926 20.912 1.00 27.51 H new ATOM 0 HG LEU A 215 39.914 17.349 20.246 1.00 28.65 H new ATOM 0 HD11 LEU A 215 38.753 15.343 20.559 1.00 25.24 H new ATOM 0 HD12 LEU A 215 39.782 15.197 19.364 1.00 25.24 H new ATOM 0 HD13 LEU A 215 40.127 14.590 20.786 1.00 25.24 H new ATOM 0 HD21 LEU A 215 39.200 16.887 22.442 1.00 26.11 H new ATOM 0 HD22 LEU A 215 40.572 16.151 22.734 1.00 26.11 H new ATOM 0 HD23 LEU A 215 40.551 17.712 22.473 1.00 26.11 H new ATOM 119 N LYS A 216 44.606 17.709 19.090 1.00 29.52 N ATOM 120 CA LYS A 216 46.000 17.394 18.839 1.00 32.01 C ATOM 121 C LYS A 216 46.907 18.541 19.296 1.00 30.50 C ATOM 122 O LYS A 216 48.041 18.325 19.703 1.00 31.99 O ATOM 123 CB LYS A 216 46.203 17.032 17.361 1.00 36.03 C ATOM 124 CG LYS A 216 47.656 17.160 16.834 1.00 45.79 C ATOM 125 CD LYS A 216 47.898 16.379 15.493 1.00 51.86 C ATOM 126 CE LYS A 216 49.047 16.987 14.606 1.00 55.84 C ATOM 127 NZ LYS A 216 50.407 16.786 15.205 1.00 57.43 N ATOM 0 H LYS A 216 44.166 17.948 18.390 1.00 29.52 H new ATOM 0 HA LYS A 216 46.252 16.617 19.362 1.00 32.01 H new ATOM 0 HB2 LYS A 216 45.906 16.119 17.224 1.00 36.03 H new ATOM 0 HB3 LYS A 216 45.630 17.601 16.824 1.00 36.03 H new ATOM 0 HG2 LYS A 216 47.863 18.098 16.697 1.00 45.79 H new ATOM 0 HG3 LYS A 216 48.269 16.830 17.509 1.00 45.79 H new ATOM 0 HD2 LYS A 216 48.114 15.456 15.700 1.00 51.86 H new ATOM 0 HD3 LYS A 216 47.075 16.370 14.980 1.00 51.86 H new ATOM 0 HE2 LYS A 216 49.022 16.579 13.726 1.00 55.84 H new ATOM 0 HE3 LYS A 216 48.888 17.936 14.484 1.00 55.84 H new ATOM 0 HZ1 LYS A 216 51.023 17.144 14.671 1.00 57.43 H new ATOM 0 HZ2 LYS A 216 50.441 17.179 16.003 1.00 57.43 H new ATOM 0 HZ3 LYS A 216 50.565 15.915 15.297 1.00 57.43 H new ATOM 128 N ASN A 217 46.395 19.764 19.285 1.00 28.74 N ATOM 129 CA ASN A 217 47.271 20.907 19.570 1.00 28.54 C ATOM 130 C ASN A 217 47.233 21.560 20.913 1.00 25.91 C ATOM 131 O ASN A 217 48.210 22.211 21.284 1.00 26.01 O ATOM 132 CB ASN A 217 47.096 21.987 18.515 1.00 27.23 C ATOM 133 CG ASN A 217 47.736 21.582 17.219 1.00 29.31 C ATOM 134 OD1 ASN A 217 49.035 21.644 17.208 1.00 27.41 O flip ATOM 135 ND2 ASN A 217 47.059 21.176 16.238 1.00 24.46 N flip ATOM 0 H ASN A 217 45.573 19.957 19.122 1.00 28.74 H new ATOM 0 HA ASN A 217 48.138 20.473 19.557 1.00 28.54 H new ATOM 0 HB2 ASN A 217 46.151 22.156 18.374 1.00 27.23 H new ATOM 0 HB3 ASN A 217 47.489 22.817 18.828 1.00 27.23 H new ATOM 0 HD21 ASN A 217 46.201 21.151 16.288 1.00 24.46 H new ATOM 0 HD22 ASN A 217 47.455 20.923 15.518 1.00 24.46 H new ATOM 136 N PHE A 218 46.120 21.446 21.628 1.00 25.54 N ATOM 137 CA PHE A 218 46.054 22.108 22.914 1.00 27.19 C ATOM 138 C PHE A 218 46.270 21.123 24.030 1.00 29.74 C ATOM 139 O PHE A 218 45.530 20.168 24.165 1.00 28.79 O ATOM 140 CB PHE A 218 44.737 22.855 23.101 1.00 24.38 C ATOM 141 CG PHE A 218 44.467 23.906 22.015 1.00 23.69 C ATOM 142 CD1 PHE A 218 45.167 25.112 22.006 1.00 19.79 C ATOM 143 CD2 PHE A 218 43.521 23.655 20.997 1.00 22.41 C ATOM 144 CE1 PHE A 218 44.912 26.072 21.031 1.00 21.26 C ATOM 145 CE2 PHE A 218 43.255 24.589 20.005 1.00 21.49 C ATOM 146 CZ PHE A 218 43.953 25.824 20.022 1.00 20.96 C ATOM 0 H PHE A 218 45.418 21.007 21.395 1.00 25.54 H new ATOM 0 HA PHE A 218 46.766 22.766 22.939 1.00 27.19 H new ATOM 0 HB2 PHE A 218 44.009 22.214 23.109 1.00 24.38 H new ATOM 0 HB3 PHE A 218 44.741 23.290 23.968 1.00 24.38 H new ATOM 0 HD1 PHE A 218 45.810 25.276 22.657 1.00 19.79 H new ATOM 0 HD2 PHE A 218 43.065 22.844 20.991 1.00 22.41 H new ATOM 0 HE1 PHE A 218 45.374 26.879 21.043 1.00 21.26 H new ATOM 0 HE2 PHE A 218 42.630 24.408 19.341 1.00 21.49 H new ATOM 0 HZ PHE A 218 43.781 26.467 19.373 1.00 20.96 H new ATOM 147 N ASN A 219 47.291 21.372 24.840 1.00 35.12 N ATOM 148 CA ASN A 219 47.628 20.500 25.985 1.00 35.62 C ATOM 149 C ASN A 219 46.498 20.394 26.983 1.00 31.47 C ATOM 150 O ASN A 219 46.329 19.386 27.636 1.00 32.36 O ATOM 151 CB ASN A 219 48.911 20.990 26.707 1.00 39.53 C ATOM 152 CG ASN A 219 48.686 22.284 27.571 1.00 45.20 C ATOM 153 OD1 ASN A 219 48.132 22.122 28.767 1.00 48.35 O flip ATOM 154 ND2 ASN A 219 49.038 23.406 27.152 1.00 45.71 N flip ATOM 0 H ASN A 219 47.814 22.049 24.750 1.00 35.12 H new ATOM 0 HA ASN A 219 47.785 19.618 25.614 1.00 35.62 H new ATOM 0 HB2 ASN A 219 49.243 20.281 27.279 1.00 39.53 H new ATOM 0 HB3 ASN A 219 49.599 21.166 26.046 1.00 39.53 H new ATOM 0 HD21 ASN A 219 49.394 23.482 26.373 1.00 45.71 H new ATOM 0 HD22 ASN A 219 48.924 24.103 27.642 1.00 45.71 H new ATOM 155 N MET A 220 45.724 21.453 27.135 1.00 30.91 N ATOM 156 CA MET A 220 44.577 21.376 28.008 1.00 29.39 C ATOM 157 C MET A 220 43.269 21.465 27.191 1.00 30.89 C ATOM 158 O MET A 220 43.177 22.257 26.267 1.00 29.10 O ATOM 159 CB MET A 220 44.622 22.490 29.053 1.00 29.97 C ATOM 160 CG MET A 220 43.348 22.568 29.875 1.00 30.24 C ATOM 161 SD MET A 220 43.248 21.251 31.117 1.00 33.83 S ATOM 162 CE MET A 220 44.974 21.435 31.958 1.00 28.52 C ATOM 0 H MET A 220 45.844 22.212 26.748 1.00 30.91 H new ATOM 0 HA MET A 220 44.600 20.521 28.466 1.00 29.39 H new ATOM 0 HB2 MET A 220 45.377 22.344 29.645 1.00 29.97 H new ATOM 0 HB3 MET A 220 44.770 23.340 28.609 1.00 29.97 H new ATOM 0 HG2 MET A 220 43.303 23.430 30.317 1.00 30.24 H new ATOM 0 HG3 MET A 220 42.581 22.512 29.284 1.00 30.24 H new ATOM 0 HE1 MET A 220 44.920 21.134 32.878 1.00 28.52 H new ATOM 0 HE2 MET A 220 45.626 20.898 31.480 1.00 28.52 H new ATOM 0 HE3 MET A 220 45.246 22.366 31.939 1.00 28.52 H new ATOM 163 N ASN A 221 42.280 20.654 27.558 1.00 31.23 N ATOM 164 CA ASN A 221 40.931 20.736 26.989 1.00 32.84 C ATOM 165 C ASN A 221 39.833 20.617 28.051 1.00 31.38 C ATOM 166 O ASN A 221 40.102 20.405 29.238 1.00 31.58 O ATOM 167 CB ASN A 221 40.711 19.713 25.858 1.00 29.87 C ATOM 168 CG ASN A 221 40.965 18.284 26.280 1.00 30.00 C ATOM 169 OD1 ASN A 221 40.450 17.817 27.307 1.00 32.91 O ATOM 170 ND2 ASN A 221 41.774 17.565 25.482 1.00 28.27 N ATOM 0 H ASN A 221 42.371 20.035 28.148 1.00 31.23 H new ATOM 0 HA ASN A 221 40.864 21.623 26.603 1.00 32.84 H new ATOM 0 HB2 ASN A 221 39.800 19.790 25.535 1.00 29.87 H new ATOM 0 HB3 ASN A 221 41.295 19.932 25.115 1.00 29.87 H new ATOM 0 HD21 ASN A 221 41.953 16.746 25.676 1.00 28.27 H new ATOM 0 HD22 ASN A 221 42.113 17.924 24.778 1.00 28.27 H new ATOM 171 N LYS A 222 38.588 20.736 27.635 1.00 31.57 N ATOM 172 CA LYS A 222 37.527 20.749 28.634 1.00 32.33 C ATOM 173 C LYS A 222 37.349 19.433 29.378 1.00 32.92 C ATOM 174 O LYS A 222 37.160 19.440 30.594 1.00 28.13 O ATOM 175 CB LYS A 222 36.208 21.249 28.065 1.00 31.78 C ATOM 176 CG LYS A 222 35.309 21.837 29.142 1.00 33.67 C ATOM 177 CD LYS A 222 34.170 22.588 28.540 1.00 31.66 C ATOM 178 CE LYS A 222 33.253 23.218 29.590 1.00 31.33 C ATOM 179 NZ LYS A 222 32.122 23.857 28.857 1.00 33.44 N ATOM 0 H LYS A 222 38.337 20.808 26.816 1.00 31.57 H new ATOM 0 HA LYS A 222 37.826 21.386 29.301 1.00 32.33 H new ATOM 0 HB2 LYS A 222 36.383 21.922 27.388 1.00 31.78 H new ATOM 0 HB3 LYS A 222 35.748 20.517 27.625 1.00 31.78 H new ATOM 0 HG2 LYS A 222 34.969 21.126 29.707 1.00 33.67 H new ATOM 0 HG3 LYS A 222 35.826 22.429 29.711 1.00 33.67 H new ATOM 0 HD2 LYS A 222 34.517 23.284 27.961 1.00 31.66 H new ATOM 0 HD3 LYS A 222 33.651 21.988 27.982 1.00 31.66 H new ATOM 0 HE2 LYS A 222 32.925 22.545 30.207 1.00 31.33 H new ATOM 0 HE3 LYS A 222 33.735 23.875 30.116 1.00 31.33 H new ATOM 0 HZ1 LYS A 222 31.448 24.002 29.419 1.00 33.44 H new ATOM 0 HZ2 LYS A 222 32.392 24.632 28.512 1.00 33.44 H new ATOM 0 HZ3 LYS A 222 31.851 23.319 28.202 1.00 33.44 H new ATOM 180 N VAL A 223 37.408 18.295 28.676 1.00 31.76 N ATOM 181 CA VAL A 223 37.244 17.035 29.413 1.00 29.31 C ATOM 182 C VAL A 223 38.326 16.939 30.490 1.00 29.30 C ATOM 183 O VAL A 223 38.045 16.714 31.662 1.00 26.37 O ATOM 184 CB VAL A 223 37.356 15.786 28.531 1.00 30.07 C ATOM 185 CG1 VAL A 223 37.007 14.561 29.351 1.00 28.67 C ATOM 186 CG2 VAL A 223 36.426 15.859 27.344 1.00 30.52 C ATOM 0 H VAL A 223 37.534 18.229 27.828 1.00 31.76 H new ATOM 0 HA VAL A 223 36.349 17.055 29.787 1.00 29.31 H new ATOM 0 HB VAL A 223 38.267 15.732 28.204 1.00 30.07 H new ATOM 0 HG11 VAL A 223 37.077 13.769 28.796 1.00 28.67 H new ATOM 0 HG12 VAL A 223 37.620 14.486 30.099 1.00 28.67 H new ATOM 0 HG13 VAL A 223 36.100 14.642 29.685 1.00 28.67 H new ATOM 0 HG21 VAL A 223 36.521 15.056 26.808 1.00 30.52 H new ATOM 0 HG22 VAL A 223 35.510 15.933 27.654 1.00 30.52 H new ATOM 0 HG23 VAL A 223 36.648 16.635 26.806 1.00 30.52 H new ATOM 187 N LYS A 224 39.580 17.095 30.092 1.00 27.65 N ATOM 188 CA LYS A 224 40.636 17.051 31.087 1.00 32.07 C ATOM 189 C LYS A 224 40.391 18.086 32.194 1.00 31.56 C ATOM 190 O LYS A 224 40.574 17.788 33.370 1.00 30.34 O ATOM 191 CB LYS A 224 41.986 17.310 30.436 1.00 33.01 C ATOM 192 CG LYS A 224 43.088 17.501 31.393 1.00 34.07 C ATOM 193 CD LYS A 224 44.374 17.680 30.607 1.00 37.55 C ATOM 194 CE LYS A 224 45.592 17.489 31.481 1.00 39.60 C ATOM 195 NZ LYS A 224 46.732 17.206 30.583 1.00 45.01 N ATOM 0 H LYS A 224 39.834 17.223 29.281 1.00 27.65 H new ATOM 0 HA LYS A 224 40.635 16.166 31.484 1.00 32.07 H new ATOM 0 HB2 LYS A 224 42.202 16.565 29.854 1.00 33.01 H new ATOM 0 HB3 LYS A 224 41.918 18.098 29.875 1.00 33.01 H new ATOM 0 HG2 LYS A 224 42.921 18.277 31.950 1.00 34.07 H new ATOM 0 HG3 LYS A 224 43.158 16.736 31.986 1.00 34.07 H new ATOM 0 HD2 LYS A 224 44.398 17.044 29.875 1.00 37.55 H new ATOM 0 HD3 LYS A 224 44.393 18.567 30.214 1.00 37.55 H new ATOM 0 HE2 LYS A 224 45.762 18.284 32.010 1.00 39.60 H new ATOM 0 HE3 LYS A 224 45.456 16.757 32.103 1.00 39.60 H new ATOM 0 HZ1 LYS A 224 47.469 17.088 31.067 1.00 45.01 H new ATOM 0 HZ2 LYS A 224 46.564 16.469 30.113 1.00 45.01 H new ATOM 0 HZ3 LYS A 224 46.849 17.891 30.027 1.00 45.01 H new ATOM 196 N ALA A 225 39.970 19.287 31.829 1.00 29.83 N ATOM 197 CA ALA A 225 39.822 20.329 32.834 1.00 30.66 C ATOM 198 C ALA A 225 38.718 19.980 33.823 1.00 33.52 C ATOM 199 O ALA A 225 38.892 20.146 35.024 1.00 31.96 O ATOM 200 CB ALA A 225 39.547 21.669 32.195 1.00 32.38 C ATOM 0 H ALA A 225 39.769 19.517 31.025 1.00 29.83 H new ATOM 0 HA ALA A 225 40.661 20.389 33.318 1.00 30.66 H new ATOM 0 HB1 ALA A 225 39.453 22.344 32.885 1.00 32.38 H new ATOM 0 HB2 ALA A 225 40.284 21.906 31.610 1.00 32.38 H new ATOM 0 HB3 ALA A 225 38.728 21.619 31.678 1.00 32.38 H new ATOM 201 N ARG A 226 37.589 19.497 33.319 1.00 34.46 N ATOM 202 CA ARG A 226 36.462 19.210 34.185 1.00 40.79 C ATOM 203 C ARG A 226 36.782 18.049 35.128 1.00 42.20 C ATOM 204 O ARG A 226 36.440 18.107 36.316 1.00 42.48 O ATOM 205 CB ARG A 226 35.178 18.952 33.385 1.00 42.65 C ATOM 206 CG ARG A 226 34.575 20.236 32.801 1.00 47.80 C ATOM 207 CD ARG A 226 34.095 21.285 33.842 1.00 51.72 C ATOM 208 NE ARG A 226 34.699 22.601 33.601 1.00 53.51 N ATOM 209 CZ ARG A 226 34.618 23.649 34.417 1.00 53.06 C ATOM 210 NH1 ARG A 226 33.960 23.579 35.568 1.00 52.16 N ATOM 211 NH2 ARG A 226 35.217 24.786 34.077 1.00 54.74 N ATOM 0 H ARG A 226 37.458 19.331 32.485 1.00 34.46 H new ATOM 0 HA ARG A 226 36.300 19.998 34.727 1.00 40.79 H new ATOM 0 HB2 ARG A 226 35.370 18.332 32.664 1.00 42.65 H new ATOM 0 HB3 ARG A 226 34.524 18.524 33.960 1.00 42.65 H new ATOM 0 HG2 ARG A 226 35.236 20.653 32.227 1.00 47.80 H new ATOM 0 HG3 ARG A 226 33.823 19.994 32.238 1.00 47.80 H new ATOM 0 HD2 ARG A 226 33.129 21.360 33.805 1.00 51.72 H new ATOM 0 HD3 ARG A 226 34.322 20.983 34.735 1.00 51.72 H new ATOM 0 HE ARG A 226 35.142 22.703 32.871 1.00 53.51 H new ATOM 0 HH11 ARG A 226 33.575 22.846 35.799 1.00 52.16 H new ATOM 0 HH12 ARG A 226 33.919 24.267 36.082 1.00 52.16 H new ATOM 0 HH21 ARG A 226 35.651 24.839 33.336 1.00 54.74 H new ATOM 0 HH22 ARG A 226 35.170 25.469 34.598 1.00 54.74 H new ATOM 212 N VAL A 227 37.453 17.021 34.602 1.00 39.73 N ATOM 213 CA VAL A 227 37.837 15.869 35.403 1.00 38.96 C ATOM 214 C VAL A 227 38.788 16.303 36.533 1.00 41.34 C ATOM 215 O VAL A 227 38.601 15.941 37.705 1.00 41.99 O ATOM 216 CB VAL A 227 38.440 14.737 34.511 1.00 38.73 C ATOM 217 CG1 VAL A 227 39.154 13.693 35.345 1.00 38.20 C ATOM 218 CG2 VAL A 227 37.340 14.076 33.599 1.00 33.99 C ATOM 0 H VAL A 227 37.694 16.977 33.778 1.00 39.73 H new ATOM 0 HA VAL A 227 37.044 15.495 35.818 1.00 38.96 H new ATOM 0 HB VAL A 227 39.098 15.149 33.929 1.00 38.73 H new ATOM 0 HG11 VAL A 227 39.516 13.006 34.764 1.00 38.20 H new ATOM 0 HG12 VAL A 227 39.876 14.112 35.839 1.00 38.20 H new ATOM 0 HG13 VAL A 227 38.527 13.292 35.967 1.00 38.20 H new ATOM 0 HG21 VAL A 227 37.744 13.379 33.058 1.00 33.99 H new ATOM 0 HG22 VAL A 227 36.646 13.691 34.156 1.00 33.99 H new ATOM 0 HG23 VAL A 227 36.952 14.750 33.019 1.00 33.99 H new ATOM 219 N ILE A 228 39.800 17.091 36.199 1.00 40.40 N ATOM 220 CA ILE A 228 40.693 17.567 37.220 1.00 39.98 C ATOM 221 C ILE A 228 39.966 18.436 38.255 1.00 44.24 C ATOM 222 O ILE A 228 40.165 18.242 39.462 1.00 46.77 O ATOM 223 CB ILE A 228 41.852 18.305 36.623 1.00 39.04 C ATOM 224 CG1 ILE A 228 42.700 17.340 35.823 1.00 35.56 C ATOM 225 CG2 ILE A 228 42.701 18.998 37.772 1.00 39.15 C ATOM 226 CD1 ILE A 228 43.854 17.990 35.134 1.00 37.79 C ATOM 0 H ILE A 228 39.979 17.354 35.400 1.00 40.40 H new ATOM 0 HA ILE A 228 41.037 16.788 37.685 1.00 39.98 H new ATOM 0 HB ILE A 228 41.530 19.000 36.028 1.00 39.04 H new ATOM 0 HG12 ILE A 228 43.034 16.648 36.414 1.00 35.56 H new ATOM 0 HG13 ILE A 228 42.142 16.903 35.161 1.00 35.56 H new ATOM 0 HG21 ILE A 228 43.449 19.474 37.379 1.00 39.15 H new ATOM 0 HG22 ILE A 228 42.140 19.623 38.257 1.00 39.15 H new ATOM 0 HG23 ILE A 228 43.033 18.321 38.382 1.00 39.15 H new ATOM 0 HD11 ILE A 228 44.355 17.322 34.641 1.00 37.79 H new ATOM 0 HD12 ILE A 228 43.526 18.665 34.520 1.00 37.79 H new ATOM 0 HD13 ILE A 228 44.432 18.406 35.793 1.00 37.79 H new ATOM 227 N LEU A 229 39.120 19.365 37.813 1.00 45.32 N ATOM 228 CA LEU A 229 38.412 20.257 38.758 1.00 48.50 C ATOM 229 C LEU A 229 37.512 19.521 39.779 1.00 51.11 C ATOM 230 O LEU A 229 37.414 19.941 40.939 1.00 48.61 O ATOM 231 CB LEU A 229 37.604 21.350 38.043 1.00 45.18 C ATOM 232 CG LEU A 229 38.426 22.445 37.349 1.00 46.66 C ATOM 233 CD1 LEU A 229 37.593 23.249 36.363 1.00 43.95 C ATOM 234 CD2 LEU A 229 39.110 23.352 38.378 1.00 47.51 C ATOM 0 H LEU A 229 38.938 19.501 36.984 1.00 45.32 H new ATOM 0 HA LEU A 229 39.127 20.674 39.263 1.00 48.50 H new ATOM 0 HB2 LEU A 229 37.036 20.927 37.380 1.00 45.18 H new ATOM 0 HB3 LEU A 229 37.018 21.771 38.691 1.00 45.18 H new ATOM 0 HG LEU A 229 39.118 22.003 36.833 1.00 46.66 H new ATOM 0 HD11 LEU A 229 38.148 23.928 35.948 1.00 43.95 H new ATOM 0 HD12 LEU A 229 37.240 22.658 35.679 1.00 43.95 H new ATOM 0 HD13 LEU A 229 36.858 23.675 36.832 1.00 43.95 H new ATOM 0 HD21 LEU A 229 39.623 24.035 37.918 1.00 47.51 H new ATOM 0 HD22 LEU A 229 38.438 23.774 38.935 1.00 47.51 H new ATOM 0 HD23 LEU A 229 39.703 22.822 38.933 1.00 47.51 H new ATOM 235 N SER A 230 36.873 18.432 39.348 1.00 53.94 N ATOM 236 CA SER A 230 36.019 17.651 40.238 1.00 58.64 C ATOM 237 C SER A 230 36.162 16.185 39.919 1.00 59.65 C ATOM 238 O SER A 230 35.737 15.766 38.839 1.00 59.17 O ATOM 239 CB SER A 230 34.551 18.058 40.071 1.00 61.79 C ATOM 240 OG SER A 230 34.251 19.277 40.762 1.00 63.96 O ATOM 0 H SER A 230 36.922 18.131 38.544 1.00 53.94 H new ATOM 0 HA SER A 230 36.293 17.820 41.153 1.00 58.64 H new ATOM 0 HB2 SER A 230 34.351 18.164 39.128 1.00 61.79 H new ATOM 0 HB3 SER A 230 33.979 17.349 40.405 1.00 61.79 H new ATOM 0 HG SER A 230 33.442 19.471 40.649 1.00 63.96 H new ATOM 241 N PRO A 237 45.288 15.033 43.408 1.00 51.92 N ATOM 242 CA PRO A 237 44.657 16.358 43.582 1.00 51.63 C ATOM 243 C PRO A 237 45.628 17.548 43.339 1.00 51.83 C ATOM 244 O PRO A 237 46.837 17.471 43.616 1.00 49.69 O ATOM 245 CB PRO A 237 44.142 16.330 45.036 1.00 52.61 C ATOM 246 CG PRO A 237 44.945 15.197 45.727 1.00 52.83 C ATOM 247 CD PRO A 237 45.814 14.497 44.679 1.00 50.89 C ATOM 0 HA PRO A 237 43.955 16.504 42.928 1.00 51.63 H new ATOM 0 HB2 PRO A 237 44.288 17.182 45.476 1.00 52.61 H new ATOM 0 HB3 PRO A 237 43.189 16.154 45.067 1.00 52.61 H new ATOM 0 HG2 PRO A 237 45.500 15.562 46.434 1.00 52.83 H new ATOM 0 HG3 PRO A 237 44.340 14.561 46.141 1.00 52.83 H new ATOM 0 HD2 PRO A 237 46.755 14.704 44.795 1.00 50.89 H new ATOM 0 HD3 PRO A 237 45.728 13.532 44.726 1.00 50.89 H new ATOM 248 N PRO A 238 45.100 18.638 42.778 1.00 51.39 N ATOM 249 CA PRO A 238 45.917 19.831 42.493 1.00 49.76 C ATOM 250 C PRO A 238 46.295 20.633 43.757 1.00 48.35 C ATOM 251 O PRO A 238 45.465 20.858 44.650 1.00 45.79 O ATOM 252 CB PRO A 238 45.012 20.684 41.584 1.00 51.24 C ATOM 253 CG PRO A 238 43.694 19.971 41.475 1.00 51.41 C ATOM 254 CD PRO A 238 43.695 18.784 42.362 1.00 51.02 C ATOM 0 HA PRO A 238 46.765 19.582 42.094 1.00 49.76 H new ATOM 0 HB2 PRO A 238 44.891 21.571 41.957 1.00 51.24 H new ATOM 0 HB3 PRO A 238 45.414 20.796 40.708 1.00 51.24 H new ATOM 0 HG2 PRO A 238 42.971 20.569 41.721 1.00 51.41 H new ATOM 0 HG3 PRO A 238 43.538 19.700 40.557 1.00 51.41 H new ATOM 0 HD2 PRO A 238 43.112 18.913 43.126 1.00 51.02 H new ATOM 0 HD3 PRO A 238 43.381 17.994 41.896 1.00 51.02 H new ATOM 255 N PHE A 239 47.549 21.058 43.818 1.00 46.96 N ATOM 256 CA PHE A 239 48.012 21.951 44.873 1.00 45.73 C ATOM 257 C PHE A 239 47.265 23.310 44.853 1.00 45.58 C ATOM 258 O PHE A 239 47.187 23.985 43.809 1.00 45.08 O ATOM 259 CB PHE A 239 49.505 22.175 44.714 1.00 47.68 C ATOM 260 CG PHE A 239 50.107 22.963 45.831 1.00 51.28 C ATOM 261 CD1 PHE A 239 50.418 24.314 45.661 1.00 50.51 C ATOM 262 CD2 PHE A 239 50.356 22.362 47.062 1.00 51.83 C ATOM 263 CE1 PHE A 239 50.970 25.053 46.686 1.00 51.50 C ATOM 264 CE2 PHE A 239 50.910 23.102 48.108 1.00 54.42 C ATOM 265 CZ PHE A 239 51.219 24.456 47.918 1.00 52.73 C ATOM 0 H PHE A 239 48.156 20.838 43.250 1.00 46.96 H new ATOM 0 HA PHE A 239 47.825 21.533 45.728 1.00 45.73 H new ATOM 0 HB2 PHE A 239 49.950 21.315 44.657 1.00 47.68 H new ATOM 0 HB3 PHE A 239 49.669 22.636 43.876 1.00 47.68 H new ATOM 0 HD1 PHE A 239 50.250 24.722 44.842 1.00 50.51 H new ATOM 0 HD2 PHE A 239 50.152 21.463 47.188 1.00 51.83 H new ATOM 0 HE1 PHE A 239 51.176 25.950 46.554 1.00 51.50 H new ATOM 0 HE2 PHE A 239 51.074 22.698 48.929 1.00 54.42 H new ATOM 0 HZ PHE A 239 51.589 24.953 48.612 1.00 52.73 H new ATOM 266 N VAL A 240 46.714 23.712 45.992 1.00 43.20 N ATOM 267 CA VAL A 240 45.961 24.959 46.080 1.00 42.92 C ATOM 268 C VAL A 240 46.843 26.154 46.482 1.00 43.66 C ATOM 269 O VAL A 240 47.572 26.087 47.481 1.00 42.77 O ATOM 270 CB VAL A 240 44.806 24.842 47.078 1.00 43.08 C ATOM 271 CG1 VAL A 240 44.053 26.148 47.160 1.00 42.47 C ATOM 272 CG2 VAL A 240 43.870 23.679 46.663 1.00 43.72 C ATOM 0 H VAL A 240 46.765 23.274 46.731 1.00 43.20 H new ATOM 0 HA VAL A 240 45.612 25.120 45.190 1.00 42.92 H new ATOM 0 HB VAL A 240 45.161 24.648 47.960 1.00 43.08 H new ATOM 0 HG11 VAL A 240 43.324 26.062 47.794 1.00 42.47 H new ATOM 0 HG12 VAL A 240 44.654 26.851 47.452 1.00 42.47 H new ATOM 0 HG13 VAL A 240 43.696 26.371 46.286 1.00 42.47 H new ATOM 0 HG21 VAL A 240 43.140 23.609 47.298 1.00 43.72 H new ATOM 0 HG22 VAL A 240 43.513 23.851 45.778 1.00 43.72 H new ATOM 0 HG23 VAL A 240 44.371 22.848 46.653 1.00 43.72 H new ATOM 273 N ILE A 241 46.783 27.231 45.685 1.00 41.36 N ATOM 274 CA ILE A 241 47.444 28.495 45.997 1.00 40.01 C ATOM 275 C ILE A 241 46.324 29.398 46.428 1.00 40.82 C ATOM 276 O ILE A 241 45.451 29.729 45.608 1.00 42.78 O ATOM 277 CB ILE A 241 48.115 29.111 44.759 1.00 38.49 C ATOM 278 CG1 ILE A 241 49.077 28.114 44.114 1.00 37.91 C ATOM 279 CG2 ILE A 241 48.776 30.446 45.142 1.00 38.19 C ATOM 280 CD1 ILE A 241 49.636 28.554 42.772 1.00 34.50 C ATOM 0 H ILE A 241 46.351 27.242 44.941 1.00 41.36 H new ATOM 0 HA ILE A 241 48.138 28.371 46.664 1.00 40.01 H new ATOM 0 HB ILE A 241 47.449 29.309 44.082 1.00 38.49 H new ATOM 0 HG12 ILE A 241 49.816 27.955 44.722 1.00 37.91 H new ATOM 0 HG13 ILE A 241 48.618 27.268 43.998 1.00 37.91 H new ATOM 0 HG21 ILE A 241 49.199 30.834 44.360 1.00 38.19 H new ATOM 0 HG22 ILE A 241 48.102 31.056 45.480 1.00 38.19 H new ATOM 0 HG23 ILE A 241 49.445 30.291 45.828 1.00 38.19 H new ATOM 0 HD11 ILE A 241 50.234 27.871 42.431 1.00 34.50 H new ATOM 0 HD12 ILE A 241 48.907 28.687 42.146 1.00 34.50 H new ATOM 0 HD13 ILE A 241 50.124 29.385 42.881 1.00 34.50 H new ATOM 281 N HIS A 242 46.331 29.778 47.707 1.00 42.23 N ATOM 282 CA HIS A 242 45.220 30.530 48.309 1.00 41.17 C ATOM 283 C HIS A 242 45.725 31.722 49.112 1.00 40.00 C ATOM 284 O HIS A 242 44.937 32.527 49.591 1.00 36.89 O ATOM 285 CB HIS A 242 44.398 29.619 49.215 1.00 43.96 C ATOM 286 CG HIS A 242 45.133 29.160 50.438 1.00 48.51 C ATOM 287 ND1 HIS A 242 45.360 29.774 51.624 1.00 50.56 N flip ATOM 288 CD2 HIS A 242 45.742 27.922 50.525 1.00 47.95 C flip ATOM 289 CE1 HIS A 242 46.099 28.908 52.394 1.00 50.00 C flip ATOM 290 NE2 HIS A 242 46.312 27.796 51.711 1.00 49.43 N flip ATOM 0 H HIS A 242 46.976 29.609 48.250 1.00 42.23 H new ATOM 0 HA HIS A 242 44.664 30.861 47.587 1.00 41.17 H new ATOM 0 HB2 HIS A 242 43.594 30.088 49.488 1.00 43.96 H new ATOM 0 HB3 HIS A 242 44.115 28.842 48.708 1.00 43.96 H new ATOM 0 HD2 HIS A 242 45.750 27.278 49.854 1.00 47.95 H new ATOM 0 HE1 HIS A 242 46.401 29.077 53.257 1.00 50.00 H new ATOM 0 HE2 HIS A 242 46.747 27.109 51.990 1.00 49.43 H new ATOM 291 N ASP A 243 47.051 31.799 49.251 1.00 40.49 N ATOM 292 CA ASP A 243 47.722 32.824 50.051 1.00 42.39 C ATOM 293 C ASP A 243 49.161 32.929 49.590 1.00 41.45 C ATOM 294 O ASP A 243 49.605 32.153 48.749 1.00 42.83 O ATOM 295 CB ASP A 243 47.623 32.523 51.565 1.00 42.73 C ATOM 296 CG ASP A 243 48.560 31.383 52.042 1.00 43.86 C ATOM 297 OD1 ASP A 243 49.255 30.702 51.245 1.00 45.87 O ATOM 298 OD2 ASP A 243 48.665 31.084 53.249 1.00 45.17 O ATOM 0 H ASP A 243 47.594 31.247 48.876 1.00 40.49 H new ATOM 0 HA ASP A 243 47.280 33.677 49.919 1.00 42.39 H new ATOM 0 HB2 ASP A 243 47.832 33.330 52.061 1.00 42.73 H new ATOM 0 HB3 ASP A 243 46.707 32.288 51.780 1.00 42.73 H new ATOM 299 N MET A 244 49.891 33.887 50.137 1.00 43.06 N ATOM 300 CA MET A 244 51.312 34.097 49.769 1.00 45.09 C ATOM 301 C MET A 244 52.272 32.905 50.008 1.00 44.65 C ATOM 302 O MET A 244 53.195 32.669 49.206 1.00 44.00 O ATOM 303 CB MET A 244 51.855 35.361 50.460 1.00 45.59 C ATOM 304 CG MET A 244 51.328 36.670 49.823 1.00 49.41 C ATOM 305 SD MET A 244 51.685 36.788 48.023 1.00 52.17 S ATOM 306 CE MET A 244 50.678 38.225 47.585 1.00 51.45 C ATOM 0 H MET A 244 49.594 34.437 50.728 1.00 43.06 H new ATOM 0 HA MET A 244 51.296 34.199 48.805 1.00 45.09 H new ATOM 0 HB2 MET A 244 51.610 35.342 51.398 1.00 45.59 H new ATOM 0 HB3 MET A 244 52.824 35.355 50.420 1.00 45.59 H new ATOM 0 HG2 MET A 244 50.370 36.728 49.962 1.00 49.41 H new ATOM 0 HG3 MET A 244 51.727 37.428 50.277 1.00 49.41 H new ATOM 0 HE1 MET A 244 50.771 38.409 46.637 1.00 51.45 H new ATOM 0 HE2 MET A 244 49.747 38.042 47.788 1.00 51.45 H new ATOM 0 HE3 MET A 244 50.975 38.996 48.094 1.00 51.45 H new ATOM 307 N GLU A 245 52.057 32.156 51.092 1.00 42.33 N ATOM 308 CA GLU A 245 52.946 31.038 51.411 1.00 44.89 C ATOM 309 C GLU A 245 52.744 29.875 50.435 1.00 41.91 C ATOM 310 O GLU A 245 53.708 29.284 49.968 1.00 42.41 O ATOM 311 CB GLU A 245 52.763 30.559 52.863 1.00 47.77 C ATOM 312 CG GLU A 245 53.516 29.273 53.150 1.00 51.85 C ATOM 313 CD GLU A 245 53.091 28.594 54.445 1.00 57.51 C ATOM 314 OE1 GLU A 245 51.874 28.592 54.776 1.00 57.81 O ATOM 315 OE2 GLU A 245 53.991 28.048 55.137 1.00 58.93 O ATOM 0 H GLU A 245 51.412 32.276 51.648 1.00 42.33 H new ATOM 0 HA GLU A 245 53.855 31.363 51.318 1.00 44.89 H new ATOM 0 HB2 GLU A 245 53.068 31.251 53.470 1.00 47.77 H new ATOM 0 HB3 GLU A 245 51.819 30.424 53.039 1.00 47.77 H new ATOM 0 HG2 GLU A 245 53.383 28.658 52.412 1.00 51.85 H new ATOM 0 HG3 GLU A 245 54.466 29.465 53.191 1.00 51.85 H new ATOM 316 N THR A 246 51.499 29.532 50.128 1.00 39.70 N ATOM 317 CA THR A 246 51.265 28.566 49.039 1.00 38.04 C ATOM 318 C THR A 246 51.719 29.051 47.657 1.00 39.45 C ATOM 319 O THR A 246 52.170 28.238 46.837 1.00 42.52 O ATOM 320 CB THR A 246 49.790 28.150 48.965 1.00 36.07 C ATOM 321 OG1 THR A 246 48.969 29.320 48.999 1.00 32.98 O ATOM 322 CG2 THR A 246 49.397 27.351 50.217 1.00 35.93 C ATOM 0 H THR A 246 50.793 29.830 50.517 1.00 39.70 H new ATOM 0 HA THR A 246 51.817 27.802 49.269 1.00 38.04 H new ATOM 0 HB THR A 246 49.670 27.630 48.155 1.00 36.07 H new ATOM 0 HG1 THR A 246 48.939 29.619 49.783 1.00 32.98 H new ATOM 0 HG21 THR A 246 48.463 27.095 50.158 1.00 35.93 H new ATOM 0 HG22 THR A 246 49.947 26.555 50.279 1.00 35.93 H new ATOM 0 HG23 THR A 246 49.532 27.899 51.006 1.00 35.93 H new ATOM 323 N LEU A 247 51.604 30.355 47.382 1.00 40.19 N ATOM 324 CA LEU A 247 52.174 30.886 46.133 1.00 40.20 C ATOM 325 C LEU A 247 53.654 30.514 46.021 1.00 40.89 C ATOM 326 O LEU A 247 54.103 29.934 45.015 1.00 40.83 O ATOM 327 CB LEU A 247 52.011 32.409 46.048 1.00 37.44 C ATOM 328 CG LEU A 247 52.555 33.045 44.764 1.00 38.72 C ATOM 329 CD1 LEU A 247 51.826 32.526 43.495 1.00 36.75 C ATOM 330 CD2 LEU A 247 52.402 34.536 44.857 1.00 36.86 C ATOM 0 H LEU A 247 51.214 30.933 47.885 1.00 40.19 H new ATOM 0 HA LEU A 247 51.688 30.487 45.394 1.00 40.20 H new ATOM 0 HB2 LEU A 247 51.069 32.625 46.127 1.00 37.44 H new ATOM 0 HB3 LEU A 247 52.459 32.812 46.808 1.00 37.44 H new ATOM 0 HG LEU A 247 53.490 32.799 44.681 1.00 38.72 H new ATOM 0 HD11 LEU A 247 52.201 32.953 42.709 1.00 36.75 H new ATOM 0 HD12 LEU A 247 51.940 31.565 43.426 1.00 36.75 H new ATOM 0 HD13 LEU A 247 50.881 32.735 43.556 1.00 36.75 H new ATOM 0 HD21 LEU A 247 52.744 34.948 44.048 1.00 36.86 H new ATOM 0 HD22 LEU A 247 51.464 34.759 44.961 1.00 36.86 H new ATOM 0 HD23 LEU A 247 52.899 34.865 45.622 1.00 36.86 H new ATOM 331 N CYS A 248 54.416 30.847 47.067 1.00 42.00 N ATOM 332 CA CYS A 248 55.857 30.569 47.114 1.00 43.30 C ATOM 333 C CYS A 248 56.194 29.081 47.025 1.00 42.39 C ATOM 334 O CYS A 248 57.170 28.723 46.352 1.00 40.36 O ATOM 335 CB CYS A 248 56.494 31.198 48.366 1.00 46.36 C ATOM 336 SG CYS A 248 56.260 32.980 48.378 1.00 48.07 S ATOM 0 H CYS A 248 54.113 31.240 47.769 1.00 42.00 H new ATOM 0 HA CYS A 248 56.237 30.980 46.322 1.00 43.30 H new ATOM 0 HB2 CYS A 248 56.100 30.811 49.163 1.00 46.36 H new ATOM 0 HB3 CYS A 248 57.442 30.992 48.389 1.00 46.36 H new ATOM 0 HG CYS A 248 55.124 33.233 48.672 1.00 48.07 H new ATOM 337 N MET A 249 55.402 28.234 47.698 1.00 43.90 N ATOM 338 CA MET A 249 55.505 26.766 47.519 1.00 47.20 C ATOM 339 C MET A 249 55.332 26.427 46.021 1.00 46.60 C ATOM 340 O MET A 249 56.220 25.810 45.401 1.00 43.67 O ATOM 341 CB MET A 249 54.442 25.975 48.322 1.00 48.85 C ATOM 342 CG MET A 249 54.280 26.323 49.812 1.00 56.84 C ATOM 343 SD MET A 249 53.368 25.059 50.858 1.00 63.49 S ATOM 344 CE MET A 249 52.283 26.125 51.955 1.00 62.72 C ATOM 0 H MET A 249 54.801 28.482 48.261 1.00 43.90 H new ATOM 0 HA MET A 249 56.378 26.504 47.851 1.00 47.20 H new ATOM 0 HB2 MET A 249 53.583 26.102 47.889 1.00 48.85 H new ATOM 0 HB3 MET A 249 54.657 25.031 48.256 1.00 48.85 H new ATOM 0 HG2 MET A 249 55.162 26.455 50.193 1.00 56.84 H new ATOM 0 HG3 MET A 249 53.812 27.170 49.879 1.00 56.84 H new ATOM 0 HE1 MET A 249 51.466 25.646 52.165 1.00 62.72 H new ATOM 0 HE2 MET A 249 52.757 26.332 52.776 1.00 62.72 H new ATOM 0 HE3 MET A 249 52.065 26.949 51.492 1.00 62.72 H new ATOM 345 N ALA A 250 54.190 26.840 45.446 1.00 45.21 N ATOM 346 CA ALA A 250 53.922 26.526 44.023 1.00 46.37 C ATOM 347 C ALA A 250 55.058 27.009 43.134 1.00 46.62 C ATOM 348 O ALA A 250 55.405 26.350 42.160 1.00 46.70 O ATOM 349 CB ALA A 250 52.594 27.087 43.556 1.00 42.11 C ATOM 0 H ALA A 250 53.574 27.289 45.844 1.00 45.21 H new ATOM 0 HA ALA A 250 53.867 25.560 43.950 1.00 46.37 H new ATOM 0 HB1 ALA A 250 52.457 26.860 42.623 1.00 42.11 H new ATOM 0 HB2 ALA A 250 51.877 26.709 44.089 1.00 42.11 H new ATOM 0 HB3 ALA A 250 52.597 28.052 43.657 1.00 42.11 H new ATOM 350 N GLU A 251 55.659 28.145 43.481 1.00 47.76 N ATOM 351 CA GLU A 251 56.751 28.668 42.662 1.00 50.02 C ATOM 352 C GLU A 251 58.007 27.793 42.763 1.00 51.61 C ATOM 353 O GLU A 251 58.795 27.723 41.814 1.00 47.28 O ATOM 354 CB GLU A 251 57.068 30.128 42.988 1.00 50.22 C ATOM 355 CG GLU A 251 55.959 31.095 42.612 1.00 52.59 C ATOM 356 CD GLU A 251 56.138 32.479 43.211 1.00 52.77 C ATOM 357 OE1 GLU A 251 56.739 32.576 44.298 1.00 54.09 O ATOM 358 OE2 GLU A 251 55.680 33.469 42.593 1.00 52.97 O ATOM 0 H GLU A 251 55.456 28.619 44.170 1.00 47.76 H new ATOM 0 HA GLU A 251 56.445 28.639 41.742 1.00 50.02 H new ATOM 0 HB2 GLU A 251 57.246 30.207 43.938 1.00 50.22 H new ATOM 0 HB3 GLU A 251 57.881 30.385 42.525 1.00 50.22 H new ATOM 0 HG2 GLU A 251 55.919 31.171 41.646 1.00 52.59 H new ATOM 0 HG3 GLU A 251 55.109 30.731 42.904 1.00 52.59 H new ATOM 359 N LYS A 252 58.177 27.123 43.905 1.00 55.05 N ATOM 360 CA LYS A 252 59.295 26.185 44.082 1.00 59.43 C ATOM 361 C LYS A 252 59.007 24.869 43.358 1.00 58.64 C ATOM 362 O LYS A 252 59.888 24.301 42.705 1.00 58.94 O ATOM 363 CB LYS A 252 59.552 25.898 45.580 1.00 63.20 C ATOM 364 CG LYS A 252 60.663 26.722 46.258 1.00 65.26 C ATOM 365 CD LYS A 252 60.552 26.596 47.797 1.00 68.04 C ATOM 366 CE LYS A 252 61.398 27.639 48.550 1.00 69.05 C ATOM 367 NZ LYS A 252 60.568 28.662 49.296 1.00 69.08 N ATOM 0 H LYS A 252 57.660 27.195 44.588 1.00 55.05 H new ATOM 0 HA LYS A 252 60.087 26.598 43.703 1.00 59.43 H new ATOM 0 HB2 LYS A 252 58.725 26.048 46.064 1.00 63.20 H new ATOM 0 HB3 LYS A 252 59.770 24.958 45.676 1.00 63.20 H new ATOM 0 HG2 LYS A 252 61.533 26.411 45.962 1.00 65.26 H new ATOM 0 HG3 LYS A 252 60.591 27.653 45.996 1.00 65.26 H new ATOM 0 HD2 LYS A 252 59.623 26.692 48.058 1.00 68.04 H new ATOM 0 HD3 LYS A 252 60.832 25.706 48.064 1.00 68.04 H new ATOM 0 HE2 LYS A 252 61.978 27.182 49.179 1.00 69.05 H new ATOM 0 HE3 LYS A 252 61.972 28.098 47.917 1.00 69.05 H new ATOM 0 HZ1 LYS A 252 61.107 29.237 49.710 1.00 69.08 H new ATOM 0 HZ2 LYS A 252 60.052 29.103 48.720 1.00 69.08 H new ATOM 0 HZ3 LYS A 252 60.057 28.249 49.896 1.00 69.08 H new ATOM 368 N THR A 253 57.758 24.416 43.468 1.00 58.48 N ATOM 369 CA THR A 253 57.319 23.091 42.999 1.00 59.58 C ATOM 370 C THR A 253 56.802 22.997 41.541 1.00 57.63 C ATOM 371 O THR A 253 57.052 22.023 40.829 1.00 57.14 O ATOM 372 CB THR A 253 56.189 22.589 43.937 1.00 60.92 C ATOM 373 OG1 THR A 253 56.702 22.413 45.262 1.00 63.70 O ATOM 374 CG2 THR A 253 55.747 21.189 43.548 1.00 63.56 C ATOM 0 H THR A 253 57.126 24.877 43.824 1.00 58.48 H new ATOM 0 HA THR A 253 58.123 22.548 43.018 1.00 59.58 H new ATOM 0 HB THR A 253 55.472 23.239 43.878 1.00 60.92 H new ATOM 0 HG1 THR A 253 56.088 22.143 45.767 1.00 63.70 H new ATOM 0 HG21 THR A 253 55.042 20.894 44.145 1.00 63.56 H new ATOM 0 HG22 THR A 253 55.416 21.196 42.636 1.00 63.56 H new ATOM 0 HG23 THR A 253 56.500 20.582 43.614 1.00 63.56 H new ATOM 375 N LEU A 254 56.066 24.007 41.106 1.00 53.63 N ATOM 376 CA LEU A 254 55.292 23.878 39.898 1.00 51.07 C ATOM 377 C LEU A 254 55.857 24.773 38.810 1.00 51.41 C ATOM 378 O LEU A 254 56.003 24.366 37.666 1.00 51.51 O ATOM 379 CB LEU A 254 53.829 24.224 40.201 1.00 49.50 C ATOM 380 CG LEU A 254 53.054 23.347 41.213 1.00 48.24 C ATOM 381 CD1 LEU A 254 51.608 23.832 41.411 1.00 45.53 C ATOM 382 CD2 LEU A 254 53.050 21.862 40.816 1.00 49.00 C ATOM 0 H LEU A 254 56.004 24.770 41.497 1.00 53.63 H new ATOM 0 HA LEU A 254 55.337 22.964 39.575 1.00 51.07 H new ATOM 0 HB2 LEU A 254 53.803 25.138 40.524 1.00 49.50 H new ATOM 0 HB3 LEU A 254 53.342 24.206 39.362 1.00 49.50 H new ATOM 0 HG LEU A 254 53.528 23.437 42.054 1.00 48.24 H new ATOM 0 HD11 LEU A 254 51.158 23.258 42.050 1.00 45.53 H new ATOM 0 HD12 LEU A 254 51.615 24.743 41.744 1.00 45.53 H new ATOM 0 HD13 LEU A 254 51.137 23.802 40.563 1.00 45.53 H new ATOM 0 HD21 LEU A 254 52.555 21.352 41.476 1.00 49.00 H new ATOM 0 HD22 LEU A 254 52.630 21.760 39.948 1.00 49.00 H new ATOM 0 HD23 LEU A 254 53.962 21.536 40.774 1.00 49.00 H new ATOM 383 N VAL A 255 56.183 25.997 39.191 1.00 52.61 N ATOM 384 CA VAL A 255 56.662 27.024 38.277 1.00 53.71 C ATOM 385 C VAL A 255 58.184 27.186 38.236 1.00 54.17 C ATOM 386 O VAL A 255 58.664 28.253 37.842 1.00 52.88 O ATOM 387 CB VAL A 255 56.152 28.422 38.707 1.00 52.32 C ATOM 388 CG1 VAL A 255 55.881 29.267 37.504 1.00 54.19 C ATOM 389 CG2 VAL A 255 54.929 28.325 39.598 1.00 53.85 C ATOM 0 H VAL A 255 56.131 26.262 40.008 1.00 52.61 H new ATOM 0 HA VAL A 255 56.332 26.727 37.415 1.00 53.71 H new ATOM 0 HB VAL A 255 56.849 28.847 39.231 1.00 52.32 H new ATOM 0 HG11 VAL A 255 55.563 30.139 37.786 1.00 54.19 H new ATOM 0 HG12 VAL A 255 56.698 29.372 36.991 1.00 54.19 H new ATOM 0 HG13 VAL A 255 55.207 28.839 36.953 1.00 54.19 H new ATOM 0 HG21 VAL A 255 54.638 29.216 39.847 1.00 53.85 H new ATOM 0 HG22 VAL A 255 54.215 27.874 39.120 1.00 53.85 H new ATOM 0 HG23 VAL A 255 55.150 27.822 40.398 1.00 53.85 H new ATOM 390 N ALA A 256 58.939 26.169 38.646 1.00 55.70 N ATOM 391 CA ALA A 256 60.407 26.298 38.744 1.00 58.78 C ATOM 392 C ALA A 256 61.089 27.108 37.625 1.00 59.73 C ATOM 393 O ALA A 256 61.730 28.145 37.887 1.00 56.98 O ATOM 394 CB ALA A 256 61.058 24.911 38.860 1.00 61.72 C ATOM 0 H ALA A 256 58.631 25.399 38.872 1.00 55.70 H new ATOM 0 HA ALA A 256 60.550 26.819 39.549 1.00 58.78 H new ATOM 0 HB1 ALA A 256 62.021 25.010 38.924 1.00 61.72 H new ATOM 0 HB2 ALA A 256 60.726 24.463 39.654 1.00 61.72 H new ATOM 0 HB3 ALA A 256 60.838 24.384 38.076 1.00 61.72 H new ATOM 395 N LYS A 257 60.941 26.640 36.383 1.00 61.40 N ATOM 396 CA LYS A 257 61.645 27.233 35.235 1.00 63.34 C ATOM 397 C LYS A 257 61.255 28.694 34.915 1.00 62.18 C ATOM 398 O LYS A 257 62.053 29.445 34.333 1.00 61.44 O ATOM 399 CB LYS A 257 61.483 26.342 33.994 1.00 66.09 C ATOM 400 CG LYS A 257 61.761 24.862 34.254 1.00 69.37 C ATOM 401 CD LYS A 257 61.992 24.109 32.943 1.00 73.35 C ATOM 402 CE LYS A 257 63.280 23.260 32.975 1.00 75.04 C ATOM 403 NZ LYS A 257 63.297 22.257 31.852 1.00 75.40 N ATOM 0 H LYS A 257 60.434 25.975 36.181 1.00 61.40 H new ATOM 0 HA LYS A 257 62.578 27.275 35.497 1.00 63.34 H new ATOM 0 HB2 LYS A 257 60.580 26.437 33.654 1.00 66.09 H new ATOM 0 HB3 LYS A 257 62.082 26.658 33.300 1.00 66.09 H new ATOM 0 HG2 LYS A 257 62.540 24.771 34.825 1.00 69.37 H new ATOM 0 HG3 LYS A 257 61.013 24.468 34.730 1.00 69.37 H new ATOM 0 HD2 LYS A 257 61.232 23.533 32.765 1.00 73.35 H new ATOM 0 HD3 LYS A 257 62.044 24.745 32.212 1.00 73.35 H new ATOM 0 HE2 LYS A 257 64.055 23.840 32.906 1.00 75.04 H new ATOM 0 HE3 LYS A 257 63.346 22.798 33.826 1.00 75.04 H new ATOM 0 HZ1 LYS A 257 64.047 21.780 31.891 1.00 75.40 H new ATOM 0 HZ2 LYS A 257 62.596 21.714 31.928 1.00 75.40 H new ATOM 0 HZ3 LYS A 257 63.257 22.684 31.072 1.00 75.40 H new ATOM 404 N LEU A 258 60.035 29.081 35.291 1.00 59.30 N ATOM 405 CA LEU A 258 59.525 30.439 35.056 1.00 57.20 C ATOM 406 C LEU A 258 60.008 31.449 36.119 1.00 57.51 C ATOM 407 O LEU A 258 59.880 31.251 37.345 1.00 54.20 O ATOM 408 CB LEU A 258 57.989 30.426 34.953 1.00 53.82 C ATOM 409 CG LEU A 258 57.420 29.261 34.127 1.00 54.10 C ATOM 410 CD1 LEU A 258 55.907 29.350 33.953 1.00 53.79 C ATOM 411 CD2 LEU A 258 58.111 29.151 32.765 1.00 54.29 C ATOM 0 H LEU A 258 59.477 28.563 35.691 1.00 59.30 H new ATOM 0 HA LEU A 258 59.891 30.740 34.210 1.00 57.20 H new ATOM 0 HB2 LEU A 258 57.616 30.387 35.847 1.00 53.82 H new ATOM 0 HB3 LEU A 258 57.695 31.262 34.559 1.00 53.82 H new ATOM 0 HG LEU A 258 57.605 28.454 34.632 1.00 54.10 H new ATOM 0 HD11 LEU A 258 55.597 28.596 33.427 1.00 53.79 H new ATOM 0 HD12 LEU A 258 55.479 29.334 34.824 1.00 53.79 H new ATOM 0 HD13 LEU A 258 55.682 30.176 33.497 1.00 53.79 H new ATOM 0 HD21 LEU A 258 57.732 28.409 32.268 1.00 54.29 H new ATOM 0 HD22 LEU A 258 57.979 29.973 32.268 1.00 54.29 H new ATOM 0 HD23 LEU A 258 59.060 29.001 32.895 1.00 54.29 H new ATOM 412 N LYS A 266 61.653 40.630 43.523 1.00 52.01 N ATOM 413 CA LYS A 266 60.593 40.150 42.561 1.00 51.13 C ATOM 414 C LYS A 266 59.134 40.124 43.135 1.00 48.69 C ATOM 415 O LYS A 266 58.663 39.056 43.510 1.00 48.06 O ATOM 416 CB LYS A 266 61.025 38.748 42.085 1.00 54.35 C ATOM 417 CG LYS A 266 62.361 38.231 42.735 1.00 54.12 C ATOM 418 CD LYS A 266 62.719 36.779 42.331 1.00 54.66 C ATOM 419 CE LYS A 266 63.084 36.635 40.816 1.00 57.41 C ATOM 420 NZ LYS A 266 61.928 36.212 39.942 1.00 54.24 N ATOM 0 HA LYS A 266 60.539 40.788 41.832 1.00 51.13 H new ATOM 0 HB2 LYS A 266 60.315 38.117 42.283 1.00 54.35 H new ATOM 0 HB3 LYS A 266 61.131 38.763 41.121 1.00 54.35 H new ATOM 0 HG2 LYS A 266 63.087 38.820 42.477 1.00 54.12 H new ATOM 0 HG3 LYS A 266 62.284 38.281 43.701 1.00 54.12 H new ATOM 0 HD2 LYS A 266 63.467 36.475 42.869 1.00 54.66 H new ATOM 0 HD3 LYS A 266 61.969 36.198 42.534 1.00 54.66 H new ATOM 0 HE2 LYS A 266 63.427 37.483 40.494 1.00 57.41 H new ATOM 0 HE3 LYS A 266 63.800 35.986 40.726 1.00 57.41 H new ATOM 0 HZ1 LYS A 266 62.205 36.135 39.100 1.00 54.24 H new ATOM 0 HZ2 LYS A 266 61.614 35.428 40.223 1.00 54.24 H new ATOM 0 HZ3 LYS A 266 61.282 36.823 39.987 1.00 54.24 H new ATOM 421 N GLU A 267 58.428 41.267 43.204 1.00 43.82 N ATOM 422 CA GLU A 267 57.102 41.345 43.857 1.00 41.79 C ATOM 423 C GLU A 267 56.090 40.280 43.375 1.00 42.76 C ATOM 424 O GLU A 267 56.053 39.942 42.190 1.00 42.48 O ATOM 425 CB GLU A 267 56.488 42.756 43.679 1.00 42.50 C ATOM 426 CG GLU A 267 55.264 43.106 44.553 1.00 40.95 C ATOM 427 CD GLU A 267 54.720 44.525 44.303 1.00 43.77 C ATOM 428 OE1 GLU A 267 53.839 45.006 45.057 1.00 42.97 O ATOM 429 OE2 GLU A 267 55.162 45.189 43.329 1.00 44.01 O ATOM 0 H GLU A 267 58.701 42.014 42.877 1.00 43.82 H new ATOM 0 HA GLU A 267 57.269 41.162 44.795 1.00 41.79 H new ATOM 0 HB2 GLU A 267 57.182 43.411 43.856 1.00 42.50 H new ATOM 0 HB3 GLU A 267 56.233 42.858 42.749 1.00 42.50 H new ATOM 0 HG2 GLU A 267 54.559 42.462 44.383 1.00 40.95 H new ATOM 0 HG3 GLU A 267 55.507 43.020 45.488 1.00 40.95 H new ATOM 430 N ALA A 268 55.275 39.773 44.290 1.00 40.33 N ATOM 431 CA ALA A 268 54.305 38.701 44.008 1.00 42.94 C ATOM 432 C ALA A 268 53.410 38.939 42.781 1.00 42.14 C ATOM 433 O ALA A 268 53.367 38.103 41.879 1.00 43.07 O ATOM 434 CB ALA A 268 53.416 38.432 45.223 1.00 39.60 C ATOM 0 H ALA A 268 55.263 40.041 45.107 1.00 40.33 H new ATOM 0 HA ALA A 268 54.856 37.930 43.803 1.00 42.94 H new ATOM 0 HB1 ALA A 268 52.787 37.724 45.014 1.00 39.60 H new ATOM 0 HB2 ALA A 268 53.967 38.162 45.974 1.00 39.60 H new ATOM 0 HB3 ALA A 268 52.929 39.239 45.453 1.00 39.60 H new ATOM 435 N GLU A 269 52.685 40.051 42.765 1.00 39.66 N ATOM 436 CA GLU A 269 51.801 40.348 41.645 1.00 38.37 C ATOM 437 C GLU A 269 52.615 40.261 40.342 1.00 39.07 C ATOM 438 O GLU A 269 52.189 39.637 39.367 1.00 38.03 O ATOM 439 CB GLU A 269 51.163 41.724 41.803 1.00 35.69 C ATOM 440 CG GLU A 269 49.953 41.792 42.743 1.00 35.53 C ATOM 441 CD GLU A 269 50.314 41.894 44.240 1.00 37.99 C ATOM 442 OE1 GLU A 269 51.512 41.752 44.616 1.00 36.27 O ATOM 443 OE2 GLU A 269 49.374 42.116 45.055 1.00 37.79 O ATOM 0 H GLU A 269 52.690 40.643 43.388 1.00 39.66 H new ATOM 0 HA GLU A 269 51.079 39.701 41.619 1.00 38.37 H new ATOM 0 HB2 GLU A 269 51.838 42.340 42.127 1.00 35.69 H new ATOM 0 HB3 GLU A 269 50.889 42.038 40.927 1.00 35.69 H new ATOM 0 HG2 GLU A 269 49.411 42.558 42.499 1.00 35.53 H new ATOM 0 HG3 GLU A 269 49.406 41.003 42.606 1.00 35.53 H new ATOM 444 N VAL A 270 53.800 40.861 40.327 1.00 38.32 N ATOM 445 CA VAL A 270 54.609 40.838 39.114 1.00 38.85 C ATOM 446 C VAL A 270 54.950 39.401 38.697 1.00 37.80 C ATOM 447 O VAL A 270 54.926 39.068 37.514 1.00 36.26 O ATOM 448 CB VAL A 270 55.878 41.694 39.266 1.00 40.29 C ATOM 449 CG1 VAL A 270 56.869 41.433 38.127 1.00 40.54 C ATOM 450 CG2 VAL A 270 55.498 43.179 39.300 1.00 42.70 C ATOM 0 H VAL A 270 54.149 41.279 40.993 1.00 38.32 H new ATOM 0 HA VAL A 270 54.078 41.231 38.403 1.00 38.85 H new ATOM 0 HB VAL A 270 56.311 41.449 40.099 1.00 40.29 H new ATOM 0 HG11 VAL A 270 57.657 41.986 38.250 1.00 40.54 H new ATOM 0 HG12 VAL A 270 57.127 40.498 38.130 1.00 40.54 H new ATOM 0 HG13 VAL A 270 56.452 41.650 37.279 1.00 40.54 H new ATOM 0 HG21 VAL A 270 56.300 43.716 39.396 1.00 42.70 H new ATOM 0 HG22 VAL A 270 55.047 43.417 38.475 1.00 42.70 H new ATOM 0 HG23 VAL A 270 54.907 43.345 40.051 1.00 42.70 H new ATOM 451 N ARG A 271 55.261 38.548 39.671 1.00 36.69 N ATOM 452 CA ARG A 271 55.560 37.148 39.381 1.00 36.25 C ATOM 453 C ARG A 271 54.293 36.417 38.843 1.00 35.08 C ATOM 454 O ARG A 271 54.358 35.630 37.911 1.00 31.91 O ATOM 455 CB ARG A 271 56.137 36.431 40.616 1.00 36.35 C ATOM 456 CG ARG A 271 57.405 37.116 41.234 1.00 37.42 C ATOM 457 CD ARG A 271 58.069 36.391 42.410 1.00 37.13 C ATOM 458 NE ARG A 271 57.147 35.737 43.348 1.00 38.27 N ATOM 459 CZ ARG A 271 56.878 36.146 44.592 1.00 39.60 C ATOM 460 NH1 ARG A 271 57.433 37.251 45.073 1.00 39.65 N ATOM 461 NH2 ARG A 271 56.036 35.444 45.368 1.00 38.59 N ATOM 0 H ARG A 271 55.304 38.759 40.504 1.00 36.69 H new ATOM 0 HA ARG A 271 56.239 37.123 38.689 1.00 36.25 H new ATOM 0 HB2 ARG A 271 55.448 36.379 41.297 1.00 36.35 H new ATOM 0 HB3 ARG A 271 56.363 35.520 40.371 1.00 36.35 H new ATOM 0 HG2 ARG A 271 58.065 37.223 40.531 1.00 37.42 H new ATOM 0 HG3 ARG A 271 57.156 38.006 41.528 1.00 37.42 H new ATOM 0 HD2 ARG A 271 58.676 35.722 42.057 1.00 37.13 H new ATOM 0 HD3 ARG A 271 58.607 37.030 42.902 1.00 37.13 H new ATOM 0 HE ARG A 271 56.745 35.029 43.073 1.00 38.27 H new ATOM 0 HH11 ARG A 271 57.971 37.710 44.584 1.00 39.65 H new ATOM 0 HH12 ARG A 271 57.255 37.508 45.874 1.00 39.65 H new ATOM 0 HH21 ARG A 271 55.668 34.728 45.065 1.00 38.59 H new ATOM 0 HH22 ARG A 271 55.865 35.710 46.168 1.00 38.59 H new ATOM 462 N ILE A 272 53.152 36.688 39.445 1.00 29.77 N ATOM 463 CA ILE A 272 51.932 36.130 38.936 1.00 31.98 C ATOM 464 C ILE A 272 51.655 36.624 37.491 1.00 29.72 C ATOM 465 O ILE A 272 51.368 35.811 36.609 1.00 30.41 O ATOM 466 CB ILE A 272 50.794 36.433 39.914 1.00 30.82 C ATOM 467 CG1 ILE A 272 51.066 35.662 41.208 1.00 31.48 C ATOM 468 CG2 ILE A 272 49.416 36.028 39.312 1.00 31.94 C ATOM 469 CD1 ILE A 272 50.225 36.117 42.422 1.00 30.98 C ATOM 0 H ILE A 272 53.067 37.187 40.140 1.00 29.77 H new ATOM 0 HA ILE A 272 52.008 35.165 38.869 1.00 31.98 H new ATOM 0 HB ILE A 272 50.758 37.386 40.092 1.00 30.82 H new ATOM 0 HG12 ILE A 272 50.899 34.720 41.050 1.00 31.48 H new ATOM 0 HG13 ILE A 272 52.006 35.750 41.431 1.00 31.48 H new ATOM 0 HG21 ILE A 272 48.713 36.229 39.949 1.00 31.94 H new ATOM 0 HG22 ILE A 272 49.262 36.525 38.493 1.00 31.94 H new ATOM 0 HG23 ILE A 272 49.414 35.078 39.118 1.00 31.94 H new ATOM 0 HD11 ILE A 272 50.457 35.581 43.196 1.00 30.98 H new ATOM 0 HD12 ILE A 272 50.407 37.051 42.610 1.00 30.98 H new ATOM 0 HD13 ILE A 272 49.282 36.005 42.223 1.00 30.98 H new ATOM 470 N PHE A 273 51.816 37.929 37.259 1.00 29.56 N ATOM 471 CA PHE A 273 51.664 38.538 35.932 1.00 32.00 C ATOM 472 C PHE A 273 52.553 37.826 34.967 1.00 33.67 C ATOM 473 O PHE A 273 52.129 37.482 33.862 1.00 33.55 O ATOM 474 CB PHE A 273 52.050 40.027 35.983 1.00 30.64 C ATOM 475 CG PHE A 273 51.741 40.821 34.722 1.00 28.81 C ATOM 476 CD1 PHE A 273 52.761 41.463 34.032 1.00 30.57 C ATOM 477 CD2 PHE A 273 50.422 40.979 34.272 1.00 27.60 C ATOM 478 CE1 PHE A 273 52.478 42.219 32.862 1.00 32.57 C ATOM 479 CE2 PHE A 273 50.119 41.727 33.152 1.00 25.76 C ATOM 480 CZ PHE A 273 51.127 42.350 32.428 1.00 28.96 C ATOM 0 H PHE A 273 52.019 38.493 37.875 1.00 29.56 H new ATOM 0 HA PHE A 273 50.739 38.464 35.649 1.00 32.00 H new ATOM 0 HB2 PHE A 273 51.588 40.440 36.729 1.00 30.64 H new ATOM 0 HB3 PHE A 273 53.000 40.094 36.165 1.00 30.64 H new ATOM 0 HD1 PHE A 273 53.637 41.398 34.338 1.00 30.57 H new ATOM 0 HD2 PHE A 273 49.732 40.568 34.741 1.00 27.60 H new ATOM 0 HE1 PHE A 273 53.167 42.623 32.385 1.00 32.57 H new ATOM 0 HE2 PHE A 273 49.234 41.814 32.881 1.00 25.76 H new ATOM 0 HZ PHE A 273 50.923 42.847 31.669 1.00 28.96 H new ATOM 481 N HIS A 274 53.802 37.594 35.381 1.00 33.89 N ATOM 482 CA HIS A 274 54.731 36.874 34.523 1.00 33.74 C ATOM 483 C HIS A 274 54.257 35.464 34.171 1.00 31.71 C ATOM 484 O HIS A 274 54.438 35.030 33.032 1.00 31.31 O ATOM 485 CB HIS A 274 56.140 36.804 35.117 1.00 36.70 C ATOM 486 CG HIS A 274 57.118 36.064 34.251 1.00 38.43 C ATOM 487 ND1 HIS A 274 57.551 36.548 33.038 1.00 41.97 N ATOM 488 CD2 HIS A 274 57.750 34.881 34.423 1.00 41.87 C ATOM 489 CE1 HIS A 274 58.399 35.694 32.491 1.00 43.04 C ATOM 490 NE2 HIS A 274 58.541 34.673 33.313 1.00 42.92 N ATOM 0 H HIS A 274 54.121 37.841 36.140 1.00 33.89 H new ATOM 0 HA HIS A 274 54.762 37.393 33.704 1.00 33.74 H new ATOM 0 HB2 HIS A 274 56.467 37.705 35.264 1.00 36.70 H new ATOM 0 HB3 HIS A 274 56.097 36.373 35.985 1.00 36.70 H new ATOM 0 HD2 HIS A 274 57.667 34.313 35.155 1.00 41.87 H new ATOM 0 HE1 HIS A 274 58.822 35.796 31.669 1.00 43.04 H new ATOM 0 HE2 HIS A 274 59.045 33.989 33.179 1.00 42.92 H new ATOM 491 N CYS A 275 53.685 34.751 35.137 1.00 31.08 N ATOM 492 CA CYS A 275 53.304 33.338 34.942 1.00 33.38 C ATOM 493 C CYS A 275 52.075 33.200 34.033 1.00 34.32 C ATOM 494 O CYS A 275 51.969 32.254 33.242 1.00 37.41 O ATOM 495 CB CYS A 275 53.076 32.636 36.294 1.00 36.39 C ATOM 496 SG CYS A 275 54.642 32.397 37.214 1.00 40.56 S ATOM 0 H CYS A 275 53.505 35.061 35.919 1.00 31.08 H new ATOM 0 HA CYS A 275 54.044 32.897 34.495 1.00 33.38 H new ATOM 0 HB2 CYS A 275 52.463 33.162 36.831 1.00 36.39 H new ATOM 0 HB3 CYS A 275 52.655 31.775 36.144 1.00 36.39 H new ATOM 0 HG CYS A 275 54.980 33.438 37.706 1.00 40.56 H new ATOM 497 N CYS A 276 51.149 34.144 34.168 1.00 32.50 N ATOM 498 CA CYS A 276 50.037 34.279 33.245 1.00 32.56 C ATOM 499 C CYS A 276 50.544 34.489 31.816 1.00 30.89 C ATOM 500 O CYS A 276 50.154 33.773 30.921 1.00 29.63 O ATOM 501 CB CYS A 276 49.108 35.413 33.665 1.00 30.03 C ATOM 502 SG CYS A 276 48.206 34.972 35.130 1.00 32.37 S ATOM 0 H CYS A 276 51.151 34.725 34.802 1.00 32.50 H new ATOM 0 HA CYS A 276 49.526 33.455 33.268 1.00 32.56 H new ATOM 0 HB2 CYS A 276 49.625 36.218 33.827 1.00 30.03 H new ATOM 0 HB3 CYS A 276 48.489 35.614 32.946 1.00 30.03 H new ATOM 0 HG CYS A 276 48.917 35.092 36.089 1.00 32.37 H new ATOM 503 N GLN A 277 51.428 35.449 31.602 1.00 30.57 N ATOM 504 CA GLN A 277 51.917 35.660 30.250 1.00 32.12 C ATOM 505 C GLN A 277 52.720 34.471 29.665 1.00 35.22 C ATOM 506 O GLN A 277 52.669 34.232 28.446 1.00 35.87 O ATOM 507 CB GLN A 277 52.524 37.080 30.073 1.00 37.12 C ATOM 508 CG GLN A 277 53.981 37.328 30.317 1.00 39.34 C ATOM 509 CD GLN A 277 54.317 38.832 30.145 1.00 41.98 C ATOM 510 OE1 GLN A 277 54.697 39.263 29.054 1.00 43.73 O ATOM 511 NE2 GLN A 277 54.180 39.617 31.220 1.00 39.94 N ATOM 0 H GLN A 277 51.749 35.974 32.202 1.00 30.57 H new ATOM 0 HA GLN A 277 51.147 35.659 29.660 1.00 32.12 H new ATOM 0 HB2 GLN A 277 52.336 37.359 29.163 1.00 37.12 H new ATOM 0 HB3 GLN A 277 52.032 37.675 30.659 1.00 37.12 H new ATOM 0 HG2 GLN A 277 54.217 37.039 31.212 1.00 39.34 H new ATOM 0 HG3 GLN A 277 54.512 36.801 29.699 1.00 39.34 H new ATOM 0 HE21 GLN A 277 53.912 39.282 31.966 1.00 39.94 H new ATOM 0 HE22 GLN A 277 54.360 40.456 31.165 1.00 39.94 H new ATOM 512 N CYS A 278 53.416 33.693 30.501 1.00 33.51 N ATOM 513 CA CYS A 278 54.039 32.472 30.001 1.00 34.15 C ATOM 514 C CYS A 278 52.948 31.510 29.457 1.00 32.76 C ATOM 515 O CYS A 278 53.111 30.824 28.443 1.00 34.48 O ATOM 516 CB CYS A 278 54.948 31.828 31.097 1.00 37.26 C ATOM 517 SG CYS A 278 56.385 32.882 31.576 1.00 40.84 S ATOM 0 H CYS A 278 53.535 33.851 31.338 1.00 33.51 H new ATOM 0 HA CYS A 278 54.626 32.681 29.258 1.00 34.15 H new ATOM 0 HB2 CYS A 278 54.413 31.646 31.885 1.00 37.26 H new ATOM 0 HB3 CYS A 278 55.276 30.974 30.774 1.00 37.26 H new ATOM 0 HG CYS A 278 55.995 33.833 32.195 1.00 40.84 H new ATOM 518 N THR A 279 51.820 31.474 30.132 1.00 30.74 N ATOM 519 CA THR A 279 50.714 30.657 29.673 1.00 30.28 C ATOM 520 C THR A 279 50.185 31.154 28.326 1.00 27.47 C ATOM 521 O THR A 279 49.867 30.343 27.462 1.00 26.77 O ATOM 522 CB THR A 279 49.621 30.636 30.739 1.00 29.68 C ATOM 523 OG1 THR A 279 49.972 29.642 31.701 1.00 33.77 O ATOM 524 CG2 THR A 279 48.313 30.123 30.177 1.00 32.40 C ATOM 0 H THR A 279 51.671 31.912 30.857 1.00 30.74 H new ATOM 0 HA THR A 279 51.024 29.749 29.533 1.00 30.28 H new ATOM 0 HB THR A 279 49.535 31.537 31.088 1.00 29.68 H new ATOM 0 HG1 THR A 279 49.430 29.668 32.342 1.00 33.77 H new ATOM 0 HG21 THR A 279 47.639 30.121 30.875 1.00 32.40 H new ATOM 0 HG22 THR A 279 48.024 30.698 29.451 1.00 32.40 H new ATOM 0 HG23 THR A 279 48.436 29.220 29.844 1.00 32.40 H new ATOM 525 N SER A 280 50.106 32.476 28.141 1.00 26.14 N ATOM 526 CA SER A 280 49.719 33.016 26.816 1.00 25.70 C ATOM 527 C SER A 280 50.703 32.724 25.716 1.00 24.50 C ATOM 528 O SER A 280 50.303 32.412 24.576 1.00 29.25 O ATOM 529 CB SER A 280 49.550 34.533 26.844 1.00 24.39 C ATOM 530 OG SER A 280 48.535 34.913 27.728 1.00 22.13 O ATOM 0 H SER A 280 50.266 33.067 28.745 1.00 26.14 H new ATOM 0 HA SER A 280 48.882 32.563 26.628 1.00 25.70 H new ATOM 0 HB2 SER A 280 50.385 34.949 27.109 1.00 24.39 H new ATOM 0 HB3 SER A 280 49.343 34.854 25.953 1.00 24.39 H new ATOM 0 HG SER A 280 48.641 35.717 27.948 1.00 22.13 H new ATOM 531 N VAL A 281 51.989 32.863 26.009 1.00 24.36 N ATOM 532 CA VAL A 281 52.995 32.534 24.995 1.00 25.87 C ATOM 533 C VAL A 281 52.828 31.097 24.475 1.00 24.44 C ATOM 534 O VAL A 281 52.811 30.854 23.281 1.00 25.73 O ATOM 535 CB VAL A 281 54.411 32.788 25.523 1.00 27.64 C ATOM 536 CG1 VAL A 281 55.472 32.122 24.619 1.00 23.88 C ATOM 537 CG2 VAL A 281 54.617 34.291 25.625 1.00 27.14 C ATOM 0 H VAL A 281 52.298 33.137 26.763 1.00 24.36 H new ATOM 0 HA VAL A 281 52.855 33.124 24.238 1.00 25.87 H new ATOM 0 HB VAL A 281 54.515 32.389 26.401 1.00 27.64 H new ATOM 0 HG11 VAL A 281 56.357 32.298 24.975 1.00 23.88 H new ATOM 0 HG12 VAL A 281 55.319 31.164 24.592 1.00 23.88 H new ATOM 0 HG13 VAL A 281 55.407 32.485 23.722 1.00 23.88 H new ATOM 0 HG21 VAL A 281 55.509 34.474 25.958 1.00 27.14 H new ATOM 0 HG22 VAL A 281 54.511 34.693 24.748 1.00 27.14 H new ATOM 0 HG23 VAL A 281 53.962 34.667 26.234 1.00 27.14 H new ATOM 538 N GLU A 282 52.664 30.151 25.387 1.00 25.87 N ATOM 539 CA GLU A 282 52.508 28.755 25.025 1.00 28.00 C ATOM 540 C GLU A 282 51.189 28.511 24.297 1.00 26.70 C ATOM 541 O GLU A 282 51.133 27.813 23.288 1.00 28.02 O ATOM 542 CB GLU A 282 52.537 27.890 26.287 1.00 32.09 C ATOM 543 CG GLU A 282 52.285 26.433 25.968 1.00 36.19 C ATOM 544 CD GLU A 282 52.805 25.474 27.050 1.00 39.11 C ATOM 545 OE1 GLU A 282 52.814 25.842 28.245 1.00 42.34 O ATOM 546 OE2 GLU A 282 53.208 24.353 26.692 1.00 38.64 O ATOM 0 H GLU A 282 52.640 30.301 26.233 1.00 25.87 H new ATOM 0 HA GLU A 282 53.239 28.520 24.433 1.00 28.00 H new ATOM 0 HB2 GLU A 282 53.398 27.982 26.724 1.00 32.09 H new ATOM 0 HB3 GLU A 282 51.866 28.206 26.912 1.00 32.09 H new ATOM 0 HG2 GLU A 282 51.332 26.294 25.853 1.00 36.19 H new ATOM 0 HG3 GLU A 282 52.708 26.216 25.122 1.00 36.19 H new ATOM 547 N THR A 283 50.109 29.097 24.791 1.00 24.41 N ATOM 548 CA THR A 283 48.851 28.964 24.061 1.00 23.41 C ATOM 549 C THR A 283 48.942 29.559 22.647 1.00 23.94 C ATOM 550 O THR A 283 48.416 28.992 21.689 1.00 23.53 O ATOM 551 CB THR A 283 47.750 29.607 24.873 1.00 23.08 C ATOM 552 OG1 THR A 283 47.737 28.970 26.168 1.00 22.63 O ATOM 553 CG2 THR A 283 46.385 29.281 24.255 1.00 19.28 C ATOM 0 H THR A 283 50.077 29.558 25.516 1.00 24.41 H new ATOM 0 HA THR A 283 48.651 28.023 23.939 1.00 23.41 H new ATOM 0 HB THR A 283 47.902 30.564 24.911 1.00 23.08 H new ATOM 0 HG1 THR A 283 48.340 29.301 26.650 1.00 22.63 H new ATOM 0 HG21 THR A 283 45.684 29.697 24.781 1.00 19.28 H new ATOM 0 HG22 THR A 283 46.351 29.620 23.347 1.00 19.28 H new ATOM 0 HG23 THR A 283 46.255 28.320 24.246 1.00 19.28 H new ATOM 554 N VAL A 284 49.626 30.689 22.496 1.00 24.44 N ATOM 555 CA VAL A 284 49.725 31.302 21.150 1.00 23.65 C ATOM 556 C VAL A 284 50.464 30.338 20.193 1.00 26.56 C ATOM 557 O VAL A 284 50.093 30.136 19.012 1.00 27.21 O ATOM 558 CB VAL A 284 50.363 32.706 21.193 1.00 22.72 C ATOM 559 CG1 VAL A 284 50.789 33.164 19.784 1.00 22.76 C ATOM 560 CG2 VAL A 284 49.375 33.715 21.836 1.00 19.44 C ATOM 0 H VAL A 284 50.030 31.112 23.127 1.00 24.44 H new ATOM 0 HA VAL A 284 48.829 31.440 20.805 1.00 23.65 H new ATOM 0 HB VAL A 284 51.164 32.667 21.739 1.00 22.72 H new ATOM 0 HG11 VAL A 284 51.186 34.047 19.837 1.00 22.76 H new ATOM 0 HG12 VAL A 284 51.437 32.539 19.423 1.00 22.76 H new ATOM 0 HG13 VAL A 284 50.012 33.194 19.204 1.00 22.76 H new ATOM 0 HG21 VAL A 284 49.781 34.595 21.860 1.00 19.44 H new ATOM 0 HG22 VAL A 284 48.560 33.750 21.311 1.00 19.44 H new ATOM 0 HG23 VAL A 284 49.165 33.431 22.739 1.00 19.44 H new ATOM 561 N THR A 285 51.480 29.698 20.732 1.00 24.50 N ATOM 562 CA THR A 285 52.197 28.642 20.026 1.00 25.56 C ATOM 563 C THR A 285 51.269 27.474 19.565 1.00 24.47 C ATOM 564 O THR A 285 51.392 26.944 18.462 1.00 25.58 O ATOM 565 CB THR A 285 53.233 28.140 21.082 1.00 25.87 C ATOM 566 OG1 THR A 285 54.496 28.819 20.895 1.00 32.49 O ATOM 567 CG2 THR A 285 53.501 26.801 20.950 1.00 25.10 C ATOM 0 H THR A 285 51.780 29.860 21.522 1.00 24.50 H new ATOM 0 HA THR A 285 52.598 28.970 19.206 1.00 25.56 H new ATOM 0 HB THR A 285 52.842 28.319 21.951 1.00 25.87 H new ATOM 0 HG1 THR A 285 55.048 28.546 21.466 1.00 32.49 H new ATOM 0 HG21 THR A 285 54.146 26.532 21.622 1.00 25.10 H new ATOM 0 HG22 THR A 285 52.682 26.294 21.067 1.00 25.10 H new ATOM 0 HG23 THR A 285 53.864 26.629 20.067 1.00 25.10 H new ATOM 568 N GLU A 286 50.362 27.042 20.437 1.00 23.62 N ATOM 569 CA GLU A 286 49.392 26.010 20.088 1.00 23.07 C ATOM 570 C GLU A 286 48.347 26.461 19.078 1.00 22.36 C ATOM 571 O GLU A 286 47.958 25.672 18.203 1.00 25.50 O ATOM 572 CB GLU A 286 48.699 25.504 21.365 1.00 26.12 C ATOM 573 CG GLU A 286 49.685 24.858 22.353 1.00 27.54 C ATOM 574 CD GLU A 286 48.986 24.414 23.631 1.00 28.59 C ATOM 575 OE1 GLU A 286 47.895 24.951 23.949 1.00 27.64 O ATOM 576 OE2 GLU A 286 49.518 23.517 24.319 1.00 30.94 O ATOM 0 H GLU A 286 50.292 27.337 21.242 1.00 23.62 H new ATOM 0 HA GLU A 286 49.891 25.297 19.660 1.00 23.07 H new ATOM 0 HB2 GLU A 286 48.248 26.245 21.800 1.00 26.12 H new ATOM 0 HB3 GLU A 286 48.016 24.858 21.125 1.00 26.12 H new ATOM 0 HG2 GLU A 286 50.111 24.094 21.934 1.00 27.54 H new ATOM 0 HG3 GLU A 286 50.388 25.490 22.570 1.00 27.54 H new ATOM 577 N LEU A 287 47.911 27.719 19.197 1.00 22.11 N ATOM 578 CA LEU A 287 46.879 28.356 18.320 1.00 22.29 C ATOM 579 C LEU A 287 47.350 28.571 16.882 1.00 25.38 C ATOM 580 O LEU A 287 46.548 28.520 15.911 1.00 20.84 O ATOM 581 CB LEU A 287 46.482 29.740 18.883 1.00 19.50 C ATOM 582 CG LEU A 287 45.436 29.704 20.010 1.00 24.38 C ATOM 583 CD1 LEU A 287 45.443 31.043 20.761 1.00 22.29 C ATOM 584 CD2 LEU A 287 43.985 29.301 19.472 1.00 22.76 C ATOM 0 H LEU A 287 48.208 28.252 19.804 1.00 22.11 H new ATOM 0 HA LEU A 287 46.130 27.739 18.311 1.00 22.29 H new ATOM 0 HB2 LEU A 287 47.280 30.181 19.214 1.00 19.50 H new ATOM 0 HB3 LEU A 287 46.138 30.283 18.157 1.00 19.50 H new ATOM 0 HG LEU A 287 45.677 29.006 20.639 1.00 24.38 H new ATOM 0 HD11 LEU A 287 44.783 31.019 21.471 1.00 22.29 H new ATOM 0 HD12 LEU A 287 46.322 31.196 21.142 1.00 22.29 H new ATOM 0 HD13 LEU A 287 45.228 31.761 20.145 1.00 22.29 H new ATOM 0 HD21 LEU A 287 43.357 29.290 20.211 1.00 22.76 H new ATOM 0 HD22 LEU A 287 43.694 29.948 18.811 1.00 22.76 H new ATOM 0 HD23 LEU A 287 44.023 28.420 19.067 1.00 22.76 H new ATOM 585 N THR A 288 48.656 28.859 16.754 1.00 25.68 N ATOM 586 CA THR A 288 49.308 28.981 15.458 1.00 27.37 C ATOM 587 C THR A 288 49.315 27.628 14.761 1.00 26.91 C ATOM 588 O THR A 288 48.997 27.531 13.570 1.00 30.16 O ATOM 589 CB THR A 288 50.784 29.423 15.632 1.00 28.62 C ATOM 590 OG1 THR A 288 50.821 30.794 16.025 1.00 29.44 O ATOM 591 CG2 THR A 288 51.430 29.486 14.274 1.00 30.69 C ATOM 0 H THR A 288 49.181 28.988 17.423 1.00 25.68 H new ATOM 0 HA THR A 288 48.821 29.639 14.937 1.00 27.37 H new ATOM 0 HB THR A 288 51.205 28.814 16.259 1.00 28.62 H new ATOM 0 HG1 THR A 288 50.629 30.857 16.840 1.00 29.44 H new ATOM 0 HG21 THR A 288 52.355 29.762 14.368 1.00 30.69 H new ATOM 0 HG22 THR A 288 51.395 28.611 13.858 1.00 30.69 H new ATOM 0 HG23 THR A 288 50.957 30.126 13.720 1.00 30.69 H new ATOM 592 N GLU A 289 49.691 26.583 15.499 1.00 29.34 N ATOM 593 CA GLU A 289 49.678 25.228 14.921 1.00 29.30 C ATOM 594 C GLU A 289 48.235 24.777 14.583 1.00 29.29 C ATOM 595 O GLU A 289 48.001 24.253 13.496 1.00 25.19 O ATOM 596 CB GLU A 289 50.373 24.209 15.826 1.00 31.89 C ATOM 597 CG GLU A 289 51.907 24.314 15.852 1.00 37.70 C ATOM 598 CD GLU A 289 52.511 24.286 14.448 1.00 40.33 C ATOM 599 OE1 GLU A 289 52.422 23.233 13.781 1.00 39.33 O ATOM 600 OE2 GLU A 289 53.045 25.330 14.001 1.00 41.45 O ATOM 0 H GLU A 289 49.952 26.629 16.317 1.00 29.34 H new ATOM 0 HA GLU A 289 50.184 25.268 14.094 1.00 29.30 H new ATOM 0 HB2 GLU A 289 50.038 24.316 16.730 1.00 31.89 H new ATOM 0 HB3 GLU A 289 50.127 23.317 15.536 1.00 31.89 H new ATOM 0 HG2 GLU A 289 52.166 25.136 16.297 1.00 37.70 H new ATOM 0 HG3 GLU A 289 52.271 23.582 16.374 1.00 37.70 H new ATOM 601 N PHE A 290 47.286 24.995 15.506 1.00 25.13 N ATOM 602 CA PHE A 290 45.863 24.773 15.215 1.00 22.43 C ATOM 603 C PHE A 290 45.449 25.562 13.995 1.00 21.97 C ATOM 604 O PHE A 290 44.775 25.054 13.120 1.00 24.25 O ATOM 605 CB PHE A 290 45.009 25.171 16.443 1.00 23.83 C ATOM 606 CG PHE A 290 43.493 25.237 16.185 1.00 25.59 C ATOM 607 CD1 PHE A 290 42.706 24.080 16.227 1.00 22.94 C ATOM 608 CD2 PHE A 290 42.853 26.456 15.985 1.00 25.07 C ATOM 609 CE1 PHE A 290 41.309 24.122 16.031 1.00 24.99 C ATOM 610 CE2 PHE A 290 41.418 26.507 15.792 1.00 25.39 C ATOM 611 CZ PHE A 290 40.658 25.332 15.822 1.00 23.40 C ATOM 0 H PHE A 290 47.447 25.271 16.304 1.00 25.13 H new ATOM 0 HA PHE A 290 45.719 23.832 15.029 1.00 22.43 H new ATOM 0 HB2 PHE A 290 45.175 24.534 17.156 1.00 23.83 H new ATOM 0 HB3 PHE A 290 45.308 26.037 16.761 1.00 23.83 H new ATOM 0 HD1 PHE A 290 43.115 23.261 16.389 1.00 22.94 H new ATOM 0 HD2 PHE A 290 43.349 27.243 15.975 1.00 25.07 H new ATOM 0 HE1 PHE A 290 40.819 23.332 16.042 1.00 24.99 H new ATOM 0 HE2 PHE A 290 41.000 27.325 15.647 1.00 25.39 H new ATOM 0 HZ PHE A 290 39.736 25.360 15.704 1.00 23.40 H new ATOM 612 N ALA A 291 45.860 26.818 13.885 1.00 24.77 N ATOM 613 CA ALA A 291 45.380 27.614 12.734 1.00 24.98 C ATOM 614 C ALA A 291 45.869 27.056 11.382 1.00 27.41 C ATOM 615 O ALA A 291 45.104 26.953 10.413 1.00 26.58 O ATOM 616 CB ALA A 291 45.735 29.096 12.897 1.00 24.76 C ATOM 0 H ALA A 291 46.389 27.222 14.429 1.00 24.77 H new ATOM 0 HA ALA A 291 44.413 27.540 12.726 1.00 24.98 H new ATOM 0 HB1 ALA A 291 45.409 29.593 12.130 1.00 24.76 H new ATOM 0 HB2 ALA A 291 45.323 29.441 13.704 1.00 24.76 H new ATOM 0 HB3 ALA A 291 46.698 29.193 12.960 1.00 24.76 H new ATOM 617 N LYS A 292 47.132 26.654 11.331 1.00 31.37 N ATOM 618 CA LYS A 292 47.673 26.077 10.102 1.00 35.75 C ATOM 619 C LYS A 292 46.935 24.815 9.661 1.00 36.90 C ATOM 620 O LYS A 292 46.947 24.464 8.482 1.00 36.26 O ATOM 621 CB LYS A 292 49.152 25.801 10.266 1.00 36.95 C ATOM 622 CG LYS A 292 49.914 27.095 10.441 1.00 40.76 C ATOM 623 CD LYS A 292 51.359 26.895 10.126 1.00 44.58 C ATOM 624 CE LYS A 292 52.151 26.849 11.386 1.00 45.32 C ATOM 625 NZ LYS A 292 53.417 26.094 11.191 1.00 48.97 N ATOM 0 H LYS A 292 47.688 26.704 11.985 1.00 31.37 H new ATOM 0 HA LYS A 292 47.541 26.731 9.398 1.00 35.75 H new ATOM 0 HB2 LYS A 292 49.297 25.227 11.035 1.00 36.95 H new ATOM 0 HB3 LYS A 292 49.486 25.325 9.490 1.00 36.95 H new ATOM 0 HG2 LYS A 292 49.542 27.777 9.860 1.00 40.76 H new ATOM 0 HG3 LYS A 292 49.817 27.414 11.352 1.00 40.76 H new ATOM 0 HD2 LYS A 292 51.479 26.071 9.629 1.00 44.58 H new ATOM 0 HD3 LYS A 292 51.678 27.616 9.561 1.00 44.58 H new ATOM 0 HE2 LYS A 292 52.351 27.752 11.680 1.00 45.32 H new ATOM 0 HE3 LYS A 292 51.626 26.432 12.087 1.00 45.32 H new ATOM 0 HZ1 LYS A 292 53.629 25.670 11.944 1.00 48.97 H new ATOM 0 HZ2 LYS A 292 53.311 25.500 10.536 1.00 48.97 H new ATOM 0 HZ3 LYS A 292 54.070 26.659 10.975 1.00 48.97 H new ATOM 626 N ALA A 293 46.288 24.138 10.608 1.00 36.89 N ATOM 627 CA ALA A 293 45.530 22.940 10.265 1.00 36.24 C ATOM 628 C ALA A 293 44.083 23.226 9.859 1.00 35.66 C ATOM 629 O ALA A 293 43.387 22.313 9.414 1.00 38.24 O ATOM 630 CB ALA A 293 45.592 21.897 11.398 1.00 36.52 C ATOM 0 H ALA A 293 46.275 24.352 11.441 1.00 36.89 H new ATOM 0 HA ALA A 293 45.961 22.570 9.478 1.00 36.24 H new ATOM 0 HB1 ALA A 293 45.081 21.113 11.144 1.00 36.52 H new ATOM 0 HB2 ALA A 293 46.515 21.644 11.555 1.00 36.52 H new ATOM 0 HB3 ALA A 293 45.219 22.277 12.209 1.00 36.52 H new ATOM 631 N ILE A 294 43.620 24.469 9.996 1.00 34.74 N ATOM 632 CA ILE A 294 42.298 24.814 9.501 1.00 34.21 C ATOM 633 C ILE A 294 42.395 24.850 7.986 1.00 37.52 C ATOM 634 O ILE A 294 43.256 25.555 7.462 1.00 39.37 O ATOM 635 CB ILE A 294 41.827 26.184 10.002 1.00 31.59 C ATOM 636 CG1 ILE A 294 41.717 26.255 11.533 1.00 28.08 C ATOM 637 CG2 ILE A 294 40.433 26.474 9.441 1.00 34.75 C ATOM 638 CD1 ILE A 294 41.793 27.752 12.090 1.00 21.49 C ATOM 0 H ILE A 294 44.051 25.114 10.367 1.00 34.74 H new ATOM 0 HA ILE A 294 41.657 24.159 9.819 1.00 34.21 H new ATOM 0 HB ILE A 294 42.488 26.829 9.705 1.00 31.59 H new ATOM 0 HG12 ILE A 294 40.880 25.852 11.812 1.00 28.08 H new ATOM 0 HG13 ILE A 294 42.430 25.730 11.929 1.00 28.08 H new ATOM 0 HG21 ILE A 294 40.131 27.340 9.756 1.00 34.75 H new ATOM 0 HG22 ILE A 294 40.468 26.477 8.472 1.00 34.75 H new ATOM 0 HG23 ILE A 294 39.815 25.789 9.740 1.00 34.75 H new ATOM 0 HD11 ILE A 294 41.719 27.742 13.057 1.00 21.49 H new ATOM 0 HD12 ILE A 294 42.640 28.150 11.835 1.00 21.49 H new ATOM 0 HD13 ILE A 294 41.066 28.274 11.716 1.00 21.49 H new ATOM 639 N PRO A 295 41.535 24.115 7.266 1.00 39.73 N ATOM 640 CA PRO A 295 41.622 24.070 5.790 1.00 38.33 C ATOM 641 C PRO A 295 41.421 25.462 5.167 1.00 41.14 C ATOM 642 O PRO A 295 40.463 26.190 5.518 1.00 39.88 O ATOM 643 CB PRO A 295 40.484 23.122 5.388 1.00 37.34 C ATOM 644 CG PRO A 295 40.182 22.292 6.663 1.00 39.18 C ATOM 645 CD PRO A 295 40.426 23.285 7.792 1.00 39.33 C ATOM 0 HA PRO A 295 42.492 23.773 5.481 1.00 38.33 H new ATOM 0 HB2 PRO A 295 39.702 23.616 5.097 1.00 37.34 H new ATOM 0 HB3 PRO A 295 40.748 22.550 4.651 1.00 37.34 H new ATOM 0 HG2 PRO A 295 39.270 21.962 6.668 1.00 39.18 H new ATOM 0 HG3 PRO A 295 40.764 21.519 6.734 1.00 39.18 H new ATOM 0 HD2 PRO A 295 39.637 23.817 7.981 1.00 39.33 H new ATOM 0 HD3 PRO A 295 40.671 22.838 8.617 1.00 39.33 H new ATOM 646 N GLY A 296 42.319 25.838 4.248 1.00 39.61 N ATOM 647 CA GLY A 296 42.291 27.185 3.695 1.00 37.15 C ATOM 648 C GLY A 296 43.319 28.143 4.330 1.00 38.54 C ATOM 649 O GLY A 296 43.852 29.006 3.646 1.00 38.10 O ATOM 0 H GLY A 296 42.942 25.332 3.939 1.00 39.61 H new ATOM 0 HA2 GLY A 296 42.454 27.136 2.740 1.00 37.15 H new ATOM 0 HA3 GLY A 296 41.402 27.555 3.812 1.00 37.15 H new ATOM 650 N PHE A 297 43.610 27.989 5.625 1.00 35.97 N ATOM 651 CA PHE A 297 44.431 28.980 6.349 1.00 34.03 C ATOM 652 C PHE A 297 45.872 29.088 5.850 1.00 34.61 C ATOM 653 O PHE A 297 46.376 30.190 5.673 1.00 33.50 O ATOM 654 CB PHE A 297 44.452 28.676 7.841 1.00 27.76 C ATOM 655 CG PHE A 297 45.063 29.740 8.671 1.00 27.45 C ATOM 656 CD1 PHE A 297 44.282 30.754 9.187 1.00 24.35 C ATOM 657 CD2 PHE A 297 46.432 29.719 8.956 1.00 27.88 C ATOM 658 CE1 PHE A 297 44.854 31.766 9.992 1.00 27.77 C ATOM 659 CE2 PHE A 297 47.018 30.703 9.763 1.00 29.34 C ATOM 660 CZ PHE A 297 46.224 31.740 10.283 1.00 27.48 C ATOM 0 H PHE A 297 43.346 27.325 6.103 1.00 35.97 H new ATOM 0 HA PHE A 297 44.004 29.833 6.175 1.00 34.03 H new ATOM 0 HB2 PHE A 297 43.542 28.527 8.143 1.00 27.76 H new ATOM 0 HB3 PHE A 297 44.938 27.849 7.985 1.00 27.76 H new ATOM 0 HD1 PHE A 297 43.370 30.772 9.003 1.00 24.35 H new ATOM 0 HD2 PHE A 297 46.962 29.041 8.604 1.00 27.88 H new ATOM 0 HE1 PHE A 297 44.320 32.449 10.328 1.00 27.77 H new ATOM 0 HE2 PHE A 297 47.928 30.670 9.954 1.00 29.34 H new ATOM 0 HZ PHE A 297 46.604 32.402 10.815 1.00 27.48 H new ATOM 661 N ALA A 298 46.521 27.950 5.648 1.00 36.97 N ATOM 662 CA ALA A 298 47.911 27.926 5.189 1.00 42.97 C ATOM 663 C ALA A 298 48.092 28.554 3.810 1.00 44.57 C ATOM 664 O ALA A 298 49.209 28.851 3.414 1.00 47.28 O ATOM 665 CB ALA A 298 48.437 26.507 5.150 1.00 42.31 C ATOM 0 H ALA A 298 46.175 27.172 5.771 1.00 36.97 H new ATOM 0 HA ALA A 298 48.413 28.455 5.829 1.00 42.97 H new ATOM 0 HB1 ALA A 298 49.357 26.511 4.844 1.00 42.31 H new ATOM 0 HB2 ALA A 298 48.394 26.121 6.039 1.00 42.31 H new ATOM 0 HB3 ALA A 298 47.897 25.978 4.542 1.00 42.31 H new ATOM 666 N ASN A 299 46.993 28.735 3.094 1.00 44.93 N ATOM 667 CA ASN A 299 47.036 29.227 1.729 1.00 46.23 C ATOM 668 C ASN A 299 46.874 30.739 1.658 1.00 46.44 C ATOM 669 O ASN A 299 47.109 31.348 0.590 1.00 46.89 O ATOM 670 CB ASN A 299 45.995 28.513 0.865 1.00 44.18 C ATOM 671 CG ASN A 299 46.344 27.032 0.627 1.00 47.84 C ATOM 672 OD1 ASN A 299 47.520 26.611 0.765 1.00 48.40 O ATOM 673 ND2 ASN A 299 45.323 26.227 0.272 1.00 45.05 N ATOM 0 H ASN A 299 46.200 28.576 3.387 1.00 44.93 H new ATOM 0 HA ASN A 299 47.916 29.025 1.375 1.00 46.23 H new ATOM 0 HB2 ASN A 299 45.127 28.573 1.294 1.00 44.18 H new ATOM 0 HB3 ASN A 299 45.922 28.967 0.011 1.00 44.18 H new ATOM 0 HD21 ASN A 299 45.464 25.391 0.131 1.00 45.05 H new ATOM 0 HD22 ASN A 299 44.530 26.550 0.187 1.00 45.05 H new ATOM 674 N LEU A 300 46.492 31.346 2.791 1.00 43.39 N ATOM 675 CA LEU A 300 46.398 32.798 2.863 1.00 40.38 C ATOM 676 C LEU A 300 47.793 33.342 2.776 1.00 40.72 C ATOM 677 O LEU A 300 48.760 32.627 3.069 1.00 37.85 O ATOM 678 CB LEU A 300 45.781 33.274 4.182 1.00 39.54 C ATOM 679 CG LEU A 300 44.407 32.719 4.545 1.00 39.62 C ATOM 680 CD1 LEU A 300 43.993 33.167 5.958 1.00 35.46 C ATOM 681 CD2 LEU A 300 43.383 33.109 3.475 1.00 38.18 C ATOM 0 H LEU A 300 46.287 30.934 3.518 1.00 43.39 H new ATOM 0 HA LEU A 300 45.830 33.108 2.140 1.00 40.38 H new ATOM 0 HB2 LEU A 300 46.395 33.052 4.899 1.00 39.54 H new ATOM 0 HB3 LEU A 300 45.717 34.241 4.153 1.00 39.54 H new ATOM 0 HG LEU A 300 44.446 31.750 4.565 1.00 39.62 H new ATOM 0 HD11 LEU A 300 43.118 32.804 6.169 1.00 35.46 H new ATOM 0 HD12 LEU A 300 44.641 32.844 6.603 1.00 35.46 H new ATOM 0 HD13 LEU A 300 43.958 34.136 5.993 1.00 35.46 H new ATOM 0 HD21 LEU A 300 42.513 32.752 3.714 1.00 38.18 H new ATOM 0 HD22 LEU A 300 43.330 34.076 3.415 1.00 38.18 H new ATOM 0 HD23 LEU A 300 43.656 32.746 2.618 1.00 38.18 H new ATOM 682 N ASP A 301 47.888 34.607 2.383 1.00 40.14 N ATOM 683 CA ASP A 301 49.131 35.355 2.454 1.00 44.34 C ATOM 684 C ASP A 301 49.676 35.347 3.876 1.00 41.67 C ATOM 685 O ASP A 301 48.926 35.535 4.819 1.00 42.42 O ATOM 686 CB ASP A 301 48.811 36.800 2.090 1.00 49.98 C ATOM 687 CG ASP A 301 50.023 37.591 1.704 1.00 55.54 C ATOM 688 OD1 ASP A 301 51.037 37.542 2.442 1.00 58.24 O ATOM 689 OD2 ASP A 301 50.043 38.308 0.662 1.00 59.73 O ATOM 0 H ASP A 301 47.227 35.056 2.066 1.00 40.14 H new ATOM 0 HA ASP A 301 49.785 34.960 1.857 1.00 44.34 H new ATOM 0 HB2 ASP A 301 48.177 36.810 1.356 1.00 49.98 H new ATOM 0 HB3 ASP A 301 48.378 37.230 2.844 1.00 49.98 H new ATOM 690 N LEU A 302 50.975 35.178 4.042 1.00 39.65 N ATOM 691 CA LEU A 302 51.571 35.157 5.372 1.00 40.96 C ATOM 692 C LEU A 302 51.288 36.419 6.223 1.00 40.24 C ATOM 693 O LEU A 302 51.130 36.335 7.442 1.00 38.02 O ATOM 694 CB LEU A 302 53.065 34.862 5.268 1.00 43.82 C ATOM 695 CG LEU A 302 53.922 34.447 6.462 1.00 47.44 C ATOM 696 CD1 LEU A 302 54.634 35.677 7.037 1.00 49.38 C ATOM 697 CD2 LEU A 302 53.173 33.703 7.549 1.00 45.46 C ATOM 0 H LEU A 302 51.534 35.073 3.397 1.00 39.65 H new ATOM 0 HA LEU A 302 51.135 34.440 5.858 1.00 40.96 H new ATOM 0 HB2 LEU A 302 53.160 34.160 4.605 1.00 43.82 H new ATOM 0 HB3 LEU A 302 53.477 35.659 4.899 1.00 43.82 H new ATOM 0 HG LEU A 302 54.569 33.809 6.122 1.00 47.44 H new ATOM 0 HD11 LEU A 302 55.178 35.411 7.795 1.00 49.38 H new ATOM 0 HD12 LEU A 302 55.201 36.071 6.356 1.00 49.38 H new ATOM 0 HD13 LEU A 302 53.975 36.328 7.325 1.00 49.38 H new ATOM 0 HD21 LEU A 302 53.785 33.477 8.267 1.00 45.46 H new ATOM 0 HD22 LEU A 302 52.462 34.265 7.895 1.00 45.46 H new ATOM 0 HD23 LEU A 302 52.792 32.890 7.181 1.00 45.46 H new ATOM 698 N ASN A 303 51.203 37.586 5.594 1.00 38.69 N ATOM 699 CA ASN A 303 50.820 38.795 6.322 1.00 36.35 C ATOM 700 C ASN A 303 49.375 38.720 6.838 1.00 35.46 C ATOM 701 O ASN A 303 49.083 39.169 7.926 1.00 32.79 O ATOM 702 CB ASN A 303 51.073 40.030 5.480 1.00 38.28 C ATOM 703 CG ASN A 303 52.569 40.199 5.163 1.00 43.40 C ATOM 704 OD1 ASN A 303 53.295 40.817 5.913 1.00 43.84 O ATOM 705 ND2 ASN A 303 53.022 39.613 4.058 1.00 46.76 N ATOM 0 H ASN A 303 51.360 37.701 4.756 1.00 38.69 H new ATOM 0 HA ASN A 303 51.382 38.862 7.110 1.00 36.35 H new ATOM 0 HB2 ASN A 303 50.571 39.967 4.653 1.00 38.28 H new ATOM 0 HB3 ASN A 303 50.750 40.815 5.949 1.00 38.28 H new ATOM 0 HD21 ASN A 303 53.856 39.665 3.855 1.00 46.76 H new ATOM 0 HD22 ASN A 303 52.481 39.182 3.547 1.00 46.76 H new ATOM 706 N ASP A 304 48.478 38.121 6.056 1.00 34.33 N ATOM 707 CA ASP A 304 47.118 37.911 6.531 1.00 31.95 C ATOM 708 C ASP A 304 47.083 36.904 7.706 1.00 31.41 C ATOM 709 O ASP A 304 46.332 37.096 8.680 1.00 28.88 O ATOM 710 CB ASP A 304 46.259 37.439 5.387 1.00 31.00 C ATOM 711 CG ASP A 304 45.715 38.589 4.585 1.00 34.36 C ATOM 712 OD1 ASP A 304 46.060 39.747 4.961 1.00 33.40 O ATOM 713 OD2 ASP A 304 44.948 38.423 3.588 1.00 34.05 O ATOM 0 H ASP A 304 48.635 37.834 5.261 1.00 34.33 H new ATOM 0 HA ASP A 304 46.768 38.751 6.866 1.00 31.95 H new ATOM 0 HB2 ASP A 304 46.780 36.860 4.809 1.00 31.00 H new ATOM 0 HB3 ASP A 304 45.524 36.909 5.732 1.00 31.00 H new ATOM 714 N GLN A 305 47.898 35.844 7.601 1.00 26.75 N ATOM 715 CA GLN A 305 47.999 34.850 8.656 1.00 28.60 C ATOM 716 C GLN A 305 48.430 35.518 9.956 1.00 29.28 C ATOM 717 O GLN A 305 47.894 35.215 11.065 1.00 30.67 O ATOM 718 CB GLN A 305 48.946 33.730 8.253 1.00 28.75 C ATOM 719 CG GLN A 305 48.413 32.801 7.139 1.00 31.29 C ATOM 720 CD GLN A 305 49.434 31.709 6.766 1.00 33.01 C ATOM 721 OE1 GLN A 305 50.049 31.085 7.648 1.00 35.07 O ATOM 722 NE2 GLN A 305 49.618 31.491 5.475 1.00 31.53 N ATOM 0 H GLN A 305 48.399 35.690 6.919 1.00 26.75 H new ATOM 0 HA GLN A 305 47.128 34.448 8.800 1.00 28.60 H new ATOM 0 HB2 GLN A 305 49.783 34.122 7.957 1.00 28.75 H new ATOM 0 HB3 GLN A 305 49.145 33.194 9.036 1.00 28.75 H new ATOM 0 HG2 GLN A 305 47.587 32.385 7.433 1.00 31.29 H new ATOM 0 HG3 GLN A 305 48.201 33.328 6.353 1.00 31.29 H new ATOM 0 HE21 GLN A 305 49.173 31.944 4.895 1.00 31.53 H new ATOM 0 HE22 GLN A 305 50.183 30.897 5.215 1.00 31.53 H new ATOM 723 N VAL A 306 49.363 36.458 9.829 1.00 26.77 N ATOM 724 CA VAL A 306 49.871 37.146 11.001 1.00 29.48 C ATOM 725 C VAL A 306 48.794 38.035 11.586 1.00 27.37 C ATOM 726 O VAL A 306 48.602 38.056 12.773 1.00 29.69 O ATOM 727 CB VAL A 306 51.132 37.992 10.694 1.00 29.77 C ATOM 728 CG1 VAL A 306 51.345 39.004 11.809 1.00 28.27 C ATOM 729 CG2 VAL A 306 52.306 37.062 10.571 1.00 28.16 C ATOM 0 H VAL A 306 49.709 36.707 9.082 1.00 26.77 H new ATOM 0 HA VAL A 306 50.127 36.464 11.642 1.00 29.48 H new ATOM 0 HB VAL A 306 51.027 38.481 9.863 1.00 29.77 H new ATOM 0 HG11 VAL A 306 52.134 39.535 11.618 1.00 28.27 H new ATOM 0 HG12 VAL A 306 50.572 39.586 11.870 1.00 28.27 H new ATOM 0 HG13 VAL A 306 51.465 38.538 12.651 1.00 28.27 H new ATOM 0 HG21 VAL A 306 53.107 37.575 10.378 1.00 28.16 H new ATOM 0 HG22 VAL A 306 52.425 36.579 11.404 1.00 28.16 H new ATOM 0 HG23 VAL A 306 52.146 36.431 9.852 1.00 28.16 H new ATOM 730 N THR A 307 48.093 38.758 10.723 1.00 27.63 N ATOM 731 CA THR A 307 47.008 39.624 11.142 1.00 28.97 C ATOM 732 C THR A 307 45.870 38.879 11.877 1.00 26.79 C ATOM 733 O THR A 307 45.332 39.371 12.893 1.00 26.79 O ATOM 734 CB THR A 307 46.429 40.339 9.912 1.00 30.44 C ATOM 735 OG1 THR A 307 47.360 41.322 9.479 1.00 34.00 O ATOM 736 CG2 THR A 307 45.183 41.153 10.286 1.00 26.36 C ATOM 0 H THR A 307 48.236 38.758 9.875 1.00 27.63 H new ATOM 0 HA THR A 307 47.384 40.256 11.775 1.00 28.97 H new ATOM 0 HB THR A 307 46.232 39.660 9.248 1.00 30.44 H new ATOM 0 HG1 THR A 307 47.232 41.490 8.666 1.00 34.00 H new ATOM 0 HG21 THR A 307 44.835 41.595 9.495 1.00 26.36 H new ATOM 0 HG22 THR A 307 44.506 40.561 10.649 1.00 26.36 H new ATOM 0 HG23 THR A 307 45.419 41.819 10.951 1.00 26.36 H new ATOM 737 N LEU A 308 45.500 37.727 11.333 1.00 23.00 N ATOM 738 CA LEU A 308 44.458 36.899 11.915 1.00 25.35 C ATOM 739 C LEU A 308 44.878 36.385 13.316 1.00 26.22 C ATOM 740 O LEU A 308 44.089 36.382 14.237 1.00 26.26 O ATOM 741 CB LEU A 308 44.080 35.751 10.983 1.00 23.56 C ATOM 742 CG LEU A 308 43.279 36.117 9.717 1.00 25.54 C ATOM 743 CD1 LEU A 308 42.875 34.874 8.923 1.00 21.94 C ATOM 744 CD2 LEU A 308 42.043 36.925 10.128 1.00 26.35 C ATOM 0 H LEU A 308 45.847 37.404 10.615 1.00 23.00 H new ATOM 0 HA LEU A 308 43.667 37.448 12.030 1.00 25.35 H new ATOM 0 HB2 LEU A 308 44.896 35.305 10.706 1.00 23.56 H new ATOM 0 HB3 LEU A 308 43.563 35.106 11.492 1.00 23.56 H new ATOM 0 HG LEU A 308 43.842 36.651 9.135 1.00 25.54 H new ATOM 0 HD11 LEU A 308 42.374 35.141 8.136 1.00 21.94 H new ATOM 0 HD12 LEU A 308 43.671 34.391 8.651 1.00 21.94 H new ATOM 0 HD13 LEU A 308 42.323 34.301 9.478 1.00 21.94 H new ATOM 0 HD21 LEU A 308 41.532 37.160 9.338 1.00 26.35 H new ATOM 0 HD22 LEU A 308 41.491 36.393 10.722 1.00 26.35 H new ATOM 0 HD23 LEU A 308 42.322 37.734 10.584 1.00 26.35 H new ATOM 745 N LEU A 309 46.128 35.981 13.485 1.00 27.06 N ATOM 746 CA LEU A 309 46.527 35.445 14.768 1.00 26.23 C ATOM 747 C LEU A 309 46.682 36.599 15.736 1.00 27.32 C ATOM 748 O LEU A 309 46.272 36.543 16.906 1.00 25.97 O ATOM 749 CB LEU A 309 47.812 34.625 14.624 1.00 25.38 C ATOM 750 CG LEU A 309 47.490 33.224 14.145 1.00 28.91 C ATOM 751 CD1 LEU A 309 48.795 32.590 13.722 1.00 35.21 C ATOM 752 CD2 LEU A 309 46.905 32.441 15.272 1.00 30.32 C ATOM 0 H LEU A 309 46.744 36.008 12.885 1.00 27.06 H new ATOM 0 HA LEU A 309 45.852 34.840 15.114 1.00 26.23 H new ATOM 0 HB2 LEU A 309 48.411 35.059 13.996 1.00 25.38 H new ATOM 0 HB3 LEU A 309 48.274 34.584 15.476 1.00 25.38 H new ATOM 0 HG LEU A 309 46.856 33.242 13.411 1.00 28.91 H new ATOM 0 HD11 LEU A 309 48.630 31.687 13.407 1.00 35.21 H new ATOM 0 HD12 LEU A 309 49.193 33.113 13.008 1.00 35.21 H new ATOM 0 HD13 LEU A 309 49.402 32.562 14.478 1.00 35.21 H new ATOM 0 HD21 LEU A 309 46.697 31.543 14.969 1.00 30.32 H new ATOM 0 HD22 LEU A 309 47.543 32.396 16.001 1.00 30.32 H new ATOM 0 HD23 LEU A 309 46.093 32.874 15.580 1.00 30.32 H new ATOM 753 N LYS A 310 47.252 37.678 15.232 1.00 24.77 N ATOM 754 CA LYS A 310 47.458 38.835 16.091 1.00 26.40 C ATOM 755 C LYS A 310 46.169 39.323 16.795 1.00 26.16 C ATOM 756 O LYS A 310 46.170 39.524 18.021 1.00 27.98 O ATOM 757 CB LYS A 310 48.136 39.959 15.264 1.00 26.34 C ATOM 758 CG LYS A 310 48.216 41.318 15.954 1.00 25.94 C ATOM 759 CD LYS A 310 48.749 42.385 14.950 1.00 29.44 C ATOM 760 CE LYS A 310 48.712 43.772 15.562 1.00 27.06 C ATOM 761 NZ LYS A 310 49.703 43.813 16.697 1.00 29.71 N ATOM 0 H LYS A 310 47.521 37.765 14.420 1.00 24.77 H new ATOM 0 HA LYS A 310 48.042 38.569 16.818 1.00 26.40 H new ATOM 0 HB2 LYS A 310 49.035 39.675 15.036 1.00 26.34 H new ATOM 0 HB3 LYS A 310 47.652 40.064 14.430 1.00 26.34 H new ATOM 0 HG2 LYS A 310 47.340 41.577 16.280 1.00 25.94 H new ATOM 0 HG3 LYS A 310 48.802 41.265 16.725 1.00 25.94 H new ATOM 0 HD2 LYS A 310 49.658 42.166 14.692 1.00 29.44 H new ATOM 0 HD3 LYS A 310 48.213 42.370 14.142 1.00 29.44 H new ATOM 0 HE2 LYS A 310 48.933 44.442 14.896 1.00 27.06 H new ATOM 0 HE3 LYS A 310 47.820 43.976 15.884 1.00 27.06 H new ATOM 0 HZ1 LYS A 310 49.835 44.657 16.946 1.00 29.71 H new ATOM 0 HZ2 LYS A 310 49.385 43.347 17.386 1.00 29.71 H new ATOM 0 HZ3 LYS A 310 50.475 43.459 16.431 1.00 29.71 H new ATOM 762 N TYR A 311 45.094 39.522 16.030 1.00 24.07 N ATOM 763 CA TYR A 311 43.809 40.051 16.548 1.00 25.91 C ATOM 764 C TYR A 311 42.896 38.997 17.110 1.00 27.67 C ATOM 765 O TYR A 311 41.914 39.323 17.757 1.00 32.40 O ATOM 766 CB TYR A 311 43.022 40.857 15.464 1.00 29.74 C ATOM 767 CG TYR A 311 43.714 42.183 15.202 1.00 32.26 C ATOM 768 CD1 TYR A 311 43.537 43.276 16.084 1.00 32.18 C ATOM 769 CD2 TYR A 311 44.570 42.324 14.122 1.00 32.71 C ATOM 770 CE1 TYR A 311 44.193 44.492 15.883 1.00 33.01 C ATOM 771 CE2 TYR A 311 45.248 43.535 13.886 1.00 36.06 C ATOM 772 CZ TYR A 311 45.055 44.619 14.773 1.00 37.16 C ATOM 773 OH TYR A 311 45.739 45.804 14.553 1.00 36.87 O ATOM 0 H TYR A 311 45.082 39.355 15.187 1.00 24.07 H new ATOM 0 HA TYR A 311 44.074 40.639 17.273 1.00 25.91 H new ATOM 0 HB2 TYR A 311 42.969 40.343 14.643 1.00 29.74 H new ATOM 0 HB3 TYR A 311 42.112 41.011 15.762 1.00 29.74 H new ATOM 0 HD1 TYR A 311 42.970 43.182 16.815 1.00 32.18 H new ATOM 0 HD2 TYR A 311 44.699 41.607 13.544 1.00 32.71 H new ATOM 0 HE1 TYR A 311 44.065 45.203 16.468 1.00 33.01 H new ATOM 0 HE2 TYR A 311 45.816 43.621 13.155 1.00 36.06 H new ATOM 0 HH TYR A 311 46.210 45.731 13.861 1.00 36.87 H new ATOM 774 N GLY A 312 43.194 37.734 16.845 1.00 25.22 N ATOM 775 CA GLY A 312 42.339 36.646 17.280 1.00 25.87 C ATOM 776 C GLY A 312 42.835 35.845 18.486 1.00 24.02 C ATOM 777 O GLY A 312 42.026 35.219 19.183 1.00 20.30 O ATOM 0 H GLY A 312 43.893 37.486 16.411 1.00 25.22 H new ATOM 0 HA2 GLY A 312 41.465 37.010 17.493 1.00 25.87 H new ATOM 0 HA3 GLY A 312 42.218 36.035 16.536 1.00 25.87 H new ATOM 778 N VAL A 313 44.150 35.850 18.757 1.00 21.20 N ATOM 779 CA VAL A 313 44.634 34.925 19.782 1.00 21.80 C ATOM 780 C VAL A 313 44.039 35.163 21.173 1.00 20.40 C ATOM 781 O VAL A 313 43.689 34.218 21.867 1.00 25.57 O ATOM 782 CB VAL A 313 46.207 34.825 19.890 1.00 22.55 C ATOM 783 CG1 VAL A 313 46.799 34.275 18.597 1.00 24.02 C ATOM 784 CG2 VAL A 313 46.850 36.154 20.375 1.00 17.36 C ATOM 0 H VAL A 313 44.742 36.349 18.383 1.00 21.20 H new ATOM 0 HA VAL A 313 44.308 34.071 19.457 1.00 21.80 H new ATOM 0 HB VAL A 313 46.429 34.185 20.584 1.00 22.55 H new ATOM 0 HG11 VAL A 313 47.764 34.220 18.680 1.00 24.02 H new ATOM 0 HG12 VAL A 313 46.439 33.391 18.426 1.00 24.02 H new ATOM 0 HG13 VAL A 313 46.571 34.864 17.861 1.00 24.02 H new ATOM 0 HG21 VAL A 313 47.813 36.048 20.427 1.00 17.36 H new ATOM 0 HG22 VAL A 313 46.636 36.864 19.750 1.00 17.36 H new ATOM 0 HG23 VAL A 313 46.503 36.381 21.252 1.00 17.36 H new ATOM 785 N TYR A 314 43.910 36.415 21.589 1.00 22.77 N ATOM 786 CA TYR A 314 43.440 36.650 22.941 1.00 21.82 C ATOM 787 C TYR A 314 41.984 36.335 23.083 1.00 23.27 C ATOM 788 O TYR A 314 41.568 35.897 24.147 1.00 24.52 O ATOM 789 CB TYR A 314 43.721 38.076 23.410 1.00 23.10 C ATOM 790 CG TYR A 314 45.076 38.155 24.037 1.00 24.61 C ATOM 791 CD1 TYR A 314 45.347 37.489 25.243 1.00 24.75 C ATOM 792 CD2 TYR A 314 46.107 38.877 23.420 1.00 22.90 C ATOM 793 CE1 TYR A 314 46.635 37.548 25.837 1.00 25.16 C ATOM 794 CE2 TYR A 314 47.400 38.926 23.996 1.00 26.43 C ATOM 795 CZ TYR A 314 47.650 38.275 25.186 1.00 25.47 C ATOM 796 OH TYR A 314 48.906 38.351 25.725 1.00 24.55 O ATOM 0 H TYR A 314 44.082 37.117 21.123 1.00 22.77 H new ATOM 0 HA TYR A 314 43.940 36.046 23.512 1.00 21.82 H new ATOM 0 HB2 TYR A 314 43.669 38.687 22.659 1.00 23.10 H new ATOM 0 HB3 TYR A 314 43.045 38.353 24.048 1.00 23.10 H new ATOM 0 HD1 TYR A 314 44.673 37.002 25.659 1.00 24.75 H new ATOM 0 HD2 TYR A 314 45.940 39.328 22.624 1.00 22.90 H new ATOM 0 HE1 TYR A 314 46.805 37.114 26.642 1.00 25.16 H new ATOM 0 HE2 TYR A 314 48.080 39.397 23.572 1.00 26.43 H new ATOM 0 HH TYR A 314 48.878 38.128 26.534 1.00 24.55 H new ATOM 797 N GLU A 315 41.195 36.574 22.034 1.00 22.75 N ATOM 798 CA GLU A 315 39.794 36.146 22.087 1.00 21.70 C ATOM 799 C GLU A 315 39.752 34.628 22.281 1.00 22.07 C ATOM 800 O GLU A 315 39.023 34.097 23.137 1.00 21.44 O ATOM 801 CB GLU A 315 39.039 36.571 20.808 1.00 20.36 C ATOM 802 CG GLU A 315 38.821 38.075 20.678 1.00 24.40 C ATOM 803 CD GLU A 315 38.248 38.514 19.320 1.00 26.44 C ATOM 804 OE1 GLU A 315 37.697 37.674 18.601 1.00 26.61 O ATOM 805 OE2 GLU A 315 38.339 39.709 18.958 1.00 27.31 O ATOM 0 H GLU A 315 41.438 36.967 21.308 1.00 22.75 H new ATOM 0 HA GLU A 315 39.349 36.576 22.834 1.00 21.70 H new ATOM 0 HB2 GLU A 315 39.534 36.258 20.034 1.00 20.36 H new ATOM 0 HB3 GLU A 315 38.177 36.127 20.792 1.00 20.36 H new ATOM 0 HG2 GLU A 315 38.219 38.366 21.381 1.00 24.40 H new ATOM 0 HG3 GLU A 315 39.667 38.528 20.823 1.00 24.40 H new ATOM 806 N ALA A 316 40.534 33.910 21.479 1.00 20.43 N ATOM 807 CA ALA A 316 40.587 32.478 21.620 1.00 21.43 C ATOM 808 C ALA A 316 41.096 32.079 23.016 1.00 22.16 C ATOM 809 O ALA A 316 40.588 31.150 23.629 1.00 23.46 O ATOM 810 CB ALA A 316 41.459 31.850 20.549 1.00 23.13 C ATOM 0 H ALA A 316 41.032 34.236 20.858 1.00 20.43 H new ATOM 0 HA ALA A 316 39.683 32.144 21.512 1.00 21.43 H new ATOM 0 HB1 ALA A 316 41.476 30.888 20.669 1.00 23.13 H new ATOM 0 HB2 ALA A 316 41.098 32.060 19.673 1.00 23.13 H new ATOM 0 HB3 ALA A 316 42.361 32.200 20.619 1.00 23.13 H new ATOM 811 N ILE A 317 42.093 32.782 23.516 1.00 20.74 N ATOM 812 CA ILE A 317 42.657 32.421 24.797 1.00 21.91 C ATOM 813 C ILE A 317 41.621 32.474 25.914 1.00 23.19 C ATOM 814 O ILE A 317 41.471 31.519 26.691 1.00 23.96 O ATOM 815 CB ILE A 317 43.906 33.322 25.115 1.00 19.09 C ATOM 816 CG1 ILE A 317 45.106 32.799 24.312 1.00 19.94 C ATOM 817 CG2 ILE A 317 44.217 33.295 26.579 1.00 20.18 C ATOM 818 CD1 ILE A 317 46.332 33.741 24.283 1.00 16.85 C ATOM 0 H ILE A 317 42.454 33.463 23.135 1.00 20.74 H new ATOM 0 HA ILE A 317 42.953 31.499 24.745 1.00 21.91 H new ATOM 0 HB ILE A 317 43.714 34.240 24.866 1.00 19.09 H new ATOM 0 HG12 ILE A 317 45.379 31.946 24.683 1.00 19.94 H new ATOM 0 HG13 ILE A 317 44.820 32.633 23.400 1.00 19.94 H new ATOM 0 HG21 ILE A 317 44.989 33.855 26.756 1.00 20.18 H new ATOM 0 HG22 ILE A 317 43.455 33.628 27.078 1.00 20.18 H new ATOM 0 HG23 ILE A 317 44.409 32.384 26.852 1.00 20.18 H new ATOM 0 HD11 ILE A 317 47.039 33.336 23.758 1.00 16.85 H new ATOM 0 HD12 ILE A 317 46.080 34.589 23.885 1.00 16.85 H new ATOM 0 HD13 ILE A 317 46.647 33.890 25.188 1.00 16.85 H new ATOM 819 N PHE A 318 40.892 33.577 25.999 1.00 22.49 N ATOM 820 CA PHE A 318 39.904 33.679 27.063 1.00 23.28 C ATOM 821 C PHE A 318 38.706 32.779 26.897 1.00 21.84 C ATOM 822 O PHE A 318 38.143 32.356 27.884 1.00 27.66 O ATOM 823 CB PHE A 318 39.520 35.116 27.294 1.00 25.23 C ATOM 824 CG PHE A 318 40.701 35.982 27.669 1.00 26.80 C ATOM 825 CD1 PHE A 318 41.517 35.617 28.740 1.00 23.31 C ATOM 826 CD2 PHE A 318 40.996 37.151 26.939 1.00 26.24 C ATOM 827 CE1 PHE A 318 42.598 36.397 29.092 1.00 25.57 C ATOM 828 CE2 PHE A 318 42.084 37.944 27.276 1.00 25.82 C ATOM 829 CZ PHE A 318 42.892 37.577 28.338 1.00 25.75 C ATOM 0 H PHE A 318 40.948 34.255 25.473 1.00 22.49 H new ATOM 0 HA PHE A 318 40.336 33.344 27.864 1.00 23.28 H new ATOM 0 HB2 PHE A 318 39.106 35.470 26.491 1.00 25.23 H new ATOM 0 HB3 PHE A 318 38.855 35.160 27.999 1.00 25.23 H new ATOM 0 HD1 PHE A 318 41.331 34.842 29.220 1.00 23.31 H new ATOM 0 HD2 PHE A 318 40.455 37.394 26.223 1.00 26.24 H new ATOM 0 HE1 PHE A 318 43.132 36.158 29.815 1.00 25.57 H new ATOM 0 HE2 PHE A 318 42.269 38.716 26.792 1.00 25.82 H new ATOM 0 HZ PHE A 318 43.628 38.099 28.562 1.00 25.75 H new ATOM 830 N ALA A 319 38.338 32.455 25.670 1.00 23.92 N ATOM 831 CA ALA A 319 37.292 31.447 25.412 1.00 25.13 C ATOM 832 C ALA A 319 37.728 30.103 26.009 1.00 27.15 C ATOM 833 O ALA A 319 36.975 29.443 26.732 1.00 28.38 O ATOM 834 CB ALA A 319 37.065 31.281 23.869 1.00 18.68 C ATOM 0 H ALA A 319 38.677 32.803 24.960 1.00 23.92 H new ATOM 0 HA ALA A 319 36.463 31.739 25.822 1.00 25.13 H new ATOM 0 HB1 ALA A 319 36.376 30.616 23.713 1.00 18.68 H new ATOM 0 HB2 ALA A 319 36.787 32.129 23.489 1.00 18.68 H new ATOM 0 HB3 ALA A 319 37.891 30.994 23.449 1.00 18.68 H new ATOM 835 N MET A 320 38.952 29.693 25.677 1.00 25.29 N ATOM 836 CA MET A 320 39.498 28.446 26.164 1.00 22.90 C ATOM 837 C MET A 320 39.818 28.423 27.664 1.00 23.64 C ATOM 838 O MET A 320 39.580 27.402 28.300 1.00 23.16 O ATOM 839 CB MET A 320 40.726 28.069 25.316 1.00 23.74 C ATOM 840 CG MET A 320 40.312 27.608 23.923 1.00 21.22 C ATOM 841 SD MET A 320 41.629 26.843 23.003 1.00 27.33 S ATOM 842 CE MET A 320 42.749 28.258 22.956 1.00 24.35 C ATOM 0 H MET A 320 39.482 30.135 25.164 1.00 25.29 H new ATOM 0 HA MET A 320 38.801 27.778 26.064 1.00 22.90 H new ATOM 0 HB2 MET A 320 41.319 28.833 25.244 1.00 23.74 H new ATOM 0 HB3 MET A 320 41.224 27.364 25.758 1.00 23.74 H new ATOM 0 HG2 MET A 320 39.577 26.980 24.004 1.00 21.22 H new ATOM 0 HG3 MET A 320 39.980 28.371 23.424 1.00 21.22 H new ATOM 0 HE1 MET A 320 43.397 28.134 22.245 1.00 24.35 H new ATOM 0 HE2 MET A 320 42.241 29.068 22.793 1.00 24.35 H new ATOM 0 HE3 MET A 320 43.212 28.333 23.805 1.00 24.35 H new ATOM 843 N LEU A 321 40.360 29.522 28.210 1.00 23.68 N ATOM 844 CA LEU A 321 40.627 29.642 29.651 1.00 28.96 C ATOM 845 C LEU A 321 39.351 29.359 30.419 1.00 28.95 C ATOM 846 O LEU A 321 39.377 28.840 31.541 1.00 28.21 O ATOM 847 CB LEU A 321 41.090 31.052 30.028 1.00 30.89 C ATOM 848 CG LEU A 321 42.562 31.433 30.217 1.00 33.72 C ATOM 849 CD1 LEU A 321 42.658 32.647 31.229 1.00 34.16 C ATOM 850 CD2 LEU A 321 43.483 30.255 30.642 1.00 32.10 C ATOM 0 H LEU A 321 40.582 30.217 27.755 1.00 23.68 H new ATOM 0 HA LEU A 321 41.327 29.008 29.872 1.00 28.96 H new ATOM 0 HB2 LEU A 321 40.739 31.647 29.347 1.00 30.89 H new ATOM 0 HB3 LEU A 321 40.641 31.275 30.858 1.00 30.89 H new ATOM 0 HG LEU A 321 42.901 31.697 29.347 1.00 33.72 H new ATOM 0 HD11 LEU A 321 43.588 32.893 31.353 1.00 34.16 H new ATOM 0 HD12 LEU A 321 42.168 33.405 30.873 1.00 34.16 H new ATOM 0 HD13 LEU A 321 42.276 32.388 32.082 1.00 34.16 H new ATOM 0 HD21 LEU A 321 44.393 30.575 30.741 1.00 32.10 H new ATOM 0 HD22 LEU A 321 43.175 29.892 31.487 1.00 32.10 H new ATOM 0 HD23 LEU A 321 43.456 29.562 29.964 1.00 32.10 H new ATOM 851 N SER A 322 38.212 29.688 29.820 1.00 28.00 N ATOM 852 CA SER A 322 36.975 29.431 30.549 1.00 29.20 C ATOM 853 C SER A 322 36.864 27.986 31.020 1.00 27.74 C ATOM 854 O SER A 322 36.314 27.754 32.095 1.00 28.02 O ATOM 855 CB SER A 322 35.732 29.837 29.746 1.00 25.22 C ATOM 856 OG SER A 322 35.684 31.242 29.706 1.00 26.15 O ATOM 0 H SER A 322 38.132 30.040 29.039 1.00 28.00 H new ATOM 0 HA SER A 322 37.014 29.993 31.339 1.00 29.20 H new ATOM 0 HB2 SER A 322 35.774 29.473 28.848 1.00 25.22 H new ATOM 0 HB3 SER A 322 34.930 29.481 30.159 1.00 25.22 H new ATOM 0 HG SER A 322 36.318 31.531 29.238 1.00 26.15 H new ATOM 857 N SER A 323 37.365 27.036 30.214 1.00 27.11 N ATOM 858 CA SER A 323 37.243 25.605 30.529 1.00 27.60 C ATOM 859 C SER A 323 37.900 25.182 31.859 1.00 28.31 C ATOM 860 O SER A 323 37.491 24.161 32.428 1.00 30.74 O ATOM 861 CB SER A 323 37.808 24.672 29.408 1.00 26.27 C ATOM 862 OG SER A 323 37.370 25.005 28.082 1.00 26.19 O ATOM 0 H SER A 323 37.780 27.202 29.479 1.00 27.11 H new ATOM 0 HA SER A 323 36.283 25.492 30.605 1.00 27.60 H new ATOM 0 HB2 SER A 323 38.777 24.704 29.434 1.00 26.27 H new ATOM 0 HB3 SER A 323 37.549 23.758 29.602 1.00 26.27 H new ATOM 0 HG SER A 323 38.018 24.947 27.550 1.00 26.19 H new ATOM 863 N VAL A 324 38.940 25.906 32.306 1.00 29.78 N ATOM 864 CA VAL A 324 39.688 25.561 33.534 1.00 28.83 C ATOM 865 C VAL A 324 39.236 26.419 34.737 1.00 33.41 C ATOM 866 O VAL A 324 39.860 26.372 35.802 1.00 33.81 O ATOM 867 CB VAL A 324 41.209 25.752 33.353 1.00 31.11 C ATOM 868 CG1 VAL A 324 41.727 24.958 32.140 1.00 30.00 C ATOM 869 CG2 VAL A 324 41.590 27.238 33.190 1.00 27.30 C ATOM 0 H VAL A 324 39.232 26.610 31.907 1.00 29.78 H new ATOM 0 HA VAL A 324 39.496 24.626 33.707 1.00 28.83 H new ATOM 0 HB VAL A 324 41.627 25.415 34.161 1.00 31.11 H new ATOM 0 HG11 VAL A 324 42.683 25.094 32.048 1.00 30.00 H new ATOM 0 HG12 VAL A 324 41.546 24.014 32.270 1.00 30.00 H new ATOM 0 HG13 VAL A 324 41.278 25.265 31.337 1.00 30.00 H new ATOM 0 HG21 VAL A 324 42.551 27.316 33.079 1.00 27.30 H new ATOM 0 HG22 VAL A 324 41.144 27.603 32.409 1.00 27.30 H new ATOM 0 HG23 VAL A 324 41.315 27.731 33.979 1.00 27.30 H new ATOM 870 N MET A 325 38.154 27.190 34.567 1.00 30.21 N ATOM 871 CA MET A 325 37.664 28.056 35.637 1.00 34.97 C ATOM 872 C MET A 325 36.278 27.673 36.219 1.00 34.73 C ATOM 873 O MET A 325 35.359 27.257 35.500 1.00 33.79 O ATOM 874 CB MET A 325 37.629 29.533 35.186 1.00 34.14 C ATOM 875 CG MET A 325 38.915 30.039 34.493 1.00 34.69 C ATOM 876 SD MET A 325 38.595 31.570 33.575 1.00 36.74 S ATOM 877 CE MET A 325 38.371 32.725 34.920 1.00 37.63 C ATOM 0 H MET A 325 37.694 27.223 33.841 1.00 30.21 H new ATOM 0 HA MET A 325 38.305 27.927 36.353 1.00 34.97 H new ATOM 0 HB2 MET A 325 36.882 29.653 34.579 1.00 34.14 H new ATOM 0 HB3 MET A 325 37.456 30.089 35.962 1.00 34.14 H new ATOM 0 HG2 MET A 325 39.605 30.194 35.157 1.00 34.69 H new ATOM 0 HG3 MET A 325 39.250 29.359 33.888 1.00 34.69 H new ATOM 0 HE1 MET A 325 38.267 33.621 34.563 1.00 37.63 H new ATOM 0 HE2 MET A 325 37.579 32.484 35.425 1.00 37.63 H new ATOM 0 HE3 MET A 325 39.146 32.698 35.503 1.00 37.63 H new ATOM 878 N ASN A 326 36.146 27.817 37.530 1.00 35.15 N ATOM 879 CA ASN A 326 34.844 27.654 38.164 1.00 38.45 C ATOM 880 C ASN A 326 34.646 28.851 39.082 1.00 39.91 C ATOM 881 O ASN A 326 35.461 29.774 39.068 1.00 41.66 O ATOM 882 CB ASN A 326 34.658 26.287 38.878 1.00 36.83 C ATOM 883 CG ASN A 326 35.624 26.070 40.057 1.00 38.95 C ATOM 884 OD1 ASN A 326 36.110 27.022 40.703 1.00 39.02 O ATOM 885 ND2 ASN A 326 35.892 24.812 40.351 1.00 38.24 N ATOM 0 H ASN A 326 36.790 28.007 38.067 1.00 35.15 H new ATOM 0 HA ASN A 326 34.150 27.634 37.487 1.00 38.45 H new ATOM 0 HB2 ASN A 326 33.746 26.221 39.201 1.00 36.83 H new ATOM 0 HB3 ASN A 326 34.783 25.574 38.232 1.00 36.83 H new ATOM 0 HD21 ASN A 326 36.417 24.626 41.006 1.00 38.24 H new ATOM 0 HD22 ASN A 326 35.542 24.178 39.887 1.00 38.24 H new ATOM 886 N LYS A 327 33.577 28.852 39.860 1.00 40.42 N ATOM 887 CA LYS A 327 33.234 30.032 40.642 1.00 40.89 C ATOM 888 C LYS A 327 34.250 30.339 41.733 1.00 41.23 C ATOM 889 O LYS A 327 34.262 31.450 42.265 1.00 45.02 O ATOM 890 CB LYS A 327 31.834 29.906 41.227 1.00 41.21 C ATOM 891 CG LYS A 327 31.517 28.548 41.853 1.00 42.56 C ATOM 892 CD LYS A 327 30.506 28.695 43.010 1.00 45.90 C ATOM 893 CE LYS A 327 30.141 27.324 43.650 1.00 47.67 C ATOM 894 NZ LYS A 327 31.161 26.920 44.709 1.00 46.24 N ATOM 0 H LYS A 327 33.039 28.187 39.951 1.00 40.42 H new ATOM 0 HA LYS A 327 33.252 30.783 40.029 1.00 40.89 H new ATOM 0 HB2 LYS A 327 31.716 30.593 41.901 1.00 41.21 H new ATOM 0 HB3 LYS A 327 31.188 30.083 40.526 1.00 41.21 H new ATOM 0 HG2 LYS A 327 31.156 27.953 41.177 1.00 42.56 H new ATOM 0 HG3 LYS A 327 32.334 28.141 42.182 1.00 42.56 H new ATOM 0 HD2 LYS A 327 30.878 29.279 43.690 1.00 45.90 H new ATOM 0 HD3 LYS A 327 29.699 29.121 42.680 1.00 45.90 H new ATOM 0 HE2 LYS A 327 29.259 27.376 44.050 1.00 47.67 H new ATOM 0 HE3 LYS A 327 30.100 26.643 42.960 1.00 47.67 H new ATOM 0 HZ1 LYS A 327 31.072 26.054 44.892 1.00 46.24 H new ATOM 0 HZ2 LYS A 327 31.983 27.076 44.405 1.00 46.24 H new ATOM 0 HZ3 LYS A 327 31.024 27.395 45.449 1.00 46.24 H new ATOM 895 N ASP A 328 35.116 29.378 42.033 1.00 38.02 N ATOM 896 CA ASP A 328 36.075 29.489 43.146 1.00 38.38 C ATOM 897 C ASP A 328 37.546 29.709 42.766 1.00 37.05 C ATOM 898 O ASP A 328 38.345 30.106 43.617 1.00 35.05 O ATOM 899 CB ASP A 328 35.991 28.231 44.043 1.00 42.42 C ATOM 900 CG ASP A 328 34.610 28.074 44.716 1.00 46.22 C ATOM 901 OD1 ASP A 328 34.107 29.073 45.315 1.00 46.32 O ATOM 902 OD2 ASP A 328 33.958 26.995 44.670 1.00 48.69 O ATOM 0 H ASP A 328 35.170 28.637 41.599 1.00 38.02 H new ATOM 0 HA ASP A 328 35.800 30.298 43.606 1.00 38.38 H new ATOM 0 HB2 ASP A 328 36.178 27.443 43.508 1.00 42.42 H new ATOM 0 HB3 ASP A 328 36.677 28.279 44.727 1.00 42.42 H new ATOM 903 N GLY A 329 37.911 29.459 41.504 1.00 33.87 N ATOM 904 CA GLY A 329 39.293 29.624 41.087 1.00 30.80 C ATOM 905 C GLY A 329 39.499 28.873 39.782 1.00 30.28 C ATOM 906 O GLY A 329 38.532 28.530 39.074 1.00 27.08 O ATOM 0 H GLY A 329 37.375 29.196 40.885 1.00 33.87 H new ATOM 0 HA2 GLY A 329 39.499 30.565 40.970 1.00 30.80 H new ATOM 0 HA3 GLY A 329 39.893 29.284 41.769 1.00 30.80 H new ATOM 907 N MET A 330 40.760 28.601 39.466 1.00 29.90 N ATOM 908 CA MET A 330 41.094 28.035 38.167 1.00 29.67 C ATOM 909 C MET A 330 42.367 27.220 38.263 1.00 30.30 C ATOM 910 O MET A 330 43.169 27.428 39.180 1.00 30.98 O ATOM 911 CB MET A 330 41.230 29.168 37.133 1.00 25.02 C ATOM 912 CG MET A 330 42.486 30.010 37.271 1.00 28.89 C ATOM 913 SD MET A 330 42.484 31.528 36.174 1.00 32.22 S ATOM 914 CE MET A 330 42.491 30.688 34.589 1.00 25.56 C ATOM 0 H MET A 330 41.432 28.736 39.986 1.00 29.90 H new ATOM 0 HA MET A 330 40.384 27.440 37.879 1.00 29.67 H new ATOM 0 HB2 MET A 330 41.212 28.781 36.244 1.00 25.02 H new ATOM 0 HB3 MET A 330 40.457 29.749 37.205 1.00 25.02 H new ATOM 0 HG2 MET A 330 42.582 30.287 38.196 1.00 28.89 H new ATOM 0 HG3 MET A 330 43.259 29.464 37.056 1.00 28.89 H new ATOM 0 HE1 MET A 330 43.171 31.079 34.018 1.00 25.56 H new ATOM 0 HE2 MET A 330 42.684 29.747 34.722 1.00 25.56 H new ATOM 0 HE3 MET A 330 41.622 30.783 34.168 1.00 25.56 H new ATOM 915 N LEU A 331 42.556 26.293 37.326 1.00 29.50 N ATOM 916 CA LEU A 331 43.755 25.482 37.285 1.00 29.26 C ATOM 917 C LEU A 331 44.963 26.267 36.768 1.00 30.23 C ATOM 918 O LEU A 331 44.822 27.231 35.993 1.00 29.88 O ATOM 919 CB LEU A 331 43.554 24.236 36.372 1.00 29.54 C ATOM 920 CG LEU A 331 42.380 23.278 36.629 1.00 31.49 C ATOM 921 CD1 LEU A 331 42.316 22.168 35.575 1.00 29.12 C ATOM 922 CD2 LEU A 331 42.499 22.677 38.004 1.00 29.25 C ATOM 0 H LEU A 331 41.991 26.122 36.701 1.00 29.50 H new ATOM 0 HA LEU A 331 43.926 25.204 38.198 1.00 29.26 H new ATOM 0 HB2 LEU A 331 43.471 24.557 35.460 1.00 29.54 H new ATOM 0 HB3 LEU A 331 44.369 23.712 36.415 1.00 29.54 H new ATOM 0 HG LEU A 331 41.559 23.791 36.569 1.00 31.49 H new ATOM 0 HD11 LEU A 331 41.566 21.583 35.766 1.00 29.12 H new ATOM 0 HD12 LEU A 331 42.202 22.562 34.696 1.00 29.12 H new ATOM 0 HD13 LEU A 331 43.139 21.655 35.595 1.00 29.12 H new ATOM 0 HD21 LEU A 331 41.755 22.074 38.159 1.00 29.25 H new ATOM 0 HD22 LEU A 331 43.333 22.186 38.072 1.00 29.25 H new ATOM 0 HD23 LEU A 331 42.486 23.384 38.668 1.00 29.25 H new ATOM 923 N VAL A 332 46.154 25.811 37.147 1.00 28.08 N ATOM 924 CA VAL A 332 47.382 26.464 36.715 1.00 29.13 C ATOM 925 C VAL A 332 48.394 25.367 36.484 1.00 30.23 C ATOM 926 O VAL A 332 48.145 24.225 36.831 1.00 31.19 O ATOM 927 CB VAL A 332 47.902 27.439 37.779 1.00 31.16 C ATOM 928 CG1 VAL A 332 46.809 28.475 38.166 1.00 26.79 C ATOM 929 CG2 VAL A 332 48.418 26.648 39.040 1.00 30.10 C ATOM 0 H VAL A 332 46.271 25.126 37.653 1.00 28.08 H new ATOM 0 HA VAL A 332 47.223 26.982 35.911 1.00 29.13 H new ATOM 0 HB VAL A 332 48.650 27.932 37.407 1.00 31.16 H new ATOM 0 HG11 VAL A 332 47.160 29.080 38.839 1.00 26.79 H new ATOM 0 HG12 VAL A 332 46.550 28.981 37.380 1.00 26.79 H new ATOM 0 HG13 VAL A 332 46.035 28.011 38.521 1.00 26.79 H new ATOM 0 HG21 VAL A 332 48.744 27.275 39.705 1.00 30.10 H new ATOM 0 HG22 VAL A 332 47.691 26.128 39.416 1.00 30.10 H new ATOM 0 HG23 VAL A 332 49.138 26.053 38.777 1.00 30.10 H new ATOM 930 N ALA A 333 49.523 25.680 35.864 1.00 34.06 N ATOM 931 CA ALA A 333 50.544 24.656 35.670 1.00 35.73 C ATOM 932 C ALA A 333 49.938 23.327 35.240 1.00 36.44 C ATOM 933 O ALA A 333 50.083 22.299 35.943 1.00 34.51 O ATOM 934 CB ALA A 333 51.403 24.465 36.980 1.00 37.38 C ATOM 0 H ALA A 333 49.717 26.458 35.554 1.00 34.06 H new ATOM 0 HA ALA A 333 51.125 24.962 34.956 1.00 35.73 H new ATOM 0 HB1 ALA A 333 52.075 23.781 36.830 1.00 37.38 H new ATOM 0 HB2 ALA A 333 51.839 25.302 37.206 1.00 37.38 H new ATOM 0 HB3 ALA A 333 50.824 24.195 37.710 1.00 37.38 H new ATOM 935 N TYR A 334 49.266 23.356 34.082 1.00 37.39 N ATOM 936 CA TYR A 334 48.723 22.170 33.418 1.00 36.34 C ATOM 937 C TYR A 334 47.805 21.349 34.261 1.00 36.53 C ATOM 938 O TYR A 334 47.790 20.137 34.135 1.00 40.87 O ATOM 939 CB TYR A 334 49.874 21.284 32.950 1.00 39.08 C ATOM 940 CG TYR A 334 50.948 22.101 32.305 1.00 39.11 C ATOM 941 CD1 TYR A 334 50.791 22.519 30.998 1.00 39.09 C ATOM 942 CD2 TYR A 334 52.107 22.486 33.010 1.00 38.06 C ATOM 943 CE1 TYR A 334 51.736 23.263 30.382 1.00 39.76 C ATOM 944 CE2 TYR A 334 53.074 23.256 32.402 1.00 40.10 C ATOM 945 CZ TYR A 334 52.880 23.636 31.075 1.00 42.04 C ATOM 946 OH TYR A 334 53.795 24.391 30.393 1.00 41.72 O ATOM 0 H TYR A 334 49.111 24.085 33.653 1.00 37.39 H new ATOM 0 HA TYR A 334 48.192 22.503 32.678 1.00 36.34 H new ATOM 0 HB2 TYR A 334 50.241 20.799 33.705 1.00 39.08 H new ATOM 0 HB3 TYR A 334 49.544 20.623 32.322 1.00 39.08 H new ATOM 0 HD1 TYR A 334 50.021 22.284 30.533 1.00 39.09 H new ATOM 0 HD2 TYR A 334 52.220 22.218 33.893 1.00 38.06 H new ATOM 0 HE1 TYR A 334 51.621 23.524 29.497 1.00 39.76 H new ATOM 0 HE2 TYR A 334 53.837 23.516 32.865 1.00 40.10 H new ATOM 0 HH TYR A 334 53.408 24.814 29.779 1.00 41.72 H new ATOM 947 N GLY A 335 47.030 21.997 35.109 1.00 34.79 N ATOM 948 CA GLY A 335 46.146 21.300 36.010 1.00 36.13 C ATOM 949 C GLY A 335 46.839 20.729 37.259 1.00 37.04 C ATOM 950 O GLY A 335 46.221 20.027 38.052 1.00 37.56 O ATOM 0 H GLY A 335 47.003 22.854 35.177 1.00 34.79 H new ATOM 0 HA2 GLY A 335 45.444 21.907 36.291 1.00 36.13 H new ATOM 0 HA3 GLY A 335 45.718 20.574 35.530 1.00 36.13 H new ATOM 951 N ASN A 336 48.118 21.029 37.452 1.00 37.72 N ATOM 952 CA ASN A 336 48.828 20.513 38.627 1.00 37.63 C ATOM 953 C ASN A 336 48.537 21.400 39.818 1.00 37.10 C ATOM 954 O ASN A 336 48.820 21.044 40.955 1.00 35.99 O ATOM 955 CB ASN A 336 50.323 20.443 38.361 1.00 37.11 C ATOM 956 CG ASN A 336 50.686 19.252 37.542 1.00 40.01 C ATOM 957 OD1 ASN A 336 50.196 18.172 37.798 1.00 42.09 O ATOM 958 ND2 ASN A 336 51.546 19.431 36.545 1.00 42.18 N ATOM 0 H ASN A 336 48.590 21.521 36.927 1.00 37.72 H new ATOM 0 HA ASN A 336 48.518 19.614 38.818 1.00 37.63 H new ATOM 0 HB2 ASN A 336 50.608 21.249 37.903 1.00 37.11 H new ATOM 0 HB3 ASN A 336 50.800 20.413 39.205 1.00 37.11 H new ATOM 0 HD21 ASN A 336 51.776 18.766 36.051 1.00 42.18 H new ATOM 0 HD22 ASN A 336 51.873 20.212 36.394 1.00 42.18 H new ATOM 959 N GLY A 337 47.943 22.556 39.536 1.00 36.20 N ATOM 960 CA GLY A 337 47.573 23.493 40.563 1.00 35.36 C ATOM 961 C GLY A 337 46.219 24.121 40.390 1.00 35.56 C ATOM 962 O GLY A 337 45.594 24.061 39.338 1.00 34.57 O ATOM 0 H GLY A 337 47.747 22.811 38.738 1.00 36.20 H new ATOM 0 HA2 GLY A 337 47.597 23.039 41.420 1.00 35.36 H new ATOM 0 HA3 GLY A 337 48.240 24.197 40.595 1.00 35.36 H new ATOM 963 N PHE A 338 45.759 24.751 41.453 1.00 34.60 N ATOM 964 CA PHE A 338 44.507 25.468 41.409 1.00 35.22 C ATOM 965 C PHE A 338 44.753 26.731 42.199 1.00 37.18 C ATOM 966 O PHE A 338 45.238 26.653 43.336 1.00 37.64 O ATOM 967 CB PHE A 338 43.451 24.637 42.083 1.00 31.06 C ATOM 968 CG PHE A 338 42.079 25.257 42.109 1.00 32.47 C ATOM 969 CD1 PHE A 338 41.576 25.818 43.283 1.00 31.48 C ATOM 970 CD2 PHE A 338 41.258 25.247 40.977 1.00 29.93 C ATOM 971 CE1 PHE A 338 40.291 26.375 43.328 1.00 30.98 C ATOM 972 CE2 PHE A 338 39.962 25.808 41.020 1.00 30.03 C ATOM 973 CZ PHE A 338 39.476 26.367 42.207 1.00 30.30 C ATOM 0 H PHE A 338 46.160 24.775 42.213 1.00 34.60 H new ATOM 0 HA PHE A 338 44.211 25.660 40.505 1.00 35.22 H new ATOM 0 HB2 PHE A 338 43.396 23.780 41.633 1.00 31.06 H new ATOM 0 HB3 PHE A 338 43.730 24.461 42.995 1.00 31.06 H new ATOM 0 HD1 PHE A 338 42.103 25.822 44.049 1.00 31.48 H new ATOM 0 HD2 PHE A 338 41.569 24.867 40.187 1.00 29.93 H new ATOM 0 HE1 PHE A 338 39.982 26.754 44.119 1.00 30.98 H new ATOM 0 HE2 PHE A 338 39.430 25.806 40.257 1.00 30.03 H new ATOM 0 HZ PHE A 338 38.619 26.728 42.243 1.00 30.30 H new ATOM 974 N ILE A 339 44.428 27.884 41.607 1.00 35.55 N ATOM 975 CA ILE A 339 44.554 29.170 42.288 1.00 33.54 C ATOM 976 C ILE A 339 43.154 29.699 42.554 1.00 33.89 C ATOM 977 O ILE A 339 42.318 29.693 41.655 1.00 34.89 O ATOM 978 CB ILE A 339 45.455 30.160 41.463 1.00 33.82 C ATOM 979 CG1 ILE A 339 45.983 31.300 42.342 1.00 32.88 C ATOM 980 CG2 ILE A 339 44.719 30.693 40.220 1.00 33.97 C ATOM 981 CD1 ILE A 339 46.995 32.186 41.654 1.00 34.25 C ATOM 0 H ILE A 339 44.130 27.939 40.802 1.00 35.55 H new ATOM 0 HA ILE A 339 45.007 29.069 43.140 1.00 33.54 H new ATOM 0 HB ILE A 339 46.224 29.660 41.147 1.00 33.82 H new ATOM 0 HG12 ILE A 339 45.235 31.844 42.634 1.00 32.88 H new ATOM 0 HG13 ILE A 339 46.386 30.922 43.139 1.00 32.88 H new ATOM 0 HG21 ILE A 339 45.300 31.299 39.735 1.00 33.97 H new ATOM 0 HG22 ILE A 339 44.474 29.951 39.646 1.00 33.97 H new ATOM 0 HG23 ILE A 339 43.918 31.166 40.496 1.00 33.97 H new ATOM 0 HD11 ILE A 339 47.285 32.882 42.265 1.00 34.25 H new ATOM 0 HD12 ILE A 339 47.760 31.654 41.384 1.00 34.25 H new ATOM 0 HD13 ILE A 339 46.591 32.592 40.871 1.00 34.25 H new ATOM 982 N THR A 340 42.888 30.129 43.793 1.00 34.06 N ATOM 983 CA THR A 340 41.525 30.512 44.184 1.00 34.89 C ATOM 984 C THR A 340 41.194 31.913 43.731 1.00 34.78 C ATOM 985 O THR A 340 42.065 32.766 43.645 1.00 34.90 O ATOM 986 CB THR A 340 41.270 30.424 45.731 1.00 37.61 C ATOM 987 OG1 THR A 340 41.979 31.484 46.408 1.00 38.20 O ATOM 988 CG2 THR A 340 41.849 29.123 46.336 1.00 38.67 C ATOM 0 H THR A 340 43.476 30.206 44.416 1.00 34.06 H new ATOM 0 HA THR A 340 40.950 29.868 43.743 1.00 34.89 H new ATOM 0 HB THR A 340 40.308 30.471 45.848 1.00 37.61 H new ATOM 0 HG1 THR A 340 41.838 31.433 47.234 1.00 38.20 H new ATOM 0 HG21 THR A 340 41.673 29.103 47.290 1.00 38.67 H new ATOM 0 HG22 THR A 340 41.431 28.356 45.915 1.00 38.67 H new ATOM 0 HG23 THR A 340 42.806 29.093 46.183 1.00 38.67 H new ATOM 989 N ARG A 341 39.914 32.134 43.480 1.00 29.00 N ATOM 990 CA ARG A 341 39.406 33.391 43.023 1.00 31.89 C ATOM 991 C ARG A 341 39.632 34.510 44.055 1.00 35.36 C ATOM 992 O ARG A 341 39.881 35.685 43.706 1.00 34.97 O ATOM 993 CB ARG A 341 37.909 33.203 42.727 1.00 29.19 C ATOM 994 CG ARG A 341 37.239 34.341 42.047 1.00 29.70 C ATOM 995 CD ARG A 341 35.857 33.995 41.593 1.00 28.31 C ATOM 996 NE ARG A 341 35.210 35.083 40.873 1.00 30.31 N ATOM 997 CZ ARG A 341 33.979 34.977 40.363 1.00 29.12 C ATOM 998 NH1 ARG A 341 33.317 33.843 40.515 1.00 26.91 N ATOM 999 NH2 ARG A 341 33.419 35.996 39.701 1.00 30.64 N ATOM 0 H ARG A 341 39.307 31.533 43.577 1.00 29.00 H new ATOM 0 HA ARG A 341 39.880 33.666 42.222 1.00 31.89 H new ATOM 0 HB2 ARG A 341 37.802 32.411 42.178 1.00 29.19 H new ATOM 0 HB3 ARG A 341 37.450 33.032 43.564 1.00 29.19 H new ATOM 0 HG2 ARG A 341 37.199 35.098 42.652 1.00 29.70 H new ATOM 0 HG3 ARG A 341 37.769 34.616 41.283 1.00 29.70 H new ATOM 0 HD2 ARG A 341 35.895 33.212 41.021 1.00 28.31 H new ATOM 0 HD3 ARG A 341 35.318 33.757 42.364 1.00 28.31 H new ATOM 0 HE ARG A 341 35.637 35.823 40.772 1.00 30.31 H new ATOM 0 HH11 ARG A 341 33.679 33.187 40.937 1.00 26.91 H new ATOM 0 HH12 ARG A 341 32.524 33.761 40.192 1.00 26.91 H new ATOM 0 HH21 ARG A 341 33.852 36.732 39.599 1.00 30.64 H new ATOM 0 HH22 ARG A 341 32.626 35.915 39.378 1.00 30.64 H new ATOM 1000 N GLU A 342 39.545 34.142 45.332 1.00 39.96 N ATOM 1001 CA GLU A 342 39.716 35.090 46.417 1.00 41.13 C ATOM 1002 C GLU A 342 41.169 35.510 46.519 1.00 40.02 C ATOM 1003 O GLU A 342 41.452 36.683 46.676 1.00 41.17 O ATOM 1004 CB GLU A 342 39.221 34.498 47.732 1.00 49.54 C ATOM 1005 CG GLU A 342 37.999 35.214 48.288 1.00 56.91 C ATOM 1006 CD GLU A 342 38.365 36.377 49.214 1.00 61.99 C ATOM 1007 OE1 GLU A 342 39.474 36.977 49.060 1.00 62.51 O ATOM 1008 OE2 GLU A 342 37.533 36.695 50.103 1.00 64.73 O ATOM 0 H GLU A 342 39.385 33.337 45.588 1.00 39.96 H new ATOM 0 HA GLU A 342 39.184 35.879 46.229 1.00 41.13 H new ATOM 0 HB2 GLU A 342 39.007 33.561 47.598 1.00 49.54 H new ATOM 0 HB3 GLU A 342 39.936 34.535 48.386 1.00 49.54 H new ATOM 0 HG2 GLU A 342 37.462 35.548 47.552 1.00 56.91 H new ATOM 0 HG3 GLU A 342 37.450 34.579 48.774 1.00 56.91 H new ATOM 1009 N PHE A 343 42.103 34.574 46.431 1.00 37.68 N ATOM 1010 CA PHE A 343 43.485 34.982 46.380 1.00 36.27 C ATOM 1011 C PHE A 343 43.699 35.968 45.220 1.00 39.46 C ATOM 1012 O PHE A 343 44.327 37.019 45.398 1.00 39.95 O ATOM 1013 CB PHE A 343 44.403 33.787 46.239 1.00 34.71 C ATOM 1014 CG PHE A 343 45.865 34.150 46.207 1.00 34.93 C ATOM 1015 CD1 PHE A 343 46.484 34.736 47.322 1.00 36.44 C ATOM 1016 CD2 PHE A 343 46.625 33.909 45.084 1.00 36.10 C ATOM 1017 CE1 PHE A 343 47.828 35.046 47.302 1.00 33.59 C ATOM 1018 CE2 PHE A 343 47.977 34.213 45.049 1.00 36.86 C ATOM 1019 CZ PHE A 343 48.580 34.784 46.157 1.00 36.31 C ATOM 0 H PHE A 343 41.960 33.726 46.401 1.00 37.68 H new ATOM 0 HA PHE A 343 43.704 35.425 47.215 1.00 36.27 H new ATOM 0 HB2 PHE A 343 44.245 33.178 46.977 1.00 34.71 H new ATOM 0 HB3 PHE A 343 44.178 33.310 45.425 1.00 34.71 H new ATOM 0 HD1 PHE A 343 45.982 34.918 48.084 1.00 36.44 H new ATOM 0 HD2 PHE A 343 46.223 33.535 44.334 1.00 36.10 H new ATOM 0 HE1 PHE A 343 48.231 35.428 48.048 1.00 33.59 H new ATOM 0 HE2 PHE A 343 48.477 34.034 44.285 1.00 36.86 H new ATOM 0 HZ PHE A 343 49.486 34.993 46.138 1.00 36.31 H new ATOM 1020 N LEU A 344 43.171 35.659 44.028 1.00 38.43 N ATOM 1021 CA LEU A 344 43.331 36.597 42.905 1.00 35.85 C ATOM 1022 C LEU A 344 42.728 38.006 43.184 1.00 38.18 C ATOM 1023 O LEU A 344 43.363 38.994 42.830 1.00 40.11 O ATOM 1024 CB LEU A 344 42.806 35.993 41.612 1.00 34.16 C ATOM 1025 CG LEU A 344 43.666 34.841 41.062 1.00 33.05 C ATOM 1026 CD1 LEU A 344 42.994 34.250 39.831 1.00 31.09 C ATOM 1027 CD2 LEU A 344 45.136 35.257 40.766 1.00 28.06 C ATOM 0 H LEU A 344 42.733 34.940 43.851 1.00 38.43 H new ATOM 0 HA LEU A 344 44.284 36.744 42.801 1.00 35.85 H new ATOM 0 HB2 LEU A 344 41.904 35.668 41.761 1.00 34.16 H new ATOM 0 HB3 LEU A 344 42.749 36.690 40.940 1.00 34.16 H new ATOM 0 HG LEU A 344 43.726 34.164 41.754 1.00 33.05 H new ATOM 0 HD11 LEU A 344 43.535 33.524 39.484 1.00 31.09 H new ATOM 0 HD12 LEU A 344 42.117 33.912 40.071 1.00 31.09 H new ATOM 0 HD13 LEU A 344 42.901 34.936 39.152 1.00 31.09 H new ATOM 0 HD21 LEU A 344 45.626 34.493 40.424 1.00 28.06 H new ATOM 0 HD22 LEU A 344 45.145 35.968 40.106 1.00 28.06 H new ATOM 0 HD23 LEU A 344 45.555 35.569 41.583 1.00 28.06 H new ATOM 1028 N LYS A 345 41.548 38.085 43.827 1.00 36.49 N ATOM 1029 CA LYS A 345 40.924 39.354 44.230 1.00 38.61 C ATOM 1030 C LYS A 345 41.757 40.107 45.284 1.00 40.71 C ATOM 1031 O LYS A 345 41.674 41.319 45.384 1.00 40.38 O ATOM 1032 CB LYS A 345 39.501 39.184 44.789 1.00 40.18 C ATOM 1033 CG LYS A 345 38.529 38.320 43.970 1.00 43.22 C ATOM 1034 CD LYS A 345 37.128 38.932 43.821 1.00 46.65 C ATOM 1035 CE LYS A 345 36.012 38.084 44.471 1.00 48.47 C ATOM 1036 NZ LYS A 345 34.678 38.171 43.801 1.00 47.80 N ATOM 0 H LYS A 345 41.085 37.393 44.042 1.00 36.49 H new ATOM 0 HA LYS A 345 40.881 39.868 43.409 1.00 38.61 H new ATOM 0 HB2 LYS A 345 39.570 38.801 45.677 1.00 40.18 H new ATOM 0 HB3 LYS A 345 39.109 40.066 44.890 1.00 40.18 H new ATOM 0 HG2 LYS A 345 38.904 38.174 43.088 1.00 43.22 H new ATOM 0 HG3 LYS A 345 38.449 37.450 44.392 1.00 43.22 H new ATOM 0 HD2 LYS A 345 37.125 39.817 44.219 1.00 46.65 H new ATOM 0 HD3 LYS A 345 36.931 39.045 42.878 1.00 46.65 H new ATOM 0 HE2 LYS A 345 36.294 37.156 44.480 1.00 48.47 H new ATOM 0 HE3 LYS A 345 35.913 38.359 45.396 1.00 48.47 H new ATOM 0 HZ1 LYS A 345 34.094 37.657 44.234 1.00 47.80 H new ATOM 0 HZ2 LYS A 345 34.395 39.015 43.812 1.00 47.80 H new ATOM 0 HZ3 LYS A 345 34.750 37.893 42.959 1.00 47.80 H new ATOM 1037 N SER A 346 42.570 39.403 46.057 1.00 39.85 N ATOM 1038 CA SER A 346 43.330 40.086 47.104 1.00 41.69 C ATOM 1039 C SER A 346 44.575 40.791 46.541 1.00 43.95 C ATOM 1040 O SER A 346 45.260 41.550 47.238 1.00 43.98 O ATOM 1041 CB SER A 346 43.711 39.110 48.214 1.00 37.30 C ATOM 1042 OG SER A 346 44.944 38.494 47.921 1.00 38.44 O ATOM 0 H SER A 346 42.697 38.554 46.000 1.00 39.85 H new ATOM 0 HA SER A 346 42.758 40.773 47.480 1.00 41.69 H new ATOM 0 HB2 SER A 346 43.770 39.580 49.060 1.00 37.30 H new ATOM 0 HB3 SER A 346 43.021 38.436 48.312 1.00 37.30 H new ATOM 0 HG SER A 346 44.865 38.023 47.230 1.00 38.44 H new ATOM 1043 N LEU A 347 44.876 40.545 45.274 1.00 42.85 N ATOM 1044 CA LEU A 347 46.033 41.167 44.690 1.00 42.59 C ATOM 1045 C LEU A 347 45.888 42.698 44.731 1.00 39.81 C ATOM 1046 O LEU A 347 44.780 43.230 44.784 1.00 42.63 O ATOM 1047 CB LEU A 347 46.219 40.642 43.263 1.00 42.44 C ATOM 1048 CG LEU A 347 47.194 39.472 43.078 1.00 42.24 C ATOM 1049 CD1 LEU A 347 47.333 38.635 44.328 1.00 42.07 C ATOM 1050 CD2 LEU A 347 46.828 38.599 41.891 1.00 38.71 C ATOM 0 H LEU A 347 44.429 40.030 44.750 1.00 42.85 H new ATOM 0 HA LEU A 347 46.827 40.942 45.199 1.00 42.59 H new ATOM 0 HB2 LEU A 347 45.351 40.369 42.926 1.00 42.44 H new ATOM 0 HB3 LEU A 347 46.520 41.378 42.707 1.00 42.44 H new ATOM 0 HG LEU A 347 48.057 39.875 42.895 1.00 42.24 H new ATOM 0 HD11 LEU A 347 47.957 37.910 44.165 1.00 42.07 H new ATOM 0 HD12 LEU A 347 47.664 39.188 45.053 1.00 42.07 H new ATOM 0 HD13 LEU A 347 46.468 38.268 44.570 1.00 42.07 H new ATOM 0 HD21 LEU A 347 47.468 37.875 41.812 1.00 38.71 H new ATOM 0 HD22 LEU A 347 45.940 38.232 42.021 1.00 38.71 H new ATOM 0 HD23 LEU A 347 46.842 39.132 41.081 1.00 38.71 H new ATOM 1051 N ARG A 348 46.988 43.427 44.725 1.00 39.01 N ATOM 1052 CA ARG A 348 46.825 44.869 44.614 1.00 41.21 C ATOM 1053 C ARG A 348 46.494 45.231 43.165 1.00 41.87 C ATOM 1054 O ARG A 348 46.916 44.529 42.241 1.00 38.98 O ATOM 1055 CB ARG A 348 48.060 45.635 45.119 1.00 41.91 C ATOM 1056 CG ARG A 348 49.220 45.749 44.138 1.00 42.76 C ATOM 1057 CD ARG A 348 50.444 46.546 44.664 1.00 39.71 C ATOM 1058 NE ARG A 348 51.620 46.372 43.794 1.00 40.23 N ATOM 1059 CZ ARG A 348 51.788 46.959 42.599 1.00 38.11 C ATOM 1060 NH1 ARG A 348 50.860 47.763 42.105 1.00 38.09 N ATOM 1061 NH2 ARG A 348 52.886 46.733 41.882 1.00 37.74 N ATOM 0 H ARG A 348 47.794 43.133 44.780 1.00 39.01 H new ATOM 0 HA ARG A 348 46.089 45.139 45.186 1.00 41.21 H new ATOM 0 HB2 ARG A 348 47.783 46.530 45.371 1.00 41.91 H new ATOM 0 HB3 ARG A 348 48.382 45.200 45.924 1.00 41.91 H new ATOM 0 HG2 ARG A 348 49.511 44.856 43.897 1.00 42.76 H new ATOM 0 HG3 ARG A 348 48.900 46.172 43.326 1.00 42.76 H new ATOM 0 HD2 ARG A 348 50.218 47.488 44.719 1.00 39.71 H new ATOM 0 HD3 ARG A 348 50.660 46.253 45.563 1.00 39.71 H new ATOM 0 HE ARG A 348 52.247 45.854 44.073 1.00 40.23 H new ATOM 0 HH11 ARG A 348 50.140 47.914 42.551 1.00 38.09 H new ATOM 0 HH12 ARG A 348 50.977 48.135 41.338 1.00 38.09 H new ATOM 0 HH21 ARG A 348 53.496 46.207 42.184 1.00 37.74 H new ATOM 0 HH22 ARG A 348 52.986 47.113 41.117 1.00 37.74 H new ATOM 1062 N LYS A 349 45.711 46.299 42.977 1.00 43.46 N ATOM 1063 CA LYS A 349 45.517 46.905 41.657 1.00 42.92 C ATOM 1064 C LYS A 349 46.873 47.361 41.097 1.00 43.65 C ATOM 1065 O LYS A 349 47.750 47.807 41.849 1.00 46.73 O ATOM 1066 CB LYS A 349 44.557 48.102 41.755 1.00 45.80 C ATOM 1067 CG LYS A 349 43.133 47.765 42.219 1.00 45.87 C ATOM 1068 CD LYS A 349 42.535 48.876 43.101 1.00 49.79 C ATOM 1069 CE LYS A 349 41.231 49.482 42.502 1.00 51.90 C ATOM 1070 NZ LYS A 349 41.071 49.293 41.019 1.00 51.77 N ATOM 0 H LYS A 349 45.279 46.690 43.610 1.00 43.46 H new ATOM 0 HA LYS A 349 45.128 46.247 41.060 1.00 42.92 H new ATOM 0 HB2 LYS A 349 44.936 48.752 42.368 1.00 45.80 H new ATOM 0 HB3 LYS A 349 44.505 48.528 40.885 1.00 45.80 H new ATOM 0 HG2 LYS A 349 42.565 47.628 41.444 1.00 45.87 H new ATOM 0 HG3 LYS A 349 43.144 46.931 42.714 1.00 45.87 H new ATOM 0 HD2 LYS A 349 42.346 48.518 43.982 1.00 49.79 H new ATOM 0 HD3 LYS A 349 43.191 49.581 43.217 1.00 49.79 H new ATOM 0 HE2 LYS A 349 40.469 49.083 42.950 1.00 51.90 H new ATOM 0 HE3 LYS A 349 41.211 50.432 42.698 1.00 51.90 H new ATOM 0 HZ1 LYS A 349 40.416 49.817 40.722 1.00 51.77 H new ATOM 0 HZ2 LYS A 349 41.831 49.508 40.608 1.00 51.77 H new ATOM 0 HZ3 LYS A 349 40.872 48.443 40.848 1.00 51.77 H new ATOM 1071 N PRO A 350 47.071 47.259 39.788 1.00 42.13 N ATOM 1072 CA PRO A 350 46.028 46.865 38.829 1.00 41.97 C ATOM 1073 C PRO A 350 45.925 45.346 38.564 1.00 40.94 C ATOM 1074 O PRO A 350 45.029 44.915 37.831 1.00 39.43 O ATOM 1075 CB PRO A 350 46.453 47.600 37.554 1.00 41.44 C ATOM 1076 CG PRO A 350 48.007 47.738 37.707 1.00 43.56 C ATOM 1077 CD PRO A 350 48.369 47.518 39.147 1.00 41.90 C ATOM 0 HA PRO A 350 45.147 47.090 39.166 1.00 41.97 H new ATOM 0 HB2 PRO A 350 46.216 47.099 36.758 1.00 41.44 H new ATOM 0 HB3 PRO A 350 46.023 48.467 37.482 1.00 41.44 H new ATOM 0 HG2 PRO A 350 48.459 47.091 37.144 1.00 43.56 H new ATOM 0 HG3 PRO A 350 48.297 48.617 37.418 1.00 43.56 H new ATOM 0 HD2 PRO A 350 48.976 46.769 39.253 1.00 41.90 H new ATOM 0 HD3 PRO A 350 48.808 48.295 39.528 1.00 41.90 H new ATOM 1078 N PHE A 351 46.821 44.560 39.162 1.00 38.21 N ATOM 1079 CA PHE A 351 46.864 43.133 38.897 1.00 39.13 C ATOM 1080 C PHE A 351 45.588 42.411 39.242 1.00 39.83 C ATOM 1081 O PHE A 351 45.144 41.555 38.472 1.00 41.40 O ATOM 1082 CB PHE A 351 48.087 42.506 39.555 1.00 40.04 C ATOM 1083 CG PHE A 351 49.358 43.156 39.119 1.00 39.32 C ATOM 1084 CD1 PHE A 351 49.934 42.823 37.918 1.00 39.00 C ATOM 1085 CD2 PHE A 351 49.941 44.139 39.891 1.00 40.42 C ATOM 1086 CE1 PHE A 351 51.093 43.429 37.502 1.00 40.56 C ATOM 1087 CE2 PHE A 351 51.089 44.746 39.489 1.00 39.12 C ATOM 1088 CZ PHE A 351 51.671 44.393 38.275 1.00 40.87 C ATOM 0 H PHE A 351 47.410 44.838 39.723 1.00 38.21 H new ATOM 0 HA PHE A 351 46.948 43.028 37.936 1.00 39.13 H new ATOM 0 HB2 PHE A 351 48.005 42.575 40.519 1.00 40.04 H new ATOM 0 HB3 PHE A 351 48.119 41.561 39.340 1.00 40.04 H new ATOM 0 HD1 PHE A 351 49.534 42.179 37.380 1.00 39.00 H new ATOM 0 HD2 PHE A 351 49.545 44.389 40.694 1.00 40.42 H new ATOM 0 HE1 PHE A 351 51.484 43.183 36.695 1.00 40.56 H new ATOM 0 HE2 PHE A 351 51.485 45.396 40.024 1.00 39.12 H new ATOM 0 HZ PHE A 351 52.451 44.813 37.992 1.00 40.87 H new ATOM 1089 N CYS A 352 44.963 42.756 40.359 1.00 39.01 N ATOM 1090 CA CYS A 352 43.697 42.112 40.674 1.00 38.80 C ATOM 1091 C CYS A 352 42.674 42.322 39.541 1.00 37.34 C ATOM 1092 O CYS A 352 41.787 41.485 39.288 1.00 39.64 O ATOM 1093 CB CYS A 352 43.153 42.597 42.033 1.00 39.24 C ATOM 1094 SG CYS A 352 42.894 44.386 42.230 1.00 39.72 S ATOM 0 H CYS A 352 45.241 43.338 40.928 1.00 39.01 H new ATOM 0 HA CYS A 352 43.853 41.158 40.749 1.00 38.80 H new ATOM 0 HB2 CYS A 352 42.307 42.151 42.195 1.00 39.24 H new ATOM 0 HB3 CYS A 352 43.766 42.303 42.725 1.00 39.24 H new ATOM 0 HG CYS A 352 42.469 44.611 43.330 1.00 39.72 H new ATOM 1095 N ASP A 353 42.798 43.440 38.855 1.00 36.05 N ATOM 1096 CA ASP A 353 41.760 43.844 37.912 1.00 37.76 C ATOM 1097 C ASP A 353 41.760 43.093 36.581 1.00 33.41 C ATOM 1098 O ASP A 353 40.808 43.177 35.831 1.00 32.12 O ATOM 1099 CB ASP A 353 41.841 45.338 37.667 1.00 39.65 C ATOM 1100 CG ASP A 353 41.353 46.122 38.843 1.00 45.08 C ATOM 1101 OD1 ASP A 353 40.492 45.567 39.593 1.00 45.99 O ATOM 1102 OD2 ASP A 353 41.776 47.284 39.086 1.00 47.13 O ATOM 0 H ASP A 353 43.466 43.979 38.915 1.00 36.05 H new ATOM 0 HA ASP A 353 40.921 43.606 38.336 1.00 37.76 H new ATOM 0 HB2 ASP A 353 42.759 45.584 37.473 1.00 39.65 H new ATOM 0 HB3 ASP A 353 41.314 45.566 36.885 1.00 39.65 H new ATOM 1103 N ILE A 354 42.828 42.374 36.288 1.00 34.15 N ATOM 1104 CA ILE A 354 42.844 41.613 35.065 1.00 34.05 C ATOM 1105 C ILE A 354 42.246 40.254 35.363 1.00 32.53 C ATOM 1106 O ILE A 354 41.962 39.498 34.449 1.00 32.66 O ATOM 1107 CB ILE A 354 44.265 41.438 34.507 1.00 33.44 C ATOM 1108 CG1 ILE A 354 45.117 40.667 35.495 1.00 30.48 C ATOM 1109 CG2 ILE A 354 44.899 42.797 34.124 1.00 34.70 C ATOM 1110 CD1 ILE A 354 46.327 40.042 34.867 1.00 31.74 C ATOM 0 H ILE A 354 43.536 42.315 36.773 1.00 34.15 H new ATOM 0 HA ILE A 354 42.333 42.089 34.392 1.00 34.05 H new ATOM 0 HB ILE A 354 44.215 40.922 33.687 1.00 33.44 H new ATOM 0 HG12 ILE A 354 45.400 41.264 36.205 1.00 30.48 H new ATOM 0 HG13 ILE A 354 44.578 39.973 35.906 1.00 30.48 H new ATOM 0 HG21 ILE A 354 45.793 42.651 33.776 1.00 34.70 H new ATOM 0 HG22 ILE A 354 44.355 43.228 33.446 1.00 34.70 H new ATOM 0 HG23 ILE A 354 44.947 43.365 34.909 1.00 34.70 H new ATOM 0 HD11 ILE A 354 46.832 39.564 35.543 1.00 31.74 H new ATOM 0 HD12 ILE A 354 46.049 39.423 34.174 1.00 31.74 H new ATOM 0 HD13 ILE A 354 46.884 40.734 34.477 1.00 31.74 H new ATOM 1111 N MET A 355 42.059 39.934 36.637 1.00 34.07 N ATOM 1112 CA MET A 355 41.609 38.577 37.005 1.00 34.64 C ATOM 1113 C MET A 355 40.096 38.398 37.011 1.00 31.64 C ATOM 1114 O MET A 355 39.570 37.564 36.274 1.00 33.24 O ATOM 1115 CB MET A 355 42.198 38.107 38.339 1.00 33.09 C ATOM 1116 CG MET A 355 43.663 38.219 38.413 1.00 33.57 C ATOM 1117 SD MET A 355 44.490 37.149 37.242 1.00 34.68 S ATOM 1118 CE MET A 355 46.193 37.423 37.683 1.00 32.80 C ATOM 0 H MET A 355 42.182 40.469 37.299 1.00 34.07 H new ATOM 0 HA MET A 355 41.954 38.014 36.294 1.00 34.64 H new ATOM 0 HB2 MET A 355 41.805 38.627 39.058 1.00 33.09 H new ATOM 0 HB3 MET A 355 41.945 37.182 38.487 1.00 33.09 H new ATOM 0 HG2 MET A 355 43.923 39.139 38.247 1.00 33.57 H new ATOM 0 HG3 MET A 355 43.957 37.999 39.311 1.00 33.57 H new ATOM 0 HE1 MET A 355 46.728 37.500 36.877 1.00 32.80 H new ATOM 0 HE2 MET A 355 46.266 38.241 38.199 1.00 32.80 H new ATOM 0 HE3 MET A 355 46.514 36.677 38.213 1.00 32.80 H new ATOM 1119 N GLU A 356 39.399 39.166 37.834 1.00 34.01 N ATOM 1120 CA GLU A 356 37.947 38.955 38.060 1.00 31.24 C ATOM 1121 C GLU A 356 37.019 39.076 36.850 1.00 29.98 C ATOM 1122 O GLU A 356 36.091 38.270 36.704 1.00 32.69 O ATOM 1123 CB GLU A 356 37.459 39.878 39.202 1.00 36.59 C ATOM 1124 CG GLU A 356 35.974 39.771 39.557 1.00 37.78 C ATOM 1125 CD GLU A 356 35.576 38.398 40.073 1.00 41.82 C ATOM 1126 OE1 GLU A 356 36.447 37.553 40.424 1.00 41.67 O ATOM 1127 OE2 GLU A 356 34.360 38.160 40.125 1.00 44.65 O ATOM 0 H GLU A 356 39.735 39.820 38.279 1.00 34.01 H new ATOM 0 HA GLU A 356 37.883 38.016 38.296 1.00 31.24 H new ATOM 0 HB2 GLU A 356 37.979 39.683 39.997 1.00 36.59 H new ATOM 0 HB3 GLU A 356 37.650 40.797 38.956 1.00 36.59 H new ATOM 0 HG2 GLU A 356 35.760 40.437 40.229 1.00 37.78 H new ATOM 0 HG3 GLU A 356 35.444 39.980 38.772 1.00 37.78 H new ATOM 1128 N PRO A 357 37.203 40.079 35.982 1.00 30.72 N ATOM 1129 CA PRO A 357 36.403 40.147 34.740 1.00 27.81 C ATOM 1130 C PRO A 357 36.483 38.882 33.907 1.00 29.07 C ATOM 1131 O PRO A 357 35.490 38.582 33.210 1.00 28.50 O ATOM 1132 CB PRO A 357 37.037 41.303 33.980 1.00 27.37 C ATOM 1133 CG PRO A 357 37.494 42.147 35.052 1.00 30.57 C ATOM 1134 CD PRO A 357 38.121 41.226 36.095 1.00 27.55 C ATOM 0 HA PRO A 357 35.459 40.259 34.935 1.00 27.81 H new ATOM 0 HB2 PRO A 357 37.767 41.009 33.413 1.00 27.37 H new ATOM 0 HB3 PRO A 357 36.398 41.756 33.408 1.00 27.37 H new ATOM 0 HG2 PRO A 357 38.141 42.794 34.730 1.00 30.57 H new ATOM 0 HG3 PRO A 357 36.757 42.649 35.434 1.00 30.57 H new ATOM 0 HD2 PRO A 357 39.038 40.992 35.884 1.00 27.55 H new ATOM 0 HD3 PRO A 357 38.125 41.615 36.983 1.00 27.55 H new ATOM 1135 N LYS A 358 37.607 38.148 33.973 1.00 26.68 N ATOM 1136 CA LYS A 358 37.672 36.856 33.260 1.00 29.27 C ATOM 1137 C LYS A 358 36.754 35.786 33.872 1.00 30.64 C ATOM 1138 O LYS A 358 36.204 34.945 33.143 1.00 33.25 O ATOM 1139 CB LYS A 358 39.105 36.315 33.155 1.00 29.20 C ATOM 1140 CG LYS A 358 40.145 37.387 32.878 1.00 29.39 C ATOM 1141 CD LYS A 358 39.954 38.019 31.505 1.00 28.88 C ATOM 1142 CE LYS A 358 41.215 38.834 31.140 1.00 28.71 C ATOM 1143 NZ LYS A 358 41.359 40.113 31.876 1.00 24.54 N ATOM 0 H LYS A 358 38.317 38.368 34.406 1.00 26.68 H new ATOM 0 HA LYS A 358 37.350 37.048 32.365 1.00 29.27 H new ATOM 0 HB2 LYS A 358 39.332 35.862 33.982 1.00 29.20 H new ATOM 0 HB3 LYS A 358 39.140 35.651 32.449 1.00 29.20 H new ATOM 0 HG2 LYS A 358 40.091 38.074 33.561 1.00 29.39 H new ATOM 0 HG3 LYS A 358 41.032 36.999 32.935 1.00 29.39 H new ATOM 0 HD2 LYS A 358 39.797 37.331 30.840 1.00 28.88 H new ATOM 0 HD3 LYS A 358 39.173 38.595 31.508 1.00 28.88 H new ATOM 0 HE2 LYS A 358 41.999 38.288 31.309 1.00 28.71 H new ATOM 0 HE3 LYS A 358 41.200 39.022 30.189 1.00 28.71 H new ATOM 0 HZ1 LYS A 358 42.064 40.558 31.563 1.00 24.54 H new ATOM 0 HZ2 LYS A 358 40.625 40.604 31.765 1.00 24.54 H new ATOM 0 HZ3 LYS A 358 41.475 39.946 32.742 1.00 24.54 H new ATOM 1144 N PHE A 359 36.609 35.789 35.198 1.00 29.49 N ATOM 1145 CA PHE A 359 35.717 34.837 35.865 1.00 28.47 C ATOM 1146 C PHE A 359 34.308 35.242 35.558 1.00 27.84 C ATOM 1147 O PHE A 359 33.445 34.399 35.362 1.00 31.91 O ATOM 1148 CB PHE A 359 35.896 34.873 37.398 1.00 27.79 C ATOM 1149 CG PHE A 359 37.046 34.076 37.876 1.00 27.35 C ATOM 1150 CD1 PHE A 359 36.874 32.738 38.214 1.00 25.48 C ATOM 1151 CD2 PHE A 359 38.318 34.652 37.950 1.00 26.17 C ATOM 1152 CE1 PHE A 359 37.940 31.970 38.630 1.00 23.69 C ATOM 1153 CE2 PHE A 359 39.394 33.908 38.381 1.00 26.00 C ATOM 1154 CZ PHE A 359 39.191 32.549 38.730 1.00 27.88 C ATOM 0 H PHE A 359 37.016 36.331 35.728 1.00 29.49 H new ATOM 0 HA PHE A 359 35.922 33.943 35.550 1.00 28.47 H new ATOM 0 HB2 PHE A 359 36.009 35.794 37.682 1.00 27.79 H new ATOM 0 HB3 PHE A 359 35.086 34.544 37.819 1.00 27.79 H new ATOM 0 HD1 PHE A 359 36.028 32.356 38.159 1.00 25.48 H new ATOM 0 HD2 PHE A 359 38.438 35.542 37.707 1.00 26.17 H new ATOM 0 HE1 PHE A 359 37.819 31.072 38.841 1.00 23.69 H new ATOM 0 HE2 PHE A 359 40.239 34.291 38.442 1.00 26.00 H new ATOM 0 HZ PHE A 359 39.909 32.040 39.030 1.00 27.88 H new ATOM 1155 N ASP A 360 34.060 36.550 35.554 1.00 30.89 N ATOM 1156 CA ASP A 360 32.730 37.044 35.216 1.00 31.53 C ATOM 1157 C ASP A 360 32.363 36.508 33.848 1.00 32.45 C ATOM 1158 O ASP A 360 31.253 36.009 33.645 1.00 30.88 O ATOM 1159 CB ASP A 360 32.680 38.568 35.247 1.00 36.37 C ATOM 1160 CG ASP A 360 31.261 39.125 35.152 1.00 43.48 C ATOM 1161 OD1 ASP A 360 30.681 39.127 34.050 1.00 49.31 O ATOM 1162 OD2 ASP A 360 30.635 39.606 36.125 1.00 50.22 O ATOM 0 H ASP A 360 34.638 37.158 35.741 1.00 30.89 H new ATOM 0 HA ASP A 360 32.087 36.735 35.873 1.00 31.53 H new ATOM 0 HB2 ASP A 360 33.091 38.883 36.068 1.00 36.37 H new ATOM 0 HB3 ASP A 360 33.209 38.918 34.513 1.00 36.37 H new ATOM 1163 N PHE A 361 33.295 36.610 32.898 1.00 31.29 N ATOM 1164 CA PHE A 361 32.974 36.130 31.567 1.00 29.75 C ATOM 1165 C PHE A 361 32.836 34.598 31.532 1.00 30.13 C ATOM 1166 O PHE A 361 31.896 34.060 30.923 1.00 26.38 O ATOM 1167 CB PHE A 361 33.989 36.574 30.531 1.00 28.64 C ATOM 1168 CG PHE A 361 33.793 35.878 29.213 1.00 31.08 C ATOM 1169 CD1 PHE A 361 34.279 34.592 29.023 1.00 29.47 C ATOM 1170 CD2 PHE A 361 33.076 36.484 28.184 1.00 26.74 C ATOM 1171 CE1 PHE A 361 34.074 33.934 27.816 1.00 29.55 C ATOM 1172 CE2 PHE A 361 32.880 35.827 26.985 1.00 27.09 C ATOM 1173 CZ PHE A 361 33.362 34.558 26.802 1.00 26.75 C ATOM 0 H PHE A 361 34.083 36.939 33.001 1.00 31.29 H new ATOM 0 HA PHE A 361 32.119 36.528 31.341 1.00 29.75 H new ATOM 0 HB2 PHE A 361 33.920 37.533 30.402 1.00 28.64 H new ATOM 0 HB3 PHE A 361 34.884 36.396 30.860 1.00 28.64 H new ATOM 0 HD1 PHE A 361 34.745 34.168 29.707 1.00 29.47 H new ATOM 0 HD2 PHE A 361 32.727 37.337 28.305 1.00 26.74 H new ATOM 0 HE1 PHE A 361 34.413 33.078 27.688 1.00 29.55 H new ATOM 0 HE2 PHE A 361 32.418 36.249 26.297 1.00 27.09 H new ATOM 0 HZ PHE A 361 33.212 34.115 25.998 1.00 26.75 H new ATOM 1174 N ALA A 362 33.778 33.910 32.190 1.00 28.07 N ATOM 1175 CA ALA A 362 33.811 32.458 32.176 1.00 29.12 C ATOM 1176 C ALA A 362 32.556 31.823 32.795 1.00 32.55 C ATOM 1177 O ALA A 362 32.052 30.825 32.274 1.00 31.81 O ATOM 1178 CB ALA A 362 35.050 31.952 32.917 1.00 26.70 C ATOM 0 H ALA A 362 34.406 34.275 32.650 1.00 28.07 H new ATOM 0 HA ALA A 362 33.842 32.192 31.244 1.00 29.12 H new ATOM 0 HB1 ALA A 362 35.063 30.982 32.902 1.00 26.70 H new ATOM 0 HB2 ALA A 362 35.848 32.292 32.483 1.00 26.70 H new ATOM 0 HB3 ALA A 362 35.026 32.260 33.836 1.00 26.70 H new ATOM 1179 N MET A 363 32.068 32.369 33.914 1.00 31.44 N ATOM 1180 CA MET A 363 30.911 31.751 34.560 1.00 37.46 C ATOM 1181 C MET A 363 29.725 31.728 33.594 1.00 35.57 C ATOM 1182 O MET A 363 29.036 30.723 33.501 1.00 35.43 O ATOM 1183 CB MET A 363 30.561 32.429 35.903 1.00 38.72 C ATOM 1184 CG MET A 363 31.667 32.286 36.964 1.00 39.79 C ATOM 1185 SD MET A 363 32.219 30.577 37.293 1.00 40.59 S ATOM 1186 CE MET A 363 33.805 30.528 36.335 1.00 39.16 C ATOM 0 H MET A 363 32.380 33.071 34.301 1.00 31.44 H new ATOM 0 HA MET A 363 31.139 30.834 34.781 1.00 37.46 H new ATOM 0 HB2 MET A 363 30.390 33.371 35.748 1.00 38.72 H new ATOM 0 HB3 MET A 363 29.740 32.045 36.247 1.00 38.72 H new ATOM 0 HG2 MET A 363 32.434 32.809 36.683 1.00 39.79 H new ATOM 0 HG3 MET A 363 31.349 32.673 37.795 1.00 39.79 H new ATOM 0 HE1 MET A 363 33.983 29.618 36.050 1.00 39.16 H new ATOM 0 HE2 MET A 363 33.731 31.102 35.556 1.00 39.16 H new ATOM 0 HE3 MET A 363 34.532 30.839 36.897 1.00 39.16 H new ATOM 1187 N LYS A 364 29.533 32.820 32.858 1.00 35.93 N ATOM 1188 CA LYS A 364 28.469 32.923 31.841 1.00 35.41 C ATOM 1189 C LYS A 364 28.727 32.101 30.592 1.00 35.11 C ATOM 1190 O LYS A 364 27.777 31.557 30.020 1.00 34.78 O ATOM 1191 CB LYS A 364 28.261 34.373 31.420 1.00 34.96 C ATOM 1192 CG LYS A 364 27.498 35.177 32.457 1.00 41.78 C ATOM 1193 CD LYS A 364 27.284 36.626 32.009 1.00 43.58 C ATOM 1194 CE LYS A 364 27.576 37.598 33.148 1.00 46.46 C ATOM 1195 NZ LYS A 364 28.151 38.916 32.665 1.00 46.28 N ATOM 0 H LYS A 364 30.015 33.529 32.930 1.00 35.93 H new ATOM 0 HA LYS A 364 27.676 32.566 32.272 1.00 35.41 H new ATOM 0 HB2 LYS A 364 29.124 34.788 31.264 1.00 34.96 H new ATOM 0 HB3 LYS A 364 27.779 34.396 30.579 1.00 34.96 H new ATOM 0 HG2 LYS A 364 26.638 34.759 32.622 1.00 41.78 H new ATOM 0 HG3 LYS A 364 27.984 35.166 33.296 1.00 41.78 H new ATOM 0 HD2 LYS A 364 27.861 36.824 31.255 1.00 43.58 H new ATOM 0 HD3 LYS A 364 26.370 36.743 31.706 1.00 43.58 H new ATOM 0 HE2 LYS A 364 26.757 37.768 33.640 1.00 46.46 H new ATOM 0 HE3 LYS A 364 28.199 37.186 33.767 1.00 46.46 H new ATOM 0 HZ1 LYS A 364 28.942 39.053 33.048 1.00 46.28 H new ATOM 0 HZ2 LYS A 364 28.250 38.891 31.781 1.00 46.28 H new ATOM 0 HZ3 LYS A 364 27.598 39.579 32.882 1.00 46.28 H new ATOM 1196 N PHE A 365 29.989 32.017 30.144 1.00 32.23 N ATOM 1197 CA PHE A 365 30.291 31.218 28.934 1.00 30.91 C ATOM 1198 C PHE A 365 30.142 29.738 29.279 1.00 30.58 C ATOM 1199 O PHE A 365 29.648 28.931 28.476 1.00 32.28 O ATOM 1200 CB PHE A 365 31.699 31.544 28.442 1.00 30.84 C ATOM 1201 CG PHE A 365 32.069 30.896 27.128 1.00 30.49 C ATOM 1202 CD1 PHE A 365 32.932 29.790 27.091 1.00 29.45 C ATOM 1203 CD2 PHE A 365 31.600 31.417 25.943 1.00 28.06 C ATOM 1204 CE1 PHE A 365 33.303 29.198 25.858 1.00 29.85 C ATOM 1205 CE2 PHE A 365 31.931 30.848 24.750 1.00 27.92 C ATOM 1206 CZ PHE A 365 32.794 29.729 24.702 1.00 29.57 C ATOM 0 H PHE A 365 30.667 32.400 30.509 1.00 32.23 H new ATOM 0 HA PHE A 365 29.674 31.433 28.217 1.00 30.91 H new ATOM 0 HB2 PHE A 365 31.783 32.506 28.350 1.00 30.84 H new ATOM 0 HB3 PHE A 365 32.338 31.267 29.117 1.00 30.84 H new ATOM 0 HD1 PHE A 365 33.265 29.441 27.886 1.00 29.45 H new ATOM 0 HD2 PHE A 365 31.050 32.167 25.957 1.00 28.06 H new ATOM 0 HE1 PHE A 365 33.878 28.467 25.834 1.00 29.85 H new ATOM 0 HE2 PHE A 365 31.586 31.199 23.961 1.00 27.92 H new ATOM 0 HZ PHE A 365 33.017 29.352 23.882 1.00 29.57 H new ATOM 1207 N ASN A 366 30.540 29.378 30.500 1.00 30.14 N ATOM 1208 CA ASN A 366 30.429 27.986 30.958 1.00 30.54 C ATOM 1209 C ASN A 366 28.998 27.491 31.191 1.00 33.07 C ATOM 1210 O ASN A 366 28.751 26.265 31.181 1.00 31.08 O ATOM 1211 CB ASN A 366 31.185 27.791 32.262 1.00 30.07 C ATOM 1212 CG ASN A 366 32.677 27.747 32.077 1.00 31.28 C ATOM 1213 OD1 ASN A 366 33.117 27.738 30.829 1.00 33.68 O flip ATOM 1214 ND2 ASN A 366 33.436 27.721 33.063 1.00 28.01 N flip ATOM 0 H ASN A 366 30.876 29.919 31.078 1.00 30.14 H new ATOM 0 HA ASN A 366 30.806 27.469 30.229 1.00 30.54 H new ATOM 0 HB2 ASN A 366 30.961 28.512 32.871 1.00 30.07 H new ATOM 0 HB3 ASN A 366 30.892 26.966 32.680 1.00 30.07 H new ATOM 0 HD21 ASN A 366 33.108 27.728 33.858 1.00 28.01 H new ATOM 0 HD22 ASN A 366 34.288 27.696 32.949 1.00 28.01 H new ATOM 1215 N ALA A 367 28.073 28.425 31.437 1.00 34.63 N ATOM 1216 CA ALA A 367 26.653 28.060 31.628 1.00 39.20 C ATOM 1217 C ALA A 367 26.041 27.554 30.322 1.00 39.72 C ATOM 1218 O ALA A 367 24.973 26.950 30.317 1.00 41.94 O ATOM 1219 CB ALA A 367 25.817 29.233 32.215 1.00 36.49 C ATOM 0 H ALA A 367 28.239 29.267 31.498 1.00 34.63 H new ATOM 0 HA ALA A 367 26.629 27.341 32.279 1.00 39.20 H new ATOM 0 HB1 ALA A 367 24.895 28.951 32.324 1.00 36.49 H new ATOM 0 HB2 ALA A 367 26.180 29.490 33.077 1.00 36.49 H new ATOM 0 HB3 ALA A 367 25.854 29.991 31.611 1.00 36.49 H new ATOM 1220 N LEU A 368 26.740 27.786 29.217 1.00 37.61 N ATOM 1221 CA LEU A 368 26.302 27.323 27.902 1.00 35.30 C ATOM 1222 C LEU A 368 26.667 25.845 27.742 1.00 33.88 C ATOM 1223 O LEU A 368 26.176 25.168 26.835 1.00 33.17 O ATOM 1224 CB LEU A 368 26.947 28.163 26.801 1.00 35.07 C ATOM 1225 CG LEU A 368 26.536 29.623 26.682 1.00 34.53 C ATOM 1226 CD1 LEU A 368 27.255 30.249 25.518 1.00 31.54 C ATOM 1227 CD2 LEU A 368 25.017 29.666 26.470 1.00 35.25 C ATOM 0 H LEU A 368 27.484 28.217 29.207 1.00 37.61 H new ATOM 0 HA LEU A 368 25.340 27.422 27.827 1.00 35.30 H new ATOM 0 HB2 LEU A 368 27.908 28.135 26.930 1.00 35.07 H new ATOM 0 HB3 LEU A 368 26.762 27.732 25.952 1.00 35.07 H new ATOM 0 HG LEU A 368 26.769 30.118 27.483 1.00 34.53 H new ATOM 0 HD11 LEU A 368 26.995 31.180 25.440 1.00 31.54 H new ATOM 0 HD12 LEU A 368 28.213 30.192 25.661 1.00 31.54 H new ATOM 0 HD13 LEU A 368 27.022 29.779 24.702 1.00 31.54 H new ATOM 0 HD21 LEU A 368 24.727 30.588 26.391 1.00 35.25 H new ATOM 0 HD22 LEU A 368 24.790 29.185 25.659 1.00 35.25 H new ATOM 0 HD23 LEU A 368 24.573 29.252 27.226 1.00 35.25 H new ATOM 1228 N GLU A 369 27.535 25.347 28.622 1.00 33.94 N ATOM 1229 CA GLU A 369 27.883 23.935 28.618 1.00 35.09 C ATOM 1230 C GLU A 369 28.353 23.477 27.227 1.00 33.91 C ATOM 1231 O GLU A 369 27.961 22.426 26.745 1.00 29.99 O ATOM 1232 CB GLU A 369 26.667 23.086 29.078 1.00 40.58 C ATOM 1233 CG GLU A 369 26.484 23.003 30.610 1.00 47.27 C ATOM 1234 CD GLU A 369 25.100 22.480 31.071 1.00 51.08 C ATOM 1235 OE1 GLU A 369 24.595 21.458 30.523 1.00 52.26 O ATOM 1236 OE2 GLU A 369 24.508 23.089 32.005 1.00 53.25 O ATOM 0 H GLU A 369 27.931 25.812 29.227 1.00 33.94 H new ATOM 0 HA GLU A 369 28.617 23.806 29.238 1.00 35.09 H new ATOM 0 HB2 GLU A 369 25.861 23.459 28.687 1.00 40.58 H new ATOM 0 HB3 GLU A 369 26.763 22.187 28.726 1.00 40.58 H new ATOM 0 HG2 GLU A 369 27.172 22.425 30.975 1.00 47.27 H new ATOM 0 HG3 GLU A 369 26.625 23.885 30.988 1.00 47.27 H new ATOM 1237 N LEU A 370 29.183 24.277 26.565 1.00 30.76 N ATOM 1238 CA LEU A 370 29.810 23.787 25.368 1.00 28.80 C ATOM 1239 C LEU A 370 30.698 22.595 25.714 1.00 30.23 C ATOM 1240 O LEU A 370 31.177 22.472 26.852 1.00 29.00 O ATOM 1241 CB LEU A 370 30.618 24.885 24.688 1.00 28.14 C ATOM 1242 CG LEU A 370 29.849 26.169 24.369 1.00 30.26 C ATOM 1243 CD1 LEU A 370 30.749 27.211 23.744 1.00 28.95 C ATOM 1244 CD2 LEU A 370 28.602 25.879 23.485 1.00 32.04 C ATOM 0 H LEU A 370 29.386 25.082 26.791 1.00 30.76 H new ATOM 0 HA LEU A 370 29.123 23.502 24.745 1.00 28.80 H new ATOM 0 HB2 LEU A 370 31.371 25.110 25.257 1.00 28.14 H new ATOM 0 HB3 LEU A 370 30.983 24.532 23.862 1.00 28.14 H new ATOM 0 HG LEU A 370 29.527 26.534 25.208 1.00 30.26 H new ATOM 0 HD11 LEU A 370 30.235 28.011 23.554 1.00 28.95 H new ATOM 0 HD12 LEU A 370 31.468 27.428 24.358 1.00 28.95 H new ATOM 0 HD13 LEU A 370 31.122 26.863 22.919 1.00 28.95 H new ATOM 0 HD21 LEU A 370 28.136 26.709 23.300 1.00 32.04 H new ATOM 0 HD22 LEU A 370 28.884 25.474 22.650 1.00 32.04 H new ATOM 0 HD23 LEU A 370 28.007 25.273 23.953 1.00 32.04 H new ATOM 1245 N ASP A 371 30.898 21.702 24.737 1.00 30.64 N ATOM 1246 CA ASP A 371 31.964 20.715 24.863 1.00 28.84 C ATOM 1247 C ASP A 371 33.111 21.080 23.910 1.00 25.39 C ATOM 1248 O ASP A 371 33.055 22.083 23.197 1.00 26.89 O ATOM 1249 CB ASP A 371 31.464 19.245 24.729 1.00 27.29 C ATOM 1250 CG ASP A 371 30.822 18.943 23.371 1.00 31.35 C ATOM 1251 OD1 ASP A 371 31.340 19.426 22.315 1.00 28.99 O ATOM 1252 OD2 ASP A 371 29.792 18.204 23.253 1.00 28.34 O ATOM 0 H ASP A 371 30.437 21.654 24.012 1.00 30.64 H new ATOM 0 HA ASP A 371 32.312 20.748 25.768 1.00 28.84 H new ATOM 0 HB2 ASP A 371 32.211 18.642 24.867 1.00 27.29 H new ATOM 0 HB3 ASP A 371 30.820 19.064 25.431 1.00 27.29 H new ATOM 1253 N ASP A 372 34.157 20.277 23.936 1.00 24.78 N ATOM 1254 CA ASP A 372 35.363 20.568 23.195 1.00 25.72 C ATOM 1255 C ASP A 372 35.101 20.678 21.717 1.00 24.42 C ATOM 1256 O ASP A 372 35.719 21.482 21.045 1.00 26.36 O ATOM 1257 CB ASP A 372 36.430 19.476 23.441 1.00 25.89 C ATOM 1258 CG ASP A 372 37.074 19.575 24.820 1.00 26.83 C ATOM 1259 OD1 ASP A 372 37.563 20.675 25.186 1.00 23.61 O ATOM 1260 OD2 ASP A 372 37.123 18.579 25.599 1.00 28.86 O ATOM 0 H ASP A 372 34.187 19.545 24.386 1.00 24.78 H new ATOM 0 HA ASP A 372 35.690 21.424 23.513 1.00 25.72 H new ATOM 0 HB2 ASP A 372 36.021 18.602 23.342 1.00 25.89 H new ATOM 0 HB3 ASP A 372 37.119 19.545 22.762 1.00 25.89 H new ATOM 1261 N SER A 373 34.209 19.846 21.195 1.00 21.68 N ATOM 1262 CA SER A 373 33.922 19.922 19.775 1.00 22.31 C ATOM 1263 C SER A 373 33.251 21.236 19.396 1.00 25.12 C ATOM 1264 O SER A 373 33.517 21.726 18.317 1.00 24.52 O ATOM 1265 CB SER A 373 33.135 18.688 19.248 1.00 24.20 C ATOM 1266 OG SER A 373 31.841 18.651 19.801 1.00 24.57 O ATOM 0 H SER A 373 33.772 19.248 21.632 1.00 21.68 H new ATOM 0 HA SER A 373 34.781 19.903 19.326 1.00 22.31 H new ATOM 0 HB2 SER A 373 33.077 18.724 18.280 1.00 24.20 H new ATOM 0 HB3 SER A 373 33.612 17.874 19.474 1.00 24.20 H new ATOM 0 HG SER A 373 31.292 18.968 19.250 1.00 24.57 H new ATOM 1267 N ASP A 374 32.419 21.820 20.265 1.00 23.92 N ATOM 1268 CA ASP A 374 31.752 23.059 19.905 1.00 24.81 C ATOM 1269 C ASP A 374 32.823 24.126 19.920 1.00 28.18 C ATOM 1270 O ASP A 374 32.904 25.011 19.045 1.00 25.15 O ATOM 1271 CB ASP A 374 30.708 23.460 20.989 1.00 25.80 C ATOM 1272 CG ASP A 374 29.668 22.374 21.250 1.00 27.33 C ATOM 1273 OD1 ASP A 374 29.147 21.800 20.263 1.00 24.63 O ATOM 1274 OD2 ASP A 374 29.326 22.009 22.407 1.00 29.09 O ATOM 0 H ASP A 374 32.235 21.518 21.049 1.00 23.92 H new ATOM 0 HA ASP A 374 31.306 22.960 19.049 1.00 24.81 H new ATOM 0 HB2 ASP A 374 31.171 23.662 21.817 1.00 25.80 H new ATOM 0 HB3 ASP A 374 30.257 24.272 20.711 1.00 25.80 H new ATOM 1275 N ILE A 375 33.634 24.043 20.983 1.00 25.25 N ATOM 1276 CA ILE A 375 34.666 25.030 21.248 1.00 24.57 C ATOM 1277 C ILE A 375 35.706 25.093 20.109 1.00 21.09 C ATOM 1278 O ILE A 375 36.185 26.172 19.743 1.00 25.56 O ATOM 1279 CB ILE A 375 35.322 24.739 22.640 1.00 24.98 C ATOM 1280 CG1 ILE A 375 34.308 25.015 23.767 1.00 25.12 C ATOM 1281 CG2 ILE A 375 36.520 25.616 22.856 1.00 23.22 C ATOM 1282 CD1 ILE A 375 34.754 24.475 25.072 1.00 26.55 C ATOM 0 H ILE A 375 33.594 23.411 21.565 1.00 25.25 H new ATOM 0 HA ILE A 375 34.258 25.910 21.282 1.00 24.57 H new ATOM 0 HB ILE A 375 35.595 23.808 22.653 1.00 24.98 H new ATOM 0 HG12 ILE A 375 34.169 25.972 23.846 1.00 25.12 H new ATOM 0 HG13 ILE A 375 33.453 24.622 23.532 1.00 25.12 H new ATOM 0 HG21 ILE A 375 36.912 25.421 23.722 1.00 23.22 H new ATOM 0 HG22 ILE A 375 37.174 25.447 22.160 1.00 23.22 H new ATOM 0 HG23 ILE A 375 36.249 26.547 22.826 1.00 23.22 H new ATOM 0 HD11 ILE A 375 34.087 24.671 25.749 1.00 26.55 H new ATOM 0 HD12 ILE A 375 34.870 23.514 25.002 1.00 26.55 H new ATOM 0 HD13 ILE A 375 35.597 24.885 25.321 1.00 26.55 H new ATOM 1283 N SER A 376 36.055 23.944 19.566 1.00 19.62 N ATOM 1284 CA SER A 376 37.043 23.902 18.502 1.00 22.90 C ATOM 1285 C SER A 376 36.519 24.702 17.315 1.00 25.12 C ATOM 1286 O SER A 376 37.266 25.504 16.715 1.00 24.41 O ATOM 1287 CB SER A 376 37.381 22.452 18.124 1.00 23.13 C ATOM 1288 OG SER A 376 36.303 21.824 17.403 1.00 27.61 O ATOM 0 H SER A 376 35.736 23.179 19.795 1.00 19.62 H new ATOM 0 HA SER A 376 37.872 24.305 18.804 1.00 22.90 H new ATOM 0 HB2 SER A 376 38.185 22.438 17.581 1.00 23.13 H new ATOM 0 HB3 SER A 376 37.572 21.944 18.928 1.00 23.13 H new ATOM 0 HG SER A 376 35.592 21.895 17.844 1.00 27.61 H new ATOM 1289 N LEU A 377 35.231 24.518 16.995 1.00 22.43 N ATOM 1290 CA LEU A 377 34.631 25.249 15.856 1.00 21.99 C ATOM 1291 C LEU A 377 34.535 26.719 16.130 1.00 19.97 C ATOM 1292 O LEU A 377 34.795 27.566 15.242 1.00 20.93 O ATOM 1293 CB LEU A 377 33.254 24.701 15.517 1.00 22.25 C ATOM 1294 CG LEU A 377 33.334 23.270 15.005 1.00 23.94 C ATOM 1295 CD1 LEU A 377 31.926 22.619 14.822 1.00 25.73 C ATOM 1296 CD2 LEU A 377 34.112 23.277 13.668 1.00 25.35 C ATOM 0 H LEU A 377 34.695 23.989 17.410 1.00 22.43 H new ATOM 0 HA LEU A 377 35.219 25.117 15.096 1.00 21.99 H new ATOM 0 HB2 LEU A 377 32.689 24.733 16.305 1.00 22.25 H new ATOM 0 HB3 LEU A 377 32.837 25.263 14.846 1.00 22.25 H new ATOM 0 HG LEU A 377 33.796 22.730 15.665 1.00 23.94 H new ATOM 0 HD11 LEU A 377 32.029 21.711 14.495 1.00 25.73 H new ATOM 0 HD12 LEU A 377 31.463 22.605 15.674 1.00 25.73 H new ATOM 0 HD13 LEU A 377 31.411 23.136 14.183 1.00 25.73 H new ATOM 0 HD21 LEU A 377 34.174 22.372 13.325 1.00 25.35 H new ATOM 0 HD22 LEU A 377 33.647 23.835 13.025 1.00 25.35 H new ATOM 0 HD23 LEU A 377 35.004 23.629 13.814 1.00 25.35 H new ATOM 1297 N PHE A 378 34.181 27.029 17.364 1.00 19.78 N ATOM 1298 CA PHE A 378 34.088 28.410 17.850 1.00 23.51 C ATOM 1299 C PHE A 378 35.436 29.156 17.765 1.00 21.56 C ATOM 1300 O PHE A 378 35.522 30.300 17.281 1.00 20.97 O ATOM 1301 CB PHE A 378 33.622 28.387 19.320 1.00 26.79 C ATOM 1302 CG PHE A 378 33.371 29.755 19.907 1.00 29.15 C ATOM 1303 CD1 PHE A 378 32.428 30.584 19.368 1.00 31.21 C ATOM 1304 CD2 PHE A 378 34.084 30.203 21.006 1.00 31.44 C ATOM 1305 CE1 PHE A 378 32.184 31.855 19.941 1.00 32.68 C ATOM 1306 CE2 PHE A 378 33.848 31.469 21.577 1.00 28.84 C ATOM 1307 CZ PHE A 378 32.909 32.275 21.040 1.00 31.66 C ATOM 0 H PHE A 378 33.983 26.440 17.958 1.00 19.78 H new ATOM 0 HA PHE A 378 33.455 28.881 17.285 1.00 23.51 H new ATOM 0 HB2 PHE A 378 32.808 27.864 19.383 1.00 26.79 H new ATOM 0 HB3 PHE A 378 34.292 27.934 19.855 1.00 26.79 H new ATOM 0 HD1 PHE A 378 31.945 30.312 18.622 1.00 31.21 H new ATOM 0 HD2 PHE A 378 34.736 29.654 21.377 1.00 31.44 H new ATOM 0 HE1 PHE A 378 31.533 32.410 19.576 1.00 32.68 H new ATOM 0 HE2 PHE A 378 34.336 31.747 22.318 1.00 28.84 H new ATOM 0 HZ PHE A 378 32.750 33.113 21.409 1.00 31.66 H new ATOM 1308 N VAL A 379 36.498 28.499 18.238 1.00 19.40 N ATOM 1309 CA VAL A 379 37.829 29.116 18.199 1.00 18.79 C ATOM 1310 C VAL A 379 38.297 29.278 16.746 1.00 19.83 C ATOM 1311 O VAL A 379 38.933 30.300 16.381 1.00 22.73 O ATOM 1312 CB VAL A 379 38.891 28.263 19.030 1.00 21.05 C ATOM 1313 CG1 VAL A 379 40.345 28.718 18.737 1.00 18.65 C ATOM 1314 CG2 VAL A 379 38.578 28.314 20.532 1.00 19.84 C ATOM 0 H VAL A 379 36.472 27.710 18.580 1.00 19.40 H new ATOM 0 HA VAL A 379 37.764 29.992 18.611 1.00 18.79 H new ATOM 0 HB VAL A 379 38.818 27.340 18.742 1.00 21.05 H new ATOM 0 HG11 VAL A 379 40.963 28.181 19.257 1.00 18.65 H new ATOM 0 HG12 VAL A 379 40.535 28.606 17.792 1.00 18.65 H new ATOM 0 HG13 VAL A 379 40.447 29.652 18.979 1.00 18.65 H new ATOM 0 HG21 VAL A 379 39.234 27.790 21.017 1.00 19.84 H new ATOM 0 HG22 VAL A 379 38.609 29.234 20.838 1.00 19.84 H new ATOM 0 HG23 VAL A 379 37.693 27.950 20.691 1.00 19.84 H new ATOM 1315 N ALA A 380 38.020 28.285 15.906 1.00 20.98 N ATOM 1316 CA ALA A 380 38.305 28.439 14.446 1.00 21.15 C ATOM 1317 C ALA A 380 37.575 29.664 13.834 1.00 23.62 C ATOM 1318 O ALA A 380 38.142 30.418 13.034 1.00 21.70 O ATOM 1319 CB ALA A 380 37.942 27.179 13.691 1.00 16.69 C ATOM 0 H ALA A 380 37.677 27.530 16.134 1.00 20.98 H new ATOM 0 HA ALA A 380 39.259 28.594 14.358 1.00 21.15 H new ATOM 0 HB1 ALA A 380 38.134 27.300 12.748 1.00 16.69 H new ATOM 0 HB2 ALA A 380 38.462 26.435 14.034 1.00 16.69 H new ATOM 0 HB3 ALA A 380 36.997 26.993 13.807 1.00 16.69 H new ATOM 1320 N ALA A 381 36.309 29.865 14.213 1.00 25.40 N ATOM 1321 CA ALA A 381 35.516 31.019 13.743 1.00 23.34 C ATOM 1322 C ALA A 381 36.111 32.370 14.196 1.00 24.87 C ATOM 1323 O ALA A 381 36.148 33.354 13.441 1.00 24.14 O ATOM 1324 CB ALA A 381 34.060 30.889 14.267 1.00 26.83 C ATOM 0 H ALA A 381 35.884 29.342 14.747 1.00 25.40 H new ATOM 0 HA ALA A 381 35.532 31.009 12.773 1.00 23.34 H new ATOM 0 HB1 ALA A 381 33.537 31.646 13.960 1.00 26.83 H new ATOM 0 HB2 ALA A 381 33.667 30.068 13.932 1.00 26.83 H new ATOM 0 HB3 ALA A 381 34.065 30.872 15.237 1.00 26.83 H new ATOM 1325 N ILE A 382 36.560 32.419 15.445 1.00 24.82 N ATOM 1326 CA ILE A 382 37.258 33.575 15.976 1.00 23.47 C ATOM 1327 C ILE A 382 38.532 33.924 15.168 1.00 25.03 C ATOM 1328 O ILE A 382 38.793 35.084 14.882 1.00 26.05 O ATOM 1329 CB ILE A 382 37.601 33.303 17.481 1.00 23.31 C ATOM 1330 CG1 ILE A 382 36.369 33.543 18.375 1.00 23.17 C ATOM 1331 CG2 ILE A 382 38.807 34.146 17.935 1.00 21.15 C ATOM 1332 CD1 ILE A 382 36.525 32.935 19.812 1.00 24.87 C ATOM 0 H ILE A 382 36.466 31.777 16.009 1.00 24.82 H new ATOM 0 HA ILE A 382 36.676 34.348 15.901 1.00 23.47 H new ATOM 0 HB ILE A 382 37.851 32.370 17.572 1.00 23.31 H new ATOM 0 HG12 ILE A 382 36.210 34.497 18.449 1.00 23.17 H new ATOM 0 HG13 ILE A 382 35.587 33.157 17.950 1.00 23.17 H new ATOM 0 HG21 ILE A 382 38.999 33.960 18.867 1.00 21.15 H new ATOM 0 HG22 ILE A 382 39.581 33.921 17.395 1.00 21.15 H new ATOM 0 HG23 ILE A 382 38.602 35.088 17.829 1.00 21.15 H new ATOM 0 HD11 ILE A 382 35.724 33.115 20.329 1.00 24.87 H new ATOM 0 HD12 ILE A 382 36.657 31.976 19.745 1.00 24.87 H new ATOM 0 HD13 ILE A 382 37.290 33.337 20.252 1.00 24.87 H new ATOM 1333 N ILE A 383 39.330 32.932 14.802 1.00 26.19 N ATOM 1334 CA ILE A 383 40.563 33.187 14.046 1.00 24.34 C ATOM 1335 C ILE A 383 40.288 33.657 12.604 1.00 26.92 C ATOM 1336 O ILE A 383 40.844 34.664 12.127 1.00 25.76 O ATOM 1337 CB ILE A 383 41.431 31.903 14.050 1.00 25.93 C ATOM 1338 CG1 ILE A 383 42.040 31.708 15.455 1.00 28.89 C ATOM 1339 CG2 ILE A 383 42.571 32.023 13.108 1.00 27.33 C ATOM 1340 CD1 ILE A 383 42.298 30.303 15.772 1.00 29.57 C ATOM 0 H ILE A 383 39.182 32.103 14.978 1.00 26.19 H new ATOM 0 HA ILE A 383 41.039 33.912 14.481 1.00 24.34 H new ATOM 0 HB ILE A 383 40.861 31.162 13.792 1.00 25.93 H new ATOM 0 HG12 ILE A 383 42.870 32.206 15.515 1.00 28.89 H new ATOM 0 HG13 ILE A 383 41.438 32.079 16.118 1.00 28.89 H new ATOM 0 HG21 ILE A 383 43.097 31.208 13.130 1.00 27.33 H new ATOM 0 HG22 ILE A 383 42.235 32.166 12.209 1.00 27.33 H new ATOM 0 HG23 ILE A 383 43.128 32.773 13.368 1.00 27.33 H new ATOM 0 HD11 ILE A 383 42.679 30.236 16.662 1.00 29.57 H new ATOM 0 HD12 ILE A 383 41.466 29.805 15.739 1.00 29.57 H new ATOM 0 HD13 ILE A 383 42.921 29.934 15.126 1.00 29.57 H new ATOM 1341 N CYS A 384 39.406 32.942 11.910 1.00 27.10 N ATOM 1342 CA CYS A 384 39.212 33.184 10.485 1.00 27.72 C ATOM 1343 C CYS A 384 38.187 34.258 10.370 1.00 28.54 C ATOM 1344 O CYS A 384 37.085 34.073 9.937 1.00 32.73 O ATOM 1345 CB CYS A 384 38.809 31.896 9.776 1.00 24.81 C ATOM 1346 SG CYS A 384 40.053 30.616 9.991 1.00 31.40 S ATOM 0 H CYS A 384 38.915 32.319 12.242 1.00 27.10 H new ATOM 0 HA CYS A 384 40.030 33.473 10.051 1.00 27.72 H new ATOM 0 HB2 CYS A 384 37.959 31.585 10.124 1.00 24.81 H new ATOM 0 HB3 CYS A 384 38.682 32.071 8.830 1.00 24.81 H new ATOM 0 HG CYS A 384 39.703 29.618 9.423 1.00 31.40 H new ATOM 1347 N CYS A 385 38.563 35.424 10.805 1.00 32.08 N ATOM 1348 CA CYS A 385 37.585 36.441 10.978 1.00 33.95 C ATOM 1349 C CYS A 385 37.866 37.557 9.984 1.00 33.68 C ATOM 1350 O CYS A 385 38.925 38.162 10.031 1.00 31.08 O ATOM 1351 CB CYS A 385 37.683 36.921 12.416 1.00 35.72 C ATOM 1352 SG CYS A 385 36.865 38.487 12.643 1.00 42.02 S ATOM 0 H CYS A 385 39.370 35.645 11.004 1.00 32.08 H new ATOM 0 HA CYS A 385 36.685 36.120 10.814 1.00 33.95 H new ATOM 0 HB2 CYS A 385 37.288 36.260 13.006 1.00 35.72 H new ATOM 0 HB3 CYS A 385 38.616 37.003 12.667 1.00 35.72 H new ATOM 0 HG CYS A 385 36.964 38.828 13.789 1.00 42.02 H new ATOM 1353 N GLY A 386 36.893 37.835 9.111 1.00 35.15 N ATOM 1354 CA GLY A 386 37.100 38.663 7.940 1.00 34.01 C ATOM 1355 C GLY A 386 37.165 40.151 8.126 1.00 37.39 C ATOM 1356 O GLY A 386 37.524 40.872 7.196 1.00 38.95 O ATOM 0 H GLY A 386 36.089 37.541 9.191 1.00 35.15 H new ATOM 0 HA2 GLY A 386 37.927 38.381 7.520 1.00 34.01 H new ATOM 0 HA3 GLY A 386 36.384 38.474 7.313 1.00 34.01 H new ATOM 1357 N ASP A 387 36.827 40.641 9.312 1.00 39.86 N ATOM 1358 CA ASP A 387 36.938 42.069 9.535 1.00 42.11 C ATOM 1359 C ASP A 387 38.101 42.500 10.444 1.00 41.04 C ATOM 1360 O ASP A 387 38.085 43.595 10.974 1.00 43.44 O ATOM 1361 CB ASP A 387 35.609 42.632 10.037 1.00 47.32 C ATOM 1362 CG ASP A 387 35.001 41.771 11.115 1.00 52.41 C ATOM 1363 OD1 ASP A 387 33.835 41.363 10.949 1.00 54.94 O ATOM 1364 OD2 ASP A 387 35.621 41.432 12.144 1.00 52.12 O ATOM 0 H ASP A 387 36.541 40.180 9.979 1.00 39.86 H new ATOM 0 HA ASP A 387 37.153 42.449 8.669 1.00 42.11 H new ATOM 0 HB2 ASP A 387 35.748 43.529 10.380 1.00 47.32 H new ATOM 0 HB3 ASP A 387 34.989 42.705 9.295 1.00 47.32 H new ATOM 1365 N ARG A 388 39.117 41.675 10.633 1.00 36.44 N ATOM 1366 CA ARG A 388 40.310 42.189 11.313 1.00 36.16 C ATOM 1367 C ARG A 388 40.918 43.329 10.467 1.00 37.18 C ATOM 1368 O ARG A 388 40.848 43.290 9.239 1.00 38.72 O ATOM 1369 CB ARG A 388 41.347 41.076 11.536 1.00 30.59 C ATOM 1370 CG ARG A 388 40.759 39.869 12.276 1.00 30.70 C ATOM 1371 CD ARG A 388 40.090 40.229 13.619 1.00 27.35 C ATOM 1372 NE ARG A 388 39.833 38.999 14.334 1.00 27.60 N ATOM 1373 CZ ARG A 388 39.295 38.902 15.557 1.00 28.24 C ATOM 1374 NH1 ARG A 388 38.926 39.969 16.247 1.00 26.98 N ATOM 1375 NH2 ARG A 388 39.132 37.707 16.089 1.00 26.36 N ATOM 0 H ARG A 388 39.146 40.850 10.391 1.00 36.44 H new ATOM 0 HA ARG A 388 40.054 42.527 12.185 1.00 36.16 H new ATOM 0 HB2 ARG A 388 41.697 40.787 10.679 1.00 30.59 H new ATOM 0 HB3 ARG A 388 42.094 41.430 12.043 1.00 30.59 H new ATOM 0 HG2 ARG A 388 40.106 39.436 11.704 1.00 30.70 H new ATOM 0 HG3 ARG A 388 41.465 39.224 12.438 1.00 30.70 H new ATOM 0 HD2 ARG A 388 40.666 40.810 14.140 1.00 27.35 H new ATOM 0 HD3 ARG A 388 39.263 40.712 13.467 1.00 27.35 H new ATOM 0 HE ARG A 388 40.044 38.265 13.939 1.00 27.60 H new ATOM 0 HH11 ARG A 388 39.029 40.754 15.912 1.00 26.98 H new ATOM 0 HH12 ARG A 388 38.583 39.877 17.030 1.00 26.98 H new ATOM 0 HH21 ARG A 388 39.370 37.006 15.652 1.00 26.36 H new ATOM 0 HH22 ARG A 388 38.788 37.629 16.873 1.00 26.36 H new ATOM 1376 N PRO A 389 41.518 44.317 11.125 1.00 38.08 N ATOM 1377 CA PRO A 389 42.147 45.466 10.453 1.00 38.86 C ATOM 1378 C PRO A 389 43.314 45.089 9.541 1.00 38.90 C ATOM 1379 O PRO A 389 44.137 44.241 9.918 1.00 33.92 O ATOM 1380 CB PRO A 389 42.731 46.286 11.632 1.00 39.67 C ATOM 1381 CG PRO A 389 41.937 45.852 12.842 1.00 39.38 C ATOM 1382 CD PRO A 389 41.634 44.394 12.600 1.00 39.51 C ATOM 0 HA PRO A 389 41.500 45.918 9.890 1.00 38.86 H new ATOM 0 HB2 PRO A 389 43.677 46.107 11.750 1.00 39.67 H new ATOM 0 HB3 PRO A 389 42.640 47.239 11.476 1.00 39.67 H new ATOM 0 HG2 PRO A 389 42.445 45.975 13.659 1.00 39.38 H new ATOM 0 HG3 PRO A 389 41.122 46.371 12.933 1.00 39.38 H new ATOM 0 HD2 PRO A 389 42.341 43.820 12.935 1.00 39.51 H new ATOM 0 HD3 PRO A 389 40.814 44.120 13.039 1.00 39.51 H new ATOM 1383 N GLY A 390 43.391 45.721 8.367 1.00 39.10 N ATOM 1384 CA GLY A 390 44.557 45.604 7.504 1.00 40.32 C ATOM 1385 C GLY A 390 44.689 44.284 6.778 1.00 42.36 C ATOM 1386 O GLY A 390 45.768 43.947 6.302 1.00 45.32 O ATOM 0 H GLY A 390 42.769 46.226 8.054 1.00 39.10 H new ATOM 0 HA2 GLY A 390 44.528 46.317 6.847 1.00 40.32 H new ATOM 0 HA3 GLY A 390 45.354 45.744 8.040 1.00 40.32 H new ATOM 1387 N LEU A 391 43.594 43.534 6.684 1.00 41.94 N ATOM 1388 CA LEU A 391 43.597 42.270 5.960 1.00 42.44 C ATOM 1389 C LEU A 391 43.774 42.508 4.459 1.00 46.95 C ATOM 1390 O LEU A 391 43.013 43.250 3.846 1.00 44.46 O ATOM 1391 CB LEU A 391 42.302 41.507 6.209 1.00 37.88 C ATOM 1392 CG LEU A 391 42.256 40.692 7.499 1.00 35.96 C ATOM 1393 CD1 LEU A 391 40.892 40.051 7.583 1.00 33.41 C ATOM 1394 CD2 LEU A 391 43.386 39.635 7.579 1.00 31.53 C ATOM 0 H LEU A 391 42.837 43.742 7.035 1.00 41.94 H new ATOM 0 HA LEU A 391 44.342 41.741 6.285 1.00 42.44 H new ATOM 0 HB2 LEU A 391 41.568 42.141 6.219 1.00 37.88 H new ATOM 0 HB3 LEU A 391 42.149 40.908 5.461 1.00 37.88 H new ATOM 0 HG LEU A 391 42.404 41.280 8.256 1.00 35.96 H new ATOM 0 HD11 LEU A 391 40.831 39.524 8.395 1.00 33.41 H new ATOM 0 HD12 LEU A 391 40.210 40.741 7.594 1.00 33.41 H new ATOM 0 HD13 LEU A 391 40.757 39.475 6.814 1.00 33.41 H new ATOM 0 HD21 LEU A 391 43.313 39.146 8.414 1.00 31.53 H new ATOM 0 HD22 LEU A 391 43.305 39.018 6.835 1.00 31.53 H new ATOM 0 HD23 LEU A 391 44.248 40.079 7.539 1.00 31.53 H new ATOM 1395 N LEU A 392 44.780 41.854 3.883 1.00 51.36 N ATOM 1396 CA LEU A 392 45.120 42.023 2.472 1.00 53.12 C ATOM 1397 C LEU A 392 44.075 41.462 1.526 1.00 52.01 C ATOM 1398 O LEU A 392 43.825 42.061 0.511 1.00 55.94 O ATOM 1399 CB LEU A 392 46.497 41.435 2.176 1.00 54.97 C ATOM 1400 CG LEU A 392 47.651 42.418 2.434 1.00 56.67 C ATOM 1401 CD1 LEU A 392 47.301 43.450 3.519 1.00 56.64 C ATOM 1402 CD2 LEU A 392 48.937 41.682 2.781 1.00 55.44 C ATOM 0 H LEU A 392 45.286 41.298 4.301 1.00 51.36 H new ATOM 0 HA LEU A 392 45.141 42.979 2.309 1.00 53.12 H new ATOM 0 HB2 LEU A 392 46.627 40.644 2.722 1.00 54.97 H new ATOM 0 HB3 LEU A 392 46.526 41.149 1.250 1.00 54.97 H new ATOM 0 HG LEU A 392 47.795 42.905 1.608 1.00 56.67 H new ATOM 0 HD11 LEU A 392 48.053 44.049 3.651 1.00 56.64 H new ATOM 0 HD12 LEU A 392 46.525 43.962 3.241 1.00 56.64 H new ATOM 0 HD13 LEU A 392 47.104 42.991 4.351 1.00 56.64 H new ATOM 0 HD21 LEU A 392 49.646 42.325 2.938 1.00 55.44 H new ATOM 0 HD22 LEU A 392 48.800 41.150 3.581 1.00 55.44 H new ATOM 0 HD23 LEU A 392 49.186 41.101 2.046 1.00 55.44 H new ATOM 1403 N ASN A 393 43.462 40.333 1.882 1.00 51.66 N ATOM 1404 CA ASN A 393 42.426 39.672 1.095 1.00 49.27 C ATOM 1405 C ASN A 393 41.149 39.301 1.860 1.00 49.15 C ATOM 1406 O ASN A 393 40.952 38.119 2.186 1.00 45.54 O ATOM 1407 CB ASN A 393 42.990 38.392 0.465 1.00 51.97 C ATOM 1408 CG ASN A 393 41.981 37.685 -0.449 1.00 53.62 C ATOM 1409 OD1 ASN A 393 42.092 36.481 -0.692 1.00 56.34 O ATOM 1410 ND2 ASN A 393 40.994 38.425 -0.949 1.00 52.77 N ATOM 0 H ASN A 393 43.645 39.919 2.613 1.00 51.66 H new ATOM 0 HA ASN A 393 42.167 40.331 0.432 1.00 49.27 H new ATOM 0 HB2 ASN A 393 43.785 38.611 -0.046 1.00 51.97 H new ATOM 0 HB3 ASN A 393 43.264 37.784 1.169 1.00 51.97 H new ATOM 0 HD21 ASN A 393 40.404 38.066 -1.462 1.00 52.77 H new ATOM 0 HD22 ASN A 393 40.946 39.262 -0.759 1.00 52.77 H new ATOM 1411 N VAL A 394 40.265 40.276 2.123 1.00 46.71 N ATOM 1412 CA VAL A 394 39.066 39.980 2.920 1.00 47.96 C ATOM 1413 C VAL A 394 38.170 38.862 2.341 1.00 47.97 C ATOM 1414 O VAL A 394 37.622 38.015 3.094 1.00 46.35 O ATOM 1415 CB VAL A 394 38.216 41.253 3.229 1.00 49.43 C ATOM 1416 CG1 VAL A 394 39.052 42.277 3.990 1.00 48.89 C ATOM 1417 CG2 VAL A 394 37.664 41.865 1.961 1.00 51.35 C ATOM 0 H VAL A 394 40.338 41.091 1.858 1.00 46.71 H new ATOM 0 HA VAL A 394 39.424 39.640 3.755 1.00 47.96 H new ATOM 0 HB VAL A 394 37.466 40.984 3.783 1.00 49.43 H new ATOM 0 HG11 VAL A 394 38.513 43.062 4.175 1.00 48.89 H new ATOM 0 HG12 VAL A 394 39.357 41.890 4.826 1.00 48.89 H new ATOM 0 HG13 VAL A 394 39.819 42.532 3.454 1.00 48.89 H new ATOM 0 HG21 VAL A 394 37.142 42.652 2.182 1.00 51.35 H new ATOM 0 HG22 VAL A 394 38.397 42.117 1.378 1.00 51.35 H new ATOM 0 HG23 VAL A 394 37.099 41.219 1.509 1.00 51.35 H new ATOM 1418 N GLY A 395 38.030 38.854 1.012 1.00 45.19 N ATOM 1419 CA GLY A 395 37.226 37.867 0.313 1.00 39.63 C ATOM 1420 C GLY A 395 37.535 36.423 0.664 1.00 39.62 C ATOM 1421 O GLY A 395 36.632 35.704 1.059 1.00 40.44 O ATOM 0 H GLY A 395 38.405 39.429 0.493 1.00 45.19 H new ATOM 0 HA2 GLY A 395 36.290 38.039 0.503 1.00 39.63 H new ATOM 0 HA3 GLY A 395 37.349 37.987 -0.642 1.00 39.63 H new ATOM 1422 N HIS A 396 38.788 35.985 0.531 1.00 43.03 N ATOM 1423 CA HIS A 396 39.136 34.594 0.851 1.00 46.24 C ATOM 1424 C HIS A 396 38.879 34.217 2.322 1.00 45.52 C ATOM 1425 O HIS A 396 38.446 33.097 2.621 1.00 46.90 O ATOM 1426 CB HIS A 396 40.579 34.279 0.467 1.00 52.02 C ATOM 1427 CG HIS A 396 40.713 33.754 -0.929 1.00 59.60 C ATOM 1428 ND1 HIS A 396 41.431 34.409 -1.911 1.00 61.78 N ATOM 1429 CD2 HIS A 396 40.191 32.648 -1.518 1.00 62.48 C ATOM 1430 CE1 HIS A 396 41.356 33.726 -3.041 1.00 63.58 C ATOM 1431 NE2 HIS A 396 40.613 32.651 -2.831 1.00 65.22 N ATOM 0 H HIS A 396 39.446 36.469 0.261 1.00 43.03 H new ATOM 0 HA HIS A 396 38.539 34.048 0.316 1.00 46.24 H new ATOM 0 HB2 HIS A 396 41.115 35.082 0.558 1.00 52.02 H new ATOM 0 HB3 HIS A 396 40.938 33.627 1.088 1.00 52.02 H new ATOM 0 HD1 HIS A 396 41.860 35.147 -1.804 1.00 61.78 H new ATOM 0 HD2 HIS A 396 39.651 32.009 -1.113 1.00 62.48 H new ATOM 0 HE1 HIS A 396 41.757 33.961 -3.846 1.00 63.58 H new ATOM 1432 N ILE A 397 39.148 35.162 3.219 1.00 41.42 N ATOM 1433 CA ILE A 397 38.972 34.954 4.644 1.00 40.12 C ATOM 1434 C ILE A 397 37.481 34.911 5.024 1.00 39.61 C ATOM 1435 O ILE A 397 37.086 34.053 5.782 1.00 36.93 O ATOM 1436 CB ILE A 397 39.739 36.020 5.424 1.00 38.45 C ATOM 1437 CG1 ILE A 397 41.238 35.881 5.098 1.00 38.63 C ATOM 1438 CG2 ILE A 397 39.456 35.876 6.903 1.00 40.89 C ATOM 1439 CD1 ILE A 397 42.141 36.957 5.675 1.00 35.05 C ATOM 0 H ILE A 397 39.439 35.944 3.012 1.00 41.42 H new ATOM 0 HA ILE A 397 39.339 34.089 4.883 1.00 40.12 H new ATOM 0 HB ILE A 397 39.453 36.910 5.167 1.00 38.45 H new ATOM 0 HG12 ILE A 397 41.543 35.019 5.420 1.00 38.63 H new ATOM 0 HG13 ILE A 397 41.343 35.877 4.134 1.00 38.63 H new ATOM 0 HG21 ILE A 397 39.945 36.555 7.394 1.00 40.89 H new ATOM 0 HG22 ILE A 397 38.505 35.984 7.063 1.00 40.89 H new ATOM 0 HG23 ILE A 397 39.736 34.997 7.202 1.00 40.89 H new ATOM 0 HD11 ILE A 397 43.059 36.782 5.416 1.00 35.05 H new ATOM 0 HD12 ILE A 397 41.869 37.824 5.336 1.00 35.05 H new ATOM 0 HD13 ILE A 397 42.072 36.953 6.643 1.00 35.05 H new ATOM 1440 N GLU A 398 36.673 35.816 4.464 1.00 39.48 N ATOM 1441 CA GLU A 398 35.226 35.801 4.651 1.00 42.27 C ATOM 1442 C GLU A 398 34.620 34.475 4.170 1.00 42.54 C ATOM 1443 O GLU A 398 33.644 33.972 4.740 1.00 41.01 O ATOM 1444 CB GLU A 398 34.561 36.990 3.904 1.00 44.75 C ATOM 1445 CG GLU A 398 34.605 38.347 4.624 1.00 47.29 C ATOM 1446 CD GLU A 398 33.904 39.496 3.871 1.00 50.72 C ATOM 1447 OE1 GLU A 398 33.582 39.385 2.643 1.00 51.66 O ATOM 1448 OE2 GLU A 398 33.665 40.537 4.519 1.00 49.70 O ATOM 0 H GLU A 398 36.954 36.457 3.964 1.00 39.48 H new ATOM 0 HA GLU A 398 35.052 35.892 5.601 1.00 42.27 H new ATOM 0 HB2 GLU A 398 34.992 37.088 3.040 1.00 44.75 H new ATOM 0 HB3 GLU A 398 33.633 36.764 3.734 1.00 44.75 H new ATOM 0 HG2 GLU A 398 34.194 38.250 5.497 1.00 47.29 H new ATOM 0 HG3 GLU A 398 35.532 38.591 4.772 1.00 47.29 H new ATOM 1449 N LYS A 399 35.193 33.895 3.115 1.00 45.01 N ATOM 1450 CA LYS A 399 34.664 32.625 2.641 1.00 45.39 C ATOM 1451 C LYS A 399 35.075 31.471 3.534 1.00 42.86 C ATOM 1452 O LYS A 399 34.302 30.527 3.715 1.00 42.09 O ATOM 1453 CB LYS A 399 35.059 32.349 1.195 1.00 51.00 C ATOM 1454 CG LYS A 399 33.901 32.562 0.218 1.00 56.47 C ATOM 1455 CD LYS A 399 33.960 33.962 -0.459 1.00 59.03 C ATOM 1456 CE LYS A 399 34.197 33.825 -1.970 1.00 61.02 C ATOM 1457 NZ LYS A 399 32.933 33.435 -2.659 1.00 61.95 N ATOM 0 H LYS A 399 35.863 34.208 2.676 1.00 45.01 H new ATOM 0 HA LYS A 399 33.698 32.700 2.678 1.00 45.39 H new ATOM 0 HB2 LYS A 399 35.797 32.929 0.948 1.00 51.00 H new ATOM 0 HB3 LYS A 399 35.378 31.436 1.119 1.00 51.00 H new ATOM 0 HG2 LYS A 399 33.923 31.873 -0.464 1.00 56.47 H new ATOM 0 HG3 LYS A 399 33.059 32.467 0.690 1.00 56.47 H new ATOM 0 HD2 LYS A 399 33.131 34.439 -0.299 1.00 59.03 H new ATOM 0 HD3 LYS A 399 34.671 34.489 -0.062 1.00 59.03 H new ATOM 0 HE2 LYS A 399 34.523 34.665 -2.330 1.00 61.02 H new ATOM 0 HE3 LYS A 399 34.882 33.159 -2.137 1.00 61.02 H new ATOM 0 HZ1 LYS A 399 33.082 33.359 -3.533 1.00 61.95 H new ATOM 0 HZ2 LYS A 399 32.648 32.655 -2.338 1.00 61.95 H new ATOM 0 HZ3 LYS A 399 32.313 34.058 -2.518 1.00 61.95 H new ATOM 1458 N MET A 400 36.287 31.514 4.085 1.00 39.55 N ATOM 1459 CA MET A 400 36.636 30.505 5.096 1.00 37.64 C ATOM 1460 C MET A 400 35.656 30.626 6.258 1.00 33.19 C ATOM 1461 O MET A 400 35.120 29.639 6.776 1.00 30.65 O ATOM 1462 CB MET A 400 38.046 30.686 5.626 1.00 37.54 C ATOM 1463 CG MET A 400 39.102 30.255 4.683 1.00 41.73 C ATOM 1464 SD MET A 400 40.659 30.409 5.493 1.00 47.35 S ATOM 1465 CE MET A 400 40.778 32.076 5.276 1.00 45.12 C ATOM 0 H MET A 400 36.899 32.089 3.902 1.00 39.55 H new ATOM 0 HA MET A 400 36.587 29.631 4.678 1.00 37.64 H new ATOM 0 HB2 MET A 400 38.182 31.621 5.845 1.00 37.54 H new ATOM 0 HB3 MET A 400 38.138 30.185 6.452 1.00 37.54 H new ATOM 0 HG2 MET A 400 38.954 29.337 4.406 1.00 41.73 H new ATOM 0 HG3 MET A 400 39.082 30.800 3.881 1.00 41.73 H new ATOM 0 HE1 MET A 400 41.710 32.343 5.321 1.00 45.12 H new ATOM 0 HE2 MET A 400 40.415 32.316 4.409 1.00 45.12 H new ATOM 0 HE3 MET A 400 40.278 32.530 5.973 1.00 45.12 H new ATOM 1466 N GLN A 401 35.425 31.861 6.655 1.00 32.70 N ATOM 1467 CA GLN A 401 34.580 32.119 7.801 1.00 34.38 C ATOM 1468 C GLN A 401 33.179 31.566 7.591 1.00 33.71 C ATOM 1469 O GLN A 401 32.617 30.951 8.495 1.00 31.45 O ATOM 1470 CB GLN A 401 34.532 33.619 8.068 1.00 36.56 C ATOM 1471 CG GLN A 401 33.324 34.004 8.900 1.00 43.63 C ATOM 1472 CD GLN A 401 33.633 35.111 9.862 1.00 44.51 C ATOM 1473 OE1 GLN A 401 33.658 36.287 9.447 1.00 44.23 O ATOM 1474 NE2 GLN A 401 33.905 34.756 11.142 1.00 41.48 N ATOM 0 H GLN A 401 35.747 32.563 6.276 1.00 32.70 H new ATOM 0 HA GLN A 401 34.957 31.667 8.572 1.00 34.38 H new ATOM 0 HB2 GLN A 401 35.342 33.892 8.527 1.00 36.56 H new ATOM 0 HB3 GLN A 401 34.510 34.097 7.224 1.00 36.56 H new ATOM 0 HG2 GLN A 401 32.603 34.279 8.313 1.00 43.63 H new ATOM 0 HG3 GLN A 401 33.010 33.228 9.391 1.00 43.63 H new ATOM 0 HE21 GLN A 401 33.873 33.929 11.375 1.00 41.48 H new ATOM 0 HE22 GLN A 401 34.109 35.358 11.721 1.00 41.48 H new ATOM 1475 N GLU A 402 32.608 31.760 6.397 1.00 36.77 N ATOM 1476 CA GLU A 402 31.217 31.348 6.181 1.00 39.04 C ATOM 1477 C GLU A 402 31.085 29.822 6.261 1.00 34.99 C ATOM 1478 O GLU A 402 30.113 29.286 6.807 1.00 34.66 O ATOM 1479 CB GLU A 402 30.656 31.937 4.868 1.00 45.46 C ATOM 1480 CG GLU A 402 31.026 31.236 3.565 1.00 52.97 C ATOM 1481 CD GLU A 402 30.098 31.625 2.382 1.00 58.23 C ATOM 1482 OE1 GLU A 402 30.234 32.750 1.824 1.00 58.25 O ATOM 1483 OE2 GLU A 402 29.222 30.800 2.004 1.00 60.19 O ATOM 0 H GLU A 402 32.996 32.118 5.718 1.00 36.77 H new ATOM 0 HA GLU A 402 30.670 31.713 6.894 1.00 39.04 H new ATOM 0 HB2 GLU A 402 29.688 31.951 4.936 1.00 45.46 H new ATOM 0 HB3 GLU A 402 30.949 32.860 4.805 1.00 45.46 H new ATOM 0 HG2 GLU A 402 31.943 31.454 3.335 1.00 52.97 H new ATOM 0 HG3 GLU A 402 30.987 30.276 3.698 1.00 52.97 H new ATOM 1484 N GLY A 403 32.090 29.136 5.736 1.00 31.31 N ATOM 1485 CA GLY A 403 32.151 27.699 5.798 1.00 32.64 C ATOM 1486 C GLY A 403 32.193 27.202 7.241 1.00 31.64 C ATOM 1487 O GLY A 403 31.390 26.333 7.643 1.00 31.58 O ATOM 0 H GLY A 403 32.757 29.500 5.333 1.00 31.31 H new ATOM 0 HA2 GLY A 403 31.380 27.322 5.347 1.00 32.64 H new ATOM 0 HA3 GLY A 403 32.938 27.387 5.324 1.00 32.64 H new ATOM 1488 N ILE A 404 33.099 27.767 8.038 1.00 30.48 N ATOM 1489 CA ILE A 404 33.192 27.367 9.451 1.00 30.13 C ATOM 1490 C ILE A 404 31.924 27.677 10.226 1.00 30.12 C ATOM 1491 O ILE A 404 31.449 26.859 11.007 1.00 30.15 O ATOM 1492 CB ILE A 404 34.433 28.027 10.136 1.00 31.07 C ATOM 1493 CG1 ILE A 404 35.722 27.591 9.417 1.00 29.32 C ATOM 1494 CG2 ILE A 404 34.497 27.651 11.618 1.00 28.03 C ATOM 1495 CD1 ILE A 404 36.930 28.513 9.662 1.00 32.72 C ATOM 0 H ILE A 404 33.660 28.371 7.792 1.00 30.48 H new ATOM 0 HA ILE A 404 33.304 26.404 9.464 1.00 30.13 H new ATOM 0 HB ILE A 404 34.346 28.991 10.072 1.00 31.07 H new ATOM 0 HG12 ILE A 404 35.951 26.693 9.703 1.00 29.32 H new ATOM 0 HG13 ILE A 404 35.549 27.549 8.463 1.00 29.32 H new ATOM 0 HG21 ILE A 404 35.272 28.069 12.025 1.00 28.03 H new ATOM 0 HG22 ILE A 404 33.693 27.958 12.065 1.00 28.03 H new ATOM 0 HG23 ILE A 404 34.567 26.687 11.705 1.00 28.03 H new ATOM 0 HD11 ILE A 404 37.699 28.174 9.178 1.00 32.72 H new ATOM 0 HD12 ILE A 404 36.722 29.408 9.352 1.00 32.72 H new ATOM 0 HD13 ILE A 404 37.131 28.539 10.611 1.00 32.72 H new ATOM 1496 N VAL A 405 31.364 28.865 10.020 1.00 34.05 N ATOM 1497 CA VAL A 405 30.181 29.295 10.780 1.00 33.99 C ATOM 1498 C VAL A 405 28.971 28.465 10.364 1.00 36.86 C ATOM 1499 O VAL A 405 28.083 28.211 11.154 1.00 37.87 O ATOM 1500 CB VAL A 405 29.892 30.803 10.586 1.00 38.51 C ATOM 1501 CG1 VAL A 405 28.584 31.237 11.286 1.00 36.74 C ATOM 1502 CG2 VAL A 405 31.096 31.644 11.092 1.00 39.50 C ATOM 0 H VAL A 405 31.649 29.440 9.447 1.00 34.05 H new ATOM 0 HA VAL A 405 30.362 29.153 11.722 1.00 33.99 H new ATOM 0 HB VAL A 405 29.771 30.963 9.637 1.00 38.51 H new ATOM 0 HG11 VAL A 405 28.439 32.185 11.142 1.00 36.74 H new ATOM 0 HG12 VAL A 405 27.839 30.736 10.919 1.00 36.74 H new ATOM 0 HG13 VAL A 405 28.653 31.062 12.238 1.00 36.74 H new ATOM 0 HG21 VAL A 405 30.907 32.587 10.967 1.00 39.50 H new ATOM 0 HG22 VAL A 405 31.242 31.466 12.034 1.00 39.50 H new ATOM 0 HG23 VAL A 405 31.891 31.405 10.591 1.00 39.50 H new ATOM 1503 N HIS A 406 28.957 28.012 9.122 1.00 37.60 N ATOM 1504 CA HIS A 406 27.913 27.135 8.674 1.00 38.24 C ATOM 1505 C HIS A 406 28.046 25.767 9.355 1.00 38.16 C ATOM 1506 O HIS A 406 27.083 25.203 9.876 1.00 36.42 O ATOM 1507 CB HIS A 406 27.990 26.974 7.154 1.00 41.65 C ATOM 1508 CG HIS A 406 26.912 26.096 6.595 1.00 43.06 C ATOM 1509 ND1 HIS A 406 27.183 24.926 5.917 1.00 45.53 N ATOM 1510 CD2 HIS A 406 25.563 26.219 6.618 1.00 44.44 C ATOM 1511 CE1 HIS A 406 26.045 24.361 5.551 1.00 48.20 C ATOM 1512 NE2 HIS A 406 25.046 25.132 5.955 1.00 46.76 N ATOM 0 H HIS A 406 29.547 28.205 8.527 1.00 37.60 H new ATOM 0 HA HIS A 406 27.054 27.519 8.910 1.00 38.24 H new ATOM 0 HB2 HIS A 406 27.933 27.849 6.739 1.00 41.65 H new ATOM 0 HB3 HIS A 406 28.855 26.604 6.918 1.00 41.65 H new ATOM 0 HD2 HIS A 406 25.078 26.909 7.009 1.00 44.44 H new ATOM 0 HE1 HIS A 406 25.960 23.559 5.089 1.00 48.20 H new ATOM 0 HE2 HIS A 406 24.210 24.977 5.824 1.00 46.76 H new ATOM 1513 N VAL A 407 29.245 25.210 9.347 1.00 38.00 N ATOM 1514 CA VAL A 407 29.399 23.916 9.990 1.00 36.59 C ATOM 1515 C VAL A 407 29.150 24.034 11.501 1.00 35.42 C ATOM 1516 O VAL A 407 28.533 23.180 12.108 1.00 36.07 O ATOM 1517 CB VAL A 407 30.745 23.299 9.647 1.00 37.26 C ATOM 1518 CG1 VAL A 407 31.029 22.125 10.535 1.00 39.50 C ATOM 1519 CG2 VAL A 407 30.755 22.879 8.199 1.00 35.63 C ATOM 0 H VAL A 407 29.954 25.544 8.993 1.00 38.00 H new ATOM 0 HA VAL A 407 28.728 23.306 9.647 1.00 36.59 H new ATOM 0 HB VAL A 407 31.440 23.960 9.791 1.00 37.26 H new ATOM 0 HG11 VAL A 407 31.890 21.744 10.303 1.00 39.50 H new ATOM 0 HG12 VAL A 407 31.043 22.415 11.461 1.00 39.50 H new ATOM 0 HG13 VAL A 407 30.337 21.455 10.417 1.00 39.50 H new ATOM 0 HG21 VAL A 407 31.615 22.486 7.982 1.00 35.63 H new ATOM 0 HG22 VAL A 407 30.053 22.227 8.046 1.00 35.63 H new ATOM 0 HG23 VAL A 407 30.603 23.654 7.636 1.00 35.63 H new ATOM 1520 N LEU A 408 29.590 25.119 12.106 1.00 34.75 N ATOM 1521 CA LEU A 408 29.273 25.347 13.510 1.00 33.06 C ATOM 1522 C LEU A 408 27.780 25.288 13.778 1.00 33.11 C ATOM 1523 O LEU A 408 27.318 24.621 14.710 1.00 31.25 O ATOM 1524 CB LEU A 408 29.740 26.740 13.902 1.00 32.23 C ATOM 1525 CG LEU A 408 30.194 27.078 15.339 1.00 34.89 C ATOM 1526 CD1 LEU A 408 29.918 28.549 15.650 1.00 33.75 C ATOM 1527 CD2 LEU A 408 29.747 26.170 16.494 1.00 30.27 C ATOM 0 H LEU A 408 30.067 25.730 11.734 1.00 34.75 H new ATOM 0 HA LEU A 408 29.716 24.651 14.021 1.00 33.06 H new ATOM 0 HB2 LEU A 408 30.480 26.962 13.316 1.00 32.23 H new ATOM 0 HB3 LEU A 408 29.016 27.348 13.687 1.00 32.23 H new ATOM 0 HG LEU A 408 31.145 26.889 15.308 1.00 34.89 H new ATOM 0 HD11 LEU A 408 30.207 28.749 16.554 1.00 33.75 H new ATOM 0 HD12 LEU A 408 30.404 29.109 15.025 1.00 33.75 H new ATOM 0 HD13 LEU A 408 28.967 28.724 15.569 1.00 33.75 H new ATOM 0 HD21 LEU A 408 30.108 26.507 17.329 1.00 30.27 H new ATOM 0 HD22 LEU A 408 28.778 26.160 16.541 1.00 30.27 H new ATOM 0 HD23 LEU A 408 30.072 25.269 16.342 1.00 30.27 H new ATOM 1528 N ARG A 409 27.023 26.057 12.995 1.00 35.51 N ATOM 1529 CA ARG A 409 25.572 26.165 13.182 1.00 37.12 C ATOM 1530 C ARG A 409 24.981 24.754 13.169 1.00 34.29 C ATOM 1531 O ARG A 409 24.250 24.370 14.056 1.00 35.63 O ATOM 1532 CB ARG A 409 24.930 27.051 12.074 1.00 41.05 C ATOM 1533 CG ARG A 409 23.453 27.484 12.322 1.00 47.84 C ATOM 1534 CD ARG A 409 22.677 27.960 11.057 1.00 53.03 C ATOM 1535 NE ARG A 409 23.168 29.229 10.520 1.00 58.49 N ATOM 1536 CZ ARG A 409 22.422 30.321 10.252 1.00 61.84 C ATOM 1537 NH1 ARG A 409 21.096 30.339 10.463 1.00 61.85 N ATOM 1538 NH2 ARG A 409 23.023 31.411 9.766 1.00 62.37 N ATOM 0 H ARG A 409 27.332 26.528 12.345 1.00 35.51 H new ATOM 0 HA ARG A 409 25.381 26.593 14.031 1.00 37.12 H new ATOM 0 HB2 ARG A 409 25.470 27.850 11.969 1.00 41.05 H new ATOM 0 HB3 ARG A 409 24.971 26.568 11.234 1.00 41.05 H new ATOM 0 HG2 ARG A 409 22.974 26.737 12.715 1.00 47.84 H new ATOM 0 HG3 ARG A 409 23.447 28.201 12.976 1.00 47.84 H new ATOM 0 HD2 ARG A 409 22.742 27.278 10.370 1.00 53.03 H new ATOM 0 HD3 ARG A 409 21.737 28.052 11.277 1.00 53.03 H new ATOM 0 HE ARG A 409 24.011 29.284 10.360 1.00 58.49 H new ATOM 0 HH11 ARG A 409 20.701 29.642 10.777 1.00 61.85 H new ATOM 0 HH12 ARG A 409 20.642 31.047 10.284 1.00 61.85 H new ATOM 0 HH21 ARG A 409 23.872 31.409 9.629 1.00 62.37 H new ATOM 0 HH22 ARG A 409 22.561 32.115 9.590 1.00 62.37 H new ATOM 1539 N LEU A 410 25.312 23.985 12.150 1.00 35.19 N ATOM 1540 CA LEU A 410 24.793 22.633 12.030 1.00 36.78 C ATOM 1541 C LEU A 410 25.261 21.736 13.158 1.00 36.47 C ATOM 1542 O LEU A 410 24.520 20.867 13.623 1.00 33.92 O ATOM 1543 CB LEU A 410 25.259 22.041 10.723 1.00 36.44 C ATOM 1544 CG LEU A 410 24.441 22.496 9.530 1.00 40.24 C ATOM 1545 CD1 LEU A 410 25.038 21.917 8.289 1.00 40.49 C ATOM 1546 CD2 LEU A 410 22.977 22.027 9.686 1.00 41.90 C ATOM 0 H LEU A 410 25.838 24.225 11.513 1.00 35.19 H new ATOM 0 HA LEU A 410 23.825 22.687 12.069 1.00 36.78 H new ATOM 0 HB2 LEU A 410 26.188 22.281 10.580 1.00 36.44 H new ATOM 0 HB3 LEU A 410 25.222 21.074 10.782 1.00 36.44 H new ATOM 0 HG LEU A 410 24.449 23.464 9.474 1.00 40.24 H new ATOM 0 HD11 LEU A 410 24.522 22.202 7.518 1.00 40.49 H new ATOM 0 HD12 LEU A 410 25.953 22.224 8.196 1.00 40.49 H new ATOM 0 HD13 LEU A 410 25.026 20.949 8.345 1.00 40.49 H new ATOM 0 HD21 LEU A 410 22.459 22.321 8.920 1.00 41.90 H new ATOM 0 HD22 LEU A 410 22.951 21.059 9.741 1.00 41.90 H new ATOM 0 HD23 LEU A 410 22.600 22.406 10.495 1.00 41.90 H new ATOM 1547 N HIS A 411 26.504 21.936 13.598 1.00 34.01 N ATOM 1548 CA HIS A 411 27.019 21.125 14.711 1.00 31.62 C ATOM 1549 C HIS A 411 26.263 21.443 16.013 1.00 28.43 C ATOM 1550 O HIS A 411 25.889 20.571 16.789 1.00 29.01 O ATOM 1551 CB HIS A 411 28.530 21.342 14.893 1.00 28.34 C ATOM 1552 CG HIS A 411 29.117 20.523 16.007 1.00 29.94 C ATOM 1553 ND1 HIS A 411 29.535 19.218 15.829 1.00 29.09 N ATOM 1554 CD2 HIS A 411 29.350 20.820 17.310 1.00 29.05 C ATOM 1555 CE1 HIS A 411 30.000 18.748 16.976 1.00 30.19 C ATOM 1556 NE2 HIS A 411 29.905 19.700 17.891 1.00 30.30 N ATOM 0 H HIS A 411 27.053 22.517 13.280 1.00 34.01 H new ATOM 0 HA HIS A 411 26.872 20.191 14.495 1.00 31.62 H new ATOM 0 HB2 HIS A 411 28.984 21.123 14.064 1.00 28.34 H new ATOM 0 HB3 HIS A 411 28.697 22.281 15.068 1.00 28.34 H new ATOM 0 HD1 HIS A 411 29.499 18.780 15.090 1.00 29.09 H new ATOM 0 HD2 HIS A 411 29.169 21.628 17.732 1.00 29.05 H new ATOM 0 HE1 HIS A 411 30.337 17.892 17.116 1.00 30.19 H new ATOM 1557 N LEU A 412 26.043 22.707 16.286 1.00 27.38 N ATOM 1558 CA LEU A 412 25.329 22.998 17.505 1.00 30.75 C ATOM 1559 C LEU A 412 23.924 22.433 17.443 1.00 36.65 C ATOM 1560 O LEU A 412 23.402 22.014 18.472 1.00 36.74 O ATOM 1561 CB LEU A 412 25.257 24.483 17.765 1.00 29.72 C ATOM 1562 CG LEU A 412 26.621 25.132 17.812 1.00 30.41 C ATOM 1563 CD1 LEU A 412 26.422 26.625 17.643 1.00 32.94 C ATOM 1564 CD2 LEU A 412 27.270 24.752 19.154 1.00 31.46 C ATOM 0 H LEU A 412 26.283 23.381 15.809 1.00 27.38 H new ATOM 0 HA LEU A 412 25.818 22.581 18.232 1.00 30.75 H new ATOM 0 HB2 LEU A 412 24.726 24.904 17.071 1.00 29.72 H new ATOM 0 HB3 LEU A 412 24.799 24.639 18.606 1.00 29.72 H new ATOM 0 HG LEU A 412 27.214 24.833 17.105 1.00 30.41 H new ATOM 0 HD11 LEU A 412 27.283 27.071 17.669 1.00 32.94 H new ATOM 0 HD12 LEU A 412 25.993 26.800 16.791 1.00 32.94 H new ATOM 0 HD13 LEU A 412 25.863 26.960 18.361 1.00 32.94 H new ATOM 0 HD21 LEU A 412 28.150 25.155 19.214 1.00 31.46 H new ATOM 0 HD22 LEU A 412 26.717 25.073 19.883 1.00 31.46 H new ATOM 0 HD23 LEU A 412 27.352 23.787 19.212 1.00 31.46 H new ATOM 1565 N GLN A 413 23.317 22.411 16.248 1.00 40.03 N ATOM 1566 CA GLN A 413 21.952 21.883 16.127 1.00 45.70 C ATOM 1567 C GLN A 413 21.901 20.407 16.500 1.00 47.23 C ATOM 1568 O GLN A 413 21.016 19.970 17.243 1.00 48.24 O ATOM 1569 CB GLN A 413 21.350 22.124 14.732 1.00 47.38 C ATOM 1570 CG GLN A 413 20.283 23.258 14.684 1.00 51.77 C ATOM 1571 CD GLN A 413 20.315 24.111 13.385 1.00 54.10 C ATOM 1572 OE1 GLN A 413 20.311 25.379 13.437 1.00 53.04 O ATOM 1573 NE2 GLN A 413 20.333 23.426 12.226 1.00 53.35 N ATOM 0 H GLN A 413 23.668 22.689 15.514 1.00 40.03 H new ATOM 0 HA GLN A 413 21.403 22.375 16.757 1.00 45.70 H new ATOM 0 HB2 GLN A 413 22.066 22.341 14.115 1.00 47.38 H new ATOM 0 HB3 GLN A 413 20.946 21.300 14.419 1.00 47.38 H new ATOM 0 HG2 GLN A 413 19.402 22.863 14.778 1.00 51.77 H new ATOM 0 HG3 GLN A 413 20.414 23.843 15.446 1.00 51.77 H new ATOM 0 HE21 GLN A 413 20.335 22.566 12.235 1.00 53.35 H new ATOM 0 HE22 GLN A 413 20.342 23.848 11.477 1.00 53.35 H new ATOM 1574 N SER A 414 22.858 19.635 16.012 1.00 47.48 N ATOM 1575 CA SER A 414 22.836 18.203 16.284 1.00 46.51 C ATOM 1576 C SER A 414 23.490 17.811 17.607 1.00 45.03 C ATOM 1577 O SER A 414 23.163 16.748 18.136 1.00 41.07 O ATOM 1578 CB SER A 414 23.459 17.392 15.131 1.00 48.39 C ATOM 1579 OG SER A 414 24.835 17.675 14.999 1.00 50.77 O ATOM 0 H SER A 414 23.516 19.909 15.531 1.00 47.48 H new ATOM 0 HA SER A 414 21.895 17.982 16.360 1.00 46.51 H new ATOM 0 HB2 SER A 414 23.335 16.444 15.294 1.00 48.39 H new ATOM 0 HB3 SER A 414 23.002 17.600 14.301 1.00 48.39 H new ATOM 0 HG SER A 414 25.155 17.223 14.368 1.00 50.77 H new ATOM 1580 N ASN A 415 24.404 18.647 18.131 1.00 40.92 N ATOM 1581 CA ASN A 415 25.053 18.345 19.420 1.00 37.96 C ATOM 1582 C ASN A 415 24.177 18.824 20.577 1.00 36.61 C ATOM 1583 O ASN A 415 24.144 18.214 21.629 1.00 34.07 O ATOM 1584 CB ASN A 415 26.490 18.944 19.488 1.00 39.71 C ATOM 1585 CG ASN A 415 27.392 18.278 20.567 1.00 40.57 C ATOM 1586 OD1 ASN A 415 27.268 17.082 20.891 1.00 39.70 O ATOM 1587 ND2 ASN A 415 28.322 19.065 21.106 1.00 39.05 N ATOM 0 H ASN A 415 24.658 19.381 17.763 1.00 40.92 H new ATOM 0 HA ASN A 415 25.150 17.383 19.498 1.00 37.96 H new ATOM 0 HB2 ASN A 415 26.913 18.849 18.620 1.00 39.71 H new ATOM 0 HB3 ASN A 415 26.428 19.895 19.671 1.00 39.71 H new ATOM 0 HD21 ASN A 415 28.861 18.751 21.698 1.00 39.05 H new ATOM 0 HD22 ASN A 415 28.383 19.887 20.862 1.00 39.05 H new ATOM 1588 N HIS A 416 23.456 19.925 20.378 1.00 37.75 N ATOM 1589 CA HIS A 416 22.587 20.450 21.413 1.00 39.00 C ATOM 1590 C HIS A 416 21.180 20.714 20.843 1.00 42.60 C ATOM 1591 O HIS A 416 20.818 21.859 20.594 1.00 39.77 O ATOM 1592 CB HIS A 416 23.156 21.760 21.969 1.00 39.97 C ATOM 1593 CG HIS A 416 24.606 21.702 22.347 1.00 38.56 C ATOM 1594 ND1 HIS A 416 25.029 21.668 23.661 1.00 39.16 N ATOM 1595 CD2 HIS A 416 25.731 21.703 21.585 1.00 36.75 C ATOM 1596 CE1 HIS A 416 26.353 21.648 23.692 1.00 40.04 C ATOM 1597 NE2 HIS A 416 26.803 21.675 22.445 1.00 36.94 N ATOM 0 H HIS A 416 23.459 20.380 19.648 1.00 37.75 H new ATOM 0 HA HIS A 416 22.530 19.794 22.125 1.00 39.00 H new ATOM 0 HB2 HIS A 416 23.035 22.458 21.307 1.00 39.97 H new ATOM 0 HB3 HIS A 416 22.641 22.017 22.750 1.00 39.97 H new ATOM 0 HD2 HIS A 416 25.769 21.720 20.656 1.00 36.75 H new ATOM 0 HE1 HIS A 416 26.878 21.620 24.459 1.00 40.04 H new ATOM 0 HE2 HIS A 416 27.631 21.675 22.212 1.00 36.94 H new ATOM 1598 N PRO A 417 20.371 19.677 20.640 1.00 46.43 N ATOM 1599 CA PRO A 417 19.111 19.848 19.881 1.00 48.31 C ATOM 1600 C PRO A 417 18.061 20.681 20.601 1.00 50.11 C ATOM 1601 O PRO A 417 17.216 21.282 19.949 1.00 52.24 O ATOM 1602 CB PRO A 417 18.615 18.419 19.675 1.00 47.41 C ATOM 1603 CG PRO A 417 19.745 17.553 20.073 1.00 48.71 C ATOM 1604 CD PRO A 417 20.573 18.295 21.097 1.00 46.66 C ATOM 0 HA PRO A 417 19.270 20.336 19.058 1.00 48.31 H new ATOM 0 HB2 PRO A 417 17.829 18.240 20.215 1.00 47.41 H new ATOM 0 HB3 PRO A 417 18.365 18.265 18.751 1.00 47.41 H new ATOM 0 HG2 PRO A 417 19.417 16.719 20.444 1.00 48.71 H new ATOM 0 HG3 PRO A 417 20.286 17.327 19.300 1.00 48.71 H new ATOM 0 HD2 PRO A 417 20.255 18.154 22.003 1.00 46.66 H new ATOM 0 HD3 PRO A 417 21.506 18.032 21.080 1.00 46.66 H new ATOM 1605 N ASP A 418 18.138 20.747 21.923 1.00 51.41 N ATOM 1606 CA ASP A 418 17.135 21.475 22.690 1.00 53.53 C ATOM 1607 C ASP A 418 17.486 22.937 23.071 1.00 52.63 C ATOM 1608 O ASP A 418 16.629 23.663 23.619 1.00 50.96 O ATOM 1609 CB ASP A 418 16.734 20.638 23.920 1.00 57.31 C ATOM 1610 CG ASP A 418 16.119 19.278 23.527 1.00 59.65 C ATOM 1611 OD1 ASP A 418 16.535 18.247 24.107 1.00 62.05 O ATOM 1612 OD2 ASP A 418 15.232 19.146 22.639 1.00 59.18 O ATOM 0 H ASP A 418 18.758 20.381 22.393 1.00 51.41 H new ATOM 0 HA ASP A 418 16.380 21.591 22.092 1.00 53.53 H new ATOM 0 HB2 ASP A 418 17.515 20.489 24.476 1.00 57.31 H new ATOM 0 HB3 ASP A 418 16.096 21.137 24.454 1.00 57.31 H new ATOM 1613 N ASP A 419 18.717 23.375 22.777 1.00 48.49 N ATOM 1614 CA ASP A 419 19.083 24.785 23.003 1.00 47.18 C ATOM 1615 C ASP A 419 18.946 25.531 21.695 1.00 44.73 C ATOM 1616 O ASP A 419 19.906 25.615 20.900 1.00 41.09 O ATOM 1617 CB ASP A 419 20.492 24.957 23.568 1.00 49.49 C ATOM 1618 CG ASP A 419 20.685 26.309 24.237 1.00 51.65 C ATOM 1619 OD1 ASP A 419 19.883 27.240 23.969 1.00 53.34 O ATOM 1620 OD2 ASP A 419 21.607 26.543 25.055 1.00 54.96 O ATOM 0 H ASP A 419 19.345 22.885 22.452 1.00 48.49 H new ATOM 0 HA ASP A 419 18.481 25.147 23.672 1.00 47.18 H new ATOM 0 HB2 ASP A 419 20.669 24.252 24.211 1.00 49.49 H new ATOM 0 HB3 ASP A 419 21.139 24.857 22.853 1.00 49.49 H new ATOM 1621 N ILE A 420 17.737 26.071 21.492 1.00 43.18 N ATOM 1622 CA ILE A 420 17.300 26.616 20.210 1.00 40.48 C ATOM 1623 C ILE A 420 18.124 27.825 19.837 1.00 36.18 C ATOM 1624 O ILE A 420 18.390 28.030 18.684 1.00 37.65 O ATOM 1625 CB ILE A 420 15.758 27.015 20.244 1.00 43.70 C ATOM 1626 CG1 ILE A 420 14.857 25.822 20.595 1.00 44.49 C ATOM 1627 CG2 ILE A 420 15.319 27.653 18.894 1.00 43.70 C ATOM 1628 CD1 ILE A 420 15.099 24.581 19.736 1.00 43.02 C ATOM 0 H ILE A 420 17.141 26.129 22.110 1.00 43.18 H new ATOM 0 HA ILE A 420 17.426 25.923 19.543 1.00 40.48 H new ATOM 0 HB ILE A 420 15.652 27.674 20.948 1.00 43.70 H new ATOM 0 HG12 ILE A 420 14.993 25.590 21.527 1.00 44.49 H new ATOM 0 HG13 ILE A 420 13.930 26.091 20.502 1.00 44.49 H new ATOM 0 HG21 ILE A 420 14.379 27.888 18.937 1.00 43.70 H new ATOM 0 HG22 ILE A 420 15.844 28.452 18.728 1.00 43.70 H new ATOM 0 HG23 ILE A 420 15.461 27.018 18.175 1.00 43.70 H new ATOM 0 HD11 ILE A 420 14.497 23.873 20.014 1.00 43.02 H new ATOM 0 HD12 ILE A 420 14.937 24.796 18.804 1.00 43.02 H new ATOM 0 HD13 ILE A 420 16.017 24.286 19.844 1.00 43.02 H new ATOM 1629 N PHE A 421 18.508 28.627 20.829 1.00 34.08 N ATOM 1630 CA PHE A 421 19.241 29.857 20.592 1.00 35.91 C ATOM 1631 C PHE A 421 20.781 29.784 20.850 1.00 37.57 C ATOM 1632 O PHE A 421 21.445 30.830 20.930 1.00 38.38 O ATOM 1633 CB PHE A 421 18.618 30.983 21.429 1.00 36.45 C ATOM 1634 CG PHE A 421 17.271 31.447 20.911 1.00 38.14 C ATOM 1635 CD1 PHE A 421 17.153 32.021 19.666 1.00 38.57 C ATOM 1636 CD2 PHE A 421 16.132 31.271 21.664 1.00 38.59 C ATOM 1637 CE1 PHE A 421 15.912 32.438 19.191 1.00 41.98 C ATOM 1638 CE2 PHE A 421 14.904 31.671 21.189 1.00 38.78 C ATOM 1639 CZ PHE A 421 14.788 32.252 19.970 1.00 39.68 C ATOM 0 H PHE A 421 18.348 28.468 21.659 1.00 34.08 H new ATOM 0 HA PHE A 421 19.160 30.032 19.641 1.00 35.91 H new ATOM 0 HB2 PHE A 421 18.517 30.678 22.344 1.00 36.45 H new ATOM 0 HB3 PHE A 421 19.227 31.738 21.447 1.00 36.45 H new ATOM 0 HD1 PHE A 421 17.909 32.132 19.136 1.00 38.57 H new ATOM 0 HD2 PHE A 421 16.193 30.877 22.504 1.00 38.59 H new ATOM 0 HE1 PHE A 421 15.841 32.839 18.355 1.00 41.98 H new ATOM 0 HE2 PHE A 421 14.145 31.541 21.710 1.00 38.78 H new ATOM 0 HZ PHE A 421 13.955 32.524 19.660 1.00 39.68 H new ATOM 1640 N LEU A 422 21.344 28.580 20.981 1.00 33.21 N ATOM 1641 CA LEU A 422 22.768 28.489 21.289 1.00 32.05 C ATOM 1642 C LEU A 422 23.566 29.193 20.205 1.00 30.06 C ATOM 1643 O LEU A 422 24.402 30.015 20.512 1.00 28.60 O ATOM 1644 CB LEU A 422 23.230 27.031 21.482 1.00 34.16 C ATOM 1645 CG LEU A 422 24.668 26.751 21.948 1.00 31.25 C ATOM 1646 CD1 LEU A 422 24.952 27.514 23.218 1.00 31.58 C ATOM 1647 CD2 LEU A 422 24.799 25.237 22.145 1.00 30.60 C ATOM 0 H LEU A 422 20.933 27.829 20.898 1.00 33.21 H new ATOM 0 HA LEU A 422 22.927 28.934 22.136 1.00 32.05 H new ATOM 0 HB2 LEU A 422 22.631 26.618 22.123 1.00 34.16 H new ATOM 0 HB3 LEU A 422 23.103 26.571 20.638 1.00 34.16 H new ATOM 0 HG LEU A 422 25.319 27.046 21.292 1.00 31.25 H new ATOM 0 HD11 LEU A 422 25.860 27.334 23.508 1.00 31.58 H new ATOM 0 HD12 LEU A 422 24.847 28.464 23.055 1.00 31.58 H new ATOM 0 HD13 LEU A 422 24.331 27.235 23.909 1.00 31.58 H new ATOM 0 HD21 LEU A 422 25.698 25.026 22.440 1.00 30.60 H new ATOM 0 HD22 LEU A 422 24.162 24.941 22.814 1.00 30.60 H new ATOM 0 HD23 LEU A 422 24.620 24.785 21.306 1.00 30.60 H new ATOM 1648 N PHE A 423 23.293 28.902 18.942 1.00 29.72 N ATOM 1649 CA PHE A 423 24.011 29.586 17.872 1.00 30.59 C ATOM 1650 C PHE A 423 24.108 31.122 18.061 1.00 34.62 C ATOM 1651 O PHE A 423 25.210 31.626 18.274 1.00 33.62 O ATOM 1652 CB PHE A 423 23.467 29.210 16.482 1.00 32.60 C ATOM 1653 CG PHE A 423 24.229 29.855 15.344 1.00 38.05 C ATOM 1654 CD1 PHE A 423 25.601 29.622 15.184 1.00 39.75 C ATOM 1655 CD2 PHE A 423 23.594 30.707 14.451 1.00 37.03 C ATOM 1656 CE1 PHE A 423 26.311 30.215 14.161 1.00 39.75 C ATOM 1657 CE2 PHE A 423 24.284 31.297 13.432 1.00 39.16 C ATOM 1658 CZ PHE A 423 25.653 31.056 13.273 1.00 40.67 C ATOM 0 H PHE A 423 22.710 28.325 18.684 1.00 29.72 H new ATOM 0 HA PHE A 423 24.924 29.263 17.928 1.00 30.59 H new ATOM 0 HB2 PHE A 423 23.500 28.246 16.379 1.00 32.60 H new ATOM 0 HB3 PHE A 423 22.534 29.470 16.426 1.00 32.60 H new ATOM 0 HD1 PHE A 423 26.041 29.058 15.778 1.00 39.75 H new ATOM 0 HD2 PHE A 423 22.685 30.878 14.548 1.00 37.03 H new ATOM 0 HE1 PHE A 423 27.222 30.053 14.067 1.00 39.75 H new ATOM 0 HE2 PHE A 423 23.842 31.862 12.840 1.00 39.16 H new ATOM 0 HZ PHE A 423 26.120 31.457 12.576 1.00 40.67 H new ATOM 1659 N PRO A 424 22.987 31.868 17.966 1.00 34.23 N ATOM 1660 CA PRO A 424 22.995 33.315 18.221 1.00 33.15 C ATOM 1661 C PRO A 424 23.645 33.676 19.532 1.00 33.78 C ATOM 1662 O PRO A 424 24.283 34.736 19.609 1.00 33.64 O ATOM 1663 CB PRO A 424 21.497 33.679 18.341 1.00 32.50 C ATOM 1664 CG PRO A 424 20.820 32.676 17.487 1.00 33.30 C ATOM 1665 CD PRO A 424 21.656 31.391 17.565 1.00 32.69 C ATOM 0 HA PRO A 424 23.485 33.775 17.522 1.00 33.15 H new ATOM 0 HB2 PRO A 424 21.191 33.629 19.260 1.00 32.50 H new ATOM 0 HB3 PRO A 424 21.325 34.583 18.034 1.00 32.50 H new ATOM 0 HG2 PRO A 424 19.914 32.517 17.796 1.00 33.30 H new ATOM 0 HG3 PRO A 424 20.757 32.990 16.571 1.00 33.30 H new ATOM 0 HD2 PRO A 424 21.291 30.767 18.212 1.00 32.69 H new ATOM 0 HD3 PRO A 424 21.684 30.931 16.711 1.00 32.69 H new ATOM 1666 N LYS A 425 23.453 32.852 20.559 1.00 33.10 N ATOM 1667 CA LYS A 425 24.069 33.120 21.855 1.00 36.47 C ATOM 1668 C LYS A 425 25.620 33.149 21.746 1.00 35.34 C ATOM 1669 O LYS A 425 26.264 34.080 22.193 1.00 35.04 O ATOM 1670 CB LYS A 425 23.609 32.086 22.866 1.00 38.01 C ATOM 1671 CG LYS A 425 22.243 32.396 23.456 1.00 43.03 C ATOM 1672 CD LYS A 425 22.108 31.665 24.781 1.00 45.49 C ATOM 1673 CE LYS A 425 20.712 31.122 25.024 1.00 46.44 C ATOM 1674 NZ LYS A 425 20.811 29.787 25.676 1.00 48.97 N ATOM 0 H LYS A 425 22.974 32.139 20.527 1.00 33.10 H new ATOM 0 HA LYS A 425 23.787 33.997 22.157 1.00 36.47 H new ATOM 0 HB2 LYS A 425 23.581 31.215 22.440 1.00 38.01 H new ATOM 0 HB3 LYS A 425 24.260 32.031 23.583 1.00 38.01 H new ATOM 0 HG2 LYS A 425 22.142 33.352 23.587 1.00 43.03 H new ATOM 0 HG3 LYS A 425 21.542 32.118 22.846 1.00 43.03 H new ATOM 0 HD2 LYS A 425 22.743 30.932 24.805 1.00 45.49 H new ATOM 0 HD3 LYS A 425 22.344 32.269 25.502 1.00 45.49 H new ATOM 0 HE2 LYS A 425 20.210 31.732 25.587 1.00 46.44 H new ATOM 0 HE3 LYS A 425 20.231 31.049 24.185 1.00 46.44 H new ATOM 0 HZ1 LYS A 425 20.138 29.686 26.250 1.00 48.97 H new ATOM 0 HZ2 LYS A 425 20.769 29.150 25.056 1.00 48.97 H new ATOM 0 HZ3 LYS A 425 21.584 29.726 26.112 1.00 48.97 H new ATOM 1675 N LEU A 426 26.185 32.126 21.129 1.00 34.36 N ATOM 1676 CA LEU A 426 27.603 32.101 20.757 1.00 34.49 C ATOM 1677 C LEU A 426 28.064 33.279 19.884 1.00 33.82 C ATOM 1678 O LEU A 426 29.120 33.841 20.124 1.00 33.79 O ATOM 1679 CB LEU A 426 27.911 30.809 20.011 1.00 34.24 C ATOM 1680 CG LEU A 426 28.380 29.629 20.846 1.00 37.24 C ATOM 1681 CD1 LEU A 426 28.757 28.489 19.894 1.00 35.70 C ATOM 1682 CD2 LEU A 426 29.551 30.023 21.810 1.00 37.74 C ATOM 0 H LEU A 426 25.757 31.414 20.908 1.00 34.36 H new ATOM 0 HA LEU A 426 28.087 32.168 21.595 1.00 34.49 H new ATOM 0 HB2 LEU A 426 27.113 30.540 19.530 1.00 34.24 H new ATOM 0 HB3 LEU A 426 28.592 30.999 19.347 1.00 34.24 H new ATOM 0 HG LEU A 426 27.663 29.332 21.428 1.00 37.24 H new ATOM 0 HD11 LEU A 426 29.060 27.724 20.408 1.00 35.70 H new ATOM 0 HD12 LEU A 426 27.982 28.238 19.367 1.00 35.70 H new ATOM 0 HD13 LEU A 426 29.468 28.782 19.303 1.00 35.70 H new ATOM 0 HD21 LEU A 426 29.822 29.247 22.324 1.00 37.74 H new ATOM 0 HD22 LEU A 426 30.304 30.345 21.290 1.00 37.74 H new ATOM 0 HD23 LEU A 426 29.253 30.722 22.413 1.00 37.74 H new ATOM 1683 N LEU A 427 27.302 33.647 18.860 1.00 34.65 N ATOM 1684 CA LEU A 427 27.659 34.841 18.081 1.00 37.45 C ATOM 1685 C LEU A 427 27.861 36.003 19.064 1.00 36.87 C ATOM 1686 O LEU A 427 28.813 36.803 18.952 1.00 34.22 O ATOM 1687 CB LEU A 427 26.553 35.241 17.089 1.00 38.04 C ATOM 1688 CG LEU A 427 26.524 34.714 15.638 1.00 42.40 C ATOM 1689 CD1 LEU A 427 26.635 33.222 15.562 1.00 44.26 C ATOM 1690 CD2 LEU A 427 25.247 35.182 14.894 1.00 42.02 C ATOM 0 H LEU A 427 26.592 33.236 18.601 1.00 34.65 H new ATOM 0 HA LEU A 427 28.461 34.643 17.573 1.00 37.45 H new ATOM 0 HB2 LEU A 427 25.709 34.989 17.495 1.00 38.04 H new ATOM 0 HB3 LEU A 427 26.563 36.209 17.034 1.00 38.04 H new ATOM 0 HG LEU A 427 27.304 35.091 15.201 1.00 42.40 H new ATOM 0 HD11 LEU A 427 26.612 32.942 14.633 1.00 44.26 H new ATOM 0 HD12 LEU A 427 27.471 32.939 15.964 1.00 44.26 H new ATOM 0 HD13 LEU A 427 25.894 32.817 16.039 1.00 44.26 H new ATOM 0 HD21 LEU A 427 25.256 34.837 13.987 1.00 42.02 H new ATOM 0 HD22 LEU A 427 24.462 34.851 15.358 1.00 42.02 H new ATOM 0 HD23 LEU A 427 25.223 36.151 14.870 1.00 42.02 H new ATOM 1691 N GLN A 428 26.954 36.102 20.029 1.00 34.98 N ATOM 1692 CA GLN A 428 27.080 37.164 21.011 1.00 38.37 C ATOM 1693 C GLN A 428 28.347 37.002 21.833 1.00 37.13 C ATOM 1694 O GLN A 428 29.020 37.988 22.107 1.00 37.46 O ATOM 1695 CB GLN A 428 25.875 37.224 21.925 1.00 42.63 C ATOM 1696 CG GLN A 428 25.114 38.497 21.712 1.00 50.80 C ATOM 1697 CD GLN A 428 25.851 39.634 22.298 1.00 50.96 C ATOM 1698 OE1 GLN A 428 26.287 40.534 21.603 1.00 53.68 O ATOM 1699 NE2 GLN A 428 26.024 39.588 23.589 1.00 53.52 N ATOM 0 H GLN A 428 26.278 35.580 20.130 1.00 34.98 H new ATOM 0 HA GLN A 428 27.131 37.999 20.521 1.00 38.37 H new ATOM 0 HB2 GLN A 428 25.297 36.464 21.756 1.00 42.63 H new ATOM 0 HB3 GLN A 428 26.161 37.163 22.850 1.00 42.63 H new ATOM 0 HG2 GLN A 428 24.978 38.646 20.763 1.00 50.80 H new ATOM 0 HG3 GLN A 428 24.236 38.429 22.118 1.00 50.80 H new ATOM 0 HE21 GLN A 428 25.699 38.934 24.043 1.00 53.52 H new ATOM 0 HE22 GLN A 428 26.463 40.212 23.987 1.00 53.52 H new ATOM 1700 N LYS A 429 28.675 35.766 22.216 1.00 35.79 N ATOM 1701 CA LYS A 429 29.887 35.547 23.011 1.00 35.88 C ATOM 1702 C LYS A 429 31.103 36.045 22.238 1.00 32.62 C ATOM 1703 O LYS A 429 32.034 36.532 22.856 1.00 33.73 O ATOM 1704 CB LYS A 429 30.060 34.085 23.489 1.00 34.34 C ATOM 1705 CG LYS A 429 28.956 33.601 24.427 1.00 36.27 C ATOM 1706 CD LYS A 429 28.693 34.625 25.526 1.00 35.79 C ATOM 1707 CE LYS A 429 27.746 34.078 26.590 1.00 34.68 C ATOM 1708 NZ LYS A 429 27.467 35.079 27.680 1.00 34.93 N ATOM 0 H LYS A 429 28.223 35.058 22.032 1.00 35.79 H new ATOM 0 HA LYS A 429 29.796 36.063 23.827 1.00 35.88 H new ATOM 0 HB2 LYS A 429 30.091 33.503 22.714 1.00 34.34 H new ATOM 0 HB3 LYS A 429 30.914 34.001 23.940 1.00 34.34 H new ATOM 0 HG2 LYS A 429 28.142 33.445 23.923 1.00 36.27 H new ATOM 0 HG3 LYS A 429 29.211 32.753 24.823 1.00 36.27 H new ATOM 0 HD2 LYS A 429 29.533 34.880 25.939 1.00 35.79 H new ATOM 0 HD3 LYS A 429 28.314 35.428 25.136 1.00 35.79 H new ATOM 0 HE2 LYS A 429 26.910 33.817 26.172 1.00 34.68 H new ATOM 0 HE3 LYS A 429 28.130 33.277 26.980 1.00 34.68 H new ATOM 0 HZ1 LYS A 429 26.913 34.721 28.277 1.00 34.93 H new ATOM 0 HZ2 LYS A 429 28.230 35.303 28.080 1.00 34.93 H new ATOM 0 HZ3 LYS A 429 27.093 35.806 27.327 1.00 34.93 H new ATOM 1709 N MET A 430 31.071 35.964 20.905 1.00 31.07 N ATOM 1710 CA MET A 430 32.165 36.480 20.099 1.00 33.92 C ATOM 1711 C MET A 430 32.420 37.976 20.297 1.00 32.86 C ATOM 1712 O MET A 430 33.581 38.388 20.478 1.00 33.61 O ATOM 1713 CB MET A 430 31.972 36.178 18.605 1.00 39.29 C ATOM 1714 CG MET A 430 32.319 34.748 18.247 1.00 43.74 C ATOM 1715 SD MET A 430 31.991 34.273 16.535 1.00 46.17 S ATOM 1716 CE MET A 430 30.731 33.142 16.761 1.00 45.03 C ATOM 0 H MET A 430 30.426 35.615 20.456 1.00 31.07 H new ATOM 0 HA MET A 430 32.951 36.010 20.418 1.00 33.92 H new ATOM 0 HB2 MET A 430 31.050 36.354 18.360 1.00 39.29 H new ATOM 0 HB3 MET A 430 32.524 36.781 18.083 1.00 39.29 H new ATOM 0 HG2 MET A 430 33.260 34.604 18.431 1.00 43.74 H new ATOM 0 HG3 MET A 430 31.822 34.155 18.832 1.00 43.74 H new ATOM 0 HE1 MET A 430 31.076 32.244 16.636 1.00 45.03 H new ATOM 0 HE2 MET A 430 30.375 33.229 17.659 1.00 45.03 H new ATOM 0 HE3 MET A 430 30.026 33.310 16.116 1.00 45.03 H new ATOM 1717 N ALA A 431 31.363 38.784 20.262 1.00 30.25 N ATOM 1718 CA ALA A 431 31.497 40.238 20.419 1.00 30.61 C ATOM 1719 C ALA A 431 31.868 40.569 21.862 1.00 29.47 C ATOM 1720 O ALA A 431 32.633 41.489 22.137 1.00 31.40 O ATOM 1721 CB ALA A 431 30.171 41.015 19.967 1.00 28.57 C ATOM 0 H ALA A 431 30.555 38.512 20.148 1.00 30.25 H new ATOM 0 HA ALA A 431 32.208 40.541 19.833 1.00 30.61 H new ATOM 0 HB1 ALA A 431 30.299 41.969 20.085 1.00 28.57 H new ATOM 0 HB2 ALA A 431 29.988 40.827 19.033 1.00 28.57 H new ATOM 0 HB3 ALA A 431 29.422 40.720 20.509 1.00 28.57 H new ATOM 1722 N ASP A 432 31.310 39.818 22.790 1.00 28.19 N ATOM 1723 CA ASP A 432 31.697 39.951 24.179 1.00 29.34 C ATOM 1724 C ASP A 432 33.186 39.679 24.399 1.00 28.50 C ATOM 1725 O ASP A 432 33.805 40.322 25.235 1.00 28.45 O ATOM 1726 CB ASP A 432 30.967 38.915 25.016 1.00 32.53 C ATOM 1727 CG ASP A 432 29.483 39.154 25.108 1.00 36.09 C ATOM 1728 OD1 ASP A 432 28.977 40.169 24.600 1.00 37.69 O ATOM 1729 OD2 ASP A 432 28.740 38.365 25.717 1.00 37.22 O ATOM 0 H ASP A 432 30.706 39.225 22.638 1.00 28.19 H new ATOM 0 HA ASP A 432 31.481 40.862 24.432 1.00 29.34 H new ATOM 0 HB2 ASP A 432 31.123 38.036 24.637 1.00 32.53 H new ATOM 0 HB3 ASP A 432 31.342 38.909 25.910 1.00 32.53 H new ATOM 1730 N LEU A 433 33.754 38.693 23.700 1.00 27.33 N ATOM 1731 CA LEU A 433 35.170 38.392 23.924 1.00 28.97 C ATOM 1732 C LEU A 433 35.981 39.528 23.380 1.00 28.31 C ATOM 1733 O LEU A 433 37.045 39.854 23.888 1.00 30.94 O ATOM 1734 CB LEU A 433 35.598 37.086 23.247 1.00 28.03 C ATOM 1735 CG LEU A 433 35.311 35.842 24.052 1.00 26.79 C ATOM 1736 CD1 LEU A 433 35.271 34.618 23.109 1.00 23.26 C ATOM 1737 CD2 LEU A 433 36.328 35.729 25.163 1.00 25.40 C ATOM 0 H LEU A 433 33.356 38.204 23.115 1.00 27.33 H new ATOM 0 HA LEU A 433 35.315 38.281 24.877 1.00 28.97 H new ATOM 0 HB2 LEU A 433 35.147 37.015 22.391 1.00 28.03 H new ATOM 0 HB3 LEU A 433 36.550 37.127 23.063 1.00 28.03 H new ATOM 0 HG LEU A 433 34.440 35.886 24.476 1.00 26.79 H new ATOM 0 HD11 LEU A 433 35.087 33.818 23.625 1.00 23.26 H new ATOM 0 HD12 LEU A 433 34.574 34.743 22.446 1.00 23.26 H new ATOM 0 HD13 LEU A 433 36.127 34.525 22.663 1.00 23.26 H new ATOM 0 HD21 LEU A 433 36.150 34.931 25.685 1.00 25.40 H new ATOM 0 HD22 LEU A 433 37.218 35.674 24.782 1.00 25.40 H new ATOM 0 HD23 LEU A 433 36.270 36.510 25.736 1.00 25.40 H new ATOM 1738 N ARG A 434 35.471 40.131 22.320 1.00 28.54 N ATOM 1739 CA ARG A 434 36.142 41.251 21.704 1.00 31.51 C ATOM 1740 C ARG A 434 36.304 42.377 22.715 1.00 31.54 C ATOM 1741 O ARG A 434 37.400 42.892 22.922 1.00 31.89 O ATOM 1742 CB ARG A 434 35.339 41.739 20.505 1.00 35.14 C ATOM 1743 CG ARG A 434 36.175 41.979 19.305 1.00 41.90 C ATOM 1744 CD ARG A 434 35.645 41.299 18.051 1.00 45.37 C ATOM 1745 NE ARG A 434 35.473 42.329 17.052 1.00 48.56 N ATOM 1746 CZ ARG A 434 35.533 42.158 15.732 1.00 50.23 C ATOM 1747 NH1 ARG A 434 35.751 40.953 15.178 1.00 46.25 N ATOM 1748 NH2 ARG A 434 35.354 43.233 14.969 1.00 50.17 N ATOM 0 H ARG A 434 34.733 39.903 21.942 1.00 28.54 H new ATOM 0 HA ARG A 434 37.020 40.969 21.403 1.00 31.51 H new ATOM 0 HB2 ARG A 434 34.656 41.084 20.291 1.00 35.14 H new ATOM 0 HB3 ARG A 434 34.880 42.560 20.742 1.00 35.14 H new ATOM 0 HG2 ARG A 434 36.234 42.934 19.146 1.00 41.90 H new ATOM 0 HG3 ARG A 434 37.076 41.664 19.479 1.00 41.90 H new ATOM 0 HD2 ARG A 434 36.265 40.620 17.741 1.00 45.37 H new ATOM 0 HD3 ARG A 434 34.803 40.853 18.232 1.00 45.37 H new ATOM 0 HE ARG A 434 35.318 43.126 17.336 1.00 48.56 H new ATOM 0 HH11 ARG A 434 35.857 40.262 15.679 1.00 46.25 H new ATOM 0 HH12 ARG A 434 35.785 40.873 14.322 1.00 46.25 H new ATOM 0 HH21 ARG A 434 35.207 43.998 15.332 1.00 50.17 H new ATOM 0 HH22 ARG A 434 35.386 43.162 14.112 1.00 50.17 H new ATOM 1749 N GLN A 435 35.196 42.748 23.346 1.00 29.62 N ATOM 1750 CA GLN A 435 35.199 43.766 24.361 1.00 31.94 C ATOM 1751 C GLN A 435 36.106 43.330 25.501 1.00 29.68 C ATOM 1752 O GLN A 435 36.874 44.143 26.024 1.00 28.18 O ATOM 1753 CB GLN A 435 33.785 44.023 24.923 1.00 35.09 C ATOM 1754 CG GLN A 435 33.715 45.214 25.909 1.00 44.12 C ATOM 1755 CD GLN A 435 34.365 46.554 25.372 1.00 49.34 C ATOM 1756 OE1 GLN A 435 35.098 47.248 26.114 1.00 52.48 O ATOM 1757 NE2 GLN A 435 34.081 46.905 24.109 1.00 49.07 N ATOM 0 H GLN A 435 34.421 42.409 23.190 1.00 29.62 H new ATOM 0 HA GLN A 435 35.518 44.588 23.956 1.00 31.94 H new ATOM 0 HB2 GLN A 435 33.177 44.188 24.185 1.00 35.09 H new ATOM 0 HB3 GLN A 435 33.474 43.222 25.373 1.00 35.09 H new ATOM 0 HG2 GLN A 435 32.785 45.384 26.127 1.00 44.12 H new ATOM 0 HG3 GLN A 435 34.158 44.962 26.734 1.00 44.12 H new ATOM 0 HE21 GLN A 435 33.574 46.405 23.627 1.00 49.07 H new ATOM 0 HE22 GLN A 435 34.406 47.630 23.781 1.00 49.07 H new ATOM 1758 N LEU A 436 35.981 42.071 25.906 1.00 25.92 N ATOM 1759 CA LEU A 436 36.813 41.535 26.996 1.00 27.21 C ATOM 1760 C LEU A 436 38.343 41.771 26.716 1.00 25.33 C ATOM 1761 O LEU A 436 39.092 42.183 27.597 1.00 23.03 O ATOM 1762 CB LEU A 436 36.508 40.043 27.224 1.00 24.18 C ATOM 1763 CG LEU A 436 37.151 39.382 28.468 1.00 26.68 C ATOM 1764 CD1 LEU A 436 36.463 39.871 29.771 1.00 26.46 C ATOM 1765 CD2 LEU A 436 37.107 37.830 28.400 1.00 24.77 C ATOM 0 H LEU A 436 35.425 41.508 25.569 1.00 25.92 H new ATOM 0 HA LEU A 436 36.592 42.015 27.809 1.00 27.21 H new ATOM 0 HB2 LEU A 436 35.546 39.937 27.289 1.00 24.18 H new ATOM 0 HB3 LEU A 436 36.795 39.552 26.438 1.00 24.18 H new ATOM 0 HG LEU A 436 38.083 39.652 28.476 1.00 26.68 H new ATOM 0 HD11 LEU A 436 36.880 39.446 30.537 1.00 26.46 H new ATOM 0 HD12 LEU A 436 36.557 40.834 29.845 1.00 26.46 H new ATOM 0 HD13 LEU A 436 35.521 39.640 29.746 1.00 26.46 H new ATOM 0 HD21 LEU A 436 37.519 37.459 29.196 1.00 24.77 H new ATOM 0 HD22 LEU A 436 36.185 37.534 28.346 1.00 24.77 H new ATOM 0 HD23 LEU A 436 37.590 37.526 27.615 1.00 24.77 H new ATOM 1766 N VAL A 437 38.783 41.480 25.494 1.00 25.26 N ATOM 1767 CA VAL A 437 40.181 41.662 25.111 1.00 25.38 C ATOM 1768 C VAL A 437 40.584 43.152 25.110 1.00 26.85 C ATOM 1769 O VAL A 437 41.657 43.513 25.596 1.00 26.37 O ATOM 1770 CB VAL A 437 40.490 41.004 23.746 1.00 24.44 C ATOM 1771 CG1 VAL A 437 41.920 41.366 23.211 1.00 22.01 C ATOM 1772 CG2 VAL A 437 40.349 39.525 23.884 1.00 23.99 C ATOM 0 H VAL A 437 38.282 41.173 24.866 1.00 25.26 H new ATOM 0 HA VAL A 437 40.718 41.213 25.783 1.00 25.38 H new ATOM 0 HB VAL A 437 39.857 41.347 23.096 1.00 24.44 H new ATOM 0 HG11 VAL A 437 42.066 40.931 22.356 1.00 22.01 H new ATOM 0 HG12 VAL A 437 41.991 42.327 23.101 1.00 22.01 H new ATOM 0 HG13 VAL A 437 42.589 41.064 23.845 1.00 22.01 H new ATOM 0 HG21 VAL A 437 40.541 39.101 23.033 1.00 23.99 H new ATOM 0 HG22 VAL A 437 40.972 39.201 24.554 1.00 23.99 H new ATOM 0 HG23 VAL A 437 39.443 39.310 24.155 1.00 23.99 H new ATOM 1773 N THR A 438 39.724 44.008 24.569 1.00 28.94 N ATOM 1774 CA THR A 438 39.951 45.448 24.563 1.00 29.39 C ATOM 1775 C THR A 438 40.167 45.990 25.988 1.00 29.04 C ATOM 1776 O THR A 438 41.114 46.750 26.259 1.00 26.24 O ATOM 1777 CB THR A 438 38.749 46.162 23.918 1.00 31.84 C ATOM 1778 OG1 THR A 438 38.764 45.920 22.515 1.00 32.86 O ATOM 1779 CG2 THR A 438 38.913 47.689 24.010 1.00 32.34 C ATOM 0 H THR A 438 38.989 43.768 24.193 1.00 28.94 H new ATOM 0 HA THR A 438 40.754 45.622 24.048 1.00 29.39 H new ATOM 0 HB THR A 438 37.951 45.843 24.368 1.00 31.84 H new ATOM 0 HG1 THR A 438 38.109 46.306 22.157 1.00 32.86 H new ATOM 0 HG21 THR A 438 38.148 48.122 23.600 1.00 32.34 H new ATOM 0 HG22 THR A 438 38.972 47.953 24.942 1.00 32.34 H new ATOM 0 HG23 THR A 438 39.722 47.956 23.547 1.00 32.34 H new ATOM 1780 N GLU A 439 39.303 45.591 26.898 1.00 25.20 N ATOM 1781 CA GLU A 439 39.485 45.973 28.289 1.00 27.70 C ATOM 1782 C GLU A 439 40.787 45.411 28.913 1.00 27.24 C ATOM 1783 O GLU A 439 41.502 46.105 29.621 1.00 25.68 O ATOM 1784 CB GLU A 439 38.278 45.500 29.045 1.00 31.14 C ATOM 1785 CG GLU A 439 37.022 46.239 28.606 1.00 38.86 C ATOM 1786 CD GLU A 439 35.738 45.573 29.065 1.00 45.96 C ATOM 1787 OE1 GLU A 439 35.798 44.460 29.660 1.00 49.40 O ATOM 1788 OE2 GLU A 439 34.657 46.170 28.822 1.00 51.81 O ATOM 0 H GLU A 439 38.612 45.105 26.739 1.00 25.20 H new ATOM 0 HA GLU A 439 39.576 46.937 28.340 1.00 27.70 H new ATOM 0 HB2 GLU A 439 38.160 44.547 28.906 1.00 31.14 H new ATOM 0 HB3 GLU A 439 38.417 45.632 29.996 1.00 31.14 H new ATOM 0 HG2 GLU A 439 37.050 47.145 28.952 1.00 38.86 H new ATOM 0 HG3 GLU A 439 37.016 46.305 27.638 1.00 38.86 H new ATOM 1789 N HIS A 440 41.090 44.145 28.615 1.00 30.57 N ATOM 1790 CA HIS A 440 42.302 43.482 29.099 1.00 28.58 C ATOM 1791 C HIS A 440 43.530 44.211 28.548 1.00 28.82 C ATOM 1792 O HIS A 440 44.447 44.569 29.307 1.00 28.41 O ATOM 1793 CB HIS A 440 42.334 41.998 28.714 1.00 24.64 C ATOM 1794 CG HIS A 440 43.585 41.300 29.154 1.00 24.59 C ATOM 1795 ND1 HIS A 440 43.752 40.822 30.436 1.00 24.38 N ATOM 1796 CD2 HIS A 440 44.746 41.042 28.499 1.00 23.58 C ATOM 1797 CE1 HIS A 440 44.954 40.277 30.549 1.00 26.41 C ATOM 1798 NE2 HIS A 440 45.583 40.405 29.389 1.00 26.54 N ATOM 0 H HIS A 440 40.594 43.644 28.123 1.00 30.57 H new ATOM 0 HA HIS A 440 42.307 43.522 30.068 1.00 28.58 H new ATOM 0 HB2 HIS A 440 41.567 41.552 29.106 1.00 24.64 H new ATOM 0 HB3 HIS A 440 42.248 41.918 27.751 1.00 24.64 H new ATOM 0 HD2 HIS A 440 44.940 41.255 27.615 1.00 23.58 H new ATOM 0 HE1 HIS A 440 45.298 39.873 31.313 1.00 26.41 H new ATOM 0 HE2 HIS A 440 46.382 40.135 29.220 1.00 26.54 H new ATOM 1799 N ALA A 441 43.535 44.449 27.228 1.00 28.42 N ATOM 1800 CA ALA A 441 44.657 45.102 26.594 1.00 27.36 C ATOM 1801 C ALA A 441 44.903 46.471 27.243 1.00 27.46 C ATOM 1802 O ALA A 441 46.041 46.884 27.459 1.00 25.57 O ATOM 1803 CB ALA A 441 44.419 45.242 25.093 1.00 29.48 C ATOM 0 H ALA A 441 42.895 44.236 26.695 1.00 28.42 H new ATOM 0 HA ALA A 441 45.449 44.557 26.719 1.00 27.36 H new ATOM 0 HB1 ALA A 441 45.181 45.682 24.684 1.00 29.48 H new ATOM 0 HB2 ALA A 441 44.304 44.363 24.700 1.00 29.48 H new ATOM 0 HB3 ALA A 441 43.620 45.771 24.940 1.00 29.48 H new ATOM 1804 N GLN A 442 43.831 47.186 27.555 1.00 29.10 N ATOM 1805 CA GLN A 442 43.965 48.460 28.225 1.00 29.49 C ATOM 1806 C GLN A 442 44.624 48.366 29.609 1.00 29.84 C ATOM 1807 O GLN A 442 45.441 49.202 29.941 1.00 31.50 O ATOM 1808 CB GLN A 442 42.637 49.187 28.257 1.00 31.66 C ATOM 1809 CG GLN A 442 42.575 50.379 29.175 1.00 34.39 C ATOM 1810 CD GLN A 442 41.237 51.120 29.044 1.00 35.93 C ATOM 1811 OE1 GLN A 442 40.903 51.620 27.969 1.00 35.22 O ATOM 1812 NE2 GLN A 442 40.478 51.160 30.122 1.00 36.12 N ATOM 0 H GLN A 442 43.022 46.949 27.387 1.00 29.10 H new ATOM 0 HA GLN A 442 44.584 48.990 27.699 1.00 29.49 H new ATOM 0 HB2 GLN A 442 42.424 49.480 27.357 1.00 31.66 H new ATOM 0 HB3 GLN A 442 41.948 48.558 28.521 1.00 31.66 H new ATOM 0 HG2 GLN A 442 42.697 50.089 30.093 1.00 34.39 H new ATOM 0 HG3 GLN A 442 43.304 50.985 28.970 1.00 34.39 H new ATOM 0 HE21 GLN A 442 40.750 50.798 30.853 1.00 36.12 H new ATOM 0 HE22 GLN A 442 39.711 51.548 30.094 1.00 36.12 H new ATOM 1813 N LEU A 443 44.310 47.343 30.390 1.00 31.49 N ATOM 1814 CA LEU A 443 44.942 47.157 31.703 1.00 31.45 C ATOM 1815 C LEU A 443 46.408 46.766 31.556 1.00 32.10 C ATOM 1816 O LEU A 443 47.271 47.217 32.324 1.00 27.76 O ATOM 1817 CB LEU A 443 44.196 46.106 32.525 1.00 35.02 C ATOM 1818 CG LEU A 443 42.984 46.617 33.326 1.00 38.62 C ATOM 1819 CD1 LEU A 443 42.033 45.490 33.746 1.00 38.49 C ATOM 1820 CD2 LEU A 443 43.485 47.422 34.528 1.00 38.57 C ATOM 0 H LEU A 443 43.733 46.740 30.184 1.00 31.49 H new ATOM 0 HA LEU A 443 44.897 48.005 32.172 1.00 31.45 H new ATOM 0 HB2 LEU A 443 43.894 45.406 31.926 1.00 35.02 H new ATOM 0 HB3 LEU A 443 44.823 45.699 33.144 1.00 35.02 H new ATOM 0 HG LEU A 443 42.457 47.194 32.751 1.00 38.62 H new ATOM 0 HD11 LEU A 443 41.290 45.863 34.245 1.00 38.49 H new ATOM 0 HD12 LEU A 443 41.697 45.038 32.956 1.00 38.49 H new ATOM 0 HD13 LEU A 443 42.510 44.855 34.303 1.00 38.49 H new ATOM 0 HD21 LEU A 443 42.727 47.748 35.038 1.00 38.57 H new ATOM 0 HD22 LEU A 443 44.034 46.855 35.092 1.00 38.57 H new ATOM 0 HD23 LEU A 443 44.012 48.174 34.217 1.00 38.57 H new ATOM 1821 N VAL A 444 46.693 45.952 30.549 1.00 29.90 N ATOM 1822 CA VAL A 444 48.069 45.546 30.296 1.00 30.19 C ATOM 1823 C VAL A 444 48.937 46.733 29.852 1.00 33.05 C ATOM 1824 O VAL A 444 50.184 46.797 30.156 1.00 30.35 O ATOM 1825 CB VAL A 444 48.146 44.391 29.268 1.00 29.60 C ATOM 1826 CG1 VAL A 444 49.581 44.165 28.807 1.00 29.44 C ATOM 1827 CG2 VAL A 444 47.573 43.101 29.893 1.00 30.37 C ATOM 0 H VAL A 444 46.112 45.626 30.005 1.00 29.90 H new ATOM 0 HA VAL A 444 48.424 45.217 31.136 1.00 30.19 H new ATOM 0 HB VAL A 444 47.618 44.632 28.491 1.00 29.60 H new ATOM 0 HG11 VAL A 444 49.604 43.438 28.165 1.00 29.44 H new ATOM 0 HG12 VAL A 444 49.919 44.974 28.392 1.00 29.44 H new ATOM 0 HG13 VAL A 444 50.135 43.939 29.571 1.00 29.44 H new ATOM 0 HG21 VAL A 444 47.622 42.379 29.247 1.00 30.37 H new ATOM 0 HG22 VAL A 444 48.089 42.866 30.680 1.00 30.37 H new ATOM 0 HG23 VAL A 444 46.648 43.247 30.145 1.00 30.37 H new ATOM 1828 N GLN A 445 48.309 47.679 29.148 1.00 29.47 N ATOM 1829 CA GLN A 445 49.028 48.883 28.760 1.00 29.34 C ATOM 1830 C GLN A 445 49.299 49.783 29.977 1.00 28.06 C ATOM 1831 O GLN A 445 50.362 50.374 30.092 1.00 28.76 O ATOM 1832 CB GLN A 445 48.273 49.661 27.689 1.00 30.00 C ATOM 1833 CG GLN A 445 48.826 51.014 27.519 1.00 33.92 C ATOM 1834 CD GLN A 445 50.020 51.070 26.540 1.00 39.95 C ATOM 1835 OE1 GLN A 445 50.550 49.906 26.140 1.00 43.03 O flip ATOM 1836 NE2 GLN A 445 50.433 52.167 26.148 1.00 35.46 N flip ATOM 0 H GLN A 445 47.488 47.641 28.893 1.00 29.47 H new ATOM 0 HA GLN A 445 49.879 48.602 28.388 1.00 29.34 H new ATOM 0 HB2 GLN A 445 48.319 49.183 26.846 1.00 30.00 H new ATOM 0 HB3 GLN A 445 47.335 49.721 27.931 1.00 30.00 H new ATOM 0 HG2 GLN A 445 48.126 51.604 27.199 1.00 33.92 H new ATOM 0 HG3 GLN A 445 49.109 51.352 28.383 1.00 33.92 H new ATOM 0 HE21 GLN A 445 50.064 52.891 26.430 1.00 35.46 H new ATOM 0 HE22 GLN A 445 51.089 52.206 25.593 1.00 35.46 H new ATOM 1837 N ILE A 446 48.334 49.869 30.880 1.00 28.72 N ATOM 1838 CA ILE A 446 48.495 50.627 32.112 1.00 30.58 C ATOM 1839 C ILE A 446 49.657 49.996 32.917 1.00 32.36 C ATOM 1840 O ILE A 446 50.576 50.686 33.392 1.00 33.73 O ATOM 1841 CB ILE A 446 47.151 50.663 32.916 1.00 28.32 C ATOM 1842 CG1 ILE A 446 46.119 51.570 32.239 1.00 28.28 C ATOM 1843 CG2 ILE A 446 47.381 51.120 34.405 1.00 30.89 C ATOM 1844 CD1 ILE A 446 44.617 51.193 32.518 1.00 28.18 C ATOM 0 H ILE A 446 47.567 49.490 30.797 1.00 28.72 H new ATOM 0 HA ILE A 446 48.718 51.552 31.921 1.00 30.58 H new ATOM 0 HB ILE A 446 46.803 49.758 32.926 1.00 28.32 H new ATOM 0 HG12 ILE A 446 46.269 52.483 32.532 1.00 28.28 H new ATOM 0 HG13 ILE A 446 46.271 51.551 31.281 1.00 28.28 H new ATOM 0 HG21 ILE A 446 46.532 51.132 34.875 1.00 30.89 H new ATOM 0 HG22 ILE A 446 47.985 50.501 34.844 1.00 30.89 H new ATOM 0 HG23 ILE A 446 47.768 52.009 34.415 1.00 30.89 H new ATOM 0 HD11 ILE A 446 44.035 51.815 32.054 1.00 28.18 H new ATOM 0 HD12 ILE A 446 44.445 50.292 32.201 1.00 28.18 H new ATOM 0 HD13 ILE A 446 44.443 51.239 33.471 1.00 28.18 H new ATOM 1845 N ILE A 447 49.629 48.682 33.048 1.00 31.63 N ATOM 1846 CA ILE A 447 50.621 47.981 33.833 1.00 30.54 C ATOM 1847 C ILE A 447 51.995 48.223 33.252 1.00 32.40 C ATOM 1848 O ILE A 447 52.970 48.511 33.974 1.00 33.09 O ATOM 1849 CB ILE A 447 50.296 46.491 33.822 1.00 32.77 C ATOM 1850 CG1 ILE A 447 49.068 46.247 34.696 1.00 32.77 C ATOM 1851 CG2 ILE A 447 51.566 45.634 34.207 1.00 29.58 C ATOM 1852 CD1 ILE A 447 48.564 44.821 34.660 1.00 34.30 C ATOM 0 H ILE A 447 49.037 48.174 32.686 1.00 31.63 H new ATOM 0 HA ILE A 447 50.611 48.306 34.747 1.00 30.54 H new ATOM 0 HB ILE A 447 50.065 46.193 32.928 1.00 32.77 H new ATOM 0 HG12 ILE A 447 49.282 46.482 35.612 1.00 32.77 H new ATOM 0 HG13 ILE A 447 48.355 46.840 34.410 1.00 32.77 H new ATOM 0 HG21 ILE A 447 51.337 44.692 34.194 1.00 29.58 H new ATOM 0 HG22 ILE A 447 52.276 45.803 33.568 1.00 29.58 H new ATOM 0 HG23 ILE A 447 51.866 45.881 35.096 1.00 29.58 H new ATOM 0 HD11 ILE A 447 47.787 44.738 35.234 1.00 34.30 H new ATOM 0 HD12 ILE A 447 48.320 44.587 33.751 1.00 34.30 H new ATOM 0 HD13 ILE A 447 49.261 44.223 34.972 1.00 34.30 H new ATOM 1853 N LYS A 448 52.067 48.142 31.933 1.00 30.42 N ATOM 1854 CA LYS A 448 53.317 48.302 31.231 1.00 32.07 C ATOM 1855 C LYS A 448 53.963 49.685 31.373 1.00 34.07 C ATOM 1856 O LYS A 448 55.198 49.819 31.322 1.00 36.82 O ATOM 1857 CB LYS A 448 53.101 47.966 29.763 1.00 31.78 C ATOM 1858 CG LYS A 448 54.290 48.089 28.894 1.00 38.59 C ATOM 1859 CD LYS A 448 53.872 48.539 27.468 1.00 42.29 C ATOM 1860 CE LYS A 448 55.064 49.192 26.726 1.00 46.43 C ATOM 1861 NZ LYS A 448 54.928 49.221 25.206 1.00 47.34 N ATOM 0 H LYS A 448 51.390 47.993 31.424 1.00 30.42 H new ATOM 0 HA LYS A 448 53.946 47.691 31.644 1.00 32.07 H new ATOM 0 HB2 LYS A 448 52.769 47.056 29.702 1.00 31.78 H new ATOM 0 HB3 LYS A 448 52.405 48.545 29.415 1.00 31.78 H new ATOM 0 HG2 LYS A 448 54.910 48.731 29.273 1.00 38.59 H new ATOM 0 HG3 LYS A 448 54.754 47.239 28.848 1.00 38.59 H new ATOM 0 HD2 LYS A 448 53.551 47.775 26.964 1.00 42.29 H new ATOM 0 HD3 LYS A 448 53.137 49.169 27.526 1.00 42.29 H new ATOM 0 HE2 LYS A 448 55.170 50.101 27.047 1.00 46.43 H new ATOM 0 HE3 LYS A 448 55.875 48.713 26.957 1.00 46.43 H new ATOM 0 HZ1 LYS A 448 55.578 49.721 24.859 1.00 47.34 H new ATOM 0 HZ2 LYS A 448 54.989 48.393 24.886 1.00 47.34 H new ATOM 0 HZ3 LYS A 448 54.138 49.567 24.985 1.00 47.34 H new ATOM 1862 N LYS A 449 53.150 50.722 31.529 1.00 33.00 N ATOM 1863 CA LYS A 449 53.694 52.069 31.547 1.00 31.19 C ATOM 1864 C LYS A 449 53.955 52.527 32.974 1.00 31.81 C ATOM 1865 O LYS A 449 54.719 53.502 33.205 1.00 32.51 O ATOM 1866 CB LYS A 449 52.738 53.047 30.859 1.00 28.88 C ATOM 1867 CG LYS A 449 52.502 52.848 29.342 1.00 28.27 C ATOM 1868 CD LYS A 449 53.784 52.583 28.451 1.00 29.88 C ATOM 1869 CE LYS A 449 54.819 53.693 28.427 1.00 28.19 C ATOM 1870 NZ LYS A 449 55.787 53.551 27.275 1.00 26.60 N ATOM 0 H LYS A 449 52.297 50.669 31.624 1.00 33.00 H new ATOM 0 HA LYS A 449 54.535 52.056 31.063 1.00 31.19 H new ATOM 0 HB2 LYS A 449 51.879 52.995 31.307 1.00 28.88 H new ATOM 0 HB3 LYS A 449 53.076 53.946 30.996 1.00 28.88 H new ATOM 0 HG2 LYS A 449 51.893 52.102 29.226 1.00 28.27 H new ATOM 0 HG3 LYS A 449 52.053 53.637 28.999 1.00 28.27 H new ATOM 0 HD2 LYS A 449 54.213 51.772 28.766 1.00 29.88 H new ATOM 0 HD3 LYS A 449 53.494 52.415 27.541 1.00 29.88 H new ATOM 0 HE2 LYS A 449 54.369 54.550 28.365 1.00 28.19 H new ATOM 0 HE3 LYS A 449 55.312 53.691 29.263 1.00 28.19 H new ATOM 0 HZ1 LYS A 449 56.375 54.219 27.297 1.00 26.60 H new ATOM 0 HZ2 LYS A 449 56.217 52.775 27.343 1.00 26.60 H new ATOM 0 HZ3 LYS A 449 55.339 53.576 26.506 1.00 26.60 H new ATOM 1871 N THR A 450 53.311 51.851 33.927 1.00 28.43 N ATOM 1872 CA THR A 450 53.387 52.279 35.320 1.00 32.25 C ATOM 1873 C THR A 450 53.989 51.285 36.324 1.00 34.77 C ATOM 1874 O THR A 450 54.135 51.611 37.491 1.00 36.01 O ATOM 1875 CB THR A 450 52.019 52.780 35.850 1.00 29.99 C ATOM 1876 OG1 THR A 450 51.120 51.677 35.916 1.00 33.37 O ATOM 1877 CG2 THR A 450 51.329 53.812 34.876 1.00 29.81 C ATOM 0 H THR A 450 52.831 51.151 33.788 1.00 28.43 H new ATOM 0 HA THR A 450 54.026 53.007 35.272 1.00 32.25 H new ATOM 0 HB THR A 450 52.194 53.197 36.708 1.00 29.99 H new ATOM 0 HG1 THR A 450 50.968 51.393 35.140 1.00 33.37 H new ATOM 0 HG21 THR A 450 50.480 54.094 35.251 1.00 29.81 H new ATOM 0 HG22 THR A 450 51.904 54.585 34.763 1.00 29.81 H new ATOM 0 HG23 THR A 450 51.178 53.393 34.014 1.00 29.81 H new ATOM 1878 N GLU A 451 54.345 50.088 35.891 1.00 37.69 N ATOM 1879 CA GLU A 451 55.019 49.150 36.802 1.00 41.01 C ATOM 1880 C GLU A 451 56.423 48.891 36.257 1.00 44.18 C ATOM 1881 O GLU A 451 56.586 48.222 35.225 1.00 43.19 O ATOM 1882 CB GLU A 451 54.244 47.832 36.945 1.00 40.47 C ATOM 1883 CG GLU A 451 52.780 47.965 37.364 1.00 43.36 C ATOM 1884 CD GLU A 451 52.597 48.075 38.862 1.00 44.31 C ATOM 1885 OE1 GLU A 451 53.591 47.860 39.599 1.00 47.15 O ATOM 1886 OE2 GLU A 451 51.469 48.374 39.304 1.00 41.41 O ATOM 0 H GLU A 451 54.214 49.795 35.093 1.00 37.69 H new ATOM 0 HA GLU A 451 55.063 49.542 37.688 1.00 41.01 H new ATOM 0 HB2 GLU A 451 54.279 47.362 36.097 1.00 40.47 H new ATOM 0 HB3 GLU A 451 54.700 47.277 37.596 1.00 40.47 H new ATOM 0 HG2 GLU A 451 52.398 48.749 36.939 1.00 43.36 H new ATOM 0 HG3 GLU A 451 52.285 47.196 37.039 1.00 43.36 H new ATOM 1887 N SER A 452 57.443 49.413 36.940 1.00 47.45 N ATOM 1888 CA SER A 452 58.822 49.301 36.426 1.00 50.48 C ATOM 1889 C SER A 452 59.359 47.871 36.383 1.00 49.28 C ATOM 1890 O SER A 452 60.346 47.579 35.681 1.00 49.65 O ATOM 1891 CB SER A 452 59.797 50.250 37.170 1.00 52.85 C ATOM 1892 OG SER A 452 59.727 50.096 38.584 1.00 53.96 O ATOM 0 H SER A 452 57.367 49.829 37.689 1.00 47.45 H new ATOM 0 HA SER A 452 58.769 49.588 35.501 1.00 50.48 H new ATOM 0 HB2 SER A 452 60.704 50.077 36.872 1.00 52.85 H new ATOM 0 HB3 SER A 452 59.592 51.169 36.936 1.00 52.85 H new ATOM 0 HG SER A 452 60.268 50.623 38.951 1.00 53.96 H new ATOM 1893 N ASP A 453 58.697 46.983 37.105 1.00 49.62 N ATOM 1894 CA ASP A 453 59.162 45.600 37.201 1.00 54.20 C ATOM 1895 C ASP A 453 58.394 44.582 36.376 1.00 53.75 C ATOM 1896 O ASP A 453 58.728 43.393 36.399 1.00 54.70 O ATOM 1897 CB ASP A 453 59.128 45.136 38.649 1.00 56.85 C ATOM 1898 CG ASP A 453 60.469 45.237 39.306 1.00 59.83 C ATOM 1899 OD1 ASP A 453 61.460 44.763 38.704 1.00 60.58 O ATOM 1900 OD2 ASP A 453 60.618 45.785 40.416 1.00 62.10 O ATOM 0 H ASP A 453 57.979 47.154 37.547 1.00 49.62 H new ATOM 0 HA ASP A 453 60.060 45.631 36.837 1.00 54.20 H new ATOM 0 HB2 ASP A 453 58.486 45.670 39.143 1.00 56.85 H new ATOM 0 HB3 ASP A 453 58.820 44.217 38.685 1.00 56.85 H new ATOM 1901 N ALA A 454 57.374 45.036 35.663 1.00 52.75 N ATOM 1902 CA ALA A 454 56.573 44.140 34.832 1.00 55.04 C ATOM 1903 C ALA A 454 56.903 44.281 33.339 1.00 57.39 C ATOM 1904 O ALA A 454 56.353 45.156 32.653 1.00 61.07 O ATOM 1905 CB ALA A 454 55.065 44.379 35.093 1.00 53.55 C ATOM 0 H ALA A 454 57.126 45.859 35.644 1.00 52.75 H new ATOM 0 HA ALA A 454 56.796 43.229 35.081 1.00 55.04 H new ATOM 0 HB1 ALA A 454 54.541 43.780 34.538 1.00 53.55 H new ATOM 0 HB2 ALA A 454 54.867 44.209 36.027 1.00 53.55 H new ATOM 0 HB3 ALA A 454 54.841 45.298 34.878 1.00 53.55 H new ATOM 1906 N ALA A 455 57.806 43.452 32.822 1.00 56.30 N ATOM 1907 CA ALA A 455 57.994 43.441 31.370 1.00 57.05 C ATOM 1908 C ALA A 455 56.945 42.539 30.712 1.00 54.25 C ATOM 1909 O ALA A 455 56.427 41.634 31.348 1.00 53.60 O ATOM 1910 CB ALA A 455 59.431 42.983 30.968 1.00 57.52 C ATOM 0 H ALA A 455 58.301 42.910 33.269 1.00 56.30 H new ATOM 0 HA ALA A 455 57.882 44.351 31.053 1.00 57.05 H new ATOM 0 HB1 ALA A 455 59.514 42.989 30.002 1.00 57.52 H new ATOM 0 HB2 ALA A 455 60.083 43.589 31.352 1.00 57.52 H new ATOM 0 HB3 ALA A 455 59.589 42.085 31.300 1.00 57.52 H new ATOM 1911 N LEU A 456 56.646 42.820 29.443 1.00 53.21 N ATOM 1912 CA LEU A 456 55.844 41.956 28.592 1.00 50.09 C ATOM 1913 C LEU A 456 56.791 41.150 27.711 1.00 48.64 C ATOM 1914 O LEU A 456 57.737 41.701 27.154 1.00 48.65 O ATOM 1915 CB LEU A 456 54.956 42.777 27.672 1.00 50.04 C ATOM 1916 CG LEU A 456 53.652 43.413 28.145 1.00 49.41 C ATOM 1917 CD1 LEU A 456 53.007 44.013 26.917 1.00 48.66 C ATOM 1918 CD2 LEU A 456 52.730 42.428 28.846 1.00 49.40 C ATOM 0 H LEU A 456 56.912 43.536 29.048 1.00 53.21 H new ATOM 0 HA LEU A 456 55.292 41.388 29.153 1.00 50.09 H new ATOM 0 HB2 LEU A 456 55.506 43.497 27.325 1.00 50.04 H new ATOM 0 HB3 LEU A 456 54.730 42.205 26.922 1.00 50.04 H new ATOM 0 HG LEU A 456 53.833 44.090 28.816 1.00 49.41 H new ATOM 0 HD11 LEU A 456 52.168 44.433 27.164 1.00 48.66 H new ATOM 0 HD12 LEU A 456 53.600 44.677 26.532 1.00 48.66 H new ATOM 0 HD13 LEU A 456 52.838 43.314 26.266 1.00 48.66 H new ATOM 0 HD21 LEU A 456 51.920 42.884 29.124 1.00 49.40 H new ATOM 0 HD22 LEU A 456 52.502 41.708 28.237 1.00 49.40 H new ATOM 0 HD23 LEU A 456 53.178 42.063 29.625 1.00 49.40 H new ATOM 1919 N HIS A 457 56.525 39.846 27.605 1.00 45.25 N ATOM 1920 CA HIS A 457 57.203 38.946 26.688 1.00 40.09 C ATOM 1921 C HIS A 457 57.154 39.539 25.287 1.00 37.72 C ATOM 1922 O HIS A 457 56.134 40.071 24.876 1.00 41.27 O ATOM 1923 CB HIS A 457 56.509 37.572 26.731 1.00 38.57 C ATOM 1924 CG HIS A 457 57.212 36.503 25.940 1.00 39.89 C ATOM 1925 ND1 HIS A 457 57.385 36.349 24.604 1.00 41.37 N flip ATOM 1926 CD2 HIS A 457 57.864 35.437 26.536 1.00 36.92 C flip ATOM 1927 CE1 HIS A 457 58.122 35.202 24.419 1.00 40.08 C flip ATOM 1928 NE2 HIS A 457 58.404 34.672 25.599 1.00 41.51 N flip ATOM 0 H HIS A 457 55.926 39.455 28.082 1.00 45.25 H new ATOM 0 HA HIS A 457 58.132 38.832 26.944 1.00 40.09 H new ATOM 0 HB2 HIS A 457 56.440 37.284 27.655 1.00 38.57 H new ATOM 0 HB3 HIS A 457 55.604 37.667 26.395 1.00 38.57 H new ATOM 0 HD2 HIS A 457 57.915 35.282 27.452 1.00 36.92 H new ATOM 0 HE1 HIS A 457 58.381 34.854 23.596 1.00 40.08 H new ATOM 0 HE2 HIS A 457 58.859 33.955 25.734 1.00 41.51 H new ATOM 1929 N PRO A 458 58.237 39.477 24.531 1.00 35.60 N ATOM 1930 CA PRO A 458 58.224 40.075 23.188 1.00 33.80 C ATOM 1931 C PRO A 458 57.131 39.546 22.225 1.00 31.16 C ATOM 1932 O PRO A 458 56.723 40.318 21.363 1.00 32.65 O ATOM 1933 CB PRO A 458 59.616 39.783 22.651 1.00 30.49 C ATOM 1934 CG PRO A 458 60.102 38.713 23.470 1.00 34.89 C ATOM 1935 CD PRO A 458 59.548 38.907 24.865 1.00 33.27 C ATOM 0 HA PRO A 458 58.004 41.018 23.249 1.00 33.80 H new ATOM 0 HB2 PRO A 458 59.587 39.526 21.716 1.00 30.49 H new ATOM 0 HB3 PRO A 458 60.189 40.563 22.713 1.00 30.49 H new ATOM 0 HG2 PRO A 458 59.823 37.856 23.110 1.00 34.89 H new ATOM 0 HG3 PRO A 458 61.072 38.712 23.487 1.00 34.89 H new ATOM 0 HD2 PRO A 458 59.477 38.074 25.357 1.00 33.27 H new ATOM 0 HD3 PRO A 458 60.090 39.508 25.401 1.00 33.27 H new ATOM 1936 N LEU A 459 56.704 38.289 22.340 1.00 27.58 N ATOM 1937 CA LEU A 459 55.584 37.794 21.521 1.00 28.93 C ATOM 1938 C LEU A 459 54.316 38.592 21.870 1.00 30.03 C ATOM 1939 O LEU A 459 53.606 39.095 20.994 1.00 30.30 O ATOM 1940 CB LEU A 459 55.318 36.298 21.778 1.00 25.45 C ATOM 1941 CG LEU A 459 54.184 35.655 20.979 1.00 22.39 C ATOM 1942 CD1 LEU A 459 54.317 35.960 19.474 1.00 21.55 C ATOM 1943 CD2 LEU A 459 54.147 34.181 21.236 1.00 22.18 C ATOM 0 H LEU A 459 57.041 37.709 22.878 1.00 27.58 H new ATOM 0 HA LEU A 459 55.817 37.908 20.586 1.00 28.93 H new ATOM 0 HB2 LEU A 459 56.135 35.809 21.592 1.00 25.45 H new ATOM 0 HB3 LEU A 459 55.127 36.182 22.722 1.00 25.45 H new ATOM 0 HG LEU A 459 53.343 36.038 21.274 1.00 22.39 H new ATOM 0 HD11 LEU A 459 53.586 35.541 18.993 1.00 21.55 H new ATOM 0 HD12 LEU A 459 54.287 36.919 19.334 1.00 21.55 H new ATOM 0 HD13 LEU A 459 55.161 35.612 19.146 1.00 21.55 H new ATOM 0 HD21 LEU A 459 53.425 33.781 20.726 1.00 22.18 H new ATOM 0 HD22 LEU A 459 54.991 33.784 20.968 1.00 22.18 H new ATOM 0 HD23 LEU A 459 54.001 34.021 22.181 1.00 22.18 H new ATOM 1944 N LEU A 460 54.051 38.698 23.166 1.00 27.59 N ATOM 1945 CA LEU A 460 52.883 39.403 23.617 1.00 30.11 C ATOM 1946 C LEU A 460 52.968 40.858 23.203 1.00 32.46 C ATOM 1947 O LEU A 460 51.946 41.482 22.837 1.00 29.42 O ATOM 1948 CB LEU A 460 52.758 39.273 25.122 1.00 27.33 C ATOM 1949 CG LEU A 460 52.719 37.802 25.567 1.00 28.07 C ATOM 1950 CD1 LEU A 460 52.345 37.709 27.049 1.00 24.88 C ATOM 1951 CD2 LEU A 460 51.800 36.933 24.678 1.00 28.10 C ATOM 0 H LEU A 460 54.539 38.367 23.792 1.00 27.59 H new ATOM 0 HA LEU A 460 52.092 39.017 23.209 1.00 30.11 H new ATOM 0 HB2 LEU A 460 53.506 39.720 25.548 1.00 27.33 H new ATOM 0 HB3 LEU A 460 51.952 39.722 25.420 1.00 27.33 H new ATOM 0 HG LEU A 460 53.610 37.436 25.454 1.00 28.07 H new ATOM 0 HD11 LEU A 460 52.323 36.778 27.320 1.00 24.88 H new ATOM 0 HD12 LEU A 460 53.004 38.184 27.580 1.00 24.88 H new ATOM 0 HD13 LEU A 460 51.471 38.106 27.188 1.00 24.88 H new ATOM 0 HD21 LEU A 460 51.810 36.018 24.999 1.00 28.10 H new ATOM 0 HD22 LEU A 460 50.894 37.278 24.714 1.00 28.10 H new ATOM 0 HD23 LEU A 460 52.118 36.957 23.762 1.00 28.10 H new ATOM 1952 N GLN A 461 54.187 41.406 23.244 1.00 33.01 N ATOM 1953 CA GLN A 461 54.352 42.800 22.875 1.00 33.22 C ATOM 1954 C GLN A 461 53.988 43.030 21.390 1.00 32.54 C ATOM 1955 O GLN A 461 53.272 44.003 21.099 1.00 32.59 O ATOM 1956 CB GLN A 461 55.749 43.311 23.256 1.00 37.81 C ATOM 1957 CG GLN A 461 56.023 44.737 22.792 1.00 45.89 C ATOM 1958 CD GLN A 461 56.031 45.763 23.940 1.00 51.93 C ATOM 1959 OE1 GLN A 461 55.138 46.626 24.010 1.00 52.93 O ATOM 1960 NE2 GLN A 461 57.042 45.673 24.843 1.00 53.42 N ATOM 0 H GLN A 461 54.907 40.996 23.476 1.00 33.01 H new ATOM 0 HA GLN A 461 53.725 43.335 23.387 1.00 33.22 H new ATOM 0 HB2 GLN A 461 55.850 43.267 24.220 1.00 37.81 H new ATOM 0 HB3 GLN A 461 56.417 42.720 22.874 1.00 37.81 H new ATOM 0 HG2 GLN A 461 56.880 44.763 22.338 1.00 45.89 H new ATOM 0 HG3 GLN A 461 55.350 44.994 22.143 1.00 45.89 H new ATOM 0 HE21 GLN A 461 57.640 45.061 24.759 1.00 53.42 H new ATOM 0 HE22 GLN A 461 57.084 46.228 25.499 1.00 53.42 H new ATOM 1961 N GLU A 462 54.416 42.157 20.452 1.00 28.99 N ATOM 1962 CA GLU A 462 53.963 42.340 19.058 1.00 30.05 C ATOM 1963 C GLU A 462 52.441 42.229 18.946 1.00 28.21 C ATOM 1964 O GLU A 462 51.820 42.994 18.243 1.00 25.46 O ATOM 1965 CB GLU A 462 54.512 41.321 18.044 1.00 32.51 C ATOM 1966 CG GLU A 462 55.881 40.754 18.318 1.00 41.27 C ATOM 1967 CD GLU A 462 56.253 39.663 17.326 1.00 42.96 C ATOM 1968 OE1 GLU A 462 57.425 39.269 17.339 1.00 45.88 O ATOM 1969 OE2 GLU A 462 55.386 39.210 16.534 1.00 43.64 O ATOM 0 H GLU A 462 54.939 41.489 20.592 1.00 28.99 H new ATOM 0 HA GLU A 462 54.303 43.222 18.841 1.00 30.05 H new ATOM 0 HB2 GLU A 462 53.885 40.583 17.989 1.00 32.51 H new ATOM 0 HB3 GLU A 462 54.530 41.744 17.171 1.00 32.51 H new ATOM 0 HG2 GLU A 462 56.539 41.465 18.277 1.00 41.27 H new ATOM 0 HG3 GLU A 462 55.907 40.394 19.218 1.00 41.27 H new ATOM 1970 N ILE A 463 51.849 41.231 19.598 1.00 26.18 N ATOM 1971 CA ILE A 463 50.398 41.067 19.482 1.00 28.58 C ATOM 1972 C ILE A 463 49.680 42.346 19.925 1.00 28.27 C ATOM 1973 O ILE A 463 48.767 42.832 19.231 1.00 27.73 O ATOM 1974 CB ILE A 463 49.922 39.829 20.288 1.00 27.14 C ATOM 1975 CG1 ILE A 463 50.370 38.576 19.560 1.00 23.31 C ATOM 1976 CG2 ILE A 463 48.424 39.810 20.460 1.00 26.47 C ATOM 1977 CD1 ILE A 463 50.574 37.476 20.472 1.00 24.47 C ATOM 0 H ILE A 463 52.250 40.656 20.096 1.00 26.18 H new ATOM 0 HA ILE A 463 50.172 40.911 18.552 1.00 28.58 H new ATOM 0 HB ILE A 463 50.314 39.870 21.174 1.00 27.14 H new ATOM 0 HG12 ILE A 463 49.705 38.330 18.899 1.00 23.31 H new ATOM 0 HG13 ILE A 463 51.194 38.757 19.080 1.00 23.31 H new ATOM 0 HG21 ILE A 463 48.166 39.024 20.967 1.00 26.47 H new ATOM 0 HG22 ILE A 463 48.143 40.607 20.935 1.00 26.47 H new ATOM 0 HG23 ILE A 463 47.998 39.786 19.589 1.00 26.47 H new ATOM 0 HD11 ILE A 463 50.859 36.693 19.976 1.00 24.47 H new ATOM 0 HD12 ILE A 463 51.256 37.714 21.119 1.00 24.47 H new ATOM 0 HD13 ILE A 463 49.744 37.281 20.935 1.00 24.47 H new ATOM 1978 N TYR A 464 50.119 42.914 21.044 1.00 28.75 N ATOM 1979 CA TYR A 464 49.427 44.053 21.634 1.00 31.27 C ATOM 1980 C TYR A 464 49.671 45.396 20.945 1.00 35.56 C ATOM 1981 O TYR A 464 48.895 46.324 21.131 1.00 36.25 O ATOM 1982 CB TYR A 464 49.810 44.216 23.087 1.00 30.74 C ATOM 1983 CG TYR A 464 49.091 43.321 24.075 1.00 29.85 C ATOM 1984 CD1 TYR A 464 47.702 43.367 24.229 1.00 31.04 C ATOM 1985 CD2 TYR A 464 49.812 42.457 24.898 1.00 28.87 C ATOM 1986 CE1 TYR A 464 47.047 42.533 25.176 1.00 28.96 C ATOM 1987 CE2 TYR A 464 49.166 41.646 25.857 1.00 29.50 C ATOM 1988 CZ TYR A 464 47.799 41.687 25.987 1.00 28.97 C ATOM 1989 OH TYR A 464 47.180 40.858 26.906 1.00 31.65 O ATOM 0 H TYR A 464 50.816 42.655 21.477 1.00 28.75 H new ATOM 0 HA TYR A 464 48.488 43.837 21.522 1.00 31.27 H new ATOM 0 HB2 TYR A 464 50.763 44.057 23.170 1.00 30.74 H new ATOM 0 HB3 TYR A 464 49.653 45.139 23.342 1.00 30.74 H new ATOM 0 HD1 TYR A 464 47.201 43.950 23.706 1.00 31.04 H new ATOM 0 HD2 TYR A 464 50.737 42.414 24.814 1.00 28.87 H new ATOM 0 HE1 TYR A 464 46.120 42.552 25.253 1.00 28.96 H new ATOM 0 HE2 TYR A 464 49.667 41.083 26.402 1.00 29.50 H new ATOM 0 HH TYR A 464 47.758 40.525 27.417 1.00 31.65 H new ATOM 1990 N ARG A 465 50.736 45.495 20.157 1.00 38.92 N ATOM 1991 CA ARG A 465 51.109 46.754 19.519 1.00 41.50 C ATOM 1992 C ARG A 465 50.013 47.275 18.569 1.00 40.42 C ATOM 1993 O ARG A 465 49.527 46.536 17.722 1.00 41.49 O ATOM 1994 CB ARG A 465 52.427 46.558 18.764 1.00 45.53 C ATOM 1995 CG ARG A 465 53.121 47.855 18.336 1.00 53.43 C ATOM 1996 CD ARG A 465 54.661 47.893 18.595 1.00 58.82 C ATOM 1997 NE ARG A 465 55.391 46.781 17.965 1.00 61.94 N ATOM 1998 CZ ARG A 465 56.321 46.028 18.571 1.00 63.83 C ATOM 1999 NH1 ARG A 465 56.665 46.258 19.839 1.00 65.40 N ATOM 2000 NH2 ARG A 465 56.909 45.042 17.903 1.00 65.06 N ATOM 0 H ARG A 465 51.261 44.838 19.977 1.00 38.92 H new ATOM 0 HA ARG A 465 51.218 47.425 20.211 1.00 41.50 H new ATOM 0 HB2 ARG A 465 53.034 46.051 19.325 1.00 45.53 H new ATOM 0 HB3 ARG A 465 52.256 46.022 17.974 1.00 45.53 H new ATOM 0 HG2 ARG A 465 52.962 47.994 17.389 1.00 53.43 H new ATOM 0 HG3 ARG A 465 52.709 48.597 18.805 1.00 53.43 H new ATOM 0 HD2 ARG A 465 55.017 48.732 18.264 1.00 58.82 H new ATOM 0 HD3 ARG A 465 54.821 47.875 19.551 1.00 58.82 H new ATOM 0 HE ARG A 465 55.207 46.600 17.145 1.00 61.94 H new ATOM 0 HH11 ARG A 465 56.289 46.895 20.278 1.00 65.40 H new ATOM 0 HH12 ARG A 465 57.263 45.769 20.218 1.00 65.40 H new ATOM 0 HH21 ARG A 465 56.693 44.888 17.085 1.00 65.06 H new ATOM 0 HH22 ARG A 465 57.506 44.557 18.289 1.00 65.06 H new ATOM 2001 N ASP A 466 49.629 48.538 18.709 1.00 38.23 N ATOM 2002 CA ASP A 466 48.567 49.134 17.875 1.00 40.31 C ATOM 2003 C ASP A 466 47.112 48.716 18.175 1.00 39.40 C ATOM 2004 O ASP A 466 46.243 48.996 17.354 1.00 39.34 O ATOM 2005 CB ASP A 466 48.780 48.812 16.395 1.00 42.07 C ATOM 2006 CG ASP A 466 50.085 49.379 15.825 1.00 46.35 C ATOM 2007 OD1 ASP A 466 50.686 50.337 16.388 1.00 43.59 O ATOM 2008 OD2 ASP A 466 50.564 48.901 14.771 1.00 47.63 O ATOM 0 H ASP A 466 49.969 49.079 19.285 1.00 38.23 H new ATOM 0 HA ASP A 466 48.656 50.074 18.096 1.00 40.31 H new ATOM 0 HB2 ASP A 466 48.776 47.849 16.277 1.00 42.07 H new ATOM 0 HB3 ASP A 466 48.034 49.163 15.885 1.00 42.07 H new ATOM 2009 N MET A 467 46.808 48.085 19.307 1.00 38.27 N ATOM 2010 CA MET A 467 45.440 47.533 19.462 1.00 41.42 C ATOM 2011 C MET A 467 44.192 48.441 19.698 1.00 45.66 C ATOM 2012 O MET A 467 43.168 48.270 18.991 1.00 50.86 O ATOM 2013 CB MET A 467 45.424 46.383 20.458 1.00 40.40 C ATOM 2014 CG MET A 467 45.631 45.044 19.775 1.00 39.65 C ATOM 2015 SD MET A 467 45.316 43.710 20.911 1.00 39.36 S ATOM 2016 CE MET A 467 45.498 42.334 19.762 1.00 39.73 C ATOM 0 H MET A 467 47.340 47.964 19.972 1.00 38.27 H new ATOM 0 HA MET A 467 45.292 47.273 18.539 1.00 41.42 H new ATOM 0 HB2 MET A 467 46.119 46.519 21.121 1.00 40.40 H new ATOM 0 HB3 MET A 467 44.578 46.377 20.932 1.00 40.40 H new ATOM 0 HG2 MET A 467 45.040 44.970 19.009 1.00 39.65 H new ATOM 0 HG3 MET A 467 46.539 44.983 19.439 1.00 39.65 H new ATOM 0 HE1 MET A 467 45.762 41.538 20.249 1.00 39.73 H new ATOM 0 HE2 MET A 467 44.653 42.172 19.314 1.00 39.73 H new ATOM 0 HE3 MET A 467 46.177 42.550 19.103 1.00 39.73 H new ATOM 2017 N TYR A 468 44.245 49.338 20.679 1.00 44.13 N ATOM 2018 CA TYR A 468 43.147 50.295 21.008 1.00 47.29 C ATOM 2019 C TYR A 468 41.681 49.843 20.872 1.00 49.31 C ATOM 2020 O TYR A 468 41.257 48.802 20.361 1.00 50.95 O ATOM 2021 CB TYR A 468 43.350 51.652 20.281 1.00 46.88 C ATOM 2022 CG TYR A 468 42.749 51.716 18.891 1.00 45.17 C ATOM 2023 CD1 TYR A 468 41.387 51.971 18.696 1.00 44.74 C ATOM 2024 CD2 TYR A 468 43.543 51.509 17.782 1.00 44.70 C ATOM 2025 CE1 TYR A 468 40.864 52.020 17.427 1.00 45.68 C ATOM 2026 CE2 TYR A 468 43.043 51.555 16.524 1.00 44.44 C ATOM 2027 CZ TYR A 468 41.710 51.811 16.338 1.00 45.68 C ATOM 2028 OH TYR A 468 41.243 51.858 15.045 1.00 46.14 O ATOM 2029 OXT TYR A 468 40.751 50.535 21.278 1.00 51.67 O ATOM 0 H TYR A 468 44.930 49.421 21.193 1.00 44.13 H new ATOM 0 HA TYR A 468 43.253 50.370 21.969 1.00 47.29 H new ATOM 0 HB2 TYR A 468 42.961 52.357 20.822 1.00 46.88 H new ATOM 0 HB3 TYR A 468 44.301 51.834 20.219 1.00 46.88 H new ATOM 0 HD1 TYR A 468 40.833 52.108 19.430 1.00 44.74 H new ATOM 0 HD2 TYR A 468 44.448 51.333 17.902 1.00 44.70 H new ATOM 0 HE1 TYR A 468 39.959 52.190 17.296 1.00 45.68 H new ATOM 0 HE2 TYR A 468 43.600 51.414 15.793 1.00 44.44 H new ATOM 0 HH TYR A 468 41.876 51.713 14.513 1.00 46.14 H new TER 2030 TYR A 468 ATOM 2031 N HIS Z 746 56.117 41.882 13.330 1.00 48.33 N ATOM 2032 CA HIS Z 746 55.655 40.646 14.072 1.00 51.80 C ATOM 2033 C HIS Z 746 56.536 39.442 13.714 1.00 48.73 C ATOM 2034 O HIS Z 746 56.074 38.422 13.174 1.00 41.87 O ATOM 2035 CB HIS Z 746 54.157 40.348 13.854 1.00 54.04 C ATOM 2036 CG HIS Z 746 53.287 41.567 13.928 1.00 56.52 C ATOM 2037 ND1 HIS Z 746 53.230 42.504 12.918 1.00 57.51 N ATOM 2038 CD2 HIS Z 746 52.459 42.015 14.901 1.00 58.09 C ATOM 2039 CE1 HIS Z 746 52.398 43.472 13.259 1.00 59.03 C ATOM 2040 NE2 HIS Z 746 51.922 43.203 14.463 1.00 59.40 N ATOM 0 HA HIS Z 746 55.755 40.823 15.020 1.00 51.80 H new ATOM 0 HB2 HIS Z 746 54.041 39.929 12.987 1.00 54.04 H new ATOM 0 HB3 HIS Z 746 53.862 39.708 14.520 1.00 54.04 H new ATOM 0 HD1 HIS Z 746 53.669 42.464 12.179 1.00 57.51 H new ATOM 0 HD2 HIS Z 746 52.286 41.597 15.714 1.00 58.09 H new ATOM 0 HE1 HIS Z 746 52.184 44.215 12.742 1.00 59.03 H new ATOM 2041 N GLN Z 747 57.809 39.627 14.050 1.00 48.33 N ATOM 2042 CA GLN Z 747 58.894 38.715 13.791 1.00 47.03 C ATOM 2043 C GLN Z 747 58.580 37.376 14.423 1.00 42.81 C ATOM 2044 O GLN Z 747 58.672 36.343 13.780 1.00 42.93 O ATOM 2045 CB GLN Z 747 60.202 39.289 14.396 1.00 52.14 C ATOM 2046 CG GLN Z 747 60.937 40.295 13.489 1.00 60.45 C ATOM 2047 CD GLN Z 747 61.571 41.505 14.242 1.00 64.73 C ATOM 2048 OE1 GLN Z 747 61.524 41.583 15.486 1.00 67.28 O ATOM 2049 NE2 GLN Z 747 62.157 42.440 13.477 1.00 64.08 N ATOM 0 H GLN Z 747 58.069 40.336 14.461 1.00 48.33 H new ATOM 0 HA GLN Z 747 59.008 38.600 12.835 1.00 47.03 H new ATOM 0 HB2 GLN Z 747 59.993 39.723 15.238 1.00 52.14 H new ATOM 0 HB3 GLN Z 747 60.802 38.554 14.597 1.00 52.14 H new ATOM 0 HG2 GLN Z 747 61.636 39.827 13.007 1.00 60.45 H new ATOM 0 HG3 GLN Z 747 60.313 40.632 12.827 1.00 60.45 H new ATOM 0 HE21 GLN Z 747 62.169 42.350 12.622 1.00 64.08 H new ATOM 0 HE22 GLN Z 747 62.520 43.129 13.842 1.00 64.08 H new ATOM 2050 N LEU Z 748 58.225 37.385 15.699 1.00 36.47 N ATOM 2051 CA LEU Z 748 58.016 36.127 16.385 1.00 35.72 C ATOM 2052 C LEU Z 748 56.734 35.433 15.915 1.00 31.42 C ATOM 2053 O LEU Z 748 56.728 34.218 15.806 1.00 28.56 O ATOM 2054 CB LEU Z 748 58.053 36.297 17.913 1.00 35.46 C ATOM 2055 CG LEU Z 748 59.358 36.900 18.460 1.00 40.72 C ATOM 2056 CD1 LEU Z 748 59.174 37.319 19.918 1.00 38.70 C ATOM 2057 CD2 LEU Z 748 60.613 35.934 18.297 1.00 41.08 C ATOM 0 H LEU Z 748 58.103 38.091 16.174 1.00 36.47 H new ATOM 0 HA LEU Z 748 58.755 35.545 16.149 1.00 35.72 H new ATOM 0 HB2 LEU Z 748 57.312 36.863 18.182 1.00 35.46 H new ATOM 0 HB3 LEU Z 748 57.913 35.431 18.326 1.00 35.46 H new ATOM 0 HG LEU Z 748 59.553 37.684 17.923 1.00 40.72 H new ATOM 0 HD11 LEU Z 748 60.002 37.698 20.253 1.00 38.70 H new ATOM 0 HD12 LEU Z 748 58.468 37.982 19.978 1.00 38.70 H new ATOM 0 HD13 LEU Z 748 58.935 36.544 20.450 1.00 38.70 H new ATOM 0 HD21 LEU Z 748 61.403 36.366 18.658 1.00 41.08 H new ATOM 0 HD22 LEU Z 748 60.449 35.107 18.777 1.00 41.08 H new ATOM 0 HD23 LEU Z 748 60.752 35.740 17.357 1.00 41.08 H new ATOM 2058 N LEU Z 749 55.673 36.189 15.617 1.00 30.79 N ATOM 2059 CA LEU Z 749 54.431 35.563 15.127 1.00 33.66 C ATOM 2060 C LEU Z 749 54.707 34.965 13.750 1.00 31.80 C ATOM 2061 O LEU Z 749 54.349 33.825 13.489 1.00 30.55 O ATOM 2062 CB LEU Z 749 53.270 36.571 15.025 1.00 29.69 C ATOM 2063 CG LEU Z 749 52.142 36.631 16.040 1.00 30.13 C ATOM 2064 CD1 LEU Z 749 51.126 37.649 15.552 1.00 29.44 C ATOM 2065 CD2 LEU Z 749 51.469 35.219 16.345 1.00 26.55 C ATOM 0 H LEU Z 749 55.647 37.046 15.688 1.00 30.79 H new ATOM 0 HA LEU Z 749 54.163 34.879 15.760 1.00 33.66 H new ATOM 0 HB2 LEU Z 749 53.671 37.454 15.006 1.00 29.69 H new ATOM 0 HB3 LEU Z 749 52.856 36.429 14.160 1.00 29.69 H new ATOM 0 HG LEU Z 749 52.514 36.904 16.893 1.00 30.13 H new ATOM 0 HD11 LEU Z 749 50.394 37.705 16.186 1.00 29.44 H new ATOM 0 HD12 LEU Z 749 51.551 38.517 15.471 1.00 29.44 H new ATOM 0 HD13 LEU Z 749 50.784 37.376 14.687 1.00 29.44 H new ATOM 0 HD21 LEU Z 749 50.761 35.332 16.998 1.00 26.55 H new ATOM 0 HD22 LEU Z 749 51.098 34.853 15.527 1.00 26.55 H new ATOM 0 HD23 LEU Z 749 52.138 34.611 16.696 1.00 26.55 H new ATOM 2066 N ARG Z 750 55.364 35.746 12.892 1.00 34.85 N ATOM 2067 CA ARG Z 750 55.794 35.282 11.564 1.00 35.80 C ATOM 2068 C ARG Z 750 56.693 34.075 11.733 1.00 35.82 C ATOM 2069 O ARG Z 750 56.556 33.071 11.006 1.00 33.76 O ATOM 2070 CB ARG Z 750 56.528 36.371 10.803 1.00 41.64 C ATOM 2071 CG ARG Z 750 55.626 37.274 10.052 1.00 48.87 C ATOM 2072 CD ARG Z 750 56.319 38.531 9.429 1.00 56.20 C ATOM 2073 NE ARG Z 750 55.786 38.804 8.081 1.00 61.66 N ATOM 2074 CZ ARG Z 750 56.297 38.288 6.961 1.00 63.91 C ATOM 2075 NH1 ARG Z 750 57.359 37.486 7.025 1.00 66.21 N ATOM 2076 NH2 ARG Z 750 55.755 38.578 5.779 1.00 66.32 N ATOM 0 H ARG Z 750 55.575 36.562 13.061 1.00 34.85 H new ATOM 0 HA ARG Z 750 55.007 35.045 11.049 1.00 35.80 H new ATOM 0 HB2 ARG Z 750 57.053 36.895 11.428 1.00 41.64 H new ATOM 0 HB3 ARG Z 750 57.152 35.960 10.184 1.00 41.64 H new ATOM 0 HG2 ARG Z 750 55.203 36.768 9.340 1.00 48.87 H new ATOM 0 HG3 ARG Z 750 54.920 37.572 10.647 1.00 48.87 H new ATOM 0 HD2 ARG Z 750 56.176 39.302 10.001 1.00 56.20 H new ATOM 0 HD3 ARG Z 750 57.277 38.387 9.380 1.00 56.20 H new ATOM 0 HE ARG Z 750 55.106 39.326 8.013 1.00 61.66 H new ATOM 0 HH11 ARG Z 750 57.714 37.302 7.787 1.00 66.21 H new ATOM 0 HH12 ARG Z 750 57.690 37.152 6.305 1.00 66.21 H new ATOM 0 HH21 ARG Z 750 55.073 39.100 5.735 1.00 66.32 H new ATOM 0 HH22 ARG Z 750 56.087 38.243 5.060 1.00 66.32 H new ATOM 2077 N TYR Z 751 57.574 34.145 12.741 1.00 33.86 N ATOM 2078 CA TYR Z 751 58.426 33.010 13.062 1.00 33.98 C ATOM 2079 C TYR Z 751 57.619 31.722 13.364 1.00 37.17 C ATOM 2080 O TYR Z 751 57.939 30.639 12.822 1.00 35.92 O ATOM 2081 CB TYR Z 751 59.452 33.334 14.167 1.00 34.34 C ATOM 2082 CG TYR Z 751 60.293 32.136 14.504 1.00 36.85 C ATOM 2083 CD1 TYR Z 751 60.002 31.354 15.610 1.00 37.52 C ATOM 2084 CD2 TYR Z 751 61.369 31.756 13.695 1.00 38.77 C ATOM 2085 CE1 TYR Z 751 60.761 30.250 15.928 1.00 38.25 C ATOM 2086 CE2 TYR Z 751 62.141 30.643 14.013 1.00 40.48 C ATOM 2087 CZ TYR Z 751 61.827 29.890 15.127 1.00 40.79 C ATOM 2088 OH TYR Z 751 62.570 28.759 15.459 1.00 44.69 O ATOM 0 H TYR Z 751 57.687 34.835 13.241 1.00 33.86 H new ATOM 0 HA TYR Z 751 58.938 32.825 12.259 1.00 33.98 H new ATOM 0 HB2 TYR Z 751 60.024 34.061 13.876 1.00 34.34 H new ATOM 0 HB3 TYR Z 751 58.988 33.639 14.962 1.00 34.34 H new ATOM 0 HD1 TYR Z 751 59.279 31.580 16.149 1.00 37.52 H new ATOM 0 HD2 TYR Z 751 61.571 32.253 12.935 1.00 38.77 H new ATOM 0 HE1 TYR Z 751 60.556 29.747 16.683 1.00 38.25 H new ATOM 0 HE2 TYR Z 751 62.864 30.408 13.478 1.00 40.48 H new ATOM 0 HH TYR Z 751 63.184 28.651 14.896 1.00 44.69 H new ATOM 2089 N LEU Z 752 56.581 31.821 14.199 1.00 34.30 N ATOM 2090 CA LEU Z 752 55.705 30.665 14.445 1.00 33.86 C ATOM 2091 C LEU Z 752 55.051 30.188 13.185 1.00 32.20 C ATOM 2092 O LEU Z 752 54.990 28.986 12.957 1.00 31.47 O ATOM 2093 CB LEU Z 752 54.595 30.959 15.493 1.00 31.62 C ATOM 2094 CG LEU Z 752 55.143 31.252 16.883 1.00 29.87 C ATOM 2095 CD1 LEU Z 752 54.083 31.800 17.879 1.00 30.12 C ATOM 2096 CD2 LEU Z 752 55.834 30.002 17.429 1.00 29.59 C ATOM 0 H LEU Z 752 56.367 32.535 14.628 1.00 34.30 H new ATOM 0 HA LEU Z 752 56.289 29.975 14.797 1.00 33.86 H new ATOM 0 HB2 LEU Z 752 54.068 31.716 15.193 1.00 31.62 H new ATOM 0 HB3 LEU Z 752 53.995 30.198 15.542 1.00 31.62 H new ATOM 0 HG LEU Z 752 55.788 31.971 16.790 1.00 29.87 H new ATOM 0 HD11 LEU Z 752 54.501 31.963 18.739 1.00 30.12 H new ATOM 0 HD12 LEU Z 752 53.715 32.630 17.536 1.00 30.12 H new ATOM 0 HD13 LEU Z 752 53.371 31.150 17.984 1.00 30.12 H new ATOM 0 HD21 LEU Z 752 56.184 30.186 18.315 1.00 29.59 H new ATOM 0 HD22 LEU Z 752 55.194 29.274 17.479 1.00 29.59 H new ATOM 0 HD23 LEU Z 752 56.562 29.751 16.840 1.00 29.59 H new ATOM 2097 N LEU Z 753 54.543 31.123 12.379 1.00 33.95 N ATOM 2098 CA LEU Z 753 53.795 30.760 11.169 1.00 34.61 C ATOM 2099 C LEU Z 753 54.693 30.301 10.035 1.00 39.99 C ATOM 2100 O LEU Z 753 55.877 30.740 9.956 1.00 39.19 O ATOM 2101 CB LEU Z 753 52.939 31.922 10.655 1.00 32.94 C ATOM 2102 CG LEU Z 753 51.741 32.160 11.574 1.00 36.08 C ATOM 2103 CD1 LEU Z 753 51.211 33.539 11.389 1.00 34.39 C ATOM 2104 CD2 LEU Z 753 50.624 31.077 11.383 1.00 32.56 C ATOM 0 H LEU Z 753 54.619 31.969 12.513 1.00 33.95 H new ATOM 0 HA LEU Z 753 53.226 30.023 11.440 1.00 34.61 H new ATOM 0 HB2 LEU Z 753 53.477 32.727 10.603 1.00 32.94 H new ATOM 0 HB3 LEU Z 753 52.629 31.729 9.756 1.00 32.94 H new ATOM 0 HG LEU Z 753 52.049 32.074 12.490 1.00 36.08 H new ATOM 0 HD11 LEU Z 753 50.452 33.676 11.978 1.00 34.39 H new ATOM 0 HD12 LEU Z 753 51.904 34.183 11.601 1.00 34.39 H new ATOM 0 HD13 LEU Z 753 50.931 33.657 10.468 1.00 34.39 H new ATOM 0 HD21 LEU Z 753 49.885 31.265 11.983 1.00 32.56 H new ATOM 0 HD22 LEU Z 753 50.308 31.096 10.466 1.00 32.56 H new ATOM 0 HD23 LEU Z 753 50.986 30.200 11.582 1.00 32.56 H new TER 2105 LEU Z 753 HETATM 2106 C25 RO7 A 1 45.595 33.375 37.110 1.00 35.06 C HETATM 2107 C7 RO7 A 1 46.753 32.412 37.125 1.00 35.40 C HETATM 2108 O3 RO7 A 1 47.748 32.580 38.035 1.00 33.88 O HETATM 2109 C2 RO7 A 1 48.630 31.553 37.748 1.00 35.76 C HETATM 2110 C16 RO7 A 1 49.828 31.194 38.371 1.00 35.56 C HETATM 2111 C26 RO7 A 1 50.575 30.086 37.947 1.00 35.97 C HETATM 2112 C29 RO7 A 1 51.776 29.740 38.581 1.00 36.22 C HETATM 2113 C31 RO7 A 1 52.224 30.528 39.663 1.00 36.17 C HETATM 2114 C30 RO7 A 1 51.486 31.632 40.092 1.00 35.82 C HETATM 2115 C27 RO7 A 1 50.290 31.967 39.447 1.00 37.52 C HETATM 2116 N1 RO7 A 1 48.238 30.757 36.707 1.00 35.21 N HETATM 2117 C4 RO7 A 1 47.072 31.253 36.268 1.00 33.91 C HETATM 2118 C20 RO7 A 1 46.182 30.788 35.162 1.00 34.32 C HETATM 2119 C23 RO7 A 1 46.481 31.527 33.879 1.00 32.04 C HETATM 2120 O22 RO7 A 1 45.622 32.647 33.806 1.00 31.08 O HETATM 2121 C13 RO7 A 1 45.842 33.611 32.874 1.00 25.95 C HETATM 2122 C19 RO7 A 1 46.685 33.412 31.772 1.00 24.33 C HETATM 2123 C17 RO7 A 1 46.882 34.430 30.821 1.00 23.68 C HETATM 2124 C5 RO7 A 1 45.120 34.869 33.048 1.00 25.90 C HETATM 2125 C15 RO7 A 1 44.205 35.184 34.121 1.00 29.14 C HETATM 2126 C12 RO7 A 1 43.771 36.498 33.889 1.00 29.92 C HETATM 2127 C6 RO7 A 1 45.302 35.931 32.082 1.00 26.01 C HETATM 2128 S9 RO7 A 1 44.416 37.247 32.499 1.00 29.81 S HETATM 2129 C8 RO7 A 1 46.225 35.679 30.934 1.00 28.01 C HETATM 2130 C11 RO7 A 1 46.501 36.725 29.876 1.00 29.29 C HETATM 2131 C14 RO7 A 1 47.779 37.468 30.281 1.00 29.65 C HETATM 2132 O24 RO7 A 1 47.497 38.359 31.381 1.00 32.51 O HETATM 2133 C28 RO7 A 1 48.688 39.008 31.867 1.00 32.33 C HETATM 2134 C10 RO7 A 1 48.305 38.199 29.084 1.00 29.46 C HETATM 2135 O21 RO7 A 1 49.028 37.589 28.294 1.00 27.86 O HETATM 2136 O18 RO7 A 1 47.977 39.371 28.898 1.00 26.85 O HETATM 0 H28B RO7 A 1 49.319 38.338 32.173 1.00 32.33 H new HETATM 0 H28A RO7 A 1 49.089 39.527 31.152 1.00 32.33 H new HETATM 0 H25B RO7 A 1 45.142 33.350 37.967 1.00 35.06 H new HETATM 0 H25A RO7 A 1 45.923 34.273 36.944 1.00 35.06 H new HETATM 0 H23A RO7 A 1 47.409 31.810 33.860 1.00 32.04 H new HETATM 0 H20A RO7 A 1 46.301 29.835 35.026 1.00 34.32 H new HETATM 0 H11A RO7 A 1 46.610 36.310 29.006 1.00 29.29 H new HETATM 0 H31 RO7 A 1 53.053 30.300 40.113 1.00 36.17 H new HETATM 0 H30 RO7 A 1 51.802 32.167 40.837 1.00 35.82 H new HETATM 0 H29 RO7 A 1 52.290 28.973 38.282 1.00 36.22 H new HETATM 0 H28 RO7 A 1 48.459 39.596 32.603 1.00 32.33 H new HETATM 0 H27 RO7 A 1 49.779 32.736 39.745 1.00 37.52 H new HETATM 0 H26 RO7 A 1 50.256 29.551 37.204 1.00 35.97 H new HETATM 0 H25 RO7 A 1 44.973 33.123 36.409 1.00 35.06 H new HETATM 0 H23 RO7 A 1 46.346 30.946 33.114 1.00 32.04 H new HETATM 0 H20 RO7 A 1 45.254 30.925 35.410 1.00 34.32 H new HETATM 0 H19 RO7 A 1 47.138 32.561 31.664 1.00 24.33 H new HETATM 0 H17 RO7 A 1 47.480 34.273 30.073 1.00 23.68 H new HETATM 0 H15 RO7 A 1 43.944 34.604 34.854 1.00 29.14 H new HETATM 0 H14 RO7 A 1 48.459 36.846 30.583 1.00 29.65 H new HETATM 0 H12 RO7 A 1 43.147 36.949 34.479 1.00 29.92 H new HETATM 0 H11 RO7 A 1 45.756 37.342 29.805 1.00 29.29 H new HETATM 2137 O HOH A 2 44.632 38.994 20.271 1.00 22.35 O HETATM 2138 O HOH A 3 41.482 36.724 13.772 1.00 23.05 O HETATM 2139 O HOH A 4 33.249 26.390 28.362 1.00 21.37 O HETATM 2140 O HOH A 5 39.299 41.992 30.543 1.00 27.97 O HETATM 2141 O HOH A 6 38.986 24.739 26.019 1.00 27.20 O HETATM 2142 O HOH A 7 35.635 27.075 27.283 1.00 25.49 O HETATM 2143 O HOH A 9 33.754 40.533 32.256 1.00 39.45 O HETATM 2144 O HOH A 10 20.331 20.236 24.064 1.00 33.34 O HETATM 2145 O HOH A 11 35.764 36.774 14.098 1.00 45.18 O HETATM 2146 O HOH A 12 31.557 27.010 38.763 1.00 36.57 O HETATM 2147 O HOH A 14 34.343 18.292 26.113 1.00 30.39 O HETATM 2148 O HOH A 16 41.543 16.106 40.387 1.00 38.65 O HETATM 2149 O HOH A 17 45.536 18.058 13.050 1.00 33.92 O HETATM 2150 O HOH A 18 56.402 47.180 39.240 1.00 38.02 O HETATM 2151 O HOH A 19 53.201 50.690 24.515 1.00 45.88 O HETATM 2152 O HOH A 21 40.239 41.205 20.009 1.00 34.39 O HETATM 2153 O HOH A 22 50.455 22.766 19.327 1.00 32.10 O HETATM 2154 O HOH A 23 28.026 30.732 7.129 1.00 39.44 O HETATM 2155 O HOH A 27 21.327 24.300 19.155 1.00 33.89 O HETATM 2156 O HOH A 28 41.828 38.949 20.251 1.00 35.28 O HETATM 2157 O HOH A 29 43.115 18.277 11.403 1.00 30.98 O HETATM 2158 O HOH A 30 40.335 39.925 41.043 1.00 32.28 O HETATM 2159 O HOH A 31 33.438 18.864 28.588 1.00 43.41 O HETATM 2160 O HOH A 34 49.079 25.745 32.250 1.00 33.19 O HETATM 2161 O HOH A 35 58.699 43.893 24.349 1.00 46.91 O HETATM 2162 O HOH A 36 40.452 47.779 31.111 1.00 35.70 O HETATM 2163 O HOH A 37 30.538 24.287 31.124 1.00 28.72 O HETATM 2164 O HOH A 39 45.932 17.599 39.076 1.00 39.25 O HETATM 2165 O HOH A 40 22.661 26.141 15.275 1.00 47.03 O HETATM 2166 O HOH A 41 42.613 30.439 1.620 1.00 46.52 O HETATM 2167 O HOH A 42 41.158 50.092 33.037 1.00 55.49 O HETATM 2168 O HOH A 43 44.579 48.061 15.474 1.00 41.33 O HETATM 2169 O HOH A 46 35.362 37.998 17.025 1.00 43.23 O HETATM 2170 O HOH A 47 45.989 24.471 25.941 1.00 40.99 O HETATM 2171 O HOH A 48 50.503 49.861 21.023 1.00 42.11 O HETATM 2172 O HOH A 49 45.493 25.339 6.233 1.00 34.69 O HETATM 2173 O HOH A 50 45.917 36.134 1.778 1.00 48.53 O HETATM 2174 O HOH A 52 41.969 47.577 17.282 1.00 49.99 O HETATM 2175 O HOH A 54 41.113 41.845 17.965 1.00 37.61 O HETATM 2176 O HOH A 55 51.666 29.285 7.705 1.00 41.12 O HETATM 2177 O HOH A 57 29.106 28.838 35.280 1.00 42.85 O HETATM 2178 O HOH A 58 55.683 40.212 47.272 1.00 37.62 O HETATM 2179 O HOH A 59 32.906 17.046 9.841 1.00 38.16 O HETATM 2180 O HOH A 60 32.091 19.251 8.493 1.00 33.69 O HETATM 2181 O HOH A 62 29.276 28.605 38.070 1.00 35.96 O HETATM 2182 O HOH A 63 39.517 42.988 15.694 1.00 28.95 O HETATM 2183 O HOH A 64 56.111 43.651 15.559 1.00 46.73 O HETATM 2184 O HOH A 68 53.331 53.559 24.613 1.00 46.99 O HETATM 2185 O HOH A 70 38.106 34.037 30.468 1.00 33.50 O HETATM 2186 O HOH A 71 50.762 41.423 9.361 1.00 46.74 O HETATM 2187 O HOH A 72 57.219 53.184 35.020 1.00 41.30 O HETATM 2188 O HOH A 73 47.993 31.887 -2.404 1.00 59.22 O HETATM 2189 O HOH A 74 46.443 14.966 13.377 1.00 51.44 O HETATM 2190 O HOH A 75 45.329 27.631 33.285 1.00 29.03 O HETATM 2191 O HOH A 76 58.404 42.373 16.172 1.00 55.28 O HETATM 2192 O HOH A 77 58.657 41.159 33.991 1.00 47.84 O HETATM 2193 O HOH A 78 55.798 29.846 27.714 1.00 42.37 O HETATM 2194 O HOH A 79 39.841 14.162 6.875 1.00 37.89 O HETATM 2195 O HOH A 80 37.587 23.043 42.713 1.00 49.22 O HETATM 2196 O HOH A 81 52.514 23.118 24.036 1.00 52.49 O HETATM 2197 O HOH A 82 47.818 20.336 30.449 1.00 46.90 O HETATM 2198 O HOH A 84 48.935 35.871 51.872 1.00 60.68 O HETATM 2199 O HOH A 85 47.986 46.035 25.896 1.00 38.95 O HETATM 2200 O HOH A 86 38.233 43.640 39.812 1.00 34.59 O HETATM 2201 O HOH A 87 60.167 40.735 40.266 1.00 45.31 O HETATM 2202 O HOH A 88 40.596 21.887 44.015 1.00 51.93 O HETATM 2203 O HOH A 89 30.790 33.122 40.277 1.00 38.82 O HETATM 2204 O HOH A 90 39.352 37.248 41.141 1.00 42.63 O HETATM 2205 O HOH A 91 37.224 16.292 23.841 1.00 29.45 O HETATM 2206 O HOH A 92 50.896 33.354 53.574 1.00 47.25 O HETATM 2207 O HOH A 97 33.786 13.848 8.734 1.00 45.71 O HETATM 2208 O HOH A 98 31.091 20.321 28.475 1.00 46.44 O HETATM 2209 O HOH A 99 29.350 37.855 28.182 1.00 41.65 O HETATM 2210 O HOH A 100 29.691 38.568 16.823 1.00 48.59 O HETATM 2211 O HOH A 101 21.703 26.599 17.804 1.00 48.34 O HETATM 2212 O HOH A 103 39.980 42.869 44.409 1.00 31.73 O HETATM 2213 O HOH A 104 19.625 21.608 26.002 1.00 57.44 O HETATM 2214 O HOH A 105 22.546 19.674 12.445 1.00 47.10 O HETATM 2215 O HOH A 106 56.512 40.573 34.373 1.00 49.67 O HETATM 2216 O HOH A 107 43.502 29.566 26.744 1.00 30.83 O HETATM 2217 O HOH A 108 47.504 41.795 6.869 1.00 34.51 O HETATM 2218 O HOH A 109 46.117 13.698 15.623 1.00 48.22 O HETATM 2219 O HOH A 110 29.992 37.035 14.266 1.00 51.63 O HETATM 2220 O HOH A 111 31.932 27.124 35.715 1.00 36.09 O HETATM 2221 O HOH A 112 30.684 35.973 38.392 1.00 42.08 O HETATM 2222 O HOH A 113 60.087 32.191 25.181 1.00 43.09 O HETATM 2223 O HOH A 114 35.826 27.308 5.453 1.00 41.34 O HETATM 2224 O HOH A 117 60.345 41.072 27.936 1.00 62.51 O HETATM 2225 O HOH A 118 41.574 25.101 28.036 1.00 47.61 O HETATM 2226 O HOH A 120 53.498 24.269 22.042 1.00 38.96 O HETATM 2227 O HOH A 122 42.348 48.473 24.514 1.00 44.36 O HETATM 2228 O HOH A 123 33.322 16.956 22.607 1.00 41.44 O HETATM 2229 O HOH A 124 35.953 42.282 42.495 1.00 50.84 O HETATM 2230 O HOH A 125 36.510 24.056 44.394 1.00 51.22 O HETATM 2231 O HOH A 126 33.197 42.541 34.292 1.00 38.74 O HETATM 2232 O HOH A 127 32.655 44.471 20.466 1.00 38.50 O HETATM 2233 O HOH A 130 54.378 54.739 38.013 1.00 35.60 O HETATM 2234 O HOH A 132 45.223 48.809 24.680 1.00 26.14 O HETATM 2235 O HOH A 134 37.596 43.902 31.850 1.00 42.32 O HETATM 2236 O HOH A 136 38.638 47.302 42.078 1.00 57.78 O HETATM 2237 O HOH A 139 41.404 42.379 0.485 1.00 61.47 O HETATM 2238 O HOH A 140 31.954 39.675 16.793 1.00 40.93 O HETATM 2239 O HOH A 141 57.448 45.999 28.196 1.00 52.68 O HETATM 2240 O HOH A 144 50.397 50.468 38.640 1.00 52.87 O HETATM 2241 O HOH A 145 34.422 19.653 37.524 1.00 42.41 O HETATM 2242 O HOH A 146 44.998 50.942 25.488 1.00 43.82 O HETATM 2243 O HOH A 147 27.836 18.067 24.997 1.00 40.31 O HETATM 2244 O HOH A 148 58.377 42.520 20.417 1.00 47.17 O HETATM 2245 O HOH A 149 34.373 27.828 2.920 1.00 47.61 O HETATM 2246 O HOH A 152 36.504 43.785 38.353 1.00 44.27 O HETATM 2247 O HOH A 153 45.315 48.090 45.352 1.00 51.62 O HETATM 2248 O HOH A 154 43.822 19.937 9.054 1.00 34.80 O HETATM 2249 O HOH A 155 25.142 35.358 24.563 1.00 39.71 O HETATM 2250 O HOH A 156 27.039 43.165 21.277 1.00 41.21 O HETATM 2251 O HOH A 157 38.056 31.689 45.918 1.00 35.82 O HETATM 2252 O HOH A 158 23.957 33.701 26.364 1.00 36.58 O HETATM 2253 O HOH A 159 32.663 41.588 36.398 1.00 54.49 O HETATM 2254 O HOH A 160 21.672 26.110 9.522 1.00 58.22 O HETATM 2255 O HOH A 162 20.685 15.397 17.428 1.00 52.84 O HETATM 2256 O HOH A 163 49.002 22.418 12.058 1.00 42.81 O HETATM 2257 O HOH A 165 38.089 49.148 29.643 1.00 44.54 O HETATM 2258 O HOH A 166 47.394 47.548 23.548 1.00 41.57 O HETATM 2259 O HOH A 167 28.447 20.540 11.218 1.00 45.09 O HETATM 2260 O HOH A 168 38.572 43.782 7.234 1.00 69.43 O HETATM 2261 O HOH A 169 29.798 36.240 35.895 1.00 54.66 O HETATM 2262 O HOH A 170 51.269 18.753 19.373 1.00 50.01 O HETATM 2263 O HOH A 171 57.369 51.417 33.567 1.00 49.60 O HETATM 2264 O HOH A 172 24.985 33.599 28.551 1.00 47.50 O HETATM 2265 O HOH A 173 36.711 45.469 36.453 1.00 50.14 O HETATM 2266 O HOH A 174 25.507 29.982 9.256 1.00 56.14 O HETATM 2267 O HOH A 176 60.405 32.516 32.248 1.00 44.82 O HETATM 2268 O HOH A 177 23.062 22.150 25.718 1.00 42.01 O HETATM 2269 O HOH A 178 50.694 20.978 23.121 1.00 45.70 O HETATM 2270 O HOH A 180 48.500 26.694 27.406 1.00 47.22 O HETATM 2271 O HOH A 181 53.035 42.109 47.107 1.00 51.36 O HETATM 2272 O HOH A 182 43.711 11.714 13.600 1.00 48.85 O HETATM 2273 O HOH A 183 36.194 42.056 45.287 1.00 53.94 O HETATM 2274 O HOH A 187 60.918 39.169 45.548 1.00 51.14 O HETATM 2275 O HOH A 188 31.831 36.230 13.564 1.00 50.35 O HETATM 2276 O HOH A 189 37.793 49.274 27.267 1.00 46.72 O HETATM 2277 O HOH A 192 49.944 24.912 27.750 1.00 76.36 O HETATM 2278 O HOH A 193 45.959 49.932 20.897 1.00 42.40 O HETATM 2279 O HOH A 196 31.441 23.865 32.982 1.00 49.52 O HETATM 2280 O HOH A 469 30.514 26.349 27.736 1.00 28.38 O HETATM 2281 O HOH A 470 60.486 35.773 43.780 1.00 64.10 O HETATM 2282 O HOH A 471 47.492 27.751 32.974 1.00 39.85 O HETATM 2283 O HOH A 472 39.528 45.803 35.712 1.00 49.82 O HETATM 2284 O HOH Z 53 60.271 36.208 11.915 1.00 38.67 O HETATM 2285 O HOH Z 66 58.863 40.630 11.296 1.00 56.40 O HETATM 2286 O HOH Z 67 58.604 43.873 11.368 1.00 49.66 O HETATM 2287 O HOH Z 93 59.601 34.228 9.551 1.00 41.94 O HETATM 2288 O HOH Z 96 63.184 35.819 14.291 1.00 51.27 O HETATM 2289 O HOH Z 116 59.818 41.451 18.342 1.00 47.54 O HETATM 2290 O HOH Z 143 57.308 30.077 8.620 1.00 52.73 O HETATM 2291 O HOH Z 150 57.590 31.432 6.627 1.00 38.03 O CONECT 2106 2107 CONECT 2107 2106 2108 2117 CONECT 2108 2107 2109 CONECT 2109 2108 2110 2116 CONECT 2110 2109 2111 2115 CONECT 2111 2110 2112 CONECT 2112 2111 2113 CONECT 2113 2112 2114 CONECT 2114 2113 2115 CONECT 2115 2110 2114 CONECT 2116 2109 2117 CONECT 2117 2107 2116 2118 CONECT 2118 2117 2119 CONECT 2119 2118 2120 CONECT 2120 2119 2121 CONECT 2121 2120 2122 2124 CONECT 2122 2121 2123 CONECT 2123 2122 2129 CONECT 2124 2121 2125 2127 CONECT 2125 2124 2126 CONECT 2126 2125 2128 CONECT 2127 2124 2128 2129 CONECT 2128 2126 2127 CONECT 2129 2123 2127 2130 CONECT 2130 2129 2131 CONECT 2131 2130 2132 2134 CONECT 2132 2131 2133 CONECT 2133 2132 CONECT 2134 2131 2135 2136 CONECT 2135 2134 CONECT 2136 2134 END