Browse entries in the PDBbind-CN Database
HEADER HYDROLASE/DNA 13-AUG-05 2AOQ TITLE CRYSTAL STRUCTURE OF MUTH-UNMETHYLATED DNA COMPLEX COMPND MOL_ID: 1; COMPND 2 MOLECULE: 5'-D(*GP*CP*AP*TP*GP*AP*TP*CP*AP*TP*GP*C)-3'; COMPND 3 CHAIN: B, C; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: DNA MISMATCH REPAIR PROTEIN MUTH; COMPND 7 CHAIN: A; COMPND 8 SYNONYM: METHYL-DIRECTED MISMATCH REPAIR PROTEIN; COMPND 9 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 MOL_ID: 2; SOURCE 4 ORGANISM_SCIENTIFIC: HAEMOPHILUS INFLUENZAE; SOURCE 5 ORGANISM_TAXID: 727; SOURCE 6 GENE: MUTH; SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 8 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 9 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 10 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 11 EXPRESSION_SYSTEM_PLASMID: PET15B-MUTH KEYWDS GATC RECOGNITION, HYDROLASE/DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR J.Y.LEE,J.CHANG,N.JOSEPH,R.GHIRLANDO,D.N.RAO,W.YANG REVDAT 2 24-FEB-09 2AOQ 1 VERSN REVDAT 1 11-OCT-05 2AOQ 0 JRNL AUTH J.Y.LEE,J.CHANG,N.JOSEPH,R.GHIRLANDO,D.N.RAO,W.YANG JRNL TITL MUTH COMPLEXED WITH HEMI- AND UNMETHYLATED DNAS: JRNL TITL 2 COUPLING BASE RECOGNITION AND DNA CLEAVAGE. JRNL REF MOL.CELL V. 20 155 2005 JRNL REFN ISSN 1097-2765 JRNL PMID 16209953 JRNL DOI 10.1016/J.MOLCEL.2005.08.019 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 2.20 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS 1.1 REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE- REMARK 3 : KUNSTLEVE,JIANG,KUSZEWSKI,NILGES, PANNU, REMARK 3 : READ,RICE,SIMONSON,WARREN REMARK 3 REMARK 3 REFINEMENT TARGET : ENGH & HUBER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.20 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 19.85 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 428123.820 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0000 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 90.8 REMARK 3 NUMBER OF REFLECTIONS : 16344 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING SET) : 0.199 REMARK 3 FREE R VALUE : 0.220 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 10.000 REMARK 3 FREE R VALUE TEST SET COUNT : 1642 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.005 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 6 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.20 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.34 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 61.10 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 1654 REMARK 3 BIN R VALUE (WORKING SET) : 0.3220 REMARK 3 BIN FREE R VALUE : 0.3700 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 9.70 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 177 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.028 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1710 REMARK 3 NUCLEIC ACID ATOMS : 486 REMARK 3 HETEROGEN ATOMS : 2 REMARK 3 SOLVENT ATOMS : 154 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 23.20 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 49.50 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 6.56000 REMARK 3 B22 (A**2) : 6.56000 REMARK 3 B33 (A**2) : -13.12000 REMARK 3 B12 (A**2) : 8.96000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.28 REMARK 3 ESD FROM SIGMAA (A) : 0.36 REMARK 3 LOW RESOLUTION CUTOFF (A) : 5.00 REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : 0.33 REMARK 3 ESD FROM C-V SIGMAA (A) : 0.41 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.006 REMARK 3 BOND ANGLES (DEGREES) : 1.20 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 21.30 REMARK 3 IMPROPER ANGLES (DEGREES) : 1.08 REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : RESTRAINED REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : 1.500 ; 1.500 REMARK 3 MAIN-CHAIN ANGLE (A**2) : 2.600 ; 2.000 REMARK 3 SIDE-CHAIN BOND (A**2) : 2.140 ; 2.000 REMARK 3 SIDE-CHAIN ANGLE (A**2) : 3.310 ; 2.500 REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : FLAT MODEL REMARK 3 KSOL : 0.36 REMARK 3 BSOL : 52.77 REMARK 3 REMARK 3 NCS MODEL : NULL REMARK 3 REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL REMARK 3 REMARK 3 PARAMETER FILE 1 : PROTEIN_REP.PARAM REMARK 3 PARAMETER FILE 2 : DNA-RNA_REP.PARAM REMARK 3 PARAMETER FILE 3 : WATER_REP.PARAM REMARK 3 PARAMETER FILE 4 : ION.PARAM REMARK 3 PARAMETER FILE 5 : NULL REMARK 3 TOPOLOGY FILE 1 : PROTEIN.TOP REMARK 3 TOPOLOGY FILE 2 : DNA-RNA.TOP REMARK 3 TOPOLOGY FILE 3 : WATER.TOP REMARK 3 TOPOLOGY FILE 4 : ION.TOP REMARK 3 TOPOLOGY FILE 5 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 2AOQ COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 25-AUG-05. REMARK 100 THE RCSB ID CODE IS RCSB034139. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 25-OCT-04 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 6.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 22-ID REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.000 REMARK 200 MONOCHROMATOR : MIRRORS REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARRESEARCH REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 16986 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.200 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 1.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 94.4 REMARK 200 DATA REDUNDANCY : 7.400 REMARK 200 R MERGE (I) : 0.06800 REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 30.4000 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 (%) : 64.6 REMARK 200 DATA REDUNDANCY IN SHELL : 4.50 REMARK 200 R MERGE FOR SHELL (I) : 0.35400 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : 1.650 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: PDB ENTRY 2AZO, CHAIN B REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 54.30 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.69 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: PEG 8000, CALCIUM ACETATE, REMARK 280 CACODYLATE, PH 6.5, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE REMARK 280 293K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 63 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z REMARK 290 3555 -X+Y,-X,Z REMARK 290 4555 -X,-Y,Z+1/2 REMARK 290 5555 Y,-X+Y,Z+1/2 REMARK 290 6555 X-Y,X,Z+1/2 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 23.37750 REMARK 290 SMTRY1 5 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 5 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 23.37750 REMARK 290 SMTRY1 6 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 23.37750 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: TRIMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: B, C, A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 LYS A 229 REMARK 465 SER A 230 REMARK 465 LEU A 231 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS(M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 LYS A 66 CG CD CE NZ REMARK 470 GLU A 68 CG CD OE1 OE2 REMARK 470 GLN A 102 CG CD OE1 NE2 REMARK 470 ASN A 103 CG OD1 ND2 REMARK 470 SER A 104 OG REMARK 470 VAL A 106 CG1 CG2 REMARK 470 LYS A 107 CD CE NZ REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ASP A 47 48.18 -153.10 REMARK 500 GLU A 68 -2.79 44.71 REMARK 500 LYS A 169 34.51 -86.79 REMARK 500 ALA A 175 -7.33 -59.78 REMARK 500 ASN A 189 -166.90 -174.46 REMARK 500 GLU A 227 20.06 -72.89 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 DA C 3 0.08 SIDE_CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH A 331 DISTANCE = 5.31 ANGSTROMS REMARK 525 HOH A 344 DISTANCE = 6.86 ANGSTROMS REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA A 232 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 DT C 4 O3' REMARK 620 2 DG C 5 OP1 53.2 REMARK 620 3 HOH A 259 O 79.3 89.2 REMARK 620 4 THR A 62 O 139.9 160.8 106.2 REMARK 620 5 ASP A 70 OD1 124.6 74.4 83.6 95.4 REMARK 620 6 HOH A 258 O 69.8 106.5 123.7 74.8 152.4 REMARK 620 7 GLU A 56 OE2 111.0 87.7 164.0 74.4 80.4 72.1 REMARK 620 N 1 2 3 4 5 6 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA A 233 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 LEU A 78 O REMARK 620 2 DG C 5 OP1 161.1 REMARK 620 3 GLU A 77 OE1 93.3 100.2 REMARK 620 4 HOH C 20 O 83.1 86.6 78.9 REMARK 620 5 HOH A 260 O 82.1 83.2 173.1 95.3 REMARK 620 6 ASP A 70 OD1 124.9 62.9 108.5 149.3 78.4 REMARK 620 7 ASP A 70 OD2 89.8 104.2 85.4 162.4 99.7 44.9 REMARK 620 N 1 2 3 4 5 6 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA A 232 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA A 233 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 2AOR RELATED DB: PDB DBREF 2AOQ A 9 231 UNP P44688 MUTH_HAEIN 1 223 DBREF 2AOQ B 1 12 PDB 2AOQ 2AOQ 1 12 DBREF 2AOQ C 1 12 PDB 2AOQ 2AOQ 1 12 SEQRES 1 B 12 DG DC DA DT DG DA DT DC DA DT DG DC SEQRES 1 C 12 DG DC DA DT DG DA DT DC DA DT DG DC SEQRES 1 A 223 MET ILE PRO GLN THR LEU GLU GLN LEU LEU SER GLN ALA SEQRES 2 A 223 GLN SER ILE ALA GLY LEU THR PHE GLY GLU LEU ALA ASP SEQRES 3 A 223 GLU LEU HIS ILE PRO VAL PRO ILE ASP LEU LYS ARG ASP SEQRES 4 A 223 LYS GLY TRP VAL GLY MET LEU LEU GLU ARG ALA LEU GLY SEQRES 5 A 223 ALA THR ALA GLY SER LYS ALA GLU GLN ASP PHE SER HIS SEQRES 6 A 223 LEU GLY VAL GLU LEU LYS THR LEU PRO ILE ASN ALA GLU SEQRES 7 A 223 GLY TYR PRO LEU GLU THR THR PHE VAL SER LEU ALA PRO SEQRES 8 A 223 LEU VAL GLN ASN SER GLY VAL LYS TRP GLU ASN SER HIS SEQRES 9 A 223 VAL ARG HIS LYS LEU SER CYS VAL LEU TRP MET PRO ILE SEQRES 10 A 223 GLU GLY SER ARG HIS ILE PRO LEU ARG GLU ARG HIS ILE SEQRES 11 A 223 GLY ALA PRO ILE PHE TRP LYS PRO THR ALA GLU GLN GLU SEQRES 12 A 223 ARG GLN LEU LYS GLN ASP TRP GLU GLU LEU MET ASP LEU SEQRES 13 A 223 ILE VAL LEU GLY LYS LEU ASP GLN ILE THR ALA ARG ILE SEQRES 14 A 223 GLY GLU VAL MET GLN LEU ARG PRO LYS GLY ALA ASN SER SEQRES 15 A 223 ARG ALA VAL THR LYS GLY ILE GLY LYS ASN GLY GLU ILE SEQRES 16 A 223 ILE ASP THR LEU PRO LEU GLY PHE TYR LEU ARG LYS GLU SEQRES 17 A 223 PHE THR ALA GLN ILE LEU ASN ALA PHE LEU GLU THR LYS SEQRES 18 A 223 SER LEU HET CA A 232 1 HET CA A 233 1 HETNAM CA CALCIUM ION FORMUL 4 CA 2(CA 2+) FORMUL 6 HOH *154(H2 O) HELIX 1 1 THR A 13 ALA A 25 1 13 HELIX 2 2 THR A 28 LEU A 36 1 9 HELIX 3 3 GLY A 49 GLY A 60 1 12 HELIX 4 5 SER A 111 LEU A 117 1 7 HELIX 5 6 PRO A 132 ARG A 136 5 5 HELIX 6 7 THR A 147 LEU A 167 1 21 HELIX 7 8 GLY A 168 GLN A 172 5 5 HELIX 8 9 ARG A 214 GLU A 227 1 14 SHEET 1 A 3 GLU A 77 ILE A 83 0 SHEET 2 A 3 VAL A 120 GLU A 126 1 O LEU A 121 N GLU A 77 SHEET 3 A 3 ILE A 142 TRP A 144 -1 O TRP A 144 N VAL A 120 SHEET 1 B 3 THR A 93 LEU A 97 0 SHEET 2 B 3 LEU A 209 LEU A 213 -1 O PHE A 211 N VAL A 95 SHEET 3 B 3 MET A 181 PRO A 185 -1 N ARG A 184 O GLY A 210 SHEET 1 C 2 THR A 194 ILE A 197 0 SHEET 2 C 2 ILE A 203 THR A 206 -1 O THR A 206 N THR A 194 LINK CA CA A 232 O3' DT C 4 1555 1555 2.98 LINK CA CA A 232 OP1 DG C 5 1555 1555 2.51 LINK CA CA A 232 O HOH A 259 1555 1555 2.29 LINK CA CA A 232 O THR A 62 1555 1555 2.88 LINK CA CA A 232 OD1 ASP A 70 1555 1555 2.29 LINK CA CA A 232 O HOH A 258 1555 1555 2.39 LINK CA CA A 232 OE2 GLU A 56 1555 1555 2.33 LINK CA CA A 233 O LEU A 78 1555 1555 2.35 LINK CA CA A 233 OP1 DG C 5 1555 1555 2.30 LINK CA CA A 233 OE1 GLU A 77 1555 1555 2.46 LINK CA CA A 233 O HOH C 20 1555 1555 2.50 LINK CA CA A 233 O HOH A 260 1555 1555 2.39 LINK CA CA A 233 OD1 ASP A 70 1555 1555 3.12 LINK CA CA A 233 OD2 ASP A 70 1555 1555 2.35 SITE 1 AC1 7 GLU A 56 THR A 62 ASP A 70 HOH A 258 SITE 2 AC1 7 HOH A 259 DT C 4 DG C 5 SITE 1 AC2 6 ASP A 70 GLU A 77 LEU A 78 HOH A 260 SITE 2 AC2 6 DG C 5 HOH C 20 CRYST1 114.624 114.624 46.755 90.00 90.00 120.00 P 63 12 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.008724 0.005037 0.000000 0.00000 SCALE2 0.000000 0.010074 0.000000 0.00000 SCALE3 0.000000 0.000000 0.021388 0.00000 ATOM 1 O5' DG B 1 61.021 61.689 22.404 1.00 61.67 O ATOM 2 C5' DG B 1 62.187 61.625 21.576 1.00 58.91 C ATOM 3 C4' DG B 1 61.828 61.361 20.132 1.00 59.55 C ATOM 4 O4' DG B 1 60.962 62.417 19.657 1.00 57.89 O ATOM 5 C3' DG B 1 63.020 61.343 19.179 1.00 58.87 C ATOM 6 O3' DG B 1 62.773 60.408 18.120 1.00 58.74 O ATOM 7 C2' DG B 1 63.091 62.779 18.687 1.00 57.52 C ATOM 8 C1' DG B 1 61.637 63.245 18.719 1.00 55.69 C ATOM 9 N9 DG B 1 61.460 64.625 19.164 1.00 53.76 N ATOM 10 C8 DG B 1 61.965 65.192 20.312 1.00 53.59 C ATOM 11 N7 DG B 1 61.604 66.438 20.473 1.00 51.93 N ATOM 12 C5 DG B 1 60.822 66.714 19.359 1.00 51.04 C ATOM 13 C6 DG B 1 60.140 67.901 18.988 1.00 49.62 C ATOM 14 O6 DG B 1 60.101 68.981 19.581 1.00 48.61 O ATOM 15 N1 DG B 1 59.455 67.746 17.791 1.00 49.57 N ATOM 16 C2 DG B 1 59.429 66.602 17.038 1.00 49.61 C ATOM 17 N2 DG B 1 58.704 66.662 15.907 1.00 48.96 N ATOM 18 N3 DG B 1 60.063 65.484 17.367 1.00 49.06 N ATOM 19 C4 DG B 1 60.731 65.612 18.532 1.00 50.98 C ATOM 20 P DC B 2 63.906 60.126 17.007 1.00 59.06 P ATOM 21 OP1 DC B 2 63.610 58.777 16.449 1.00 56.41 O ATOM 22 OP2 DC B 2 65.249 60.415 17.566 1.00 54.86 O ATOM 23 O5' DC B 2 63.597 61.210 15.879 1.00 56.36 O ATOM 24 C5' DC B 2 62.384 61.144 15.129 1.00 54.11 C ATOM 25 C4' DC B 2 62.320 62.269 14.122 1.00 51.72 C ATOM 26 O4' DC B 2 62.111 63.546 14.775 1.00 49.82 O ATOM 27 C3' DC B 2 63.564 62.442 13.250 1.00 50.02 C ATOM 28 O3' DC B 2 63.135 62.843 11.953 1.00 51.13 O ATOM 29 C2' DC B 2 64.273 63.616 13.900 1.00 49.39 C ATOM 30 C1' DC B 2 63.082 64.464 14.305 1.00 48.79 C ATOM 31 N1 DC B 2 63.326 65.451 15.364 1.00 47.53 N ATOM 32 C2 DC B 2 62.665 66.671 15.289 1.00 47.18 C ATOM 33 O2 DC B 2 61.915 66.877 14.323 1.00 48.90 O ATOM 34 N3 DC B 2 62.861 67.595 16.259 1.00 46.47 N ATOM 35 C4 DC B 2 63.684 67.329 17.272 1.00 46.92 C ATOM 36 N4 DC B 2 63.832 68.258 18.217 1.00 47.59 N ATOM 37 C5 DC B 2 64.389 66.094 17.367 1.00 46.44 C ATOM 38 C6 DC B 2 64.179 65.190 16.401 1.00 46.22 C ATOM 39 P DA B 3 63.775 62.168 10.654 1.00 48.43 P ATOM 40 OP1 DA B 3 63.268 60.777 10.546 1.00 48.28 O ATOM 41 OP2 DA B 3 65.242 62.422 10.698 1.00 48.81 O ATOM 42 O5' DA B 3 63.122 62.999 9.463 1.00 48.55 O ATOM 43 C5' DA B 3 61.706 63.084 9.336 1.00 46.02 C ATOM 44 C4' DA B 3 61.306 64.435 8.793 1.00 44.54 C ATOM 45 O4' DA B 3 61.567 65.473 9.764 1.00 45.11 O ATOM 46 C3' DA B 3 62.039 64.856 7.527 1.00 44.76 C ATOM 47 O3' DA B 3 61.126 65.568 6.695 1.00 45.31 O ATOM 48 C2' DA B 3 63.154 65.745 8.047 1.00 43.38 C ATOM 49 C1' DA B 3 62.535 66.395 9.274 1.00 43.56 C ATOM 50 N9 DA B 3 63.489 66.628 10.356 1.00 43.36 N ATOM 51 C8 DA B 3 64.506 65.797 10.757 1.00 42.88 C ATOM 52 N7 DA B 3 65.161 66.231 11.808 1.00 43.08 N ATOM 53 C5 DA B 3 64.539 67.434 12.114 1.00 40.82 C ATOM 54 C6 DA B 3 64.748 68.371 13.138 1.00 40.88 C ATOM 55 N6 DA B 3 65.653 68.216 14.109 1.00 40.65 N ATOM 56 N1 DA B 3 63.976 69.479 13.144 1.00 41.36 N ATOM 57 C2 DA B 3 63.041 69.612 12.197 1.00 41.85 C ATOM 58 N3 DA B 3 62.730 68.788 11.199 1.00 42.68 N ATOM 59 C4 DA B 3 63.526 67.705 11.212 1.00 42.17 C ATOM 60 P DT B 4 61.621 66.178 5.298 1.00 45.92 P ATOM 61 OP1 DT B 4 60.645 65.757 4.266 1.00 48.47 O ATOM 62 OP2 DT B 4 63.062 65.897 5.099 1.00 47.77 O ATOM 63 O5' DT B 4 61.445 67.742 5.534 1.00 46.26 O ATOM 64 C5' DT B 4 60.356 68.232 6.313 1.00 43.57 C ATOM 65 C4' DT B 4 60.548 69.696 6.625 1.00 43.21 C ATOM 66 O4' DT B 4 61.556 69.857 7.650 1.00 43.97 O ATOM 67 C3' DT B 4 61.000 70.541 5.436 1.00 45.81 C ATOM 68 O3' DT B 4 60.308 71.797 5.424 1.00 46.69 O ATOM 69 C2' DT B 4 62.495 70.712 5.667 1.00 45.37 C ATOM 70 C1' DT B 4 62.630 70.659 7.185 1.00 42.38 C ATOM 71 N1 DT B 4 63.879 70.048 7.689 1.00 42.25 N ATOM 72 C2 DT B 4 64.467 70.622 8.788 1.00 42.76 C ATOM 73 O2 DT B 4 64.056 71.646 9.300 1.00 48.14 O ATOM 74 N3 DT B 4 65.569 69.954 9.266 1.00 41.47 N ATOM 75 C4 DT B 4 66.145 68.809 8.746 1.00 39.61 C ATOM 76 O4 DT B 4 67.110 68.298 9.306 1.00 40.50 O ATOM 77 C5 DT B 4 65.523 68.297 7.554 1.00 39.34 C ATOM 78 C7 DT B 4 66.133 67.107 6.881 1.00 37.20 C ATOM 79 C6 DT B 4 64.425 68.923 7.094 1.00 40.55 C ATOM 80 P DG B 5 60.426 72.759 4.143 1.00 49.05 P ATOM 81 OP1 DG B 5 59.093 73.380 3.925 1.00 48.81 O ATOM 82 OP2 DG B 5 61.076 72.019 3.036 1.00 48.20 O ATOM 83 O5' DG B 5 61.421 73.889 4.651 1.00 48.10 O ATOM 84 C5' DG B 5 61.144 74.565 5.867 1.00 47.75 C ATOM 85 C4' DG B 5 62.376 75.268 6.387 1.00 48.41 C ATOM 86 O4' DG B 5 63.343 74.309 6.879 1.00 47.14 O ATOM 87 C3' DG B 5 63.124 76.173 5.404 1.00 47.55 C ATOM 88 O3' DG B 5 63.401 77.409 6.072 1.00 47.47 O ATOM 89 C2' DG B 5 64.401 75.399 5.115 1.00 45.87 C ATOM 90 C1' DG B 5 64.632 74.681 6.433 1.00 44.46 C ATOM 91 N9 DG B 5 65.469 73.480 6.382 1.00 41.20 N ATOM 92 C8 DG B 5 65.447 72.477 5.441 1.00 40.73 C ATOM 93 N7 DG B 5 66.338 71.547 5.663 1.00 40.80 N ATOM 94 C5 DG B 5 66.986 71.961 6.821 1.00 39.23 C ATOM 95 C6 DG B 5 68.065 71.371 7.546 1.00 38.47 C ATOM 96 O6 DG B 5 68.691 70.338 7.296 1.00 40.15 O ATOM 97 N1 DG B 5 68.402 72.123 8.662 1.00 34.97 N ATOM 98 C2 DG B 5 67.797 73.295 9.032 1.00 34.52 C ATOM 99 N2 DG B 5 68.267 73.878 10.144 1.00 37.21 N ATOM 100 N3 DG B 5 66.806 73.858 8.367 1.00 35.46 N ATOM 101 C4 DG B 5 66.452 73.145 7.282 1.00 37.67 C ATOM 102 P DA B 6 64.393 78.492 5.412 1.00 51.89 P ATOM 103 OP1 DA B 6 63.790 79.826 5.686 1.00 52.65 O ATOM 104 OP2 DA B 6 64.739 78.119 4.017 1.00 48.48 O ATOM 105 O5' DA B 6 65.683 78.359 6.332 1.00 47.59 O ATOM 106 C5' DA B 6 65.528 78.258 7.738 1.00 44.19 C ATOM 107 C4' DA B 6 66.868 78.325 8.426 1.00 44.16 C ATOM 108 O4' DA B 6 67.532 77.038 8.379 1.00 43.39 O ATOM 109 C3' DA B 6 67.837 79.353 7.839 1.00 44.13 C ATOM 110 O3' DA B 6 68.362 80.161 8.890 1.00 44.63 O ATOM 111 C2' DA B 6 68.914 78.509 7.170 1.00 41.32 C ATOM 112 C1' DA B 6 68.880 77.195 7.942 1.00 41.90 C ATOM 113 N9 DA B 6 69.227 76.014 7.141 1.00 40.19 N ATOM 114 C8 DA B 6 68.689 75.658 5.930 1.00 37.43 C ATOM 115 N7 DA B 6 69.174 74.544 5.443 1.00 36.79 N ATOM 116 C5 DA B 6 70.101 74.138 6.393 1.00 38.22 C ATOM 117 C6 DA B 6 70.963 73.019 6.462 1.00 38.55 C ATOM 118 N6 DA B 6 71.033 72.078 5.518 1.00 36.45 N ATOM 119 N1 DA B 6 71.757 72.904 7.546 1.00 36.95 N ATOM 120 C2 DA B 6 71.683 73.850 8.489 1.00 36.26 C ATOM 121 N3 DA B 6 70.921 74.943 8.536 1.00 36.44 N ATOM 122 C4 DA B 6 70.145 75.032 7.444 1.00 36.70 C ATOM 123 P DT B 7 69.515 81.232 8.577 1.00 47.11 P ATOM 124 OP1 DT B 7 69.467 82.228 9.673 1.00 45.48 O ATOM 125 OP2 DT B 7 69.418 81.681 7.167 1.00 45.57 O ATOM 126 O5' DT B 7 70.830 80.362 8.781 1.00 48.33 O ATOM 127 C5' DT B 7 70.957 79.585 9.964 1.00 46.70 C ATOM 128 C4' DT B 7 72.280 78.865 10.003 1.00 46.87 C ATOM 129 O4' DT B 7 72.240 77.698 9.149 1.00 45.42 O ATOM 130 C3' DT B 7 73.501 79.685 9.585 1.00 45.78 C ATOM 131 O3' DT B 7 74.461 79.686 10.638 1.00 49.49 O ATOM 132 C2' DT B 7 74.041 78.949 8.367 1.00 45.07 C ATOM 133 C1' DT B 7 73.493 77.538 8.532 1.00 42.66 C ATOM 134 N1 DT B 7 73.283 76.803 7.270 1.00 39.35 N ATOM 135 C2 DT B 7 73.965 75.622 7.095 1.00 37.87 C ATOM 136 O2 DT B 7 74.691 75.152 7.951 1.00 40.41 O ATOM 137 N3 DT B 7 73.764 75.013 5.881 1.00 33.93 N ATOM 138 C4 DT B 7 72.960 75.466 4.849 1.00 36.84 C ATOM 139 O4 DT B 7 72.893 74.836 3.796 1.00 37.56 O ATOM 140 C5 DT B 7 72.253 76.698 5.112 1.00 37.71 C ATOM 141 C7 DT B 7 71.348 77.250 4.058 1.00 39.43 C ATOM 142 C6 DT B 7 72.444 77.297 6.296 1.00 38.60 C ATOM 143 P DC B 8 75.616 80.804 10.662 1.00 48.90 P ATOM 144 OP1 DC B 8 75.633 81.419 12.007 1.00 49.51 O ATOM 145 OP2 DC B 8 75.477 81.662 9.461 1.00 50.35 O ATOM 146 O5' DC B 8 76.939 79.936 10.505 1.00 50.17 O ATOM 147 C5' DC B 8 77.162 78.801 11.337 1.00 48.15 C ATOM 148 C4' DC B 8 78.427 78.101 10.909 1.00 49.85 C ATOM 149 O4' DC B 8 78.174 77.068 9.923 1.00 47.44 O ATOM 150 C3' DC B 8 79.422 79.065 10.273 1.00 49.37 C ATOM 151 O3' DC B 8 80.718 78.863 10.801 1.00 53.53 O ATOM 152 C2' DC B 8 79.414 78.685 8.806 1.00 47.87 C ATOM 153 C1' DC B 8 79.101 77.205 8.865 1.00 45.50 C ATOM 154 N1 DC B 8 78.492 76.669 7.633 1.00 43.06 N ATOM 155 C2 DC B 8 79.029 75.513 7.080 1.00 41.58 C ATOM 156 O2 DC B 8 79.953 74.942 7.679 1.00 39.16 O ATOM 157 N3 DC B 8 78.529 75.043 5.914 1.00 40.02 N ATOM 158 C4 DC B 8 77.519 75.682 5.317 1.00 40.66 C ATOM 159 N4 DC B 8 77.066 75.197 4.153 1.00 37.97 N ATOM 160 C5 DC B 8 76.931 76.848 5.880 1.00 37.35 C ATOM 161 C6 DC B 8 77.440 77.300 7.028 1.00 40.46 C ATOM 162 P DA B 9 81.857 79.939 10.492 1.00 54.00 P ATOM 163 OP1 DA B 9 82.461 80.293 11.805 1.00 55.54 O ATOM 164 OP2 DA B 9 81.285 81.002 9.629 1.00 53.34 O ATOM 165 O5' DA B 9 82.896 79.109 9.628 1.00 52.76 O ATOM 166 C5' DA B 9 83.476 77.936 10.161 1.00 50.11 C ATOM 167 C4' DA B 9 84.422 77.327 9.159 1.00 50.23 C ATOM 168 O4' DA B 9 83.674 76.657 8.115 1.00 48.24 O ATOM 169 C3' DA B 9 85.332 78.339 8.463 1.00 49.71 C ATOM 170 O3' DA B 9 86.666 77.835 8.451 1.00 51.99 O ATOM 171 C2' DA B 9 84.753 78.435 7.059 1.00 48.02 C ATOM 172 C1' DA B 9 84.178 77.043 6.850 1.00 47.19 C ATOM 173 N9 DA B 9 83.080 76.930 5.887 1.00 43.59 N ATOM 174 C8 DA B 9 81.911 77.642 5.857 1.00 40.85 C ATOM 175 N7 DA B 9 81.103 77.290 4.887 1.00 40.42 N ATOM 176 C5 DA B 9 81.789 76.283 4.229 1.00 37.42 C ATOM 177 C6 DA B 9 81.467 75.498 3.110 1.00 37.83 C ATOM 178 N6 DA B 9 80.324 75.613 2.432 1.00 35.53 N ATOM 179 N1 DA B 9 82.371 74.581 2.705 1.00 37.24 N ATOM 180 C2 DA B 9 83.517 74.475 3.384 1.00 38.14 C ATOM 181 N3 DA B 9 83.933 75.156 4.449 1.00 38.43 N ATOM 182 C4 DA B 9 83.011 76.054 4.827 1.00 39.02 C ATOM 183 P DT B 10 87.878 78.796 8.022 1.00 54.82 P ATOM 184 OP1 DT B 10 89.075 78.321 8.761 1.00 56.09 O ATOM 185 OP2 DT B 10 87.469 80.224 8.119 1.00 53.64 O ATOM 186 O5' DT B 10 88.075 78.425 6.491 1.00 53.74 O ATOM 187 C5' DT B 10 88.217 77.065 6.111 1.00 53.00 C ATOM 188 C4' DT B 10 88.308 76.943 4.610 1.00 53.68 C ATOM 189 O4' DT B 10 86.996 76.815 4.010 1.00 52.32 O ATOM 190 C3' DT B 10 89.005 78.109 3.903 1.00 54.26 C ATOM 191 O3' DT B 10 90.030 77.616 3.042 1.00 58.24 O ATOM 192 C2' DT B 10 87.897 78.742 3.075 1.00 52.55 C ATOM 193 C1' DT B 10 86.987 77.553 2.803 1.00 51.74 C ATOM 194 N1 DT B 10 85.580 77.877 2.466 1.00 48.45 N ATOM 195 C2 DT B 10 84.984 77.203 1.418 1.00 46.92 C ATOM 196 O2 DT B 10 85.554 76.352 0.756 1.00 47.45 O ATOM 197 N3 DT B 10 83.683 77.564 1.173 1.00 45.54 N ATOM 198 C4 DT B 10 82.934 78.499 1.854 1.00 45.03 C ATOM 199 O4 DT B 10 81.764 78.699 1.532 1.00 46.42 O ATOM 200 C5 DT B 10 83.622 79.174 2.931 1.00 45.93 C ATOM 201 C7 DT B 10 82.896 80.223 3.711 1.00 45.34 C ATOM 202 C6 DT B 10 84.891 78.829 3.183 1.00 46.36 C ATOM 203 P DG B 11 91.233 78.586 2.597 1.00 60.96 P ATOM 204 OP1 DG B 11 92.510 77.949 3.010 1.00 59.37 O ATOM 205 OP2 DG B 11 90.936 79.983 3.022 1.00 57.61 O ATOM 206 O5' DG B 11 91.152 78.516 1.014 1.00 56.84 O ATOM 207 C5' DG B 11 91.122 77.257 0.359 1.00 56.02 C ATOM 208 C4' DG B 11 90.810 77.450 -1.104 1.00 55.92 C ATOM 209 O4' DG B 11 89.390 77.648 -1.297 1.00 56.07 O ATOM 210 C3' DG B 11 91.501 78.670 -1.702 1.00 56.64 C ATOM 211 O3' DG B 11 92.063 78.334 -2.964 1.00 58.06 O ATOM 212 C2' DG B 11 90.386 79.699 -1.822 1.00 54.34 C ATOM 213 C1' DG B 11 89.153 78.836 -2.036 1.00 53.42 C ATOM 214 N9 DG B 11 87.894 79.408 -1.564 1.00 50.73 N ATOM 215 C8 DG B 11 87.705 80.233 -0.480 1.00 51.08 C ATOM 216 N7 DG B 11 86.451 80.541 -0.279 1.00 49.45 N ATOM 217 C5 DG B 11 85.772 79.887 -1.297 1.00 48.04 C ATOM 218 C6 DG B 11 84.381 79.836 -1.590 1.00 47.48 C ATOM 219 O6 DG B 11 83.446 80.373 -0.987 1.00 46.72 O ATOM 220 N1 DG B 11 84.126 79.062 -2.715 1.00 46.51 N ATOM 221 C2 DG B 11 85.084 78.428 -3.470 1.00 47.25 C ATOM 222 N2 DG B 11 84.645 77.750 -4.542 1.00 46.09 N ATOM 223 N3 DG B 11 86.378 78.460 -3.201 1.00 47.47 N ATOM 224 C4 DG B 11 86.646 79.200 -2.108 1.00 47.70 C ATOM 225 P DC B 12 92.980 79.401 -3.728 1.00 61.37 P ATOM 226 OP1 DC B 12 94.124 78.655 -4.314 1.00 62.49 O ATOM 227 OP2 DC B 12 93.241 80.541 -2.815 1.00 59.08 O ATOM 228 O5' DC B 12 92.028 79.898 -4.905 1.00 61.08 O ATOM 229 C5' DC B 12 91.427 78.956 -5.791 1.00 59.13 C ATOM 230 C4' DC B 12 90.360 79.620 -6.634 1.00 59.43 C ATOM 231 O4' DC B 12 89.165 79.877 -5.854 1.00 58.02 O ATOM 232 C3' DC B 12 90.746 80.959 -7.270 1.00 58.81 C ATOM 233 O3' DC B 12 90.105 81.071 -8.538 1.00 63.30 O ATOM 234 C2' DC B 12 90.017 81.972 -6.408 1.00 56.33 C ATOM 235 C1' DC B 12 88.748 81.209 -6.102 1.00 53.67 C ATOM 236 N1 DC B 12 87.974 81.685 -4.947 1.00 47.08 N ATOM 237 C2 DC B 12 86.591 81.550 -4.985 1.00 44.28 C ATOM 238 O2 DC B 12 86.081 80.941 -5.936 1.00 41.73 O ATOM 239 N3 DC B 12 85.845 82.071 -3.986 1.00 43.92 N ATOM 240 C4 DC B 12 86.440 82.689 -2.964 1.00 45.36 C ATOM 241 N4 DC B 12 85.661 83.222 -2.017 1.00 46.26 N ATOM 242 C5 DC B 12 87.859 82.793 -2.871 1.00 44.03 C ATOM 243 C6 DC B 12 88.581 82.280 -3.877 1.00 45.15 C TER 244 DC B 12 ATOM 245 O5' DG C 1 75.798 84.851 -5.085 1.00 59.98 O ATOM 246 C5' DG C 1 75.836 85.034 -6.498 1.00 58.61 C ATOM 247 C4' DG C 1 76.539 83.901 -7.209 1.00 58.15 C ATOM 248 O4' DG C 1 77.920 83.845 -6.794 1.00 57.02 O ATOM 249 C3' DG C 1 75.972 82.510 -6.940 1.00 58.91 C ATOM 250 O3' DG C 1 76.083 81.736 -8.132 1.00 59.61 O ATOM 251 C2' DG C 1 76.880 81.967 -5.848 1.00 57.51 C ATOM 252 C1' DG C 1 78.216 82.586 -6.210 1.00 55.49 C ATOM 253 N9 DG C 1 79.117 82.836 -5.091 1.00 52.83 N ATOM 254 C8 DG C 1 78.830 83.501 -3.925 1.00 52.71 C ATOM 255 N7 DG C 1 79.868 83.634 -3.141 1.00 51.29 N ATOM 256 C5 DG C 1 80.896 83.007 -3.829 1.00 48.90 C ATOM 257 C6 DG C 1 82.263 82.853 -3.494 1.00 47.87 C ATOM 258 O6 DG C 1 82.869 83.284 -2.501 1.00 45.88 O ATOM 259 N1 DG C 1 82.948 82.131 -4.466 1.00 47.28 N ATOM 260 C2 DG C 1 82.400 81.645 -5.622 1.00 47.05 C ATOM 261 N2 DG C 1 83.232 80.973 -6.437 1.00 44.23 N ATOM 262 N3 DG C 1 81.130 81.802 -5.958 1.00 49.11 N ATOM 263 C4 DG C 1 80.446 82.486 -5.022 1.00 49.90 C ATOM 264 P DC C 2 75.409 80.285 -8.206 1.00 63.56 P ATOM 265 OP1 DC C 2 74.803 80.159 -9.557 1.00 62.42 O ATOM 266 OP2 DC C 2 74.574 80.059 -6.996 1.00 63.64 O ATOM 267 O5' DC C 2 76.657 79.301 -8.145 1.00 61.65 O ATOM 268 C5' DC C 2 77.660 79.358 -9.150 1.00 58.75 C ATOM 269 C4' DC C 2 78.771 78.388 -8.835 1.00 57.76 C ATOM 270 O4' DC C 2 79.569 78.853 -7.720 1.00 56.04 O ATOM 271 C3' DC C 2 78.316 76.976 -8.469 1.00 57.20 C ATOM 272 O3' DC C 2 79.234 76.064 -9.062 1.00 57.73 O ATOM 273 C2' DC C 2 78.458 76.947 -6.956 1.00 54.57 C ATOM 274 C1' DC C 2 79.690 77.813 -6.764 1.00 52.97 C ATOM 275 N1 DC C 2 79.861 78.434 -5.440 1.00 48.95 N ATOM 276 C2 DC C 2 81.134 78.436 -4.870 1.00 46.60 C ATOM 277 O2 DC C 2 82.066 77.902 -5.487 1.00 48.29 O ATOM 278 N3 DC C 2 81.322 79.019 -3.669 1.00 45.32 N ATOM 279 C4 DC C 2 80.297 79.592 -3.038 1.00 46.21 C ATOM 280 N4 DC C 2 80.538 80.172 -1.858 1.00 41.98 N ATOM 281 C5 DC C 2 78.980 79.598 -3.590 1.00 46.58 C ATOM 282 C6 DC C 2 78.809 79.009 -4.782 1.00 48.30 C ATOM 283 P DA C 3 78.735 74.618 -9.528 1.00 60.90 P ATOM 284 OP1 DA C 3 79.112 74.460 -10.957 1.00 60.58 O ATOM 285 OP2 DA C 3 77.321 74.423 -9.113 1.00 60.84 O ATOM 286 O5' DA C 3 79.662 73.650 -8.674 1.00 59.47 O ATOM 287 C5' DA C 3 81.067 73.641 -8.889 1.00 57.38 C ATOM 288 C4' DA C 3 81.775 73.078 -7.682 1.00 54.76 C ATOM 289 O4' DA C 3 81.923 74.096 -6.656 1.00 54.18 O ATOM 290 C3' DA C 3 81.038 71.904 -7.035 1.00 51.74 C ATOM 291 O3' DA C 3 81.916 70.806 -6.820 1.00 49.15 O ATOM 292 C2' DA C 3 80.598 72.455 -5.695 1.00 53.53 C ATOM 293 C1' DA C 3 81.652 73.507 -5.407 1.00 51.71 C ATOM 294 N9 DA C 3 81.156 74.528 -4.485 1.00 47.48 N ATOM 295 C8 DA C 3 79.878 75.013 -4.411 1.00 46.10 C ATOM 296 N7 DA C 3 79.662 75.776 -3.371 1.00 47.04 N ATOM 297 C5 DA C 3 80.891 75.830 -2.737 1.00 44.33 C ATOM 298 C6 DA C 3 81.307 76.447 -1.556 1.00 43.69 C ATOM 299 N6 DA C 3 80.484 77.121 -0.756 1.00 41.93 N ATOM 300 N1 DA C 3 82.609 76.330 -1.208 1.00 46.23 N ATOM 301 C2 DA C 3 83.420 75.618 -2.003 1.00 45.31 C ATOM 302 N3 DA C 3 83.137 74.968 -3.128 1.00 46.78 N ATOM 303 C4 DA C 3 81.837 75.110 -3.443 1.00 46.98 C ATOM 304 P DT C 4 81.368 69.471 -6.109 1.00 45.95 P ATOM 305 OP1 DT C 4 81.653 68.346 -7.029 1.00 42.94 O ATOM 306 OP2 DT C 4 79.984 69.686 -5.625 1.00 44.36 O ATOM 307 O5' DT C 4 82.303 69.360 -4.826 1.00 43.68 O ATOM 308 C5' DT C 4 83.716 69.434 -4.957 1.00 42.11 C ATOM 309 C4' DT C 4 84.351 69.734 -3.624 1.00 40.88 C ATOM 310 O4' DT C 4 84.093 71.109 -3.248 1.00 42.00 O ATOM 311 C3' DT C 4 83.823 68.947 -2.436 1.00 40.64 C ATOM 312 O3' DT C 4 84.357 67.627 -2.382 1.00 38.50 O ATOM 313 C2' DT C 4 84.292 69.805 -1.268 1.00 38.64 C ATOM 314 C1' DT C 4 84.115 71.218 -1.834 1.00 39.84 C ATOM 315 N1 DT C 4 82.867 71.862 -1.382 1.00 39.02 N ATOM 316 C2 DT C 4 82.930 72.581 -0.215 1.00 38.80 C ATOM 317 O2 DT C 4 83.958 72.703 0.430 1.00 40.59 O ATOM 318 N3 DT C 4 81.747 73.152 0.174 1.00 37.15 N ATOM 319 C4 DT C 4 80.533 73.080 -0.472 1.00 37.29 C ATOM 320 O4 DT C 4 79.553 73.666 0.004 1.00 35.99 O ATOM 321 C5 DT C 4 80.535 72.293 -1.696 1.00 36.59 C ATOM 322 C7 DT C 4 79.260 72.120 -2.453 1.00 38.40 C ATOM 323 C6 DT C 4 81.691 71.741 -2.088 1.00 37.00 C ATOM 324 P DG C 5 83.453 66.429 -1.799 1.00 36.68 P ATOM 325 OP1 DG C 5 84.273 65.196 -1.812 1.00 36.30 O ATOM 326 OP2 DG C 5 82.134 66.446 -2.497 1.00 36.78 O ATOM 327 O5' DG C 5 83.219 66.832 -0.279 1.00 36.19 O ATOM 328 C5' DG C 5 84.320 66.914 0.610 1.00 34.94 C ATOM 329 C4' DG C 5 83.874 67.399 1.967 1.00 35.57 C ATOM 330 O4' DG C 5 83.544 68.810 1.951 1.00 33.81 O ATOM 331 C3' DG C 5 82.631 66.775 2.576 1.00 32.95 C ATOM 332 O3' DG C 5 82.953 65.479 3.056 1.00 34.57 O ATOM 333 C2' DG C 5 82.345 67.749 3.718 1.00 32.24 C ATOM 334 C1' DG C 5 82.772 69.094 3.106 1.00 32.66 C ATOM 335 N9 DG C 5 81.617 69.890 2.740 1.00 31.54 N ATOM 336 C8 DG C 5 80.735 69.683 1.704 1.00 31.33 C ATOM 337 N7 DG C 5 79.726 70.510 1.715 1.00 29.44 N ATOM 338 C5 DG C 5 79.973 71.321 2.810 1.00 27.23 C ATOM 339 C6 DG C 5 79.215 72.394 3.342 1.00 26.81 C ATOM 340 O6 DG C 5 78.125 72.827 2.957 1.00 29.75 O ATOM 341 N1 DG C 5 79.842 72.966 4.443 1.00 26.13 N ATOM 342 C2 DG C 5 81.041 72.548 4.975 1.00 30.13 C ATOM 343 N2 DG C 5 81.507 73.239 6.042 1.00 29.52 N ATOM 344 N3 DG C 5 81.742 71.529 4.503 1.00 28.23 N ATOM 345 C4 DG C 5 81.147 70.978 3.429 1.00 28.49 C ATOM 346 P DA C 6 81.786 64.480 3.525 1.00 30.50 P ATOM 347 OP1 DA C 6 82.457 63.238 4.007 1.00 32.87 O ATOM 348 OP2 DA C 6 80.769 64.392 2.455 1.00 31.60 O ATOM 349 O5' DA C 6 81.185 65.218 4.795 1.00 32.30 O ATOM 350 C5' DA C 6 79.789 65.414 4.966 1.00 29.98 C ATOM 351 C4' DA C 6 79.574 66.606 5.862 1.00 29.76 C ATOM 352 O4' DA C 6 79.291 67.776 5.064 1.00 30.64 O ATOM 353 C3' DA C 6 78.422 66.545 6.837 1.00 30.55 C ATOM 354 O3' DA C 6 78.874 65.854 7.986 1.00 31.34 O ATOM 355 C2' DA C 6 78.196 68.019 7.160 1.00 30.63 C ATOM 356 C1' DA C 6 78.567 68.697 5.839 1.00 29.31 C ATOM 357 N9 DA C 6 77.435 69.193 5.059 1.00 30.24 N ATOM 358 C8 DA C 6 76.764 68.643 3.993 1.00 30.18 C ATOM 359 N7 DA C 6 75.776 69.393 3.549 1.00 28.41 N ATOM 360 C5 DA C 6 75.809 70.506 4.376 1.00 29.19 C ATOM 361 C6 DA C 6 75.028 71.671 4.431 1.00 29.31 C ATOM 362 N6 DA C 6 74.015 71.931 3.608 1.00 27.30 N ATOM 363 N1 DA C 6 75.330 72.579 5.380 1.00 31.97 N ATOM 364 C2 DA C 6 76.347 72.328 6.210 1.00 31.74 C ATOM 365 N3 DA C 6 77.150 71.276 6.260 1.00 31.05 N ATOM 366 C4 DA C 6 76.824 70.393 5.305 1.00 30.61 C ATOM 367 P DT C 7 77.812 65.312 9.051 1.00 32.62 P ATOM 368 OP1 DT C 7 78.580 64.388 9.931 1.00 30.91 O ATOM 369 OP2 DT C 7 76.621 64.825 8.306 1.00 32.42 O ATOM 370 O5' DT C 7 77.406 66.605 9.879 1.00 30.48 O ATOM 371 C5' DT C 7 78.407 67.361 10.540 1.00 30.27 C ATOM 372 C4' DT C 7 77.788 68.537 11.246 1.00 32.22 C ATOM 373 O4' DT C 7 77.067 69.328 10.270 1.00 33.97 O ATOM 374 C3' DT C 7 76.775 68.169 12.334 1.00 33.54 C ATOM 375 O3' DT C 7 76.953 69.063 13.432 1.00 38.92 O ATOM 376 C2' DT C 7 75.432 68.365 11.661 1.00 33.07 C ATOM 377 C1' DT C 7 75.713 69.479 10.673 1.00 32.52 C ATOM 378 N1 DT C 7 74.877 69.440 9.467 1.00 30.74 N ATOM 379 C2 DT C 7 74.156 70.563 9.184 1.00 28.42 C ATOM 380 O2 DT C 7 74.186 71.551 9.886 1.00 28.96 O ATOM 381 N3 DT C 7 73.403 70.494 8.048 1.00 27.62 N ATOM 382 C4 DT C 7 73.317 69.435 7.169 1.00 28.40 C ATOM 383 O4 DT C 7 72.618 69.534 6.165 1.00 27.69 O ATOM 384 C5 DT C 7 74.102 68.272 7.529 1.00 29.46 C ATOM 385 C7 DT C 7 74.079 67.071 6.635 1.00 28.93 C ATOM 386 C6 DT C 7 74.828 68.329 8.652 1.00 31.03 C ATOM 387 P DC C 8 75.907 69.080 14.646 1.00 38.20 P ATOM 388 OP1 DC C 8 76.724 69.213 15.874 1.00 38.25 O ATOM 389 OP2 DC C 8 74.943 67.961 14.527 1.00 39.81 O ATOM 390 O5' DC C 8 75.145 70.456 14.412 1.00 39.63 O ATOM 391 C5' DC C 8 75.885 71.638 14.115 1.00 39.56 C ATOM 392 C4' DC C 8 74.956 72.821 13.988 1.00 40.89 C ATOM 393 O4' DC C 8 74.126 72.670 12.814 1.00 41.80 O ATOM 394 C3' DC C 8 73.999 73.024 15.160 1.00 40.62 C ATOM 395 O3' DC C 8 73.841 74.431 15.369 1.00 44.96 O ATOM 396 C2' DC C 8 72.712 72.376 14.672 1.00 40.81 C ATOM 397 C1' DC C 8 72.749 72.654 13.177 1.00 40.91 C ATOM 398 N1 DC C 8 72.088 71.655 12.321 1.00 38.48 N ATOM 399 C2 DC C 8 70.995 72.046 11.549 1.00 38.85 C ATOM 400 O2 DC C 8 70.568 73.206 11.660 1.00 39.06 O ATOM 401 N3 DC C 8 70.428 71.153 10.702 1.00 36.72 N ATOM 402 C4 DC C 8 70.909 69.911 10.627 1.00 36.27 C ATOM 403 N4 DC C 8 70.339 69.068 9.763 1.00 36.76 N ATOM 404 C5 DC C 8 72.000 69.477 11.431 1.00 35.62 C ATOM 405 C6 DC C 8 72.553 70.372 12.257 1.00 37.87 C ATOM 406 P DA C 9 73.183 74.981 16.729 1.00 44.91 P ATOM 407 OP1 DA C 9 73.534 76.416 16.835 1.00 48.59 O ATOM 408 OP2 DA C 9 73.515 74.068 17.843 1.00 45.08 O ATOM 409 O5' DA C 9 71.619 74.893 16.436 1.00 47.08 O ATOM 410 C5' DA C 9 70.958 75.930 15.708 1.00 46.80 C ATOM 411 C4' DA C 9 69.468 75.687 15.688 1.00 48.59 C ATOM 412 O4' DA C 9 69.143 74.596 14.796 1.00 48.19 O ATOM 413 C3' DA C 9 68.846 75.316 17.037 1.00 50.93 C ATOM 414 O3' DA C 9 67.505 75.808 17.061 1.00 57.33 O ATOM 415 C2' DA C 9 68.756 73.805 16.951 1.00 48.47 C ATOM 416 C1' DA C 9 68.340 73.663 15.500 1.00 45.42 C ATOM 417 N9 DA C 9 68.528 72.353 14.889 1.00 41.25 N ATOM 418 C8 DA C 9 69.375 71.336 15.252 1.00 39.60 C ATOM 419 N7 DA C 9 69.307 70.290 14.467 1.00 39.68 N ATOM 420 C5 DA C 9 68.350 70.644 13.524 1.00 37.81 C ATOM 421 C6 DA C 9 67.831 69.973 12.406 1.00 37.61 C ATOM 422 N6 DA C 9 68.232 68.762 12.013 1.00 35.81 N ATOM 423 N1 DA C 9 66.878 70.600 11.687 1.00 37.41 N ATOM 424 C2 DA C 9 66.493 71.828 12.063 1.00 37.43 C ATOM 425 N3 DA C 9 66.918 72.566 13.082 1.00 38.32 N ATOM 426 C4 DA C 9 67.856 71.906 13.781 1.00 38.17 C ATOM 427 P DT C 10 67.081 76.962 18.094 1.00 59.38 P ATOM 428 OP1 DT C 10 68.156 77.981 18.148 1.00 59.62 O ATOM 429 OP2 DT C 10 66.611 76.321 19.347 1.00 59.31 O ATOM 430 O5' DT C 10 65.845 77.617 17.346 1.00 58.94 O ATOM 431 C5' DT C 10 65.986 78.082 16.007 1.00 60.25 C ATOM 432 C4' DT C 10 64.828 77.600 15.169 1.00 61.55 C ATOM 433 O4' DT C 10 64.974 76.193 14.847 1.00 62.30 O ATOM 434 C3' DT C 10 63.476 77.738 15.864 1.00 63.37 C ATOM 435 O3' DT C 10 62.511 78.208 14.927 1.00 66.44 O ATOM 436 C2' DT C 10 63.163 76.322 16.324 1.00 61.16 C ATOM 437 C1' DT C 10 63.796 75.486 15.223 1.00 59.05 C ATOM 438 N1 DT C 10 64.189 74.103 15.595 1.00 52.82 N ATOM 439 C2 DT C 10 63.858 73.082 14.725 1.00 49.10 C ATOM 440 O2 DT C 10 63.218 73.259 13.701 1.00 48.49 O ATOM 441 N3 DT C 10 64.309 71.841 15.100 1.00 46.71 N ATOM 442 C4 DT C 10 65.038 71.522 16.231 1.00 46.86 C ATOM 443 O4 DT C 10 65.419 70.371 16.410 1.00 44.24 O ATOM 444 C5 DT C 10 65.309 72.629 17.123 1.00 47.72 C ATOM 445 C7 DT C 10 66.047 72.367 18.396 1.00 46.14 C ATOM 446 C6 DT C 10 64.880 73.848 16.765 1.00 50.44 C ATOM 447 P DG C 11 61.030 78.576 15.428 1.00 69.67 P ATOM 448 OP1 DG C 11 60.712 79.927 14.889 1.00 69.64 O ATOM 449 OP2 DG C 11 60.915 78.311 16.894 1.00 65.90 O ATOM 450 O5' DG C 11 60.137 77.527 14.644 1.00 64.75 O ATOM 451 C5' DG C 11 60.314 77.345 13.247 1.00 61.90 C ATOM 452 C4' DG C 11 59.419 76.233 12.767 1.00 60.73 C ATOM 453 O4' DG C 11 59.941 74.966 13.235 1.00 59.30 O ATOM 454 C3' DG C 11 57.996 76.339 13.315 1.00 58.82 C ATOM 455 O3' DG C 11 57.057 75.994 12.303 1.00 59.85 O ATOM 456 C2' DG C 11 57.975 75.348 14.465 1.00 56.55 C ATOM 457 C1' DG C 11 58.973 74.290 14.025 1.00 55.33 C ATOM 458 N9 DG C 11 59.681 73.642 15.122 1.00 49.96 N ATOM 459 C8 DG C 11 60.029 74.201 16.326 1.00 49.20 C ATOM 460 N7 DG C 11 60.683 73.381 17.101 1.00 47.89 N ATOM 461 C5 DG C 11 60.768 72.209 16.365 1.00 45.16 C ATOM 462 C6 DG C 11 61.378 70.974 16.686 1.00 44.56 C ATOM 463 O6 DG C 11 61.987 70.662 17.718 1.00 43.63 O ATOM 464 N1 DG C 11 61.233 70.050 15.655 1.00 41.63 N ATOM 465 C2 DG C 11 60.583 70.285 14.471 1.00 42.51 C ATOM 466 N2 DG C 11 60.537 69.264 13.604 1.00 41.67 N ATOM 467 N3 DG C 11 60.014 71.439 14.159 1.00 45.09 N ATOM 468 C4 DG C 11 60.147 72.348 15.147 1.00 46.29 C ATOM 469 P DC C 12 55.493 75.975 12.646 1.00 61.72 P ATOM 470 OP1 DC C 12 54.782 76.407 11.420 1.00 60.32 O ATOM 471 OP2 DC C 12 55.254 76.684 13.925 1.00 60.48 O ATOM 472 O5' DC C 12 55.214 74.423 12.844 1.00 62.09 O ATOM 473 C5' DC C 12 55.543 73.516 11.799 1.00 61.08 C ATOM 474 C4' DC C 12 55.339 72.088 12.245 1.00 60.84 C ATOM 475 O4' DC C 12 56.365 71.699 13.194 1.00 58.52 O ATOM 476 C3' DC C 12 53.991 71.790 12.906 1.00 59.66 C ATOM 477 O3' DC C 12 53.346 70.692 12.268 1.00 62.66 O ATOM 478 C2' DC C 12 54.355 71.427 14.336 1.00 58.34 C ATOM 479 C1' DC C 12 55.774 70.901 14.198 1.00 54.66 C ATOM 480 N1 DC C 12 56.581 71.030 15.421 1.00 49.69 N ATOM 481 C2 DC C 12 57.330 69.932 15.856 1.00 46.00 C ATOM 482 O2 DC C 12 57.347 68.902 15.164 1.00 45.17 O ATOM 483 N3 DC C 12 58.017 70.021 17.012 1.00 44.37 N ATOM 484 C4 DC C 12 57.985 71.150 17.724 1.00 46.08 C ATOM 485 N4 DC C 12 58.659 71.183 18.876 1.00 47.03 N ATOM 486 C5 DC C 12 57.258 72.294 17.290 1.00 45.50 C ATOM 487 C6 DC C 12 56.581 72.193 16.141 1.00 47.90 C TER 488 DC C 12 ATOM 489 N MET A 9 100.899 57.705 -1.071 1.00 81.27 N ATOM 490 CA MET A 9 99.791 58.267 -0.248 1.00 80.98 C ATOM 491 C MET A 9 98.456 58.007 -0.944 1.00 78.78 C ATOM 492 O MET A 9 97.498 57.541 -0.326 1.00 78.56 O ATOM 493 CB MET A 9 99.994 59.773 -0.058 1.00 84.24 C ATOM 494 CG MET A 9 101.426 60.169 0.284 1.00 87.82 C ATOM 495 SD MET A 9 101.603 61.940 0.603 1.00 93.42 S ATOM 496 CE MET A 9 101.417 62.607 -1.056 1.00 91.36 C ATOM 497 N ILE A 10 98.401 58.313 -2.235 1.00 75.47 N ATOM 498 CA ILE A 10 97.192 58.102 -3.021 1.00 72.87 C ATOM 499 C ILE A 10 97.129 56.637 -3.445 1.00 69.99 C ATOM 500 O ILE A 10 98.040 56.132 -4.097 1.00 70.39 O ATOM 501 CB ILE A 10 97.202 58.977 -4.284 1.00 73.95 C ATOM 502 CG1 ILE A 10 97.605 60.407 -3.922 1.00 74.96 C ATOM 503 CG2 ILE A 10 95.828 58.967 -4.930 1.00 73.97 C ATOM 504 CD1 ILE A 10 97.715 61.331 -5.119 1.00 75.88 C ATOM 505 N PRO A 11 96.051 55.929 -3.081 1.00 67.77 N ATOM 506 CA PRO A 11 95.956 54.517 -3.469 1.00 65.72 C ATOM 507 C PRO A 11 95.981 54.337 -4.985 1.00 63.03 C ATOM 508 O PRO A 11 95.480 55.181 -5.726 1.00 61.60 O ATOM 509 CB PRO A 11 94.633 54.078 -2.843 1.00 65.33 C ATOM 510 CG PRO A 11 93.815 55.327 -2.904 1.00 66.55 C ATOM 511 CD PRO A 11 94.803 56.384 -2.447 1.00 66.59 C ATOM 512 N GLN A 12 96.562 53.234 -5.442 1.00 60.88 N ATOM 513 CA GLN A 12 96.651 52.967 -6.873 1.00 59.33 C ATOM 514 C GLN A 12 95.538 52.048 -7.360 1.00 56.52 C ATOM 515 O GLN A 12 95.237 52.007 -8.551 1.00 55.26 O ATOM 516 CB GLN A 12 98.010 52.344 -7.209 1.00 61.99 C ATOM 517 CG GLN A 12 99.198 53.259 -6.947 1.00 66.49 C ATOM 518 CD GLN A 12 99.152 54.533 -7.773 1.00 68.71 C ATOM 519 OE1 GLN A 12 99.298 54.503 -8.996 1.00 70.37 O ATOM 520 NE2 GLN A 12 98.942 55.662 -7.105 1.00 70.13 N ATOM 521 N THR A 13 94.932 51.316 -6.431 1.00 53.18 N ATOM 522 CA THR A 13 93.861 50.380 -6.755 1.00 50.69 C ATOM 523 C THR A 13 92.763 50.402 -5.701 1.00 48.06 C ATOM 524 O THR A 13 92.950 50.926 -4.606 1.00 46.77 O ATOM 525 CB THR A 13 94.402 48.947 -6.829 1.00 52.25 C ATOM 526 OG1 THR A 13 94.972 48.593 -5.562 1.00 50.62 O ATOM 527 CG2 THR A 13 95.473 48.838 -7.908 1.00 53.41 C ATOM 528 N LEU A 14 91.616 49.822 -6.032 1.00 47.07 N ATOM 529 CA LEU A 14 90.511 49.769 -5.088 1.00 46.14 C ATOM 530 C LEU A 14 90.961 48.986 -3.861 1.00 45.52 C ATOM 531 O LEU A 14 90.648 49.351 -2.727 1.00 45.97 O ATOM 532 CB LEU A 14 89.289 49.090 -5.720 1.00 44.86 C ATOM 533 CG LEU A 14 88.065 48.973 -4.800 1.00 46.15 C ATOM 534 CD1 LEU A 14 87.671 50.361 -4.314 1.00 44.76 C ATOM 535 CD2 LEU A 14 86.900 48.306 -5.537 1.00 45.22 C ATOM 536 N GLU A 15 91.709 47.913 -4.098 1.00 45.07 N ATOM 537 CA GLU A 15 92.205 47.063 -3.023 1.00 44.14 C ATOM 538 C GLU A 15 93.026 47.848 -2.016 1.00 43.49 C ATOM 539 O GLU A 15 92.927 47.635 -0.810 1.00 42.81 O ATOM 540 CB GLU A 15 93.057 45.927 -3.595 1.00 45.54 C ATOM 541 CG GLU A 15 93.702 45.027 -2.540 1.00 47.73 C ATOM 542 CD GLU A 15 94.330 43.773 -3.144 1.00 51.43 C ATOM 543 OE1 GLU A 15 94.321 43.651 -4.389 1.00 49.33 O ATOM 544 OE2 GLU A 15 94.830 42.912 -2.377 1.00 50.90 O ATOM 545 N GLN A 16 93.835 48.765 -2.522 1.00 43.06 N ATOM 546 CA GLN A 16 94.689 49.574 -1.674 1.00 42.11 C ATOM 547 C GLN A 16 93.855 50.561 -0.861 1.00 41.08 C ATOM 548 O GLN A 16 94.128 50.782 0.317 1.00 40.40 O ATOM 549 CB GLN A 16 95.708 50.307 -2.548 1.00 43.40 C ATOM 550 CG GLN A 16 97.105 50.393 -1.970 1.00 44.76 C ATOM 551 CD GLN A 16 98.166 50.646 -3.039 1.00 47.26 C ATOM 552 OE1 GLN A 16 98.020 51.531 -3.889 1.00 45.76 O ATOM 553 NE2 GLN A 16 99.246 49.868 -2.993 1.00 47.44 N ATOM 554 N LEU A 17 92.836 51.145 -1.493 1.00 39.64 N ATOM 555 CA LEU A 17 91.965 52.100 -0.820 1.00 38.61 C ATOM 556 C LEU A 17 91.146 51.421 0.271 1.00 38.89 C ATOM 557 O LEU A 17 91.015 51.948 1.373 1.00 38.39 O ATOM 558 CB LEU A 17 91.014 52.763 -1.816 1.00 36.61 C ATOM 559 CG LEU A 17 89.936 53.667 -1.197 1.00 36.84 C ATOM 560 CD1 LEU A 17 90.573 54.869 -0.502 1.00 34.37 C ATOM 561 CD2 LEU A 17 88.977 54.136 -2.282 1.00 36.33 C ATOM 562 N LEU A 18 90.594 50.252 -0.041 1.00 40.09 N ATOM 563 CA LEU A 18 89.793 49.521 0.926 1.00 40.02 C ATOM 564 C LEU A 18 90.658 49.055 2.064 1.00 40.05 C ATOM 565 O LEU A 18 90.198 48.927 3.192 1.00 39.67 O ATOM 566 CB LEU A 18 89.125 48.316 0.277 1.00 42.70 C ATOM 567 CG LEU A 18 88.045 48.647 -0.753 1.00 45.97 C ATOM 568 CD1 LEU A 18 87.428 47.352 -1.278 1.00 45.98 C ATOM 569 CD2 LEU A 18 86.979 49.524 -0.105 1.00 46.31 C ATOM 570 N SER A 19 91.921 48.798 1.765 1.00 40.76 N ATOM 571 CA SER A 19 92.846 48.342 2.790 1.00 42.23 C ATOM 572 C SER A 19 93.185 49.482 3.757 1.00 40.97 C ATOM 573 O SER A 19 93.204 49.294 4.978 1.00 42.11 O ATOM 574 CB SER A 19 94.116 47.800 2.138 1.00 44.43 C ATOM 575 OG SER A 19 95.062 47.437 3.125 1.00 50.29 O ATOM 576 N GLN A 20 93.453 50.660 3.207 1.00 39.55 N ATOM 577 CA GLN A 20 93.760 51.832 4.018 1.00 40.80 C ATOM 578 C GLN A 20 92.562 52.231 4.874 1.00 40.05 C ATOM 579 O GLN A 20 92.735 52.706 5.985 1.00 39.64 O ATOM 580 CB GLN A 20 94.156 53.022 3.136 1.00 39.26 C ATOM 581 CG GLN A 20 95.635 53.351 3.176 1.00 48.67 C ATOM 582 CD GLN A 20 96.143 53.623 4.589 1.00 50.64 C ATOM 583 OE1 GLN A 20 95.705 54.569 5.253 1.00 52.18 O ATOM 584 NE2 GLN A 20 97.067 52.787 5.054 1.00 50.71 N ATOM 585 N ALA A 21 91.351 52.060 4.347 1.00 40.50 N ATOM 586 CA ALA A 21 90.152 52.413 5.100 1.00 41.50 C ATOM 587 C ALA A 21 89.993 51.452 6.266 1.00 41.42 C ATOM 588 O ALA A 21 89.750 51.871 7.393 1.00 43.31 O ATOM 589 CB ALA A 21 88.918 52.355 4.206 1.00 40.33 C ATOM 590 N GLN A 22 90.129 50.161 5.986 1.00 42.59 N ATOM 591 CA GLN A 22 90.009 49.145 7.018 1.00 43.53 C ATOM 592 C GLN A 22 91.059 49.412 8.084 1.00 43.44 C ATOM 593 O GLN A 22 90.869 49.108 9.256 1.00 44.47 O ATOM 594 CB GLN A 22 90.216 47.750 6.425 1.00 45.01 C ATOM 595 CG GLN A 22 89.873 46.620 7.384 1.00 49.36 C ATOM 596 CD GLN A 22 88.479 46.768 7.985 1.00 49.88 C ATOM 597 OE1 GLN A 22 88.322 46.834 9.203 1.00 50.23 O ATOM 598 NE2 GLN A 22 87.462 46.822 7.127 1.00 49.58 N ATOM 599 N SER A 23 92.168 50.002 7.669 1.00 42.12 N ATOM 600 CA SER A 23 93.244 50.310 8.595 1.00 41.79 C ATOM 601 C SER A 23 92.902 51.408 9.611 1.00 42.79 C ATOM 602 O SER A 23 93.407 51.392 10.737 1.00 42.87 O ATOM 603 CB SER A 23 94.492 50.706 7.815 1.00 40.80 C ATOM 604 OG SER A 23 95.461 51.245 8.683 1.00 45.31 O ATOM 605 N ILE A 24 92.057 52.360 9.218 1.00 41.75 N ATOM 606 CA ILE A 24 91.674 53.447 10.118 1.00 39.38 C ATOM 607 C ILE A 24 90.342 53.189 10.821 1.00 38.29 C ATOM 608 O ILE A 24 89.887 54.021 11.606 1.00 37.45 O ATOM 609 CB ILE A 24 91.582 54.812 9.382 1.00 38.75 C ATOM 610 CG1 ILE A 24 90.421 54.807 8.388 1.00 38.57 C ATOM 611 CG2 ILE A 24 92.881 55.098 8.664 1.00 36.13 C ATOM 612 CD1 ILE A 24 90.210 56.145 7.706 1.00 39.36 C ATOM 613 N ALA A 25 89.720 52.046 10.533 1.00 36.90 N ATOM 614 CA ALA A 25 88.449 51.677 11.164 1.00 36.47 C ATOM 615 C ALA A 25 88.711 51.307 12.624 1.00 37.62 C ATOM 616 O ALA A 25 89.498 50.396 12.909 1.00 37.80 O ATOM 617 CB ALA A 25 87.821 50.496 10.436 1.00 35.48 C ATOM 618 N GLY A 26 88.055 52.013 13.543 1.00 38.04 N ATOM 619 CA GLY A 26 88.246 51.754 14.961 1.00 36.51 C ATOM 620 C GLY A 26 89.067 52.832 15.645 1.00 36.34 C ATOM 621 O GLY A 26 89.107 52.928 16.870 1.00 35.90 O ATOM 622 N LEU A 27 89.745 53.649 14.854 1.00 36.51 N ATOM 623 CA LEU A 27 90.539 54.725 15.425 1.00 36.67 C ATOM 624 C LEU A 27 89.570 55.830 15.823 1.00 36.73 C ATOM 625 O LEU A 27 88.442 55.868 15.326 1.00 36.20 O ATOM 626 CB LEU A 27 91.532 55.247 14.385 1.00 37.62 C ATOM 627 CG LEU A 27 92.971 54.714 14.366 1.00 41.80 C ATOM 628 CD1 LEU A 27 93.031 53.212 14.590 1.00 40.30 C ATOM 629 CD2 LEU A 27 93.586 55.093 13.022 1.00 41.00 C ATOM 630 N THR A 28 89.991 56.705 16.733 1.00 36.25 N ATOM 631 CA THR A 28 89.159 57.834 17.143 1.00 37.13 C ATOM 632 C THR A 28 89.614 59.017 16.285 1.00 35.40 C ATOM 633 O THR A 28 90.729 59.016 15.771 1.00 36.08 O ATOM 634 CB THR A 28 89.377 58.200 18.631 1.00 38.11 C ATOM 635 OG1 THR A 28 90.778 58.357 18.871 1.00 40.85 O ATOM 636 CG2 THR A 28 88.839 57.109 19.557 1.00 38.84 C ATOM 637 N PHE A 29 88.759 60.017 16.123 1.00 37.11 N ATOM 638 CA PHE A 29 89.114 61.200 15.340 1.00 36.48 C ATOM 639 C PHE A 29 90.406 61.771 15.931 1.00 37.27 C ATOM 640 O PHE A 29 91.322 62.161 15.201 1.00 38.59 O ATOM 641 CB PHE A 29 87.998 62.259 15.420 1.00 36.85 C ATOM 642 CG PHE A 29 86.666 61.815 14.841 1.00 35.85 C ATOM 643 CD1 PHE A 29 86.506 60.544 14.288 1.00 36.03 C ATOM 644 CD2 PHE A 29 85.578 62.691 14.825 1.00 35.37 C ATOM 645 CE1 PHE A 29 85.290 60.157 13.718 1.00 35.48 C ATOM 646 CE2 PHE A 29 84.354 62.315 14.258 1.00 33.06 C ATOM 647 CZ PHE A 29 84.210 61.052 13.705 1.00 35.71 C ATOM 648 N GLY A 30 90.474 61.808 17.259 1.00 36.85 N ATOM 649 CA GLY A 30 91.654 62.330 17.934 1.00 38.39 C ATOM 650 C GLY A 30 92.944 61.624 17.556 1.00 40.85 C ATOM 651 O GLY A 30 93.951 62.273 17.257 1.00 42.46 O ATOM 652 N GLU A 31 92.928 60.296 17.583 1.00 40.31 N ATOM 653 CA GLU A 31 94.105 59.517 17.218 1.00 43.25 C ATOM 654 C GLU A 31 94.510 59.792 15.771 1.00 42.83 C ATOM 655 O GLU A 31 95.690 59.958 15.458 1.00 42.89 O ATOM 656 CB GLU A 31 93.826 58.020 17.344 1.00 45.97 C ATOM 657 CG GLU A 31 93.656 57.502 18.739 1.00 50.73 C ATOM 658 CD GLU A 31 93.137 56.076 18.738 1.00 56.16 C ATOM 659 OE1 GLU A 31 91.970 55.872 18.332 1.00 58.07 O ATOM 660 OE2 GLU A 31 93.894 55.158 19.131 1.00 58.54 O ATOM 661 N LEU A 32 93.524 59.828 14.883 1.00 41.87 N ATOM 662 CA LEU A 32 93.808 60.052 13.477 1.00 42.54 C ATOM 663 C LEU A 32 94.297 61.474 13.239 1.00 43.90 C ATOM 664 O LEU A 32 95.309 61.683 12.568 1.00 43.69 O ATOM 665 CB LEU A 32 92.563 59.755 12.640 1.00 40.83 C ATOM 666 CG LEU A 32 92.702 59.801 11.120 1.00 38.59 C ATOM 667 CD1 LEU A 32 93.740 58.797 10.631 1.00 35.51 C ATOM 668 CD2 LEU A 32 91.343 59.515 10.510 1.00 35.99 C ATOM 669 N ALA A 33 93.586 62.445 13.805 1.00 44.57 N ATOM 670 CA ALA A 33 93.957 63.849 13.667 1.00 45.99 C ATOM 671 C ALA A 33 95.394 64.097 14.144 1.00 48.30 C ATOM 672 O ALA A 33 96.194 64.715 13.436 1.00 49.95 O ATOM 673 CB ALA A 33 92.993 64.717 14.453 1.00 44.39 C ATOM 674 N ASP A 34 95.723 63.619 15.341 1.00 49.30 N ATOM 675 CA ASP A 34 97.072 63.806 15.872 1.00 51.04 C ATOM 676 C ASP A 34 98.107 63.180 14.953 1.00 51.37 C ATOM 677 O ASP A 34 99.145 63.774 14.673 1.00 51.88 O ATOM 678 CB ASP A 34 97.200 63.178 17.258 1.00 51.42 C ATOM 679 CG ASP A 34 96.379 63.899 18.306 1.00 53.15 C ATOM 680 OD1 ASP A 34 96.350 63.414 19.455 1.00 55.41 O ATOM 681 OD2 ASP A 34 95.770 64.944 17.991 1.00 52.02 O ATOM 682 N GLU A 35 97.815 61.975 14.484 1.00 52.11 N ATOM 683 CA GLU A 35 98.719 61.257 13.602 1.00 52.77 C ATOM 684 C GLU A 35 98.978 62.011 12.303 1.00 51.30 C ATOM 685 O GLU A 35 100.014 61.829 11.671 1.00 50.41 O ATOM 686 CB GLU A 35 98.131 59.885 13.285 1.00 55.67 C ATOM 687 CG GLU A 35 99.054 58.953 12.526 1.00 61.74 C ATOM 688 CD GLU A 35 98.424 57.582 12.301 1.00 66.44 C ATOM 689 OE1 GLU A 35 97.890 56.997 13.276 1.00 67.44 O ATOM 690 OE2 GLU A 35 98.468 57.085 11.152 1.00 68.76 O ATOM 691 N LEU A 36 98.032 62.860 11.911 1.00 50.54 N ATOM 692 CA LEU A 36 98.153 63.616 10.671 1.00 49.03 C ATOM 693 C LEU A 36 98.492 65.069 10.929 1.00 49.00 C ATOM 694 O LEU A 36 98.594 65.864 9.998 1.00 49.13 O ATOM 695 CB LEU A 36 96.848 63.532 9.879 1.00 47.41 C ATOM 696 CG LEU A 36 96.405 62.156 9.381 1.00 47.59 C ATOM 697 CD1 LEU A 36 95.018 62.255 8.776 1.00 45.73 C ATOM 698 CD2 LEU A 36 97.389 61.638 8.357 1.00 48.50 C ATOM 699 N HIS A 37 98.658 65.411 12.199 1.00 49.96 N ATOM 700 CA HIS A 37 98.982 66.775 12.592 1.00 51.73 C ATOM 701 C HIS A 37 97.887 67.733 12.163 1.00 50.11 C ATOM 702 O HIS A 37 98.159 68.788 11.602 1.00 50.01 O ATOM 703 CB HIS A 37 100.319 67.202 11.980 1.00 55.63 C ATOM 704 CG HIS A 37 101.467 66.340 12.399 1.00 60.09 C ATOM 705 ND1 HIS A 37 101.882 66.244 13.710 1.00 62.50 N ATOM 706 CD2 HIS A 37 102.250 65.493 11.692 1.00 62.49 C ATOM 707 CE1 HIS A 37 102.870 65.371 13.793 1.00 63.45 C ATOM 708 NE2 HIS A 37 103.113 64.901 12.583 1.00 64.49 N ATOM 709 N ILE A 38 96.643 67.347 12.426 1.00 49.67 N ATOM 710 CA ILE A 38 95.486 68.171 12.086 1.00 47.37 C ATOM 711 C ILE A 38 94.814 68.575 13.389 1.00 46.72 C ATOM 712 O ILE A 38 94.464 67.723 14.202 1.00 46.12 O ATOM 713 CB ILE A 38 94.472 67.391 11.213 1.00 47.20 C ATOM 714 CG1 ILE A 38 95.079 67.106 9.836 1.00 46.15 C ATOM 715 CG2 ILE A 38 93.174 68.183 11.077 1.00 44.34 C ATOM 716 CD1 ILE A 38 94.183 66.296 8.925 1.00 46.03 C ATOM 717 N PRO A 39 94.637 69.885 13.612 1.00 46.91 N ATOM 718 CA PRO A 39 93.998 70.351 14.850 1.00 47.14 C ATOM 719 C PRO A 39 92.518 69.968 14.955 1.00 46.28 C ATOM 720 O PRO A 39 91.753 70.115 14.007 1.00 47.74 O ATOM 721 CB PRO A 39 94.235 71.863 14.811 1.00 46.73 C ATOM 722 CG PRO A 39 94.263 72.167 13.344 1.00 46.67 C ATOM 723 CD PRO A 39 95.061 71.017 12.769 1.00 46.36 C ATOM 724 N VAL A 40 92.126 69.466 16.119 1.00 46.95 N ATOM 725 CA VAL A 40 90.750 69.045 16.355 1.00 45.41 C ATOM 726 C VAL A 40 89.959 70.138 17.054 1.00 45.30 C ATOM 727 O VAL A 40 90.346 70.579 18.126 1.00 45.08 O ATOM 728 CB VAL A 40 90.717 67.811 17.252 1.00 44.44 C ATOM 729 CG1 VAL A 40 89.288 67.336 17.430 1.00 47.40 C ATOM 730 CG2 VAL A 40 91.582 66.735 16.672 1.00 42.69 C ATOM 731 N PRO A 41 88.839 70.586 16.461 1.00 46.53 N ATOM 732 CA PRO A 41 88.008 71.639 17.069 1.00 46.37 C ATOM 733 C PRO A 41 87.229 71.064 18.248 1.00 48.21 C ATOM 734 O PRO A 41 87.209 69.846 18.432 1.00 49.43 O ATOM 735 CB PRO A 41 87.096 72.053 15.927 1.00 46.06 C ATOM 736 CG PRO A 41 86.890 70.757 15.199 1.00 46.30 C ATOM 737 CD PRO A 41 88.287 70.172 15.157 1.00 46.40 C ATOM 738 N ILE A 42 86.580 71.912 19.042 1.00 49.06 N ATOM 739 CA ILE A 42 85.834 71.404 20.193 1.00 49.59 C ATOM 740 C ILE A 42 84.556 70.691 19.783 1.00 47.51 C ATOM 741 O ILE A 42 84.134 69.739 20.431 1.00 49.40 O ATOM 742 CB ILE A 42 85.463 72.520 21.190 1.00 52.16 C ATOM 743 CG1 ILE A 42 84.427 73.462 20.568 1.00 55.53 C ATOM 744 CG2 ILE A 42 86.708 73.298 21.579 1.00 53.06 C ATOM 745 CD1 ILE A 42 83.857 74.486 21.547 1.00 58.18 C ATOM 746 N ASP A 43 83.929 71.161 18.715 1.00 45.91 N ATOM 747 CA ASP A 43 82.707 70.534 18.219 1.00 43.51 C ATOM 748 C ASP A 43 82.593 70.833 16.729 1.00 42.10 C ATOM 749 O ASP A 43 83.479 71.470 16.155 1.00 43.44 O ATOM 750 CB ASP A 43 81.475 71.046 18.978 1.00 40.86 C ATOM 751 CG ASP A 43 81.301 72.553 18.873 1.00 42.76 C ATOM 752 OD1 ASP A 43 81.422 73.092 17.751 1.00 40.87 O ATOM 753 OD2 ASP A 43 81.031 73.196 19.913 1.00 43.28 O ATOM 754 N LEU A 44 81.509 70.386 16.106 1.00 40.57 N ATOM 755 CA LEU A 44 81.326 70.592 14.674 1.00 40.93 C ATOM 756 C LEU A 44 80.461 71.794 14.278 1.00 42.85 C ATOM 757 O LEU A 44 80.270 72.054 13.089 1.00 42.42 O ATOM 758 CB LEU A 44 80.760 69.310 14.049 1.00 37.41 C ATOM 759 CG LEU A 44 81.607 68.037 14.219 1.00 35.37 C ATOM 760 CD1 LEU A 44 80.937 66.854 13.532 1.00 32.33 C ATOM 761 CD2 LEU A 44 82.994 68.262 13.620 1.00 34.06 C ATOM 762 N LYS A 45 79.958 72.535 15.266 1.00 45.06 N ATOM 763 CA LYS A 45 79.101 73.693 15.001 1.00 47.38 C ATOM 764 C LYS A 45 79.670 74.663 13.972 1.00 48.36 C ATOM 765 O LYS A 45 78.927 75.228 13.172 1.00 48.18 O ATOM 766 CB LYS A 45 78.799 74.440 16.304 1.00 49.09 C ATOM 767 CG LYS A 45 77.874 73.688 17.237 1.00 53.10 C ATOM 768 CD LYS A 45 77.593 74.460 18.524 1.00 55.04 C ATOM 769 CE LYS A 45 76.703 73.635 19.455 1.00 58.08 C ATOM 770 NZ LYS A 45 76.344 74.347 20.716 1.00 62.44 N ATOM 771 N ARG A 46 80.984 74.863 13.995 1.00 51.61 N ATOM 772 CA ARG A 46 81.620 75.761 13.040 1.00 54.30 C ATOM 773 C ARG A 46 82.753 75.107 12.253 1.00 53.08 C ATOM 774 O ARG A 46 83.683 75.768 11.810 1.00 54.31 O ATOM 775 CB ARG A 46 82.106 77.030 13.750 1.00 59.37 C ATOM 776 CG ARG A 46 80.990 78.057 13.919 1.00 65.86 C ATOM 777 CD ARG A 46 81.465 79.413 14.438 1.00 70.58 C ATOM 778 NE ARG A 46 80.497 80.448 14.077 1.00 76.00 N ATOM 779 CZ ARG A 46 80.494 81.691 14.550 1.00 79.97 C ATOM 780 NH1 ARG A 46 81.413 82.082 15.424 1.00 82.29 N ATOM 781 NH2 ARG A 46 79.568 82.549 14.142 1.00 81.88 N ATOM 782 N ASP A 47 82.660 73.794 12.086 1.00 51.42 N ATOM 783 CA ASP A 47 83.637 73.014 11.327 1.00 49.42 C ATOM 784 C ASP A 47 82.861 71.802 10.813 1.00 45.38 C ATOM 785 O ASP A 47 83.301 70.658 10.922 1.00 43.94 O ATOM 786 CB ASP A 47 84.802 72.556 12.225 1.00 54.04 C ATOM 787 CG ASP A 47 85.856 73.640 12.434 1.00 58.69 C ATOM 788 OD1 ASP A 47 85.597 74.608 13.183 1.00 62.42 O ATOM 789 OD2 ASP A 47 86.952 73.527 11.845 1.00 60.84 O ATOM 790 N LYS A 48 81.698 72.076 10.240 1.00 40.69 N ATOM 791 CA LYS A 48 80.819 71.030 9.756 1.00 35.90 C ATOM 792 C LYS A 48 81.411 69.985 8.821 1.00 33.40 C ATOM 793 O LYS A 48 81.025 68.831 8.897 1.00 30.86 O ATOM 794 CB LYS A 48 79.562 71.665 9.155 1.00 34.71 C ATOM 795 CG LYS A 48 78.746 72.441 10.203 1.00 31.61 C ATOM 796 CD LYS A 48 77.425 72.961 9.652 1.00 32.17 C ATOM 797 CE LYS A 48 76.651 73.743 10.714 1.00 34.13 C ATOM 798 NZ LYS A 48 75.304 74.180 10.223 1.00 35.16 N ATOM 799 N GLY A 49 82.360 70.362 7.968 1.00 30.70 N ATOM 800 CA GLY A 49 82.940 69.389 7.062 1.00 28.92 C ATOM 801 C GLY A 49 84.268 68.815 7.526 1.00 30.06 C ATOM 802 O GLY A 49 84.978 68.154 6.762 1.00 28.37 O ATOM 803 N TRP A 50 84.595 69.055 8.788 1.00 31.04 N ATOM 804 CA TRP A 50 85.855 68.600 9.357 1.00 32.81 C ATOM 805 C TRP A 50 86.075 67.092 9.267 1.00 33.26 C ATOM 806 O TRP A 50 87.134 66.654 8.827 1.00 34.89 O ATOM 807 CB TRP A 50 85.962 69.065 10.818 1.00 33.84 C ATOM 808 CG TRP A 50 87.291 68.811 11.435 1.00 34.58 C ATOM 809 CD1 TRP A 50 88.420 69.582 11.313 1.00 33.46 C ATOM 810 CD2 TRP A 50 87.678 67.645 12.173 1.00 34.35 C ATOM 811 NE1 TRP A 50 89.485 68.956 11.922 1.00 33.70 N ATOM 812 CE2 TRP A 50 89.060 67.770 12.458 1.00 34.06 C ATOM 813 CE3 TRP A 50 86.994 66.509 12.624 1.00 35.87 C ATOM 814 CZ2 TRP A 50 89.768 66.794 13.163 1.00 34.68 C ATOM 815 CZ3 TRP A 50 87.702 65.534 13.329 1.00 35.73 C ATOM 816 CH2 TRP A 50 89.076 65.687 13.592 1.00 36.37 C ATOM 817 N VAL A 51 85.094 66.289 9.671 1.00 32.82 N ATOM 818 CA VAL A 51 85.293 64.849 9.609 1.00 31.67 C ATOM 819 C VAL A 51 85.477 64.414 8.168 1.00 32.58 C ATOM 820 O VAL A 51 86.285 63.530 7.867 1.00 32.78 O ATOM 821 CB VAL A 51 84.122 64.072 10.219 1.00 33.02 C ATOM 822 CG1 VAL A 51 84.480 62.593 10.290 1.00 30.00 C ATOM 823 CG2 VAL A 51 83.818 64.597 11.625 1.00 33.59 C ATOM 824 N GLY A 52 84.736 65.046 7.271 1.00 32.77 N ATOM 825 CA GLY A 52 84.867 64.704 5.872 1.00 33.58 C ATOM 826 C GLY A 52 86.292 64.934 5.418 1.00 35.58 C ATOM 827 O GLY A 52 86.911 64.078 4.796 1.00 36.91 O ATOM 828 N MET A 53 86.837 66.092 5.759 1.00 37.46 N ATOM 829 CA MET A 53 88.194 66.412 5.347 1.00 38.17 C ATOM 830 C MET A 53 89.228 65.520 6.010 1.00 37.82 C ATOM 831 O MET A 53 90.259 65.174 5.408 1.00 38.64 O ATOM 832 CB MET A 53 88.501 67.871 5.651 1.00 41.56 C ATOM 833 CG MET A 53 87.643 68.866 4.826 1.00 52.02 C ATOM 834 SD MET A 53 87.618 68.487 3.012 1.00 63.24 S ATOM 835 CE MET A 53 87.255 70.152 2.180 1.00 60.74 C ATOM 836 N LEU A 54 88.952 65.154 7.261 1.00 36.48 N ATOM 837 CA LEU A 54 89.860 64.288 8.013 1.00 37.94 C ATOM 838 C LEU A 54 90.043 62.985 7.247 1.00 37.94 C ATOM 839 O LEU A 54 91.151 62.509 7.081 1.00 39.66 O ATOM 840 CB LEU A 54 89.337 64.009 9.450 1.00 38.51 C ATOM 841 CG LEU A 54 90.221 63.049 10.284 1.00 41.11 C ATOM 842 CD1 LEU A 54 91.649 63.602 10.432 1.00 40.41 C ATOM 843 CD2 LEU A 54 89.616 62.807 11.676 1.00 41.33 C ATOM 844 N LEU A 55 88.947 62.418 6.771 1.00 36.37 N ATOM 845 CA LEU A 55 89.008 61.184 6.017 1.00 35.84 C ATOM 846 C LEU A 55 89.661 61.378 4.644 1.00 36.02 C ATOM 847 O LEU A 55 90.371 60.505 4.175 1.00 33.99 O ATOM 848 CB LEU A 55 87.605 60.601 5.844 1.00 36.62 C ATOM 849 CG LEU A 55 87.016 59.659 6.906 1.00 39.75 C ATOM 850 CD1 LEU A 55 87.553 58.263 6.698 1.00 41.70 C ATOM 851 CD2 LEU A 55 87.328 60.142 8.306 1.00 38.33 C ATOM 852 N GLU A 56 89.434 62.508 3.985 1.00 37.49 N ATOM 853 CA GLU A 56 90.059 62.709 2.675 1.00 38.41 C ATOM 854 C GLU A 56 91.584 62.631 2.801 1.00 39.59 C ATOM 855 O GLU A 56 92.262 61.959 2.016 1.00 36.92 O ATOM 856 CB GLU A 56 89.654 64.054 2.080 1.00 37.34 C ATOM 857 CG GLU A 56 88.200 64.125 1.673 1.00 39.18 C ATOM 858 CD GLU A 56 87.927 65.282 0.733 1.00 39.59 C ATOM 859 OE1 GLU A 56 88.378 66.405 1.036 1.00 42.55 O ATOM 860 OE2 GLU A 56 87.265 65.073 -0.301 1.00 36.83 O ATOM 861 N ARG A 57 92.116 63.301 3.816 1.00 40.21 N ATOM 862 CA ARG A 57 93.550 63.297 4.031 1.00 42.38 C ATOM 863 C ARG A 57 94.059 61.931 4.442 1.00 41.70 C ATOM 864 O ARG A 57 95.146 61.523 4.048 1.00 43.84 O ATOM 865 CB ARG A 57 93.934 64.330 5.088 1.00 44.88 C ATOM 866 CG ARG A 57 93.643 65.763 4.662 1.00 53.17 C ATOM 867 CD ARG A 57 94.454 66.751 5.484 1.00 58.68 C ATOM 868 NE ARG A 57 95.873 66.396 5.464 1.00 64.30 N ATOM 869 CZ ARG A 57 96.818 67.044 6.139 1.00 66.38 C ATOM 870 NH1 ARG A 57 96.499 68.091 6.892 1.00 66.39 N ATOM 871 NH2 ARG A 57 98.080 66.636 6.068 1.00 67.69 N ATOM 872 N ALA A 58 93.272 61.217 5.229 1.00 40.52 N ATOM 873 CA ALA A 58 93.681 59.904 5.680 1.00 38.64 C ATOM 874 C ALA A 58 93.657 58.864 4.561 1.00 38.13 C ATOM 875 O ALA A 58 94.389 57.889 4.608 1.00 39.46 O ATOM 876 CB ALA A 58 92.792 59.455 6.852 1.00 37.64 C ATOM 877 N LEU A 59 92.832 59.059 3.545 1.00 39.01 N ATOM 878 CA LEU A 59 92.778 58.066 2.483 1.00 39.75 C ATOM 879 C LEU A 59 93.408 58.513 1.169 1.00 40.25 C ATOM 880 O LEU A 59 93.366 57.785 0.177 1.00 39.42 O ATOM 881 CB LEU A 59 91.333 57.625 2.257 1.00 39.87 C ATOM 882 CG LEU A 59 90.665 57.051 3.510 1.00 39.80 C ATOM 883 CD1 LEU A 59 89.173 56.904 3.290 1.00 38.82 C ATOM 884 CD2 LEU A 59 91.285 55.711 3.837 1.00 39.90 C ATOM 885 N GLY A 60 93.995 59.705 1.166 1.00 41.90 N ATOM 886 CA GLY A 60 94.642 60.205 -0.036 1.00 45.42 C ATOM 887 C GLY A 60 93.691 60.620 -1.143 1.00 48.81 C ATOM 888 O GLY A 60 93.970 60.406 -2.325 1.00 49.23 O ATOM 889 N ALA A 61 92.569 61.219 -0.761 1.00 50.54 N ATOM 890 CA ALA A 61 91.573 61.673 -1.722 1.00 54.43 C ATOM 891 C ALA A 61 91.843 63.109 -2.162 1.00 58.03 C ATOM 892 O ALA A 61 92.624 63.828 -1.531 1.00 57.66 O ATOM 893 CB ALA A 61 90.184 61.578 -1.113 1.00 52.47 C ATOM 894 N THR A 62 91.192 63.520 -3.249 1.00 61.88 N ATOM 895 CA THR A 62 91.345 64.877 -3.768 1.00 66.19 C ATOM 896 C THR A 62 90.701 65.859 -2.788 1.00 67.58 C ATOM 897 O THR A 62 89.522 65.718 -2.442 1.00 66.65 O ATOM 898 CB THR A 62 90.646 65.054 -5.145 1.00 66.97 C ATOM 899 OG1 THR A 62 91.037 63.998 -6.028 1.00 69.53 O ATOM 900 CG2 THR A 62 91.041 66.381 -5.772 1.00 67.36 C ATOM 901 N ALA A 63 91.481 66.842 -2.342 1.00 68.51 N ATOM 902 CA ALA A 63 90.991 67.855 -1.415 1.00 69.86 C ATOM 903 C ALA A 63 90.450 69.032 -2.216 1.00 70.44 C ATOM 904 O ALA A 63 90.254 68.933 -3.428 1.00 69.71 O ATOM 905 CB ALA A 63 92.121 68.321 -0.504 1.00 69.75 C ATOM 906 N GLY A 64 90.213 70.145 -1.530 1.00 71.58 N ATOM 907 CA GLY A 64 89.715 71.334 -2.196 1.00 73.68 C ATOM 908 C GLY A 64 88.398 71.168 -2.930 1.00 74.67 C ATOM 909 O GLY A 64 87.645 70.223 -2.689 1.00 74.30 O ATOM 910 N SER A 65 88.129 72.095 -3.844 1.00 75.38 N ATOM 911 CA SER A 65 86.892 72.079 -4.608 1.00 75.92 C ATOM 912 C SER A 65 87.022 71.348 -5.944 1.00 76.26 C ATOM 913 O SER A 65 86.243 71.586 -6.872 1.00 76.34 O ATOM 914 CB SER A 65 86.415 73.518 -4.832 1.00 76.27 C ATOM 915 OG SER A 65 86.345 74.226 -3.600 1.00 76.50 O ATOM 916 N LYS A 66 88.006 70.459 -6.042 1.00 76.75 N ATOM 917 CA LYS A 66 88.204 69.690 -7.268 1.00 78.14 C ATOM 918 C LYS A 66 86.868 69.025 -7.593 1.00 79.12 C ATOM 919 O LYS A 66 86.329 68.266 -6.784 1.00 78.96 O ATOM 920 CB LYS A 66 89.288 68.643 -7.066 1.00 77.61 C ATOM 921 N ALA A 67 86.351 69.310 -8.784 1.00 80.05 N ATOM 922 CA ALA A 67 85.055 68.808 -9.236 1.00 80.60 C ATOM 923 C ALA A 67 84.729 67.306 -9.225 1.00 81.22 C ATOM 924 O ALA A 67 85.425 66.473 -9.816 1.00 81.31 O ATOM 925 CB ALA A 67 84.752 69.380 -10.620 1.00 80.72 C ATOM 926 N GLU A 68 83.633 67.013 -8.529 1.00 81.22 N ATOM 927 CA GLU A 68 83.001 65.700 -8.370 1.00 79.52 C ATOM 928 C GLU A 68 83.714 64.381 -8.074 1.00 77.84 C ATOM 929 O GLU A 68 83.020 63.368 -7.932 1.00 78.90 O ATOM 930 CB GLU A 68 82.050 65.475 -9.550 1.00 78.93 C ATOM 931 N GLN A 69 85.041 64.320 -7.986 1.00 73.50 N ATOM 932 CA GLN A 69 85.594 63.004 -7.676 1.00 69.40 C ATOM 933 C GLN A 69 86.908 62.841 -6.924 1.00 64.92 C ATOM 934 O GLN A 69 87.988 63.200 -7.393 1.00 64.88 O ATOM 935 CB GLN A 69 85.573 62.113 -8.927 1.00 70.71 C ATOM 936 CG GLN A 69 84.454 61.062 -8.815 1.00 73.55 C ATOM 937 CD GLN A 69 84.288 60.168 -10.031 1.00 75.64 C ATOM 938 OE1 GLN A 69 85.248 59.876 -10.749 1.00 75.98 O ATOM 939 NE2 GLN A 69 83.060 59.704 -10.250 1.00 76.69 N ATOM 940 N ASP A 70 86.764 62.259 -5.736 1.00 58.64 N ATOM 941 CA ASP A 70 87.850 61.990 -4.810 1.00 53.26 C ATOM 942 C ASP A 70 88.933 61.077 -5.384 1.00 51.50 C ATOM 943 O ASP A 70 90.117 61.307 -5.167 1.00 49.95 O ATOM 944 CB ASP A 70 87.273 61.379 -3.525 1.00 50.15 C ATOM 945 CG ASP A 70 86.174 62.240 -2.910 1.00 46.88 C ATOM 946 OD1 ASP A 70 86.433 63.438 -2.653 1.00 42.34 O ATOM 947 OD2 ASP A 70 85.058 61.718 -2.686 1.00 42.89 O ATOM 948 N PHE A 71 88.530 60.034 -6.100 1.00 49.72 N ATOM 949 CA PHE A 71 89.496 59.115 -6.690 1.00 49.26 C ATOM 950 C PHE A 71 89.136 58.916 -8.161 1.00 49.54 C ATOM 951 O PHE A 71 88.672 57.852 -8.570 1.00 47.72 O ATOM 952 CB PHE A 71 89.486 57.777 -5.943 1.00 46.68 C ATOM 953 CG PHE A 71 89.666 57.910 -4.456 1.00 44.66 C ATOM 954 CD1 PHE A 71 88.567 57.863 -3.602 1.00 43.25 C ATOM 955 CD2 PHE A 71 90.935 58.076 -3.907 1.00 43.74 C ATOM 956 CE1 PHE A 71 88.728 57.980 -2.219 1.00 43.52 C ATOM 957 CE2 PHE A 71 91.115 58.195 -2.531 1.00 42.57 C ATOM 958 CZ PHE A 71 90.010 58.146 -1.680 1.00 43.78 C ATOM 959 N SER A 72 89.352 59.968 -8.943 1.00 51.39 N ATOM 960 CA SER A 72 89.043 59.965 -10.365 1.00 53.23 C ATOM 961 C SER A 72 89.678 58.794 -11.102 1.00 53.64 C ATOM 962 O SER A 72 89.071 58.235 -12.009 1.00 54.48 O ATOM 963 CB SER A 72 89.478 61.297 -10.998 1.00 53.99 C ATOM 964 OG SER A 72 90.847 61.583 -10.739 1.00 57.05 O ATOM 965 N HIS A 73 90.890 58.411 -10.711 1.00 54.84 N ATOM 966 CA HIS A 73 91.561 57.295 -11.369 1.00 56.17 C ATOM 967 C HIS A 73 90.924 55.961 -11.005 1.00 54.80 C ATOM 968 O HIS A 73 91.156 54.955 -11.674 1.00 54.73 O ATOM 969 CB HIS A 73 93.048 57.264 -11.011 1.00 59.35 C ATOM 970 CG HIS A 73 93.318 57.076 -9.552 1.00 62.48 C ATOM 971 ND1 HIS A 73 93.151 58.084 -8.627 1.00 63.41 N ATOM 972 CD2 HIS A 73 93.753 55.997 -8.859 1.00 64.17 C ATOM 973 CE1 HIS A 73 93.475 57.636 -7.427 1.00 64.90 C ATOM 974 NE2 HIS A 73 93.844 56.372 -7.540 1.00 65.69 N ATOM 975 N LEU A 74 90.128 55.958 -9.938 1.00 53.17 N ATOM 976 CA LEU A 74 89.437 54.750 -9.494 1.00 50.82 C ATOM 977 C LEU A 74 87.945 54.862 -9.771 1.00 50.08 C ATOM 978 O LEU A 74 87.239 53.851 -9.858 1.00 50.65 O ATOM 979 CB LEU A 74 89.635 54.532 -7.994 1.00 48.62 C ATOM 980 CG LEU A 74 91.048 54.263 -7.498 1.00 46.90 C ATOM 981 CD1 LEU A 74 91.023 53.989 -5.994 1.00 47.61 C ATOM 982 CD2 LEU A 74 91.613 53.081 -8.248 1.00 44.08 C ATOM 983 N GLY A 75 87.467 56.097 -9.902 1.00 47.68 N ATOM 984 CA GLY A 75 86.056 56.314 -10.143 1.00 45.41 C ATOM 985 C GLY A 75 85.289 56.093 -8.854 1.00 43.83 C ATOM 986 O GLY A 75 84.156 55.608 -8.861 1.00 45.18 O ATOM 987 N VAL A 76 85.916 56.431 -7.734 1.00 39.97 N ATOM 988 CA VAL A 76 85.259 56.268 -6.454 1.00 37.99 C ATOM 989 C VAL A 76 85.028 57.603 -5.768 1.00 37.62 C ATOM 990 O VAL A 76 85.888 58.482 -5.806 1.00 37.74 O ATOM 991 CB VAL A 76 86.074 55.361 -5.518 1.00 38.33 C ATOM 992 CG1 VAL A 76 85.404 55.284 -4.154 1.00 35.47 C ATOM 993 CG2 VAL A 76 86.190 53.970 -6.121 1.00 37.35 C ATOM 994 N GLU A 77 83.848 57.738 -5.161 1.00 36.92 N ATOM 995 CA GLU A 77 83.447 58.928 -4.410 1.00 36.06 C ATOM 996 C GLU A 77 83.449 58.558 -2.930 1.00 36.75 C ATOM 997 O GLU A 77 82.856 57.556 -2.535 1.00 36.85 O ATOM 998 CB GLU A 77 82.037 59.376 -4.803 1.00 37.02 C ATOM 999 CG GLU A 77 81.453 60.478 -3.916 1.00 41.28 C ATOM 1000 CD GLU A 77 82.163 61.832 -4.064 1.00 45.89 C ATOM 1001 OE1 GLU A 77 81.982 62.694 -3.173 1.00 44.44 O ATOM 1002 OE2 GLU A 77 82.890 62.043 -5.066 1.00 46.94 O ATOM 1003 N LEU A 78 84.117 59.364 -2.112 1.00 35.69 N ATOM 1004 CA LEU A 78 84.184 59.105 -0.680 1.00 33.75 C ATOM 1005 C LEU A 78 83.135 59.926 0.072 1.00 33.74 C ATOM 1006 O LEU A 78 82.942 61.111 -0.202 1.00 32.75 O ATOM 1007 CB LEU A 78 85.580 59.456 -0.163 1.00 31.78 C ATOM 1008 CG LEU A 78 85.812 59.409 1.346 1.00 33.33 C ATOM 1009 CD1 LEU A 78 85.789 57.967 1.820 1.00 32.98 C ATOM 1010 CD2 LEU A 78 87.148 60.057 1.679 1.00 29.73 C ATOM 1011 N LYS A 79 82.439 59.291 1.010 1.00 34.98 N ATOM 1012 CA LYS A 79 81.436 59.991 1.808 1.00 34.99 C ATOM 1013 C LYS A 79 81.360 59.485 3.228 1.00 33.63 C ATOM 1014 O LYS A 79 81.272 58.292 3.448 1.00 34.16 O ATOM 1015 CB LYS A 79 80.054 59.872 1.173 1.00 35.89 C ATOM 1016 CG LYS A 79 79.877 60.743 -0.049 1.00 38.37 C ATOM 1017 CD LYS A 79 78.422 60.804 -0.479 1.00 42.33 C ATOM 1018 CE LYS A 79 78.253 61.851 -1.553 1.00 42.64 C ATOM 1019 NZ LYS A 79 78.834 63.134 -1.075 1.00 44.21 N ATOM 1020 N THR A 80 81.418 60.395 4.195 1.00 33.85 N ATOM 1021 CA THR A 80 81.299 60.015 5.602 1.00 33.73 C ATOM 1022 C THR A 80 79.801 59.907 5.869 1.00 32.74 C ATOM 1023 O THR A 80 79.011 60.531 5.167 1.00 32.57 O ATOM 1024 CB THR A 80 81.869 61.089 6.540 1.00 33.68 C ATOM 1025 OG1 THR A 80 81.318 62.362 6.184 1.00 32.47 O ATOM 1026 CG2 THR A 80 83.390 61.133 6.459 1.00 32.15 C ATOM 1027 N LEU A 81 79.414 59.127 6.876 1.00 32.67 N ATOM 1028 CA LEU A 81 78.001 58.934 7.209 1.00 31.74 C ATOM 1029 C LEU A 81 77.839 58.836 8.720 1.00 30.15 C ATOM 1030 O LEU A 81 78.131 57.808 9.321 1.00 30.82 O ATOM 1031 CB LEU A 81 77.491 57.656 6.539 1.00 32.37 C ATOM 1032 CG LEU A 81 76.046 57.210 6.755 1.00 34.33 C ATOM 1033 CD1 LEU A 81 75.067 58.224 6.162 1.00 32.37 C ATOM 1034 CD2 LEU A 81 75.869 55.854 6.098 1.00 34.17 C ATOM 1035 N PRO A 82 77.359 59.908 9.357 1.00 30.65 N ATOM 1036 CA PRO A 82 77.198 59.859 10.807 1.00 30.04 C ATOM 1037 C PRO A 82 76.085 58.920 11.267 1.00 31.33 C ATOM 1038 O PRO A 82 74.986 58.946 10.735 1.00 32.37 O ATOM 1039 CB PRO A 82 76.955 61.321 11.167 1.00 27.69 C ATOM 1040 CG PRO A 82 76.204 61.822 10.003 1.00 32.75 C ATOM 1041 CD PRO A 82 76.917 61.207 8.818 1.00 29.63 C ATOM 1042 N ILE A 83 76.393 58.081 12.250 1.00 32.14 N ATOM 1043 CA ILE A 83 75.433 57.128 12.782 1.00 34.18 C ATOM 1044 C ILE A 83 75.380 57.187 14.307 1.00 36.33 C ATOM 1045 O ILE A 83 76.345 57.593 14.964 1.00 36.43 O ATOM 1046 CB ILE A 83 75.799 55.685 12.398 1.00 33.90 C ATOM 1047 CG1 ILE A 83 77.221 55.373 12.864 1.00 34.90 C ATOM 1048 CG2 ILE A 83 75.648 55.478 10.903 1.00 33.72 C ATOM 1049 CD1 ILE A 83 77.579 53.891 12.781 1.00 37.77 C ATOM 1050 N ASN A 84 74.248 56.776 14.869 1.00 37.48 N ATOM 1051 CA ASN A 84 74.106 56.749 16.320 1.00 39.07 C ATOM 1052 C ASN A 84 74.524 55.367 16.819 1.00 39.45 C ATOM 1053 O ASN A 84 75.038 54.557 16.044 1.00 39.36 O ATOM 1054 CB ASN A 84 72.668 57.059 16.739 1.00 37.55 C ATOM 1055 CG ASN A 84 71.672 56.044 16.225 1.00 37.36 C ATOM 1056 OD1 ASN A 84 72.037 54.940 15.819 1.00 36.28 O ATOM 1057 ND2 ASN A 84 70.394 56.411 16.255 1.00 36.71 N ATOM 1058 N ALA A 85 74.294 55.109 18.106 1.00 41.54 N ATOM 1059 CA ALA A 85 74.652 53.842 18.753 1.00 41.84 C ATOM 1060 C ALA A 85 73.987 52.592 18.176 1.00 43.00 C ATOM 1061 O ALA A 85 74.555 51.499 18.227 1.00 43.55 O ATOM 1062 CB ALA A 85 74.358 53.932 20.240 1.00 41.37 C ATOM 1063 N GLU A 86 72.786 52.749 17.634 1.00 43.38 N ATOM 1064 CA GLU A 86 72.071 51.624 17.045 1.00 45.41 C ATOM 1065 C GLU A 86 72.446 51.396 15.571 1.00 44.81 C ATOM 1066 O GLU A 86 71.878 50.522 14.902 1.00 42.71 O ATOM 1067 CB GLU A 86 70.558 51.843 17.158 1.00 50.11 C ATOM 1068 CG GLU A 86 70.010 51.933 18.586 1.00 57.95 C ATOM 1069 CD GLU A 86 70.398 53.222 19.302 1.00 64.81 C ATOM 1070 OE1 GLU A 86 70.683 54.231 18.620 1.00 68.79 O ATOM 1071 OE2 GLU A 86 70.399 53.235 20.554 1.00 68.66 O ATOM 1072 N GLY A 87 73.399 52.186 15.070 1.00 42.64 N ATOM 1073 CA GLY A 87 73.834 52.055 13.689 1.00 40.14 C ATOM 1074 C GLY A 87 72.937 52.756 12.684 1.00 39.89 C ATOM 1075 O GLY A 87 72.956 52.434 11.495 1.00 39.43 O ATOM 1076 N TYR A 88 72.153 53.722 13.149 1.00 38.28 N ATOM 1077 CA TYR A 88 71.245 54.446 12.264 1.00 36.62 C ATOM 1078 C TYR A 88 71.791 55.842 11.886 1.00 35.60 C ATOM 1079 O TYR A 88 72.436 56.510 12.693 1.00 34.49 O ATOM 1080 CB TYR A 88 69.864 54.571 12.935 1.00 36.05 C ATOM 1081 CG TYR A 88 68.744 54.882 11.972 1.00 34.52 C ATOM 1082 CD1 TYR A 88 68.184 53.883 11.178 1.00 33.88 C ATOM 1083 CD2 TYR A 88 68.281 56.189 11.810 1.00 36.11 C ATOM 1084 CE1 TYR A 88 67.188 54.172 10.240 1.00 34.97 C ATOM 1085 CE2 TYR A 88 67.283 56.494 10.870 1.00 37.68 C ATOM 1086 CZ TYR A 88 66.741 55.477 10.092 1.00 37.66 C ATOM 1087 OH TYR A 88 65.732 55.759 9.193 1.00 41.63 O ATOM 1088 N PRO A 89 71.523 56.302 10.650 1.00 36.29 N ATOM 1089 CA PRO A 89 72.021 57.625 10.230 1.00 36.27 C ATOM 1090 C PRO A 89 71.462 58.803 11.027 1.00 35.06 C ATOM 1091 O PRO A 89 70.250 58.915 11.207 1.00 36.91 O ATOM 1092 CB PRO A 89 71.617 57.712 8.750 1.00 36.00 C ATOM 1093 CG PRO A 89 71.456 56.270 8.325 1.00 36.41 C ATOM 1094 CD PRO A 89 70.837 55.613 9.540 1.00 34.43 C ATOM 1095 N LEU A 90 72.355 59.681 11.481 1.00 33.68 N ATOM 1096 CA LEU A 90 71.984 60.874 12.235 1.00 34.08 C ATOM 1097 C LEU A 90 71.724 62.090 11.342 1.00 34.44 C ATOM 1098 O LEU A 90 71.224 63.109 11.816 1.00 36.43 O ATOM 1099 CB LEU A 90 73.082 61.219 13.242 1.00 35.82 C ATOM 1100 CG LEU A 90 73.050 60.452 14.562 1.00 38.81 C ATOM 1101 CD1 LEU A 90 74.429 60.453 15.241 1.00 39.14 C ATOM 1102 CD2 LEU A 90 72.001 61.091 15.451 1.00 37.26 C ATOM 1103 N GLU A 91 72.076 61.994 10.061 1.00 33.55 N ATOM 1104 CA GLU A 91 71.875 63.100 9.126 1.00 34.38 C ATOM 1105 C GLU A 91 71.620 62.574 7.726 1.00 33.32 C ATOM 1106 O GLU A 91 71.881 61.406 7.435 1.00 32.40 O ATOM 1107 CB GLU A 91 73.117 64.001 9.062 1.00 37.00 C ATOM 1108 CG GLU A 91 73.486 64.745 10.340 1.00 38.93 C ATOM 1109 CD GLU A 91 72.486 65.828 10.699 1.00 41.94 C ATOM 1110 OE1 GLU A 91 71.832 66.362 9.778 1.00 42.41 O ATOM 1111 OE2 GLU A 91 72.365 66.158 11.901 1.00 43.61 O ATOM 1112 N THR A 92 71.106 63.448 6.864 1.00 33.68 N ATOM 1113 CA THR A 92 70.862 63.111 5.467 1.00 34.57 C ATOM 1114 C THR A 92 72.227 63.235 4.779 1.00 34.66 C ATOM 1115 O THR A 92 73.191 63.713 5.379 1.00 33.32 O ATOM 1116 CB THR A 92 69.892 64.107 4.813 1.00 35.79 C ATOM 1117 OG1 THR A 92 70.384 65.436 5.017 1.00 33.83 O ATOM 1118 CG2 THR A 92 68.490 63.986 5.428 1.00 32.08 C ATOM 1119 N THR A 93 72.319 62.814 3.525 1.00 33.88 N ATOM 1120 CA THR A 93 73.588 62.888 2.823 1.00 34.36 C ATOM 1121 C THR A 93 73.515 63.802 1.608 1.00 35.49 C ATOM 1122 O THR A 93 72.712 63.582 0.697 1.00 32.02 O ATOM 1123 CB THR A 93 74.045 61.494 2.358 1.00 34.39 C ATOM 1124 OG1 THR A 93 74.266 60.658 3.500 1.00 32.57 O ATOM 1125 CG2 THR A 93 75.325 61.596 1.533 1.00 31.29 C ATOM 1126 N PHE A 94 74.363 64.826 1.602 1.00 35.94 N ATOM 1127 CA PHE A 94 74.408 65.764 0.489 1.00 36.03 C ATOM 1128 C PHE A 94 75.028 65.076 -0.718 1.00 35.33 C ATOM 1129 O PHE A 94 76.019 64.358 -0.584 1.00 35.32 O ATOM 1130 CB PHE A 94 75.246 66.990 0.851 1.00 36.76 C ATOM 1131 CG PHE A 94 75.478 67.902 -0.305 1.00 36.72 C ATOM 1132 CD1 PHE A 94 74.406 68.532 -0.927 1.00 36.88 C ATOM 1133 CD2 PHE A 94 76.751 68.069 -0.827 1.00 35.08 C ATOM 1134 CE1 PHE A 94 74.595 69.310 -2.059 1.00 35.38 C ATOM 1135 CE2 PHE A 94 76.948 68.845 -1.956 1.00 37.72 C ATOM 1136 CZ PHE A 94 75.863 69.466 -2.574 1.00 36.08 C ATOM 1137 N VAL A 95 74.445 65.290 -1.892 1.00 36.16 N ATOM 1138 CA VAL A 95 74.949 64.675 -3.115 1.00 37.19 C ATOM 1139 C VAL A 95 75.570 65.737 -4.028 1.00 40.14 C ATOM 1140 O VAL A 95 76.764 65.677 -4.330 1.00 41.33 O ATOM 1141 CB VAL A 95 73.814 63.926 -3.867 1.00 36.15 C ATOM 1142 CG1 VAL A 95 74.358 63.241 -5.095 1.00 32.72 C ATOM 1143 CG2 VAL A 95 73.169 62.896 -2.947 1.00 36.43 C ATOM 1144 N SER A 96 74.771 66.711 -4.462 1.00 42.48 N ATOM 1145 CA SER A 96 75.287 67.766 -5.333 1.00 44.74 C ATOM 1146 C SER A 96 74.284 68.893 -5.545 1.00 46.01 C ATOM 1147 O SER A 96 73.076 68.695 -5.441 1.00 46.80 O ATOM 1148 CB SER A 96 75.686 67.186 -6.689 1.00 46.76 C ATOM 1149 OG SER A 96 74.553 66.689 -7.372 1.00 49.46 O ATOM 1150 N LEU A 97 74.791 70.083 -5.834 1.00 47.08 N ATOM 1151 CA LEU A 97 73.931 71.225 -6.065 1.00 48.52 C ATOM 1152 C LEU A 97 73.014 70.966 -7.251 1.00 49.92 C ATOM 1153 O LEU A 97 73.385 70.257 -8.185 1.00 50.41 O ATOM 1154 CB LEU A 97 74.780 72.458 -6.345 1.00 49.74 C ATOM 1155 CG LEU A 97 75.416 73.141 -5.141 1.00 51.15 C ATOM 1156 CD1 LEU A 97 76.563 74.017 -5.605 1.00 52.32 C ATOM 1157 CD2 LEU A 97 74.364 73.956 -4.409 1.00 50.15 C ATOM 1158 N ALA A 98 71.817 71.541 -7.215 1.00 51.11 N ATOM 1159 CA ALA A 98 70.867 71.380 -8.310 1.00 53.61 C ATOM 1160 C ALA A 98 70.958 72.577 -9.252 1.00 55.22 C ATOM 1161 O ALA A 98 71.001 73.728 -8.808 1.00 54.13 O ATOM 1162 CB ALA A 98 69.450 71.254 -7.770 1.00 53.28 C ATOM 1163 N PRO A 99 71.009 72.319 -10.568 1.00 57.44 N ATOM 1164 CA PRO A 99 71.093 73.391 -11.563 1.00 58.27 C ATOM 1165 C PRO A 99 69.691 73.932 -11.799 1.00 58.83 C ATOM 1166 O PRO A 99 68.880 73.297 -12.468 1.00 59.50 O ATOM 1167 CB PRO A 99 71.656 72.672 -12.782 1.00 59.65 C ATOM 1168 CG PRO A 99 70.989 71.330 -12.694 1.00 58.72 C ATOM 1169 CD PRO A 99 71.084 70.994 -11.213 1.00 57.88 C ATOM 1170 N LEU A 100 69.407 75.102 -11.244 1.00 60.42 N ATOM 1171 CA LEU A 100 68.084 75.697 -11.376 1.00 63.27 C ATOM 1172 C LEU A 100 67.847 76.433 -12.697 1.00 65.90 C ATOM 1173 O LEU A 100 66.783 77.020 -12.907 1.00 64.43 O ATOM 1174 CB LEU A 100 67.834 76.640 -10.200 1.00 61.69 C ATOM 1175 CG LEU A 100 68.052 76.033 -8.811 1.00 61.72 C ATOM 1176 CD1 LEU A 100 67.697 77.067 -7.753 1.00 61.34 C ATOM 1177 CD2 LEU A 100 67.200 74.780 -8.646 1.00 61.00 C ATOM 1178 N VAL A 101 68.838 76.391 -13.583 1.00 69.74 N ATOM 1179 CA VAL A 101 68.743 77.050 -14.880 1.00 74.57 C ATOM 1180 C VAL A 101 69.538 76.281 -15.924 1.00 77.93 C ATOM 1181 O VAL A 101 70.565 75.682 -15.613 1.00 78.68 O ATOM 1182 CB VAL A 101 69.294 78.494 -14.822 1.00 74.62 C ATOM 1183 CG1 VAL A 101 69.431 79.057 -16.225 1.00 75.45 C ATOM 1184 CG2 VAL A 101 68.367 79.375 -14.001 1.00 74.93 C ATOM 1185 N GLN A 102 69.055 76.304 -17.162 1.00 81.70 N ATOM 1186 CA GLN A 102 69.719 75.623 -18.269 1.00 84.94 C ATOM 1187 C GLN A 102 69.855 74.120 -18.041 1.00 86.88 C ATOM 1188 O GLN A 102 70.719 73.470 -18.634 1.00 87.09 O ATOM 1189 CB GLN A 102 71.096 76.241 -18.509 1.00 85.42 C ATOM 1190 N ASN A 103 69.003 73.572 -17.181 1.00 88.60 N ATOM 1191 CA ASN A 103 69.036 72.144 -16.900 1.00 90.35 C ATOM 1192 C ASN A 103 68.644 71.399 -18.173 1.00 91.71 C ATOM 1193 O ASN A 103 68.797 70.179 -18.273 1.00 93.07 O ATOM 1194 CB ASN A 103 68.072 71.811 -15.775 1.00 90.17 C ATOM 1195 N SER A 104 68.138 72.150 -19.147 1.00 91.84 N ATOM 1196 CA SER A 104 67.716 71.582 -20.421 1.00 91.39 C ATOM 1197 C SER A 104 68.836 70.784 -21.095 1.00 90.70 C ATOM 1198 O SER A 104 69.871 71.344 -21.468 1.00 91.09 O ATOM 1199 CB SER A 104 67.238 72.698 -21.346 1.00 92.04 C ATOM 1200 N GLY A 105 68.627 69.476 -21.240 1.00 89.15 N ATOM 1201 CA GLY A 105 69.623 68.635 -21.886 1.00 86.47 C ATOM 1202 C GLY A 105 70.006 67.339 -21.186 1.00 84.32 C ATOM 1203 O GLY A 105 70.144 66.295 -21.831 1.00 84.57 O ATOM 1204 N VAL A 106 70.177 67.397 -19.869 1.00 80.74 N ATOM 1205 CA VAL A 106 70.579 66.226 -19.098 1.00 76.78 C ATOM 1206 C VAL A 106 69.491 65.183 -18.865 1.00 73.76 C ATOM 1207 O VAL A 106 68.342 65.510 -18.578 1.00 73.72 O ATOM 1208 CB VAL A 106 71.157 66.672 -17.757 1.00 76.61 C ATOM 1209 N LYS A 107 69.876 63.919 -19.002 1.00 70.39 N ATOM 1210 CA LYS A 107 68.984 62.789 -18.768 1.00 67.25 C ATOM 1211 C LYS A 107 69.537 62.135 -17.509 1.00 64.39 C ATOM 1212 O LYS A 107 70.682 62.388 -17.131 1.00 63.47 O ATOM 1213 CB LYS A 107 69.043 61.788 -19.929 1.00 68.36 C ATOM 1214 CG LYS A 107 68.605 62.369 -21.145 1.00 69.51 C ATOM 1215 N TRP A 108 68.740 61.301 -16.854 1.00 60.74 N ATOM 1216 CA TRP A 108 69.207 60.645 -15.644 1.00 56.80 C ATOM 1217 C TRP A 108 70.571 59.991 -15.851 1.00 56.97 C ATOM 1218 O TRP A 108 71.501 60.209 -15.075 1.00 55.47 O ATOM 1219 CB TRP A 108 68.203 59.589 -15.185 1.00 52.58 C ATOM 1220 CG TRP A 108 68.795 58.599 -14.220 1.00 47.93 C ATOM 1221 CD1 TRP A 108 68.980 57.265 -14.433 1.00 45.78 C ATOM 1222 CD2 TRP A 108 69.301 58.869 -12.906 1.00 44.20 C ATOM 1223 NE1 TRP A 108 69.569 56.684 -13.340 1.00 44.45 N ATOM 1224 CE2 TRP A 108 69.781 57.646 -12.387 1.00 43.98 C ATOM 1225 CE3 TRP A 108 69.401 60.024 -12.121 1.00 42.77 C ATOM 1226 CZ2 TRP A 108 70.347 57.541 -11.114 1.00 40.75 C ATOM 1227 CZ3 TRP A 108 69.964 59.920 -10.853 1.00 43.14 C ATOM 1228 CH2 TRP A 108 70.432 58.684 -10.364 1.00 42.12 C ATOM 1229 N GLU A 109 70.681 59.197 -16.907 1.00 56.99 N ATOM 1230 CA GLU A 109 71.914 58.483 -17.216 1.00 58.13 C ATOM 1231 C GLU A 109 73.173 59.347 -17.252 1.00 55.81 C ATOM 1232 O GLU A 109 74.261 58.866 -16.941 1.00 54.84 O ATOM 1233 CB GLU A 109 71.772 57.744 -18.550 1.00 61.42 C ATOM 1234 CG GLU A 109 70.616 56.743 -18.607 1.00 65.70 C ATOM 1235 CD GLU A 109 69.252 57.414 -18.549 1.00 68.22 C ATOM 1236 OE1 GLU A 109 69.026 58.378 -19.315 1.00 69.14 O ATOM 1237 OE2 GLU A 109 68.402 56.975 -17.745 1.00 70.83 O ATOM 1238 N ASN A 110 73.036 60.616 -17.623 1.00 54.09 N ATOM 1239 CA ASN A 110 74.196 61.503 -17.694 1.00 54.32 C ATOM 1240 C ASN A 110 74.168 62.619 -16.641 1.00 53.11 C ATOM 1241 O ASN A 110 74.764 63.677 -16.839 1.00 52.88 O ATOM 1242 CB ASN A 110 74.295 62.127 -19.093 1.00 56.68 C ATOM 1243 CG ASN A 110 73.904 61.157 -20.196 1.00 60.25 C ATOM 1244 OD1 ASN A 110 74.492 60.081 -20.339 1.00 60.05 O ATOM 1245 ND2 ASN A 110 72.904 61.538 -20.987 1.00 62.15 N ATOM 1246 N SER A 111 73.493 62.385 -15.521 1.00 51.42 N ATOM 1247 CA SER A 111 73.397 63.397 -14.470 1.00 50.25 C ATOM 1248 C SER A 111 74.588 63.399 -13.532 1.00 49.40 C ATOM 1249 O SER A 111 75.246 62.368 -13.356 1.00 48.80 O ATOM 1250 CB SER A 111 72.143 63.169 -13.627 1.00 49.72 C ATOM 1251 OG SER A 111 72.181 61.891 -13.024 1.00 47.78 O ATOM 1252 N HIS A 112 74.848 64.565 -12.937 1.00 49.25 N ATOM 1253 CA HIS A 112 75.916 64.723 -11.950 1.00 49.68 C ATOM 1254 C HIS A 112 75.563 63.792 -10.794 1.00 47.81 C ATOM 1255 O HIS A 112 76.422 63.084 -10.265 1.00 47.83 O ATOM 1256 CB HIS A 112 75.982 66.159 -11.395 1.00 53.47 C ATOM 1257 CG HIS A 112 76.643 67.145 -12.310 1.00 60.02 C ATOM 1258 ND1 HIS A 112 77.805 66.858 -12.996 1.00 61.76 N ATOM 1259 CD2 HIS A 112 76.320 68.421 -12.636 1.00 61.50 C ATOM 1260 CE1 HIS A 112 78.167 67.912 -13.707 1.00 62.85 C ATOM 1261 NE2 HIS A 112 77.283 68.875 -13.506 1.00 62.69 N ATOM 1262 N VAL A 113 74.289 63.802 -10.411 1.00 44.02 N ATOM 1263 CA VAL A 113 73.813 62.967 -9.312 1.00 42.02 C ATOM 1264 C VAL A 113 74.110 61.482 -9.520 1.00 41.56 C ATOM 1265 O VAL A 113 74.694 60.836 -8.650 1.00 39.87 O ATOM 1266 CB VAL A 113 72.290 63.161 -9.083 1.00 41.11 C ATOM 1267 CG1 VAL A 113 71.724 62.025 -8.212 1.00 37.40 C ATOM 1268 CG2 VAL A 113 72.048 64.518 -8.423 1.00 37.94 C ATOM 1269 N ARG A 114 73.710 60.945 -10.666 1.00 41.12 N ATOM 1270 CA ARG A 114 73.944 59.539 -10.950 1.00 42.57 C ATOM 1271 C ARG A 114 75.444 59.254 -10.943 1.00 43.97 C ATOM 1272 O ARG A 114 75.896 58.227 -10.430 1.00 43.55 O ATOM 1273 CB ARG A 114 73.366 59.166 -12.312 1.00 42.93 C ATOM 1274 CG ARG A 114 73.555 57.713 -12.644 1.00 45.40 C ATOM 1275 CD ARG A 114 73.394 57.435 -14.111 1.00 49.65 C ATOM 1276 NE ARG A 114 73.660 56.026 -14.378 1.00 53.46 N ATOM 1277 CZ ARG A 114 74.024 55.537 -15.558 1.00 53.90 C ATOM 1278 NH1 ARG A 114 74.169 56.339 -16.605 1.00 55.69 N ATOM 1279 NH2 ARG A 114 74.258 54.241 -15.682 1.00 55.26 N ATOM 1280 N HIS A 115 76.214 60.170 -11.520 1.00 44.68 N ATOM 1281 CA HIS A 115 77.658 60.010 -11.579 1.00 45.89 C ATOM 1282 C HIS A 115 78.288 59.947 -10.183 1.00 45.86 C ATOM 1283 O HIS A 115 79.081 59.048 -9.889 1.00 43.98 O ATOM 1284 CB HIS A 115 78.278 61.153 -12.377 1.00 48.08 C ATOM 1285 CG HIS A 115 79.767 61.070 -12.484 1.00 53.43 C ATOM 1286 ND1 HIS A 115 80.609 61.983 -11.884 1.00 55.83 N ATOM 1287 CD2 HIS A 115 80.566 60.184 -13.125 1.00 55.57 C ATOM 1288 CE1 HIS A 115 81.863 61.664 -12.154 1.00 57.27 C ATOM 1289 NE2 HIS A 115 81.865 60.577 -12.905 1.00 57.40 N ATOM 1290 N LYS A 116 77.937 60.897 -9.322 1.00 44.69 N ATOM 1291 CA LYS A 116 78.493 60.910 -7.978 1.00 44.95 C ATOM 1292 C LYS A 116 78.070 59.704 -7.150 1.00 43.99 C ATOM 1293 O LYS A 116 78.820 59.249 -6.294 1.00 43.06 O ATOM 1294 CB LYS A 116 78.130 62.209 -7.255 1.00 45.74 C ATOM 1295 CG LYS A 116 79.085 63.348 -7.595 1.00 50.04 C ATOM 1296 CD LYS A 116 78.891 64.548 -6.694 1.00 54.62 C ATOM 1297 CE LYS A 116 79.857 65.670 -7.055 1.00 56.43 C ATOM 1298 NZ LYS A 116 79.525 66.937 -6.329 1.00 58.87 N ATOM 1299 N LEU A 117 76.887 59.170 -7.433 1.00 42.30 N ATOM 1300 CA LEU A 117 76.380 58.025 -6.699 1.00 40.89 C ATOM 1301 C LEU A 117 76.568 56.693 -7.396 1.00 41.52 C ATOM 1302 O LEU A 117 75.979 55.696 -6.974 1.00 41.91 O ATOM 1303 CB LEU A 117 74.895 58.201 -6.405 1.00 39.39 C ATOM 1304 CG LEU A 117 74.545 59.278 -5.388 1.00 38.35 C ATOM 1305 CD1 LEU A 117 73.029 59.397 -5.270 1.00 34.53 C ATOM 1306 CD2 LEU A 117 75.178 58.927 -4.060 1.00 35.93 C ATOM 1307 N SER A 118 77.372 56.653 -8.454 1.00 41.02 N ATOM 1308 CA SER A 118 77.569 55.383 -9.159 1.00 43.34 C ATOM 1309 C SER A 118 78.474 54.422 -8.391 1.00 43.79 C ATOM 1310 O SER A 118 78.309 53.205 -8.479 1.00 44.16 O ATOM 1311 CB SER A 118 78.135 55.618 -10.562 1.00 41.59 C ATOM 1312 OG SER A 118 79.300 56.410 -10.506 1.00 43.34 O ATOM 1313 N CYS A 119 79.419 54.975 -7.635 1.00 43.34 N ATOM 1314 CA CYS A 119 80.347 54.171 -6.848 1.00 43.12 C ATOM 1315 C CYS A 119 80.825 54.936 -5.611 1.00 40.88 C ATOM 1316 O CYS A 119 81.720 55.782 -5.691 1.00 39.76 O ATOM 1317 CB CYS A 119 81.544 53.780 -7.702 1.00 47.00 C ATOM 1318 SG CYS A 119 82.558 52.542 -6.900 1.00 57.63 S ATOM 1319 N VAL A 120 80.243 54.611 -4.463 1.00 37.58 N ATOM 1320 CA VAL A 120 80.571 55.297 -3.220 1.00 35.61 C ATOM 1321 C VAL A 120 81.272 54.451 -2.169 1.00 35.35 C ATOM 1322 O VAL A 120 80.955 53.274 -1.983 1.00 36.77 O ATOM 1323 CB VAL A 120 79.288 55.870 -2.564 1.00 34.20 C ATOM 1324 CG1 VAL A 120 79.652 56.782 -1.413 1.00 31.98 C ATOM 1325 CG2 VAL A 120 78.452 56.614 -3.604 1.00 32.60 C ATOM 1326 N LEU A 121 82.235 55.062 -1.490 1.00 33.69 N ATOM 1327 CA LEU A 121 82.936 54.401 -0.402 1.00 33.11 C ATOM 1328 C LEU A 121 82.389 55.116 0.826 1.00 32.19 C ATOM 1329 O LEU A 121 82.817 56.228 1.137 1.00 32.40 O ATOM 1330 CB LEU A 121 84.445 54.638 -0.468 1.00 33.31 C ATOM 1331 CG LEU A 121 85.364 53.693 0.320 1.00 34.76 C ATOM 1332 CD1 LEU A 121 86.581 54.485 0.744 1.00 34.55 C ATOM 1333 CD2 LEU A 121 84.694 53.103 1.549 1.00 33.47 C ATOM 1334 N TRP A 122 81.421 54.501 1.497 1.00 31.42 N ATOM 1335 CA TRP A 122 80.844 55.095 2.692 1.00 30.81 C ATOM 1336 C TRP A 122 81.728 54.793 3.890 1.00 33.52 C ATOM 1337 O TRP A 122 82.136 53.645 4.092 1.00 33.29 O ATOM 1338 CB TRP A 122 79.462 54.521 2.982 1.00 32.08 C ATOM 1339 CG TRP A 122 78.464 54.708 1.891 1.00 32.36 C ATOM 1340 CD1 TRP A 122 78.173 53.834 0.883 1.00 32.52 C ATOM 1341 CD2 TRP A 122 77.638 55.853 1.683 1.00 30.89 C ATOM 1342 NE1 TRP A 122 77.211 54.369 0.055 1.00 33.16 N ATOM 1343 CE2 TRP A 122 76.871 55.611 0.520 1.00 30.87 C ATOM 1344 CE3 TRP A 122 77.478 57.066 2.357 1.00 29.60 C ATOM 1345 CZ2 TRP A 122 75.950 56.538 0.022 1.00 31.05 C ATOM 1346 CZ3 TRP A 122 76.561 57.989 1.863 1.00 32.94 C ATOM 1347 CH2 TRP A 122 75.812 57.718 0.701 1.00 32.17 C ATOM 1348 N MET A 123 82.042 55.821 4.672 1.00 33.37 N ATOM 1349 CA MET A 123 82.829 55.632 5.880 1.00 34.13 C ATOM 1350 C MET A 123 81.924 56.030 7.035 1.00 34.46 C ATOM 1351 O MET A 123 81.792 57.213 7.361 1.00 33.28 O ATOM 1352 CB MET A 123 84.085 56.513 5.892 1.00 35.96 C ATOM 1353 CG MET A 123 85.223 56.027 4.981 1.00 39.13 C ATOM 1354 SD MET A 123 85.764 54.334 5.374 1.00 41.33 S ATOM 1355 CE MET A 123 86.871 54.647 6.750 1.00 38.47 C ATOM 1356 N PRO A 124 81.257 55.046 7.659 1.00 34.50 N ATOM 1357 CA PRO A 124 80.376 55.371 8.781 1.00 34.73 C ATOM 1358 C PRO A 124 81.225 55.957 9.890 1.00 33.86 C ATOM 1359 O PRO A 124 82.380 55.564 10.053 1.00 34.57 O ATOM 1360 CB PRO A 124 79.805 54.010 9.169 1.00 33.12 C ATOM 1361 CG PRO A 124 79.755 53.312 7.834 1.00 34.94 C ATOM 1362 CD PRO A 124 81.159 53.610 7.358 1.00 34.88 C ATOM 1363 N ILE A 125 80.673 56.904 10.639 1.00 31.21 N ATOM 1364 CA ILE A 125 81.410 57.490 11.748 1.00 31.32 C ATOM 1365 C ILE A 125 80.448 57.751 12.881 1.00 32.03 C ATOM 1366 O ILE A 125 79.262 57.984 12.659 1.00 34.40 O ATOM 1367 CB ILE A 125 82.051 58.842 11.388 1.00 31.01 C ATOM 1368 CG1 ILE A 125 80.960 59.805 10.900 1.00 31.42 C ATOM 1369 CG2 ILE A 125 83.155 58.645 10.355 1.00 29.97 C ATOM 1370 CD1 ILE A 125 81.417 61.212 10.725 1.00 34.88 C ATOM 1371 N GLU A 126 80.949 57.703 14.101 1.00 33.04 N ATOM 1372 CA GLU A 126 80.105 57.988 15.250 1.00 35.09 C ATOM 1373 C GLU A 126 79.698 59.460 15.160 1.00 34.96 C ATOM 1374 O GLU A 126 80.557 60.340 15.060 1.00 33.86 O ATOM 1375 CB GLU A 126 80.881 57.715 16.543 1.00 35.73 C ATOM 1376 CG GLU A 126 80.893 56.235 16.918 1.00 40.65 C ATOM 1377 CD GLU A 126 81.770 55.918 18.109 1.00 44.77 C ATOM 1378 OE1 GLU A 126 82.040 56.822 18.927 1.00 47.47 O ATOM 1379 OE2 GLU A 126 82.183 54.748 18.236 1.00 50.21 O ATOM 1380 N GLY A 127 78.398 59.737 15.194 1.00 34.23 N ATOM 1381 CA GLY A 127 77.960 61.120 15.087 1.00 34.75 C ATOM 1382 C GLY A 127 77.234 61.742 16.268 1.00 37.10 C ATOM 1383 O GLY A 127 76.946 62.942 16.239 1.00 39.16 O ATOM 1384 N SER A 128 76.943 60.955 17.303 1.00 37.36 N ATOM 1385 CA SER A 128 76.223 61.469 18.469 1.00 38.67 C ATOM 1386 C SER A 128 76.847 62.713 19.070 1.00 40.16 C ATOM 1387 O SER A 128 78.028 62.727 19.421 1.00 39.70 O ATOM 1388 CB SER A 128 76.098 60.385 19.535 1.00 38.71 C ATOM 1389 OG SER A 128 75.279 59.335 19.054 1.00 41.97 O ATOM 1390 N ARG A 129 76.027 63.754 19.198 1.00 41.94 N ATOM 1391 CA ARG A 129 76.467 65.037 19.729 1.00 44.13 C ATOM 1392 C ARG A 129 77.068 65.005 21.125 1.00 46.19 C ATOM 1393 O ARG A 129 77.974 65.779 21.429 1.00 45.51 O ATOM 1394 CB ARG A 129 75.312 66.039 19.691 1.00 45.08 C ATOM 1395 CG ARG A 129 74.960 66.521 18.284 1.00 47.42 C ATOM 1396 CD ARG A 129 73.633 67.271 18.250 1.00 48.72 C ATOM 1397 NE ARG A 129 73.230 67.601 16.881 1.00 50.99 N ATOM 1398 CZ ARG A 129 71.994 67.936 16.523 1.00 50.64 C ATOM 1399 NH1 ARG A 129 71.032 67.989 17.432 1.00 51.90 N ATOM 1400 NH2 ARG A 129 71.714 68.208 15.255 1.00 50.97 N ATOM 1401 N HIS A 130 76.591 64.115 21.984 1.00 48.16 N ATOM 1402 CA HIS A 130 77.140 64.080 23.332 1.00 49.78 C ATOM 1403 C HIS A 130 78.562 63.514 23.399 1.00 50.40 C ATOM 1404 O HIS A 130 79.251 63.697 24.403 1.00 51.35 O ATOM 1405 CB HIS A 130 76.235 63.279 24.265 1.00 50.36 C ATOM 1406 CG HIS A 130 76.235 61.810 23.988 1.00 52.00 C ATOM 1407 ND1 HIS A 130 75.364 61.219 23.098 1.00 53.27 N ATOM 1408 CD2 HIS A 130 76.998 60.809 24.489 1.00 51.61 C ATOM 1409 CE1 HIS A 130 75.588 59.917 23.065 1.00 53.88 C ATOM 1410 NE2 HIS A 130 76.575 59.642 23.900 1.00 53.78 N ATOM 1411 N ILE A 131 79.005 62.823 22.350 1.00 48.51 N ATOM 1412 CA ILE A 131 80.354 62.263 22.360 1.00 46.43 C ATOM 1413 C ILE A 131 81.371 63.337 22.009 1.00 44.88 C ATOM 1414 O ILE A 131 81.243 64.004 20.982 1.00 44.53 O ATOM 1415 CB ILE A 131 80.521 61.112 21.336 1.00 47.00 C ATOM 1416 CG1 ILE A 131 79.490 60.012 21.591 1.00 46.69 C ATOM 1417 CG2 ILE A 131 81.911 60.509 21.457 1.00 47.35 C ATOM 1418 CD1 ILE A 131 79.601 58.844 20.619 1.00 44.64 C ATOM 1419 N PRO A 132 82.391 63.533 22.863 1.00 44.18 N ATOM 1420 CA PRO A 132 83.413 64.551 22.577 1.00 42.88 C ATOM 1421 C PRO A 132 84.040 64.234 21.215 1.00 42.09 C ATOM 1422 O PRO A 132 84.484 63.108 20.977 1.00 39.72 O ATOM 1423 CB PRO A 132 84.407 64.376 23.724 1.00 42.57 C ATOM 1424 CG PRO A 132 83.538 63.891 24.841 1.00 45.28 C ATOM 1425 CD PRO A 132 82.656 62.873 24.152 1.00 43.72 C ATOM 1426 N LEU A 133 84.057 65.223 20.327 1.00 41.89 N ATOM 1427 CA LEU A 133 84.591 65.050 18.980 1.00 41.76 C ATOM 1428 C LEU A 133 85.827 64.143 18.932 1.00 42.83 C ATOM 1429 O LEU A 133 85.903 63.219 18.118 1.00 41.06 O ATOM 1430 CB LEU A 133 84.912 66.419 18.372 1.00 40.55 C ATOM 1431 CG LEU A 133 85.351 66.443 16.906 1.00 39.84 C ATOM 1432 CD1 LEU A 133 84.372 65.617 16.068 1.00 37.64 C ATOM 1433 CD2 LEU A 133 85.423 67.895 16.402 1.00 39.23 C ATOM 1434 N ARG A 134 86.779 64.395 19.822 1.00 43.00 N ATOM 1435 CA ARG A 134 88.005 63.607 19.873 1.00 43.98 C ATOM 1436 C ARG A 134 87.814 62.113 20.143 1.00 43.49 C ATOM 1437 O ARG A 134 88.634 61.300 19.733 1.00 44.44 O ATOM 1438 CB ARG A 134 88.957 64.181 20.937 1.00 45.15 C ATOM 1439 CG ARG A 134 90.213 64.856 20.372 1.00 44.87 C ATOM 1440 CD ARG A 134 91.202 65.232 21.472 1.00 42.74 C ATOM 1441 NE ARG A 134 92.298 64.272 21.565 1.00 44.96 N ATOM 1442 CZ ARG A 134 93.304 64.196 20.698 1.00 42.67 C ATOM 1443 NH1 ARG A 134 93.374 65.026 19.671 1.00 44.99 N ATOM 1444 NH2 ARG A 134 94.235 63.273 20.848 1.00 46.21 N ATOM 1445 N GLU A 135 86.736 61.750 20.824 1.00 44.67 N ATOM 1446 CA GLU A 135 86.489 60.351 21.182 1.00 45.63 C ATOM 1447 C GLU A 135 85.625 59.518 20.230 1.00 43.59 C ATOM 1448 O GLU A 135 85.511 58.296 20.391 1.00 43.32 O ATOM 1449 CB GLU A 135 85.898 60.295 22.598 1.00 49.20 C ATOM 1450 CG GLU A 135 86.900 60.613 23.715 1.00 56.03 C ATOM 1451 CD GLU A 135 86.224 60.969 25.037 1.00 61.57 C ATOM 1452 OE1 GLU A 135 85.277 60.255 25.445 1.00 63.71 O ATOM 1453 OE2 GLU A 135 86.646 61.963 25.671 1.00 62.69 O ATOM 1454 N ARG A 136 85.021 60.165 19.240 1.00 40.36 N ATOM 1455 CA ARG A 136 84.182 59.452 18.285 1.00 39.12 C ATOM 1456 C ARG A 136 85.034 58.516 17.438 1.00 40.11 C ATOM 1457 O ARG A 136 86.173 58.844 17.091 1.00 41.31 O ATOM 1458 CB ARG A 136 83.463 60.451 17.391 1.00 38.56 C ATOM 1459 CG ARG A 136 82.723 61.500 18.194 1.00 38.72 C ATOM 1460 CD ARG A 136 81.947 62.458 17.328 1.00 36.67 C ATOM 1461 NE ARG A 136 81.301 63.459 18.163 1.00 38.29 N ATOM 1462 CZ ARG A 136 80.529 64.441 17.713 1.00 38.22 C ATOM 1463 NH1 ARG A 136 80.295 64.567 16.413 1.00 33.63 N ATOM 1464 NH2 ARG A 136 79.984 65.290 18.576 1.00 37.19 N ATOM 1465 N HIS A 137 84.487 57.348 17.114 1.00 38.33 N ATOM 1466 CA HIS A 137 85.206 56.379 16.308 1.00 37.01 C ATOM 1467 C HIS A 137 84.819 56.407 14.827 1.00 36.70 C ATOM 1468 O HIS A 137 83.720 56.835 14.444 1.00 34.08 O ATOM 1469 CB HIS A 137 84.983 54.953 16.833 1.00 39.60 C ATOM 1470 CG HIS A 137 85.468 54.728 18.232 1.00 42.98 C ATOM 1471 ND1 HIS A 137 84.751 55.120 19.344 1.00 43.75 N ATOM 1472 CD2 HIS A 137 86.593 54.136 18.700 1.00 43.86 C ATOM 1473 CE1 HIS A 137 85.413 54.777 20.435 1.00 43.10 C ATOM 1474 NE2 HIS A 137 86.533 54.179 20.073 1.00 44.56 N ATOM 1475 N ILE A 138 85.757 55.930 14.013 1.00 36.67 N ATOM 1476 CA ILE A 138 85.602 55.808 12.573 1.00 36.14 C ATOM 1477 C ILE A 138 85.138 54.369 12.348 1.00 36.66 C ATOM 1478 O ILE A 138 85.681 53.446 12.960 1.00 37.23 O ATOM 1479 CB ILE A 138 86.950 56.024 11.878 1.00 36.33 C ATOM 1480 CG1 ILE A 138 87.389 57.473 12.090 1.00 36.30 C ATOM 1481 CG2 ILE A 138 86.852 55.678 10.399 1.00 35.05 C ATOM 1482 CD1 ILE A 138 88.831 57.734 11.774 1.00 30.82 C ATOM 1483 N GLY A 139 84.135 54.179 11.492 1.00 34.73 N ATOM 1484 CA GLY A 139 83.628 52.839 11.240 1.00 36.47 C ATOM 1485 C GLY A 139 84.333 52.086 10.122 1.00 39.09 C ATOM 1486 O GLY A 139 85.229 52.626 9.467 1.00 38.20 O ATOM 1487 N ALA A 140 83.930 50.833 9.901 1.00 39.79 N ATOM 1488 CA ALA A 140 84.524 50.018 8.845 1.00 39.77 C ATOM 1489 C ALA A 140 84.000 50.505 7.506 1.00 39.86 C ATOM 1490 O ALA A 140 82.846 50.912 7.391 1.00 41.38 O ATOM 1491 CB ALA A 140 84.177 48.544 9.044 1.00 39.21 C ATOM 1492 N PRO A 141 84.842 50.458 6.468 1.00 39.85 N ATOM 1493 CA PRO A 141 84.432 50.911 5.140 1.00 38.76 C ATOM 1494 C PRO A 141 83.319 50.076 4.516 1.00 39.76 C ATOM 1495 O PRO A 141 83.226 48.867 4.748 1.00 39.57 O ATOM 1496 CB PRO A 141 85.731 50.833 4.345 1.00 38.79 C ATOM 1497 CG PRO A 141 86.396 49.626 4.936 1.00 40.40 C ATOM 1498 CD PRO A 141 86.184 49.846 6.426 1.00 40.24 C ATOM 1499 N ILE A 142 82.461 50.732 3.738 1.00 38.18 N ATOM 1500 CA ILE A 142 81.381 50.045 3.046 1.00 36.59 C ATOM 1501 C ILE A 142 81.408 50.527 1.610 1.00 36.27 C ATOM 1502 O ILE A 142 81.074 51.677 1.321 1.00 36.76 O ATOM 1503 CB ILE A 142 79.997 50.337 3.683 1.00 35.94 C ATOM 1504 CG1 ILE A 142 79.991 49.845 5.134 1.00 34.63 C ATOM 1505 CG2 ILE A 142 78.888 49.626 2.887 1.00 33.65 C ATOM 1506 CD1 ILE A 142 78.700 50.083 5.864 1.00 36.00 C ATOM 1507 N PHE A 143 81.832 49.644 0.713 1.00 36.64 N ATOM 1508 CA PHE A 143 81.923 49.964 -0.702 1.00 38.48 C ATOM 1509 C PHE A 143 80.573 49.667 -1.347 1.00 39.08 C ATOM 1510 O PHE A 143 80.110 48.532 -1.354 1.00 39.96 O ATOM 1511 CB PHE A 143 83.037 49.140 -1.343 1.00 38.36 C ATOM 1512 CG PHE A 143 83.361 49.544 -2.737 1.00 40.40 C ATOM 1513 CD1 PHE A 143 83.767 50.845 -3.019 1.00 41.24 C ATOM 1514 CD2 PHE A 143 83.201 48.648 -3.784 1.00 39.43 C ATOM 1515 CE1 PHE A 143 84.049 51.234 -4.319 1.00 40.33 C ATOM 1516 CE2 PHE A 143 83.481 49.022 -5.090 1.00 40.23 C ATOM 1517 CZ PHE A 143 83.886 50.322 -5.363 1.00 41.77 C ATOM 1518 N TRP A 144 79.954 50.693 -1.915 1.00 39.19 N ATOM 1519 CA TRP A 144 78.623 50.538 -2.477 1.00 37.87 C ATOM 1520 C TRP A 144 78.409 50.997 -3.913 1.00 37.74 C ATOM 1521 O TRP A 144 79.006 51.967 -4.369 1.00 37.63 O ATOM 1522 CB TRP A 144 77.640 51.283 -1.560 1.00 36.51 C ATOM 1523 CG TRP A 144 76.230 51.401 -2.061 1.00 36.04 C ATOM 1524 CD1 TRP A 144 75.230 50.486 -1.914 1.00 35.47 C ATOM 1525 CD2 TRP A 144 75.653 52.524 -2.743 1.00 34.24 C ATOM 1526 NE1 TRP A 144 74.063 50.970 -2.457 1.00 34.75 N ATOM 1527 CE2 TRP A 144 74.294 52.211 -2.978 1.00 34.38 C ATOM 1528 CE3 TRP A 144 76.152 53.754 -3.187 1.00 33.58 C ATOM 1529 CZ2 TRP A 144 73.422 53.099 -3.624 1.00 34.31 C ATOM 1530 CZ3 TRP A 144 75.282 54.640 -3.832 1.00 34.05 C ATOM 1531 CH2 TRP A 144 73.932 54.300 -4.049 1.00 35.08 C ATOM 1532 N LYS A 145 77.536 50.272 -4.603 1.00 38.58 N ATOM 1533 CA LYS A 145 77.112 50.573 -5.969 1.00 39.27 C ATOM 1534 C LYS A 145 75.607 50.344 -5.894 1.00 39.27 C ATOM 1535 O LYS A 145 75.159 49.305 -5.407 1.00 39.74 O ATOM 1536 CB LYS A 145 77.724 49.609 -6.998 1.00 39.43 C ATOM 1537 CG LYS A 145 79.217 49.771 -7.213 1.00 40.99 C ATOM 1538 CD LYS A 145 79.645 49.272 -8.587 1.00 42.85 C ATOM 1539 CE LYS A 145 79.155 50.198 -9.690 1.00 42.37 C ATOM 1540 NZ LYS A 145 79.917 49.994 -10.954 1.00 43.45 N ATOM 1541 N PRO A 146 74.802 51.309 -6.366 1.00 40.04 N ATOM 1542 CA PRO A 146 73.352 51.111 -6.298 1.00 40.27 C ATOM 1543 C PRO A 146 72.848 49.841 -6.985 1.00 42.03 C ATOM 1544 O PRO A 146 73.349 49.443 -8.044 1.00 41.12 O ATOM 1545 CB PRO A 146 72.799 52.384 -6.938 1.00 40.38 C ATOM 1546 CG PRO A 146 73.871 52.768 -7.915 1.00 39.05 C ATOM 1547 CD PRO A 146 75.139 52.518 -7.141 1.00 38.34 C ATOM 1548 N THR A 147 71.874 49.194 -6.351 1.00 43.74 N ATOM 1549 CA THR A 147 71.251 47.995 -6.905 1.00 44.34 C ATOM 1550 C THR A 147 70.276 48.505 -7.956 1.00 46.55 C ATOM 1551 O THR A 147 70.042 49.715 -8.064 1.00 46.50 O ATOM 1552 CB THR A 147 70.415 47.243 -5.864 1.00 41.88 C ATOM 1553 OG1 THR A 147 69.373 48.110 -5.390 1.00 42.23 O ATOM 1554 CG2 THR A 147 71.271 46.784 -4.714 1.00 37.96 C ATOM 1555 N ALA A 148 69.696 47.585 -8.718 1.00 47.90 N ATOM 1556 CA ALA A 148 68.735 47.960 -9.749 1.00 48.49 C ATOM 1557 C ALA A 148 67.605 48.792 -9.137 1.00 47.99 C ATOM 1558 O ALA A 148 67.258 49.858 -9.650 1.00 47.99 O ATOM 1559 CB ALA A 148 68.169 46.706 -10.413 1.00 49.04 C ATOM 1560 N GLU A 149 67.049 48.300 -8.033 1.00 47.40 N ATOM 1561 CA GLU A 149 65.954 48.975 -7.342 1.00 48.60 C ATOM 1562 C GLU A 149 66.340 50.370 -6.850 1.00 48.68 C ATOM 1563 O GLU A 149 65.587 51.334 -7.019 1.00 48.04 O ATOM 1564 CB GLU A 149 65.492 48.126 -6.154 1.00 50.48 C ATOM 1565 CG GLU A 149 64.266 48.658 -5.439 1.00 53.71 C ATOM 1566 CD GLU A 149 63.129 48.957 -6.397 1.00 57.21 C ATOM 1567 OE1 GLU A 149 63.081 48.315 -7.472 1.00 58.86 O ATOM 1568 OE2 GLU A 149 62.281 49.824 -6.071 1.00 57.00 O ATOM 1569 N GLN A 150 67.514 50.475 -6.242 1.00 47.49 N ATOM 1570 CA GLN A 150 67.968 51.755 -5.736 1.00 46.21 C ATOM 1571 C GLN A 150 68.112 52.781 -6.840 1.00 47.29 C ATOM 1572 O GLN A 150 67.778 53.950 -6.644 1.00 47.21 O ATOM 1573 CB GLN A 150 69.280 51.588 -4.978 1.00 43.60 C ATOM 1574 CG GLN A 150 69.098 50.780 -3.720 1.00 40.18 C ATOM 1575 CD GLN A 150 70.400 50.444 -3.044 1.00 39.02 C ATOM 1576 OE1 GLN A 150 71.397 50.137 -3.701 1.00 36.36 O ATOM 1577 NE2 GLN A 150 70.398 50.479 -1.719 1.00 38.02 N ATOM 1578 N GLU A 151 68.585 52.364 -8.011 1.00 49.32 N ATOM 1579 CA GLU A 151 68.727 53.330 -9.086 1.00 51.35 C ATOM 1580 C GLU A 151 67.354 53.682 -9.635 1.00 52.68 C ATOM 1581 O GLU A 151 67.116 54.818 -10.056 1.00 53.01 O ATOM 1582 CB GLU A 151 69.624 52.806 -10.214 1.00 52.39 C ATOM 1583 CG GLU A 151 70.273 53.964 -10.975 1.00 55.82 C ATOM 1584 CD GLU A 151 71.266 53.541 -12.039 1.00 56.80 C ATOM 1585 OE1 GLU A 151 71.992 52.548 -11.826 1.00 59.63 O ATOM 1586 OE2 GLU A 151 71.333 54.228 -13.080 1.00 57.40 O ATOM 1587 N ARG A 152 66.447 52.709 -9.623 1.00 53.47 N ATOM 1588 CA ARG A 152 65.091 52.937 -10.117 1.00 54.73 C ATOM 1589 C ARG A 152 64.479 54.014 -9.222 1.00 53.34 C ATOM 1590 O ARG A 152 63.831 54.951 -9.696 1.00 53.40 O ATOM 1591 CB ARG A 152 64.276 51.630 -10.057 1.00 56.09 C ATOM 1592 CG ARG A 152 63.022 51.591 -10.939 1.00 57.92 C ATOM 1593 CD ARG A 152 61.849 52.286 -10.276 1.00 61.07 C ATOM 1594 NE ARG A 152 61.511 51.636 -9.011 1.00 62.42 N ATOM 1595 CZ ARG A 152 60.764 52.185 -8.062 1.00 62.84 C ATOM 1596 NH1 ARG A 152 60.264 53.401 -8.230 1.00 64.46 N ATOM 1597 NH2 ARG A 152 60.540 51.529 -6.933 1.00 63.20 N ATOM 1598 N GLN A 153 64.728 53.896 -7.923 1.00 51.53 N ATOM 1599 CA GLN A 153 64.207 54.860 -6.969 1.00 51.00 C ATOM 1600 C GLN A 153 64.868 56.217 -7.183 1.00 49.15 C ATOM 1601 O GLN A 153 64.186 57.231 -7.338 1.00 48.92 O ATOM 1602 CB GLN A 153 64.443 54.358 -5.541 1.00 52.62 C ATOM 1603 CG GLN A 153 63.871 52.962 -5.303 1.00 58.53 C ATOM 1604 CD GLN A 153 64.034 52.470 -3.870 1.00 62.73 C ATOM 1605 OE1 GLN A 153 65.144 52.426 -3.330 1.00 64.68 O ATOM 1606 NE2 GLN A 153 62.921 52.090 -3.249 1.00 64.84 N ATOM 1607 N LEU A 154 66.197 56.234 -7.208 1.00 47.49 N ATOM 1608 CA LEU A 154 66.936 57.474 -7.406 1.00 46.04 C ATOM 1609 C LEU A 154 66.532 58.181 -8.693 1.00 47.29 C ATOM 1610 O LEU A 154 66.351 59.400 -8.714 1.00 47.33 O ATOM 1611 CB LEU A 154 68.435 57.189 -7.436 1.00 44.96 C ATOM 1612 CG LEU A 154 69.045 56.742 -6.112 1.00 43.95 C ATOM 1613 CD1 LEU A 154 70.438 56.216 -6.372 1.00 43.52 C ATOM 1614 CD2 LEU A 154 69.061 57.905 -5.116 1.00 41.34 C ATOM 1615 N LYS A 155 66.393 57.412 -9.768 1.00 49.04 N ATOM 1616 CA LYS A 155 66.019 57.976 -11.060 1.00 50.93 C ATOM 1617 C LYS A 155 64.664 58.662 -10.982 1.00 51.08 C ATOM 1618 O LYS A 155 64.502 59.790 -11.447 1.00 51.08 O ATOM 1619 CB LYS A 155 65.981 56.880 -12.133 1.00 52.82 C ATOM 1620 CG LYS A 155 65.512 57.367 -13.515 1.00 55.12 C ATOM 1621 CD LYS A 155 65.578 56.252 -14.557 1.00 58.23 C ATOM 1622 CE LYS A 155 64.913 56.653 -15.870 1.00 58.58 C ATOM 1623 NZ LYS A 155 65.521 57.876 -16.461 1.00 60.55 N ATOM 1624 N GLN A 156 63.697 57.973 -10.387 1.00 51.27 N ATOM 1625 CA GLN A 156 62.349 58.501 -10.248 1.00 51.69 C ATOM 1626 C GLN A 156 62.343 59.867 -9.574 1.00 50.89 C ATOM 1627 O GLN A 156 61.773 60.824 -10.102 1.00 50.97 O ATOM 1628 CB GLN A 156 61.494 57.522 -9.446 1.00 54.67 C ATOM 1629 CG GLN A 156 60.030 57.906 -9.323 1.00 57.53 C ATOM 1630 CD GLN A 156 59.238 56.852 -8.583 1.00 61.34 C ATOM 1631 OE1 GLN A 156 58.635 57.122 -7.543 1.00 63.42 O ATOM 1632 NE2 GLN A 156 59.245 55.631 -9.112 1.00 61.64 N ATOM 1633 N ASP A 157 62.975 59.960 -8.407 1.00 49.81 N ATOM 1634 CA ASP A 157 63.016 61.223 -7.685 1.00 48.46 C ATOM 1635 C ASP A 157 63.710 62.325 -8.476 1.00 46.32 C ATOM 1636 O ASP A 157 63.234 63.462 -8.507 1.00 43.41 O ATOM 1637 CB ASP A 157 63.710 61.060 -6.329 1.00 51.16 C ATOM 1638 CG ASP A 157 62.917 60.197 -5.361 1.00 54.78 C ATOM 1639 OD1 ASP A 157 61.672 60.134 -5.486 1.00 55.29 O ATOM 1640 OD2 ASP A 157 63.545 59.592 -4.461 1.00 55.53 O ATOM 1641 N TRP A 158 64.831 61.989 -9.112 1.00 46.11 N ATOM 1642 CA TRP A 158 65.583 62.962 -9.896 1.00 46.13 C ATOM 1643 C TRP A 158 64.713 63.605 -10.985 1.00 46.47 C ATOM 1644 O TRP A 158 64.672 64.832 -11.123 1.00 43.83 O ATOM 1645 CB TRP A 158 66.800 62.292 -10.539 1.00 45.82 C ATOM 1646 CG TRP A 158 67.774 63.274 -11.138 1.00 48.10 C ATOM 1647 CD1 TRP A 158 68.765 63.952 -10.484 1.00 47.88 C ATOM 1648 CD2 TRP A 158 67.842 63.690 -12.509 1.00 48.30 C ATOM 1649 NE1 TRP A 158 69.448 64.760 -11.362 1.00 47.07 N ATOM 1650 CE2 TRP A 158 68.903 64.620 -12.611 1.00 48.46 C ATOM 1651 CE3 TRP A 158 67.109 63.370 -13.662 1.00 49.50 C ATOM 1652 CZ2 TRP A 158 69.253 65.232 -13.821 1.00 49.64 C ATOM 1653 CZ3 TRP A 158 67.455 63.978 -14.868 1.00 50.83 C ATOM 1654 CH2 TRP A 158 68.520 64.900 -14.936 1.00 50.58 C ATOM 1655 N GLU A 159 64.014 62.775 -11.752 1.00 48.36 N ATOM 1656 CA GLU A 159 63.153 63.276 -12.826 1.00 52.34 C ATOM 1657 C GLU A 159 62.023 64.144 -12.292 1.00 52.69 C ATOM 1658 O GLU A 159 61.710 65.188 -12.868 1.00 52.95 O ATOM 1659 CB GLU A 159 62.575 62.112 -13.635 1.00 52.73 C ATOM 1660 CG GLU A 159 63.642 61.284 -14.320 1.00 57.71 C ATOM 1661 CD GLU A 159 63.077 60.227 -15.245 1.00 60.67 C ATOM 1662 OE1 GLU A 159 62.207 59.450 -14.800 1.00 63.11 O ATOM 1663 OE2 GLU A 159 63.512 60.167 -16.418 1.00 63.84 O ATOM 1664 N GLU A 160 61.421 63.713 -11.187 1.00 53.84 N ATOM 1665 CA GLU A 160 60.327 64.457 -10.575 1.00 54.40 C ATOM 1666 C GLU A 160 60.805 65.839 -10.153 1.00 54.19 C ATOM 1667 O GLU A 160 60.203 66.850 -10.514 1.00 54.92 O ATOM 1668 CB GLU A 160 59.794 63.716 -9.345 1.00 56.34 C ATOM 1669 CG GLU A 160 58.448 64.233 -8.846 1.00 58.81 C ATOM 1670 CD GLU A 160 57.959 63.498 -7.609 1.00 60.86 C ATOM 1671 OE1 GLU A 160 58.269 62.294 -7.469 1.00 61.68 O ATOM 1672 OE2 GLU A 160 57.251 64.118 -6.784 1.00 62.39 O ATOM 1673 N LEU A 161 61.897 65.876 -9.395 1.00 53.17 N ATOM 1674 CA LEU A 161 62.448 67.135 -8.911 1.00 52.17 C ATOM 1675 C LEU A 161 62.958 68.015 -10.049 1.00 52.20 C ATOM 1676 O LEU A 161 62.796 69.233 -10.014 1.00 51.03 O ATOM 1677 CB LEU A 161 63.560 66.859 -7.895 1.00 50.70 C ATOM 1678 CG LEU A 161 63.093 66.165 -6.608 1.00 49.64 C ATOM 1679 CD1 LEU A 161 64.288 65.665 -5.807 1.00 49.66 C ATOM 1680 CD2 LEU A 161 62.264 67.136 -5.786 1.00 47.22 C ATOM 1681 N MET A 162 63.562 67.402 -11.062 1.00 53.36 N ATOM 1682 CA MET A 162 64.065 68.163 -12.202 1.00 56.14 C ATOM 1683 C MET A 162 62.943 68.821 -13.009 1.00 57.69 C ATOM 1684 O MET A 162 63.079 69.967 -13.441 1.00 57.33 O ATOM 1685 CB MET A 162 64.899 67.270 -13.124 1.00 55.81 C ATOM 1686 CG MET A 162 66.296 67.004 -12.617 1.00 58.50 C ATOM 1687 SD MET A 162 67.160 68.546 -12.247 1.00 60.21 S ATOM 1688 CE MET A 162 67.660 69.070 -13.904 1.00 59.68 C ATOM 1689 N ASP A 163 61.842 68.104 -13.223 1.00 59.53 N ATOM 1690 CA ASP A 163 60.732 68.674 -13.980 1.00 62.37 C ATOM 1691 C ASP A 163 60.282 69.970 -13.327 1.00 63.12 C ATOM 1692 O ASP A 163 60.112 70.983 -14.001 1.00 63.85 O ATOM 1693 CB ASP A 163 59.546 67.704 -14.061 1.00 63.43 C ATOM 1694 CG ASP A 163 59.824 66.511 -14.962 1.00 66.36 C ATOM 1695 OD1 ASP A 163 60.558 66.676 -15.965 1.00 67.11 O ATOM 1696 OD2 ASP A 163 59.296 65.410 -14.677 1.00 68.05 O ATOM 1697 N LEU A 164 60.101 69.936 -12.012 1.00 63.53 N ATOM 1698 CA LEU A 164 59.681 71.118 -11.271 1.00 64.01 C ATOM 1699 C LEU A 164 60.624 72.300 -11.515 1.00 64.87 C ATOM 1700 O LEU A 164 60.176 73.426 -11.754 1.00 65.53 O ATOM 1701 CB LEU A 164 59.619 70.796 -9.776 1.00 63.96 C ATOM 1702 CG LEU A 164 58.498 69.852 -9.340 1.00 64.01 C ATOM 1703 CD1 LEU A 164 58.778 69.331 -7.951 1.00 65.57 C ATOM 1704 CD2 LEU A 164 57.173 70.583 -9.372 1.00 64.99 C ATOM 1705 N ILE A 165 61.927 72.038 -11.459 1.00 64.28 N ATOM 1706 CA ILE A 165 62.932 73.074 -11.666 1.00 64.05 C ATOM 1707 C ILE A 165 62.889 73.624 -13.081 1.00 65.00 C ATOM 1708 O ILE A 165 63.082 74.821 -13.294 1.00 65.60 O ATOM 1709 CB ILE A 165 64.356 72.540 -11.400 1.00 63.79 C ATOM 1710 CG1 ILE A 165 64.543 72.276 -9.906 1.00 62.76 C ATOM 1711 CG2 ILE A 165 65.394 73.539 -11.895 1.00 63.78 C ATOM 1712 CD1 ILE A 165 65.879 71.688 -9.560 1.00 62.48 C ATOM 1713 N VAL A 166 62.640 72.744 -14.045 1.00 65.99 N ATOM 1714 CA VAL A 166 62.576 73.138 -15.448 1.00 67.01 C ATOM 1715 C VAL A 166 61.272 73.856 -15.790 1.00 67.36 C ATOM 1716 O VAL A 166 61.185 74.557 -16.794 1.00 67.81 O ATOM 1717 CB VAL A 166 62.736 71.906 -16.371 1.00 66.50 C ATOM 1718 CG1 VAL A 166 62.605 72.319 -17.831 1.00 66.20 C ATOM 1719 CG2 VAL A 166 64.086 71.254 -16.125 1.00 65.91 C ATOM 1720 N LEU A 167 60.266 73.696 -14.942 1.00 68.11 N ATOM 1721 CA LEU A 167 58.975 74.325 -15.185 1.00 69.24 C ATOM 1722 C LEU A 167 58.674 75.522 -14.277 1.00 69.26 C ATOM 1723 O LEU A 167 57.523 75.923 -14.143 1.00 70.15 O ATOM 1724 CB LEU A 167 57.862 73.282 -15.054 1.00 69.91 C ATOM 1725 CG LEU A 167 58.059 72.061 -15.964 1.00 71.19 C ATOM 1726 CD1 LEU A 167 56.962 71.037 -15.710 1.00 71.24 C ATOM 1727 CD2 LEU A 167 58.060 72.496 -17.424 1.00 71.47 C ATOM 1728 N GLY A 168 59.705 76.092 -13.660 1.00 69.12 N ATOM 1729 CA GLY A 168 59.518 77.245 -12.790 1.00 68.03 C ATOM 1730 C GLY A 168 58.710 77.056 -11.512 1.00 67.89 C ATOM 1731 O GLY A 168 58.355 78.057 -10.878 1.00 68.14 O ATOM 1732 N LYS A 169 58.428 75.817 -11.112 1.00 67.71 N ATOM 1733 CA LYS A 169 57.659 75.584 -9.894 1.00 67.42 C ATOM 1734 C LYS A 169 58.607 75.556 -8.729 1.00 67.02 C ATOM 1735 O LYS A 169 58.423 74.798 -7.787 1.00 67.46 O ATOM 1736 CB LYS A 169 56.875 74.278 -10.033 1.00 66.78 C ATOM 1737 CG LYS A 169 55.988 74.335 -11.257 1.00 67.32 C ATOM 1738 CD LYS A 169 55.179 73.055 -11.480 1.00 68.91 C ATOM 1739 CE LYS A 169 54.460 73.091 -12.839 1.00 68.18 C ATOM 1740 NZ LYS A 169 53.691 71.848 -13.161 1.00 69.53 N ATOM 1741 N LEU A 170 59.643 76.376 -8.826 1.00 66.52 N ATOM 1742 CA LEU A 170 60.603 76.443 -7.756 1.00 66.49 C ATOM 1743 C LEU A 170 59.924 76.801 -6.436 1.00 66.88 C ATOM 1744 O LEU A 170 60.351 76.406 -5.348 1.00 67.17 O ATOM 1745 CB LEU A 170 61.630 77.492 -8.088 1.00 66.54 C ATOM 1746 CG LEU A 170 62.754 77.305 -9.064 1.00 65.30 C ATOM 1747 CD1 LEU A 170 63.602 78.519 -8.901 1.00 64.42 C ATOM 1748 CD2 LEU A 170 63.511 76.043 -8.750 1.00 65.08 C ATOM 1749 N ASP A 171 58.831 77.537 -6.549 1.00 68.01 N ATOM 1750 CA ASP A 171 58.104 77.958 -5.379 1.00 69.66 C ATOM 1751 C ASP A 171 57.264 76.826 -4.825 1.00 69.33 C ATOM 1752 O ASP A 171 56.724 76.973 -3.749 1.00 68.27 O ATOM 1753 CB ASP A 171 57.216 79.171 -5.680 1.00 72.45 C ATOM 1754 CG ASP A 171 56.223 78.899 -6.807 1.00 76.27 C ATOM 1755 OD1 ASP A 171 56.658 78.717 -7.967 1.00 76.95 O ATOM 1756 OD2 ASP A 171 55.000 78.834 -6.539 1.00 78.12 O ATOM 1757 N GLN A 172 57.148 75.697 -5.530 1.00 68.68 N ATOM 1758 CA GLN A 172 56.371 74.533 -5.028 1.00 67.79 C ATOM 1759 C GLN A 172 57.269 73.423 -4.475 1.00 65.77 C ATOM 1760 O GLN A 172 56.805 72.486 -3.827 1.00 66.47 O ATOM 1761 CB GLN A 172 55.499 73.910 -6.143 1.00 66.87 C ATOM 1762 CG GLN A 172 54.702 74.939 -6.907 1.00 69.74 C ATOM 1763 CD GLN A 172 53.826 74.414 -8.072 1.00 71.12 C ATOM 1764 OE1 GLN A 172 53.056 73.449 -7.944 1.00 71.07 O ATOM 1765 NE2 GLN A 172 53.923 75.097 -9.211 1.00 70.53 N ATOM 1766 N ILE A 173 58.546 73.492 -4.812 1.00 62.92 N ATOM 1767 CA ILE A 173 59.494 72.494 -4.352 1.00 59.92 C ATOM 1768 C ILE A 173 59.648 72.550 -2.839 1.00 57.68 C ATOM 1769 O ILE A 173 59.937 73.603 -2.278 1.00 56.98 O ATOM 1770 CB ILE A 173 60.862 72.723 -4.994 1.00 59.85 C ATOM 1771 CG1 ILE A 173 60.748 72.546 -6.501 1.00 58.92 C ATOM 1772 CG2 ILE A 173 61.881 71.791 -4.398 1.00 58.66 C ATOM 1773 CD1 ILE A 173 62.045 72.738 -7.225 1.00 60.06 C ATOM 1774 N THR A 174 59.431 71.418 -2.181 1.00 56.75 N ATOM 1775 CA THR A 174 59.568 71.337 -0.732 1.00 56.24 C ATOM 1776 C THR A 174 60.380 70.083 -0.423 1.00 55.16 C ATOM 1777 O THR A 174 60.376 69.130 -1.205 1.00 54.54 O ATOM 1778 CB THR A 174 58.192 71.232 -0.040 1.00 56.06 C ATOM 1779 OG1 THR A 174 58.363 71.248 1.381 1.00 58.61 O ATOM 1780 CG2 THR A 174 57.507 69.940 -0.427 1.00 57.93 C ATOM 1781 N ALA A 175 61.075 70.085 0.712 1.00 54.07 N ATOM 1782 CA ALA A 175 61.896 68.943 1.114 1.00 53.29 C ATOM 1783 C ALA A 175 61.074 67.666 1.267 1.00 52.87 C ATOM 1784 O ALA A 175 61.629 66.590 1.464 1.00 53.38 O ATOM 1785 CB ALA A 175 62.618 69.252 2.424 1.00 52.80 C ATOM 1786 N ARG A 176 59.753 67.791 1.171 1.00 52.53 N ATOM 1787 CA ARG A 176 58.863 66.644 1.318 1.00 51.43 C ATOM 1788 C ARG A 176 58.716 65.844 0.033 1.00 50.43 C ATOM 1789 O ARG A 176 58.312 64.683 0.056 1.00 49.44 O ATOM 1790 CB ARG A 176 57.492 67.111 1.810 1.00 51.46 C ATOM 1791 CG ARG A 176 57.566 67.857 3.135 1.00 51.78 C ATOM 1792 CD ARG A 176 56.200 68.225 3.681 1.00 51.39 C ATOM 1793 NE ARG A 176 56.316 68.930 4.955 1.00 52.75 N ATOM 1794 CZ ARG A 176 56.737 70.187 5.086 1.00 53.09 C ATOM 1795 NH1 ARG A 176 57.078 70.896 4.014 1.00 52.99 N ATOM 1796 NH2 ARG A 176 56.844 70.731 6.293 1.00 51.29 N ATOM 1797 N ILE A 177 59.051 66.469 -1.088 1.00 50.61 N ATOM 1798 CA ILE A 177 58.968 65.808 -2.384 1.00 49.74 C ATOM 1799 C ILE A 177 60.136 64.834 -2.527 1.00 49.29 C ATOM 1800 O ILE A 177 61.259 65.134 -2.113 1.00 47.62 O ATOM 1801 CB ILE A 177 59.029 66.836 -3.536 1.00 51.19 C ATOM 1802 CG1 ILE A 177 57.957 67.912 -3.328 1.00 50.94 C ATOM 1803 CG2 ILE A 177 58.830 66.135 -4.878 1.00 49.43 C ATOM 1804 CD1 ILE A 177 58.034 69.047 -4.323 1.00 52.16 C ATOM 1805 N GLY A 178 59.856 63.669 -3.110 1.00 49.23 N ATOM 1806 CA GLY A 178 60.878 62.651 -3.308 1.00 48.26 C ATOM 1807 C GLY A 178 60.799 61.540 -2.275 1.00 47.79 C ATOM 1808 O GLY A 178 60.648 61.813 -1.086 1.00 48.20 O ATOM 1809 N GLU A 179 60.917 60.289 -2.711 1.00 47.42 N ATOM 1810 CA GLU A 179 60.838 59.167 -1.784 1.00 47.61 C ATOM 1811 C GLU A 179 62.154 58.847 -1.068 1.00 46.99 C ATOM 1812 O GLU A 179 62.154 58.567 0.133 1.00 47.67 O ATOM 1813 CB GLU A 179 60.332 57.919 -2.506 1.00 50.96 C ATOM 1814 CG GLU A 179 59.870 56.815 -1.566 1.00 58.15 C ATOM 1815 CD GLU A 179 59.439 55.561 -2.305 1.00 63.74 C ATOM 1816 OE1 GLU A 179 58.607 55.680 -3.232 1.00 68.14 O ATOM 1817 OE2 GLU A 179 59.928 54.460 -1.962 1.00 65.19 O ATOM 1818 N VAL A 180 63.270 58.871 -1.793 1.00 43.72 N ATOM 1819 CA VAL A 180 64.565 58.592 -1.176 1.00 41.22 C ATOM 1820 C VAL A 180 65.533 59.770 -1.328 1.00 41.96 C ATOM 1821 O VAL A 180 66.460 59.934 -0.529 1.00 42.05 O ATOM 1822 CB VAL A 180 65.216 57.320 -1.758 1.00 39.88 C ATOM 1823 CG1 VAL A 180 64.338 56.116 -1.469 1.00 38.10 C ATOM 1824 CG2 VAL A 180 65.452 57.485 -3.246 1.00 38.48 C ATOM 1825 N MET A 181 65.313 60.588 -2.352 1.00 40.54 N ATOM 1826 CA MET A 181 66.148 61.755 -2.587 1.00 38.91 C ATOM 1827 C MET A 181 65.253 62.982 -2.596 1.00 40.84 C ATOM 1828 O MET A 181 64.107 62.929 -3.059 1.00 40.60 O ATOM 1829 CB MET A 181 66.897 61.629 -3.910 1.00 39.14 C ATOM 1830 CG MET A 181 67.868 62.774 -4.174 1.00 40.79 C ATOM 1831 SD MET A 181 69.090 62.367 -5.439 1.00 43.78 S ATOM 1832 CE MET A 181 68.072 62.443 -6.916 1.00 42.77 C ATOM 1833 N GLN A 182 65.786 64.090 -2.095 1.00 39.95 N ATOM 1834 CA GLN A 182 65.029 65.328 -1.985 1.00 39.51 C ATOM 1835 C GLN A 182 65.867 66.565 -2.312 1.00 40.12 C ATOM 1836 O GLN A 182 67.076 66.479 -2.550 1.00 39.48 O ATOM 1837 CB GLN A 182 64.536 65.462 -0.545 1.00 40.51 C ATOM 1838 CG GLN A 182 65.722 65.481 0.437 1.00 41.53 C ATOM 1839 CD GLN A 182 65.353 65.623 1.907 1.00 41.55 C ATOM 1840 OE1 GLN A 182 66.224 65.509 2.776 1.00 40.38 O ATOM 1841 NE2 GLN A 182 64.076 65.878 2.194 1.00 37.72 N ATOM 1842 N LEU A 183 65.198 67.716 -2.292 1.00 39.67 N ATOM 1843 CA LEU A 183 65.822 69.014 -2.517 1.00 39.03 C ATOM 1844 C LEU A 183 65.692 69.868 -1.245 1.00 39.08 C ATOM 1845 O LEU A 183 64.592 70.080 -0.731 1.00 38.41 O ATOM 1846 CB LEU A 183 65.147 69.755 -3.685 1.00 40.12 C ATOM 1847 CG LEU A 183 65.409 69.277 -5.119 1.00 42.82 C ATOM 1848 CD1 LEU A 183 64.569 70.090 -6.097 1.00 41.75 C ATOM 1849 CD2 LEU A 183 66.892 69.407 -5.439 1.00 40.31 C ATOM 1850 N ARG A 184 66.818 70.344 -0.728 1.00 37.53 N ATOM 1851 CA ARG A 184 66.807 71.200 0.448 1.00 37.31 C ATOM 1852 C ARG A 184 67.795 72.327 0.160 1.00 37.91 C ATOM 1853 O ARG A 184 68.615 72.220 -0.757 1.00 38.62 O ATOM 1854 CB ARG A 184 67.238 70.433 1.706 1.00 36.19 C ATOM 1855 CG ARG A 184 66.490 69.133 1.986 1.00 34.96 C ATOM 1856 CD ARG A 184 66.188 68.970 3.480 1.00 32.05 C ATOM 1857 NE ARG A 184 67.338 69.244 4.350 1.00 35.42 N ATOM 1858 CZ ARG A 184 68.391 68.437 4.513 1.00 34.04 C ATOM 1859 NH1 ARG A 184 68.467 67.281 3.869 1.00 28.02 N ATOM 1860 NH2 ARG A 184 69.374 68.792 5.329 1.00 30.58 N ATOM 1861 N PRO A 185 67.723 73.432 0.919 1.00 38.29 N ATOM 1862 CA PRO A 185 68.652 74.542 0.681 1.00 38.51 C ATOM 1863 C PRO A 185 70.115 74.098 0.823 1.00 38.68 C ATOM 1864 O PRO A 185 70.431 73.191 1.597 1.00 39.78 O ATOM 1865 CB PRO A 185 68.245 75.564 1.737 1.00 38.73 C ATOM 1866 CG PRO A 185 66.772 75.277 1.934 1.00 39.89 C ATOM 1867 CD PRO A 185 66.742 73.776 1.961 1.00 38.03 C ATOM 1868 N LYS A 186 70.999 74.740 0.071 1.00 36.83 N ATOM 1869 CA LYS A 186 72.415 74.406 0.099 1.00 39.68 C ATOM 1870 C LYS A 186 73.208 75.680 -0.145 1.00 39.73 C ATOM 1871 O LYS A 186 73.319 76.133 -1.279 1.00 41.01 O ATOM 1872 CB LYS A 186 72.712 73.372 -0.992 1.00 38.28 C ATOM 1873 CG LYS A 186 74.173 72.990 -1.154 1.00 37.15 C ATOM 1874 CD LYS A 186 74.760 72.404 0.111 1.00 34.24 C ATOM 1875 CE LYS A 186 76.128 71.793 -0.163 1.00 31.81 C ATOM 1876 NZ LYS A 186 76.776 71.280 1.087 1.00 31.58 N ATOM 1877 N GLY A 187 73.754 76.257 0.919 1.00 41.41 N ATOM 1878 CA GLY A 187 74.512 77.490 0.778 1.00 42.95 C ATOM 1879 C GLY A 187 74.890 78.069 2.122 1.00 44.20 C ATOM 1880 O GLY A 187 74.817 77.379 3.139 1.00 45.51 O ATOM 1881 N ALA A 188 75.285 79.337 2.140 1.00 44.75 N ATOM 1882 CA ALA A 188 75.690 79.986 3.383 1.00 45.68 C ATOM 1883 C ALA A 188 74.541 80.130 4.367 1.00 45.86 C ATOM 1884 O ALA A 188 74.715 79.924 5.567 1.00 46.76 O ATOM 1885 CB ALA A 188 76.282 81.349 3.088 1.00 44.88 C ATOM 1886 N ASN A 189 73.371 80.497 3.860 1.00 46.68 N ATOM 1887 CA ASN A 189 72.200 80.674 4.708 1.00 48.58 C ATOM 1888 C ASN A 189 70.966 80.961 3.870 1.00 49.39 C ATOM 1889 O ASN A 189 70.991 80.796 2.660 1.00 49.80 O ATOM 1890 CB ASN A 189 72.417 81.815 5.710 1.00 48.33 C ATOM 1891 CG ASN A 189 72.766 83.139 5.040 1.00 47.94 C ATOM 1892 OD1 ASN A 189 72.202 83.502 4.003 1.00 46.29 O ATOM 1893 ND2 ASN A 189 73.691 83.877 5.647 1.00 46.90 N ATOM 1894 N SER A 190 69.897 81.404 4.518 1.00 50.88 N ATOM 1895 CA SER A 190 68.645 81.694 3.829 1.00 54.53 C ATOM 1896 C SER A 190 68.702 82.881 2.861 1.00 56.29 C ATOM 1897 O SER A 190 67.833 83.010 1.998 1.00 56.66 O ATOM 1898 CB SER A 190 67.544 81.942 4.854 1.00 54.85 C ATOM 1899 OG SER A 190 67.828 83.102 5.610 1.00 60.52 O ATOM 1900 N ARG A 191 69.710 83.743 2.991 1.00 58.45 N ATOM 1901 CA ARG A 191 69.821 84.910 2.110 1.00 60.38 C ATOM 1902 C ARG A 191 70.660 84.632 0.870 1.00 60.15 C ATOM 1903 O ARG A 191 70.788 85.489 -0.004 1.00 61.36 O ATOM 1904 CB ARG A 191 70.416 86.098 2.869 1.00 63.43 C ATOM 1905 CG ARG A 191 69.706 86.419 4.170 1.00 66.98 C ATOM 1906 CD ARG A 191 70.735 86.667 5.252 1.00 72.19 C ATOM 1907 NE ARG A 191 70.292 86.193 6.560 1.00 77.05 N ATOM 1908 CZ ARG A 191 71.113 85.953 7.579 1.00 79.52 C ATOM 1909 NH1 ARG A 191 72.421 86.140 7.437 1.00 80.86 N ATOM 1910 NH2 ARG A 191 70.630 85.525 8.740 1.00 80.90 N ATOM 1911 N ALA A 192 71.241 83.439 0.800 1.00 59.43 N ATOM 1912 CA ALA A 192 72.039 83.065 -0.358 1.00 59.03 C ATOM 1913 C ALA A 192 71.093 83.108 -1.551 1.00 59.48 C ATOM 1914 O ALA A 192 69.909 82.817 -1.412 1.00 59.55 O ATOM 1915 CB ALA A 192 72.602 81.662 -0.182 1.00 56.61 C ATOM 1916 N VAL A 193 71.605 83.470 -2.719 1.00 60.39 N ATOM 1917 CA VAL A 193 70.758 83.552 -3.898 1.00 62.65 C ATOM 1918 C VAL A 193 71.456 83.078 -5.168 1.00 63.31 C ATOM 1919 O VAL A 193 72.646 83.327 -5.367 1.00 64.30 O ATOM 1920 CB VAL A 193 70.258 85.002 -4.111 1.00 63.84 C ATOM 1921 CG1 VAL A 193 69.487 85.102 -5.406 1.00 65.44 C ATOM 1922 CG2 VAL A 193 69.372 85.426 -2.947 1.00 64.12 C ATOM 1923 N THR A 194 70.702 82.383 -6.017 1.00 63.70 N ATOM 1924 CA THR A 194 71.209 81.873 -7.289 1.00 64.21 C ATOM 1925 C THR A 194 70.160 82.156 -8.363 1.00 65.06 C ATOM 1926 O THR A 194 69.033 82.547 -8.051 1.00 65.08 O ATOM 1927 CB THR A 194 71.473 80.342 -7.232 1.00 63.41 C ATOM 1928 OG1 THR A 194 72.077 79.907 -8.457 1.00 61.33 O ATOM 1929 CG2 THR A 194 70.176 79.583 -7.033 1.00 63.40 C ATOM 1930 N LYS A 195 70.533 81.963 -9.623 1.00 65.21 N ATOM 1931 CA LYS A 195 69.613 82.193 -10.729 1.00 66.39 C ATOM 1932 C LYS A 195 68.722 80.977 -10.951 1.00 66.40 C ATOM 1933 O LYS A 195 69.200 79.843 -10.971 1.00 65.66 O ATOM 1934 CB LYS A 195 70.390 82.499 -12.013 1.00 68.31 C ATOM 1935 CG LYS A 195 71.198 83.790 -11.973 1.00 72.56 C ATOM 1936 CD LYS A 195 70.298 84.996 -11.751 1.00 75.70 C ATOM 1937 CE LYS A 195 71.090 86.294 -11.770 1.00 78.71 C ATOM 1938 NZ LYS A 195 70.206 87.481 -11.560 1.00 81.04 N ATOM 1939 N GLY A 196 67.426 81.229 -11.116 1.00 67.86 N ATOM 1940 CA GLY A 196 66.465 80.162 -11.343 1.00 69.08 C ATOM 1941 C GLY A 196 65.479 80.520 -12.445 1.00 69.95 C ATOM 1942 O GLY A 196 65.766 81.371 -13.287 1.00 71.39 O ATOM 1943 N ILE A 197 64.316 79.872 -12.440 1.00 69.84 N ATOM 1944 CA ILE A 197 63.273 80.113 -13.446 1.00 69.43 C ATOM 1945 C ILE A 197 61.958 80.491 -12.772 1.00 69.66 C ATOM 1946 O ILE A 197 61.442 79.751 -11.917 1.00 67.87 O ATOM 1947 CB ILE A 197 63.010 78.863 -14.298 1.00 70.65 C ATOM 1948 CG1 ILE A 197 64.279 78.423 -15.031 1.00 66.69 C ATOM 1949 CG2 ILE A 197 61.899 79.155 -15.297 1.00 68.84 C ATOM 1950 CD1 ILE A 197 64.109 77.065 -15.704 1.00 66.95 C ATOM 1951 N GLY A 198 61.410 81.631 -13.181 1.00 71.82 N ATOM 1952 CA GLY A 198 60.179 82.108 -12.583 1.00 74.37 C ATOM 1953 C GLY A 198 58.915 81.420 -13.040 1.00 75.63 C ATOM 1954 O GLY A 198 58.922 80.577 -13.949 1.00 76.22 O ATOM 1955 N LYS A 199 57.813 81.776 -12.392 1.00 76.88 N ATOM 1956 CA LYS A 199 56.534 81.191 -12.754 1.00 78.58 C ATOM 1957 C LYS A 199 56.181 81.461 -14.229 1.00 79.19 C ATOM 1958 O LYS A 199 55.254 80.849 -14.748 1.00 80.22 O ATOM 1959 CB LYS A 199 55.430 81.771 -11.867 1.00 78.21 C ATOM 1960 CG LYS A 199 55.741 81.738 -10.376 1.00 78.38 C ATOM 1961 CD LYS A 199 54.708 82.540 -9.578 1.00 77.32 C ATOM 1962 CE LYS A 199 55.108 82.676 -8.103 1.00 77.01 C ATOM 1963 NZ LYS A 199 54.227 83.620 -7.338 1.00 76.83 N ATOM 1964 N ASN A 200 56.919 82.350 -14.900 1.00 79.42 N ATOM 1965 CA ASN A 200 56.619 82.708 -16.285 1.00 79.36 C ATOM 1966 C ASN A 200 57.791 82.562 -17.224 1.00 78.60 C ATOM 1967 O ASN A 200 57.844 83.180 -18.295 1.00 78.20 O ATOM 1968 CB ASN A 200 56.123 84.133 -16.335 1.00 81.46 C ATOM 1969 CG ASN A 200 54.694 84.250 -15.844 1.00 84.66 C ATOM 1970 OD1 ASN A 200 53.792 83.642 -16.423 1.00 86.75 O ATOM 1971 ND2 ASN A 200 54.475 85.011 -14.768 1.00 84.47 N ATOM 1972 N GLY A 201 58.754 81.754 -16.806 1.00 77.78 N ATOM 1973 CA GLY A 201 59.902 81.489 -17.645 1.00 76.42 C ATOM 1974 C GLY A 201 60.998 82.523 -17.633 1.00 76.40 C ATOM 1975 O GLY A 201 61.889 82.420 -18.465 1.00 76.02 O ATOM 1976 N GLU A 202 60.957 83.486 -16.709 1.00 76.16 N ATOM 1977 CA GLU A 202 61.985 84.525 -16.611 1.00 76.07 C ATOM 1978 C GLU A 202 63.033 84.220 -15.527 1.00 75.55 C ATOM 1979 O GLU A 202 62.703 83.774 -14.428 1.00 75.86 O ATOM 1980 CB GLU A 202 61.329 85.879 -16.316 1.00 76.97 C ATOM 1981 CG GLU A 202 59.798 85.870 -16.436 1.00 77.94 C ATOM 1982 CD GLU A 202 59.088 85.121 -15.295 1.00 79.06 C ATOM 1983 OE1 GLU A 202 59.290 83.895 -15.136 1.00 78.45 O ATOM 1984 OE2 GLU A 202 58.313 85.766 -14.552 1.00 79.67 O ATOM 1985 N ILE A 203 64.298 84.470 -15.842 1.00 74.74 N ATOM 1986 CA ILE A 203 65.366 84.234 -14.886 1.00 73.40 C ATOM 1987 C ILE A 203 65.187 85.134 -13.668 1.00 72.53 C ATOM 1988 O ILE A 203 65.147 86.358 -13.793 1.00 72.32 O ATOM 1989 CB ILE A 203 66.736 84.514 -15.509 1.00 73.49 C ATOM 1990 CG1 ILE A 203 66.956 83.560 -16.685 1.00 74.14 C ATOM 1991 CG2 ILE A 203 67.832 84.343 -14.459 1.00 74.63 C ATOM 1992 CD1 ILE A 203 68.293 83.719 -17.370 1.00 75.59 C ATOM 1993 N ILE A 204 65.087 84.519 -12.491 1.00 71.35 N ATOM 1994 CA ILE A 204 64.916 85.260 -11.240 1.00 71.06 C ATOM 1995 C ILE A 204 65.954 84.858 -10.190 1.00 70.19 C ATOM 1996 O ILE A 204 66.803 83.990 -10.424 1.00 69.14 O ATOM 1997 CB ILE A 204 63.531 85.002 -10.624 1.00 71.39 C ATOM 1998 CG1 ILE A 204 63.420 83.521 -10.256 1.00 71.57 C ATOM 1999 CG2 ILE A 204 62.434 85.441 -11.601 1.00 71.96 C ATOM 2000 CD1 ILE A 204 62.170 83.183 -9.476 1.00 72.05 C ATOM 2001 N ASP A 205 65.872 85.507 -9.033 1.00 68.86 N ATOM 2002 CA ASP A 205 66.754 85.223 -7.912 1.00 67.97 C ATOM 2003 C ASP A 205 65.984 84.292 -6.980 1.00 67.17 C ATOM 2004 O ASP A 205 64.796 84.512 -6.706 1.00 68.04 O ATOM 2005 CB ASP A 205 67.144 86.520 -7.180 1.00 67.78 C ATOM 2006 CG ASP A 205 68.034 87.428 -8.027 1.00 71.41 C ATOM 2007 OD1 ASP A 205 68.436 88.520 -7.557 1.00 72.26 O ATOM 2008 OD2 ASP A 205 68.332 87.038 -9.177 1.00 71.46 O ATOM 2009 N THR A 206 66.662 83.250 -6.506 1.00 64.15 N ATOM 2010 CA THR A 206 66.048 82.275 -5.619 1.00 61.26 C ATOM 2011 C THR A 206 67.094 81.584 -4.740 1.00 59.78 C ATOM 2012 O THR A 206 68.299 81.804 -4.887 1.00 60.38 O ATOM 2013 CB THR A 206 65.268 81.217 -6.440 1.00 60.46 C ATOM 2014 OG1 THR A 206 64.427 80.455 -5.566 1.00 60.50 O ATOM 2015 CG2 THR A 206 66.225 80.279 -7.162 1.00 59.04 C ATOM 2016 N LEU A 207 66.620 80.750 -3.821 1.00 58.45 N ATOM 2017 CA LEU A 207 67.492 80.030 -2.905 1.00 55.08 C ATOM 2018 C LEU A 207 68.143 78.828 -3.581 1.00 52.59 C ATOM 2019 O LEU A 207 67.479 78.037 -4.251 1.00 51.70 O ATOM 2020 CB LEU A 207 66.689 79.571 -1.689 1.00 55.31 C ATOM 2021 CG LEU A 207 67.457 78.965 -0.515 1.00 55.75 C ATOM 2022 CD1 LEU A 207 68.393 80.001 0.092 1.00 55.45 C ATOM 2023 CD2 LEU A 207 66.470 78.473 0.527 1.00 54.27 C ATOM 2024 N PRO A 208 69.464 78.684 -3.420 1.00 51.17 N ATOM 2025 CA PRO A 208 70.220 77.574 -4.013 1.00 49.53 C ATOM 2026 C PRO A 208 69.774 76.253 -3.396 1.00 47.68 C ATOM 2027 O PRO A 208 69.656 76.144 -2.178 1.00 46.41 O ATOM 2028 CB PRO A 208 71.668 77.910 -3.657 1.00 49.66 C ATOM 2029 CG PRO A 208 71.651 79.407 -3.509 1.00 51.62 C ATOM 2030 CD PRO A 208 70.369 79.644 -2.767 1.00 51.14 C ATOM 2031 N LEU A 209 69.537 75.250 -4.230 1.00 45.14 N ATOM 2032 CA LEU A 209 69.095 73.962 -3.720 1.00 43.24 C ATOM 2033 C LEU A 209 70.047 72.834 -4.070 1.00 41.26 C ATOM 2034 O LEU A 209 70.742 72.885 -5.079 1.00 42.19 O ATOM 2035 CB LEU A 209 67.708 73.635 -4.269 1.00 43.37 C ATOM 2036 CG LEU A 209 66.609 74.652 -3.977 1.00 44.82 C ATOM 2037 CD1 LEU A 209 65.321 74.181 -4.628 1.00 46.57 C ATOM 2038 CD2 LEU A 209 66.426 74.813 -2.480 1.00 43.56 C ATOM 2039 N GLY A 210 70.072 71.811 -3.226 1.00 39.63 N ATOM 2040 CA GLY A 210 70.924 70.669 -3.487 1.00 38.70 C ATOM 2041 C GLY A 210 70.179 69.363 -3.283 1.00 38.07 C ATOM 2042 O GLY A 210 69.125 69.335 -2.651 1.00 38.33 O ATOM 2043 N PHE A 211 70.725 68.281 -3.820 1.00 37.26 N ATOM 2044 CA PHE A 211 70.131 66.957 -3.688 1.00 37.09 C ATOM 2045 C PHE A 211 70.672 66.259 -2.433 1.00 37.96 C ATOM 2046 O PHE A 211 71.872 66.296 -2.165 1.00 37.96 O ATOM 2047 CB PHE A 211 70.473 66.105 -4.910 1.00 37.75 C ATOM 2048 CG PHE A 211 69.733 66.494 -6.161 1.00 40.10 C ATOM 2049 CD1 PHE A 211 68.430 66.050 -6.381 1.00 38.85 C ATOM 2050 CD2 PHE A 211 70.358 67.265 -7.152 1.00 39.56 C ATOM 2051 CE1 PHE A 211 67.760 66.359 -7.567 1.00 39.04 C ATOM 2052 CE2 PHE A 211 69.693 67.579 -8.344 1.00 39.06 C ATOM 2053 CZ PHE A 211 68.394 67.123 -8.552 1.00 38.55 C ATOM 2054 N TYR A 212 69.785 65.617 -1.678 1.00 36.22 N ATOM 2055 CA TYR A 212 70.172 64.911 -0.463 1.00 33.52 C ATOM 2056 C TYR A 212 69.479 63.548 -0.408 1.00 33.20 C ATOM 2057 O TYR A 212 68.365 63.387 -0.909 1.00 34.57 O ATOM 2058 CB TYR A 212 69.751 65.704 0.783 1.00 31.82 C ATOM 2059 CG TYR A 212 70.410 67.052 1.002 1.00 33.56 C ATOM 2060 CD1 TYR A 212 69.994 68.187 0.298 1.00 33.22 C ATOM 2061 CD2 TYR A 212 71.410 67.206 1.969 1.00 32.39 C ATOM 2062 CE1 TYR A 212 70.559 69.451 0.560 1.00 33.39 C ATOM 2063 CE2 TYR A 212 71.974 68.448 2.236 1.00 33.25 C ATOM 2064 CZ TYR A 212 71.547 69.572 1.530 1.00 34.55 C ATOM 2065 OH TYR A 212 72.112 70.807 1.800 1.00 31.46 O ATOM 2066 N LEU A 213 70.127 62.572 0.211 1.00 30.97 N ATOM 2067 CA LEU A 213 69.521 61.262 0.348 1.00 32.70 C ATOM 2068 C LEU A 213 68.871 61.258 1.723 1.00 33.38 C ATOM 2069 O LEU A 213 69.451 61.776 2.674 1.00 34.53 O ATOM 2070 CB LEU A 213 70.580 60.161 0.289 1.00 31.07 C ATOM 2071 CG LEU A 213 71.408 60.126 -0.985 1.00 30.72 C ATOM 2072 CD1 LEU A 213 72.513 59.087 -0.848 1.00 32.65 C ATOM 2073 CD2 LEU A 213 70.501 59.819 -2.162 1.00 30.15 C ATOM 2074 N ARG A 214 67.665 60.702 1.828 1.00 34.46 N ATOM 2075 CA ARG A 214 66.980 60.636 3.116 1.00 34.87 C ATOM 2076 C ARG A 214 67.667 59.550 3.914 1.00 34.61 C ATOM 2077 O ARG A 214 68.288 58.659 3.339 1.00 34.71 O ATOM 2078 CB ARG A 214 65.493 60.286 2.938 1.00 35.56 C ATOM 2079 CG ARG A 214 64.663 61.374 2.240 1.00 37.62 C ATOM 2080 CD ARG A 214 63.169 61.049 2.230 1.00 36.30 C ATOM 2081 NE ARG A 214 62.425 61.960 1.359 1.00 36.70 N ATOM 2082 CZ ARG A 214 61.916 63.129 1.735 1.00 34.02 C ATOM 2083 NH1 ARG A 214 62.053 63.555 2.982 1.00 34.45 N ATOM 2084 NH2 ARG A 214 61.277 63.882 0.853 1.00 33.21 N ATOM 2085 N LYS A 215 67.556 59.632 5.236 1.00 35.38 N ATOM 2086 CA LYS A 215 68.164 58.658 6.146 1.00 36.43 C ATOM 2087 C LYS A 215 67.722 57.220 5.873 1.00 37.53 C ATOM 2088 O LYS A 215 68.496 56.278 6.058 1.00 37.74 O ATOM 2089 CB LYS A 215 67.817 59.001 7.595 1.00 36.03 C ATOM 2090 CG LYS A 215 68.311 60.344 8.080 1.00 33.80 C ATOM 2091 CD LYS A 215 67.887 60.550 9.515 1.00 34.60 C ATOM 2092 CE LYS A 215 68.352 61.877 10.056 1.00 35.86 C ATOM 2093 NZ LYS A 215 67.849 62.040 11.448 1.00 37.08 N ATOM 2094 N GLU A 216 66.473 57.053 5.451 1.00 38.04 N ATOM 2095 CA GLU A 216 65.944 55.719 5.164 1.00 41.64 C ATOM 2096 C GLU A 216 66.740 55.013 4.065 1.00 40.75 C ATOM 2097 O GLU A 216 67.009 53.814 4.164 1.00 41.57 O ATOM 2098 CB GLU A 216 64.463 55.799 4.766 1.00 41.82 C ATOM 2099 CG GLU A 216 63.503 56.048 5.934 1.00 46.81 C ATOM 2100 CD GLU A 216 63.652 57.436 6.568 1.00 52.65 C ATOM 2101 OE1 GLU A 216 63.965 57.511 7.786 1.00 52.77 O ATOM 2102 OE2 GLU A 216 63.448 58.448 5.852 1.00 51.96 O ATOM 2103 N PHE A 217 67.117 55.767 3.031 1.00 40.03 N ATOM 2104 CA PHE A 217 67.884 55.234 1.907 1.00 37.96 C ATOM 2105 C PHE A 217 69.262 54.770 2.365 1.00 38.34 C ATOM 2106 O PHE A 217 69.629 53.622 2.141 1.00 39.46 O ATOM 2107 CB PHE A 217 68.042 56.297 0.817 1.00 38.20 C ATOM 2108 CG PHE A 217 68.638 55.779 -0.473 1.00 40.33 C ATOM 2109 CD1 PHE A 217 67.849 55.106 -1.401 1.00 38.57 C ATOM 2110 CD2 PHE A 217 69.993 55.967 -0.759 1.00 40.80 C ATOM 2111 CE1 PHE A 217 68.385 54.646 -2.595 1.00 39.37 C ATOM 2112 CE2 PHE A 217 70.545 55.508 -1.953 1.00 40.63 C ATOM 2113 CZ PHE A 217 69.737 54.839 -2.874 1.00 40.53 C ATOM 2114 N THR A 218 70.025 55.645 3.020 1.00 37.82 N ATOM 2115 CA THR A 218 71.359 55.252 3.471 1.00 37.15 C ATOM 2116 C THR A 218 71.312 54.172 4.539 1.00 38.26 C ATOM 2117 O THR A 218 72.244 53.372 4.659 1.00 37.69 O ATOM 2118 CB THR A 218 72.175 56.454 4.006 1.00 36.11 C ATOM 2119 OG1 THR A 218 71.410 57.171 4.976 1.00 34.29 O ATOM 2120 CG2 THR A 218 72.560 57.380 2.866 1.00 33.37 C ATOM 2121 N ALA A 219 70.234 54.149 5.320 1.00 39.13 N ATOM 2122 CA ALA A 219 70.087 53.129 6.358 1.00 40.27 C ATOM 2123 C ALA A 219 69.981 51.747 5.697 1.00 39.82 C ATOM 2124 O ALA A 219 70.515 50.769 6.198 1.00 38.55 O ATOM 2125 CB ALA A 219 68.850 53.410 7.205 1.00 39.58 C ATOM 2126 N GLN A 220 69.297 51.678 4.563 1.00 40.57 N ATOM 2127 CA GLN A 220 69.147 50.419 3.845 1.00 42.98 C ATOM 2128 C GLN A 220 70.520 49.971 3.339 1.00 42.34 C ATOM 2129 O GLN A 220 70.804 48.777 3.255 1.00 41.79 O ATOM 2130 CB GLN A 220 68.198 50.601 2.658 1.00 46.32 C ATOM 2131 CG GLN A 220 67.268 49.428 2.399 1.00 52.47 C ATOM 2132 CD GLN A 220 67.997 48.160 2.006 1.00 55.89 C ATOM 2133 OE1 GLN A 220 68.641 48.094 0.956 1.00 59.10 O ATOM 2134 NE2 GLN A 220 67.895 47.141 2.850 1.00 56.46 N ATOM 2135 N ILE A 221 71.373 50.932 2.993 1.00 40.90 N ATOM 2136 CA ILE A 221 72.701 50.591 2.507 1.00 39.80 C ATOM 2137 C ILE A 221 73.462 49.961 3.659 1.00 41.63 C ATOM 2138 O ILE A 221 74.192 48.991 3.479 1.00 41.17 O ATOM 2139 CB ILE A 221 73.459 51.836 2.001 1.00 37.53 C ATOM 2140 CG1 ILE A 221 72.823 52.332 0.699 1.00 37.28 C ATOM 2141 CG2 ILE A 221 74.939 51.510 1.811 1.00 36.07 C ATOM 2142 CD1 ILE A 221 73.460 53.602 0.123 1.00 36.66 C ATOM 2143 N LEU A 222 73.273 50.522 4.848 1.00 44.39 N ATOM 2144 CA LEU A 222 73.921 50.020 6.053 1.00 47.17 C ATOM 2145 C LEU A 222 73.389 48.631 6.385 1.00 49.80 C ATOM 2146 O LEU A 222 74.147 47.742 6.772 1.00 49.71 O ATOM 2147 CB LEU A 222 73.660 50.966 7.229 1.00 46.02 C ATOM 2148 CG LEU A 222 74.370 52.321 7.216 1.00 44.19 C ATOM 2149 CD1 LEU A 222 73.845 53.188 8.329 1.00 44.40 C ATOM 2150 CD2 LEU A 222 75.859 52.116 7.378 1.00 43.83 C ATOM 2151 N ASN A 223 72.082 48.453 6.229 1.00 53.19 N ATOM 2152 CA ASN A 223 71.445 47.173 6.507 1.00 57.10 C ATOM 2153 C ASN A 223 71.829 46.088 5.517 1.00 57.67 C ATOM 2154 O ASN A 223 72.186 44.982 5.910 1.00 57.38 O ATOM 2155 CB ASN A 223 69.929 47.328 6.515 1.00 59.13 C ATOM 2156 CG ASN A 223 69.395 47.662 7.884 1.00 64.72 C ATOM 2157 OD1 ASN A 223 69.857 48.610 8.535 1.00 66.53 O ATOM 2158 ND2 ASN A 223 68.414 46.884 8.341 1.00 65.66 N ATOM 2159 N ALA A 224 71.747 46.403 4.231 1.00 58.58 N ATOM 2160 CA ALA A 224 72.087 45.433 3.201 1.00 60.81 C ATOM 2161 C ALA A 224 73.540 45.009 3.332 1.00 62.92 C ATOM 2162 O ALA A 224 73.951 43.998 2.774 1.00 63.79 O ATOM 2163 CB ALA A 224 71.840 46.022 1.828 1.00 60.20 C ATOM 2164 N PHE A 225 74.321 45.796 4.061 1.00 65.05 N ATOM 2165 CA PHE A 225 75.723 45.484 4.259 1.00 67.05 C ATOM 2166 C PHE A 225 75.825 44.497 5.410 1.00 69.70 C ATOM 2167 O PHE A 225 76.522 43.487 5.315 1.00 70.10 O ATOM 2168 CB PHE A 225 76.507 46.753 4.586 1.00 65.91 C ATOM 2169 CG PHE A 225 77.943 46.506 4.925 1.00 63.92 C ATOM 2170 CD1 PHE A 225 78.831 46.045 3.961 1.00 64.85 C ATOM 2171 CD2 PHE A 225 78.408 46.715 6.218 1.00 63.51 C ATOM 2172 CE1 PHE A 225 80.165 45.798 4.285 1.00 64.52 C ATOM 2173 CE2 PHE A 225 79.737 46.471 6.548 1.00 62.91 C ATOM 2174 CZ PHE A 225 80.615 46.011 5.583 1.00 62.28 C ATOM 2175 N LEU A 226 75.120 44.792 6.497 1.00 72.12 N ATOM 2176 CA LEU A 226 75.128 43.915 7.658 1.00 76.07 C ATOM 2177 C LEU A 226 74.581 42.537 7.277 1.00 78.37 C ATOM 2178 O LEU A 226 75.104 41.514 7.713 1.00 77.98 O ATOM 2179 CB LEU A 226 74.296 44.524 8.794 1.00 77.40 C ATOM 2180 CG LEU A 226 74.765 45.894 9.307 1.00 80.54 C ATOM 2181 CD1 LEU A 226 73.843 46.371 10.421 1.00 80.87 C ATOM 2182 CD2 LEU A 226 76.206 45.804 9.807 1.00 81.70 C ATOM 2183 N GLU A 227 73.537 42.509 6.452 1.00 81.04 N ATOM 2184 CA GLU A 227 72.944 41.245 6.020 1.00 84.08 C ATOM 2185 C GLU A 227 73.845 40.530 5.021 1.00 85.09 C ATOM 2186 O GLU A 227 73.396 39.672 4.262 1.00 86.17 O ATOM 2187 CB GLU A 227 71.567 41.476 5.389 1.00 85.59 C ATOM 2188 CG GLU A 227 70.488 41.931 6.365 1.00 88.16 C ATOM 2189 CD GLU A 227 69.104 41.955 5.731 1.00 89.37 C ATOM 2190 OE1 GLU A 227 68.925 42.653 4.709 1.00 89.13 O ATOM 2191 OE2 GLU A 227 68.196 41.275 6.258 1.00 90.91 O ATOM 2192 N THR A 228 75.118 40.902 5.022 1.00 86.40 N ATOM 2193 CA THR A 228 76.104 40.301 4.136 1.00 87.56 C ATOM 2194 C THR A 228 77.096 39.519 4.997 1.00 88.81 C ATOM 2195 O THR A 228 77.772 38.623 4.454 1.00 87.66 O ATOM 2196 CB THR A 228 76.842 41.386 3.296 1.00 87.30 C ATOM 2197 OG1 THR A 228 75.950 41.904 2.301 1.00 87.97 O ATOM 2198 CG2 THR A 228 78.071 40.809 2.601 1.00 88.11 C TER 2199 THR A 228 HETATM 2200 CA CA A 232 86.644 65.711 -2.454 1.00 45.97 CA HETATM 2201 CA CA A 233 83.623 63.034 -1.370 1.00 36.14 CA HETATM 2202 O HOH B 13 62.402 73.578 10.414 1.00 37.46 O HETATM 2203 O HOH B 14 66.470 63.467 8.403 1.00 42.16 O HETATM 2204 O HOH B 15 68.001 65.793 9.091 1.00 40.05 O HETATM 2205 O HOH B 16 58.693 64.009 4.777 1.00 40.52 O HETATM 2206 O HOH B 17 71.375 75.828 11.063 1.00 31.07 O HETATM 2207 O HOH B 18 81.292 74.935 9.798 1.00 48.32 O HETATM 2208 O HOH B 19 64.924 64.021 4.852 1.00 41.64 O HETATM 2209 O HOH B 20 64.809 56.387 14.328 1.00 72.05 O HETATM 2210 O HOH B 21 63.202 53.799 12.269 1.00 78.32 O HETATM 2211 O HOH B 22 65.212 53.789 13.953 1.00 70.32 O HETATM 2212 O HOH B 23 78.015 77.654 1.936 1.00 52.54 O HETATM 2213 O HOH B 24 67.800 66.781 15.213 1.00 58.89 O HETATM 2214 O HOH B 25 64.711 75.021 10.136 1.00 43.02 O HETATM 2215 O HOH B 26 63.711 72.859 2.365 1.00 45.99 O HETATM 2216 O HOH B 27 61.507 79.851 7.500 1.00 66.34 O HETATM 2217 O HOH B 28 86.234 78.227 -7.003 1.00 62.99 O HETATM 2218 O HOH B 29 73.625 83.598 8.502 1.00 64.86 O HETATM 2219 O HOH B 30 56.385 65.068 6.110 1.00 70.60 O HETATM 2220 O HOH B 31 85.009 80.211 12.928 1.00 69.78 O HETATM 2221 O HOH B 32 82.701 82.450 0.467 1.00 50.63 O HETATM 2222 O HOH B 33 87.901 76.849 -4.515 1.00 72.35 O HETATM 2223 O HOH B 34 63.636 60.667 7.773 1.00 64.82 O HETATM 2224 O HOH B 35 60.359 66.729 12.170 1.00 64.39 O HETATM 2225 O HOH B 36 94.124 82.332 -1.349 1.00 74.91 O HETATM 2226 O HOH B 37 65.530 68.121 20.806 1.00 55.63 O HETATM 2227 O HOH B 38 67.657 78.183 3.991 1.00 60.29 O HETATM 2228 O HOH B 39 81.523 80.734 6.810 1.00 58.43 O HETATM 2229 O HOH C 13 78.943 63.958 12.508 1.00 32.18 O HETATM 2230 O HOH C 14 75.905 63.721 5.943 1.00 29.82 O HETATM 2231 O HOH C 15 74.197 65.558 13.823 1.00 32.90 O HETATM 2232 O HOH C 16 85.038 62.585 2.997 1.00 31.38 O HETATM 2233 O HOH C 17 81.034 64.061 8.706 1.00 38.50 O HETATM 2234 O HOH C 18 78.542 62.974 3.048 1.00 29.43 O HETATM 2235 O HOH C 19 77.424 74.977 0.654 1.00 42.85 O HETATM 2236 O HOH C 20 81.573 64.018 -0.343 1.00 42.88 O HETATM 2237 O HOH C 21 82.218 79.619 -8.581 1.00 50.38 O HETATM 2238 O HOH C 22 62.083 74.209 19.252 1.00 55.65 O HETATM 2239 O HOH C 23 66.602 75.596 12.478 1.00 52.49 O HETATM 2240 O HOH C 24 75.728 70.407 17.998 1.00 49.76 O HETATM 2241 O HOH C 25 77.386 75.644 -1.997 1.00 64.07 O HETATM 2242 O HOH C 26 76.734 71.371 -9.900 1.00 63.20 O HETATM 2243 O HOH C 27 80.473 68.232 -9.656 1.00 58.69 O HETATM 2244 O HOH A 234 72.256 66.309 -11.742 1.00 36.95 O HETATM 2245 O HOH A 235 74.051 75.982 11.854 1.00 33.66 O HETATM 2246 O HOH A 236 80.976 63.059 13.936 1.00 37.14 O HETATM 2247 O HOH A 237 65.791 61.766 6.246 1.00 34.80 O HETATM 2248 O HOH A 238 63.318 72.396 -0.478 1.00 49.20 O HETATM 2249 O HOH A 239 62.428 67.736 -2.137 1.00 41.07 O HETATM 2250 O HOH A 240 70.390 65.963 7.523 1.00 31.37 O HETATM 2251 O HOH A 241 94.890 41.463 -5.675 1.00 41.53 O HETATM 2252 O HOH A 242 76.273 61.450 5.031 1.00 35.41 O HETATM 2253 O HOH A 243 61.601 57.370 -5.957 1.00 48.94 O HETATM 2254 O HOH A 244 72.141 59.878 4.963 1.00 39.88 O HETATM 2255 O HOH A 245 76.869 64.544 14.145 1.00 46.53 O HETATM 2256 O HOH A 246 84.166 72.505 7.438 1.00 34.33 O HETATM 2257 O HOH A 247 78.241 66.317 16.148 1.00 47.33 O HETATM 2258 O HOH A 248 68.131 65.045 11.761 1.00 40.60 O HETATM 2259 O HOH A 249 76.561 64.777 3.408 1.00 39.08 O HETATM 2260 O HOH A 250 76.078 80.682 -0.360 1.00 46.41 O HETATM 2261 O HOH A 251 94.311 44.813 -6.543 1.00 40.08 O HETATM 2262 O HOH A 252 82.297 66.747 8.578 1.00 40.72 O HETATM 2263 O HOH A 253 68.662 52.424 -0.298 1.00 46.99 O HETATM 2264 O HOH A 254 90.989 53.066 18.641 1.00 43.29 O HETATM 2265 O HOH A 255 70.008 66.635 13.023 1.00 36.31 O HETATM 2266 O HOH A 256 65.721 60.831 -17.559 1.00 52.69 O HETATM 2267 O HOH A 257 91.447 46.492 -6.692 1.00 48.04 O HETATM 2268 O HOH A 258 87.259 67.683 -1.254 1.00 46.57 O HETATM 2269 O HOH A 259 86.014 65.706 -4.657 1.00 46.83 O HETATM 2270 O HOH A 260 84.995 63.318 0.560 1.00 29.13 O HETATM 2271 O HOH A 261 93.923 66.807 -3.269 1.00 54.76 O HETATM 2272 O HOH A 262 90.934 48.859 -8.968 1.00 55.02 O HETATM 2273 O HOH A 263 91.171 45.838 0.216 1.00 53.08 O HETATM 2274 O HOH A 264 97.101 56.321 8.002 1.00 50.53 O HETATM 2275 O HOH A 265 97.787 52.814 10.922 1.00 72.79 O HETATM 2276 O HOH A 266 97.441 55.142 14.765 1.00 58.77 O HETATM 2277 O HOH A 267 95.785 67.060 16.454 1.00 49.11 O HETATM 2278 O HOH A 268 93.588 68.847 18.901 1.00 55.75 O HETATM 2279 O HOH A 269 86.146 74.653 17.881 1.00 62.38 O HETATM 2280 O HOH A 270 79.364 69.268 17.141 1.00 42.46 O HETATM 2281 O HOH A 271 97.297 63.488 2.159 1.00 59.98 O HETATM 2282 O HOH A 272 93.584 60.592 -8.816 1.00 59.13 O HETATM 2283 O HOH A 273 86.732 51.143 -9.420 1.00 62.95 O HETATM 2284 O HOH A 274 84.384 51.836 -10.189 1.00 53.53 O HETATM 2285 O HOH A 275 74.531 57.031 19.678 1.00 57.91 O HETATM 2286 O HOH A 276 69.953 59.283 17.855 1.00 42.59 O HETATM 2287 O HOH A 277 72.364 60.911 19.182 1.00 46.20 O HETATM 2288 O HOH A 278 73.143 63.168 18.468 1.00 43.80 O HETATM 2289 O HOH A 279 70.885 75.396 -6.585 1.00 51.35 O HETATM 2290 O HOH A 280 75.358 77.066 -2.883 1.00 47.40 O HETATM 2291 O HOH A 281 77.419 70.060 -6.699 1.00 48.50 O HETATM 2292 O HOH A 282 74.654 54.183 -11.596 1.00 43.75 O HETATM 2293 O HOH A 283 81.100 57.881 -7.859 1.00 52.50 O HETATM 2294 O HOH A 284 81.952 47.229 1.572 1.00 62.29 O HETATM 2295 O HOH A 285 81.584 46.095 -2.189 1.00 72.43 O HETATM 2296 O HOH A 286 77.084 47.253 -3.068 1.00 54.23 O HETATM 2297 O HOH A 287 70.103 46.798 -0.975 1.00 48.56 O HETATM 2298 O HOH A 288 68.342 47.836 -2.956 1.00 55.46 O HETATM 2299 O HOH A 289 67.805 45.469 -7.233 1.00 57.34 O HETATM 2300 O HOH A 290 60.923 58.369 -18.146 1.00 70.47 O HETATM 2301 O HOH A 291 60.167 63.377 -17.737 1.00 71.02 O HETATM 2302 O HOH A 292 63.588 65.880 -17.138 1.00 73.86 O HETATM 2303 O HOH A 293 56.992 60.033 0.061 1.00 73.86 O HETATM 2304 O HOH A 294 62.979 75.448 0.827 1.00 49.48 O HETATM 2305 O HOH A 295 65.442 51.892 5.454 1.00 52.59 O HETATM 2306 O HOH A 296 66.199 51.770 -0.961 1.00 54.09 O HETATM 2307 O HOH A 297 66.452 48.989 -1.671 1.00 60.12 O HETATM 2308 O HOH A 298 75.025 47.889 0.935 1.00 47.80 O HETATM 2309 O HOH A 299 81.609 51.879 -9.725 1.00 64.03 O HETATM 2310 O HOH A 300 89.038 75.787 13.610 1.00 74.87 O HETATM 2311 O HOH A 301 55.219 84.824 -20.823 1.00 62.40 O HETATM 2312 O HOH A 302 68.316 59.547 13.411 1.00 50.40 O HETATM 2313 O HOH A 303 73.135 66.598 -14.157 1.00 68.21 O HETATM 2314 O HOH A 304 62.810 74.905 -1.695 1.00 58.09 O HETATM 2315 O HOH A 305 74.633 57.384 22.133 1.00 84.73 O HETATM 2316 O HOH A 306 74.369 47.640 -3.153 1.00 50.52 O HETATM 2317 O HOH A 307 57.481 69.083 8.448 1.00 61.61 O HETATM 2318 O HOH A 308 84.771 73.807 -8.024 1.00 57.82 O HETATM 2319 O HOH A 309 75.191 79.940 -2.674 1.00 46.23 O HETATM 2320 O HOH A 310 67.397 55.210 15.790 1.00 59.18 O HETATM 2321 O HOH A 311 72.764 64.356 15.693 1.00 41.84 O HETATM 2322 O HOH A 312 59.960 78.414 -0.472 1.00 64.16 O HETATM 2323 O HOH A 313 96.128 51.582 12.554 1.00 72.77 O HETATM 2324 O HOH A 314 88.478 68.645 20.728 1.00 51.24 O HETATM 2325 O HOH A 315 73.831 87.194 4.827 1.00 75.72 O HETATM 2326 O HOH A 316 59.256 60.016 -7.029 1.00 52.26 O HETATM 2327 O HOH A 317 87.069 66.627 21.725 1.00 53.65 O HETATM 2328 O HOH A 318 69.939 44.617 -8.772 1.00 54.58 O HETATM 2329 O HOH A 319 75.190 50.231 -10.326 1.00 58.61 O HETATM 2330 O HOH A 320 84.531 46.734 6.078 1.00 55.22 O HETATM 2331 O HOH A 321 96.797 55.292 10.218 1.00 73.46 O HETATM 2332 O HOH A 322 91.364 61.332 -7.861 1.00 63.32 O HETATM 2333 O HOH A 323 72.383 63.966 -20.385 1.00 73.94 O HETATM 2334 O HOH A 324 70.381 64.177 14.259 1.00 45.31 O HETATM 2335 O HOH A 325 87.055 45.953 4.753 1.00 64.85 O HETATM 2336 O HOH A 326 93.762 69.706 -2.606 1.00 77.16 O HETATM 2337 O HOH A 327 75.926 46.494 -6.242 1.00 62.29 O HETATM 2338 O HOH A 328 66.754 50.249 -12.356 1.00 70.24 O HETATM 2339 O HOH A 329 64.946 77.819 -4.877 1.00 56.85 O HETATM 2340 O HOH A 330 64.285 77.101 -11.984 1.00 73.64 O HETATM 2341 O HOH A 331 50.514 76.768 -4.592 1.00 76.23 O HETATM 2342 O HOH A 332 58.901 62.951 -13.399 1.00 68.24 O HETATM 2343 O HOH A 333 84.152 45.072 8.838 1.00 57.38 O HETATM 2344 O HOH A 334 66.129 44.088 4.020 1.00 69.76 O HETATM 2345 O HOH A 335 62.522 55.028 -12.162 1.00 63.11 O HETATM 2346 O HOH A 336 76.449 55.121 -13.379 1.00 54.64 O HETATM 2347 O HOH A 337 82.664 56.236 21.618 1.00 67.18 O HETATM 2348 O HOH A 338 94.930 63.202 1.164 1.00 77.41 O HETATM 2349 O HOH A 339 72.141 42.160 1.373 1.00 61.83 O HETATM 2350 O HOH A 340 59.927 55.171 -5.485 1.00 69.11 O HETATM 2351 O HOH A 341 94.580 42.491 0.062 1.00 66.21 O HETATM 2352 O HOH A 342 79.250 66.258 -11.060 1.00 68.22 O HETATM 2353 O HOH A 343 101.424 62.119 8.913 1.00 66.32 O HETATM 2354 O HOH A 344 50.262 73.264 -1.681 1.00 63.18 O HETATM 2355 O HOH A 345 70.601 50.582 10.455 1.00 70.74 O CONECT 312 2200 CONECT 325 2200 2201 CONECT 860 2200 CONECT 897 2200 CONECT 946 2200 2201 CONECT 947 2201 CONECT 1001 2201 CONECT 1006 2201 CONECT 2200 312 325 860 897 CONECT 2200 946 2268 2269 CONECT 2201 325 946 947 1001 CONECT 2201 1006 2236 2270 CONECT 2236 2201 CONECT 2268 2200 CONECT 2269 2200 CONECT 2270 2201 MASTER 341 0 2 8 8 0 4 6 2352 3 16 20 END
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Related entries of code: 2aoq
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
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Complexes with the same small molecule ligand
PDB Code
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Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
2aoq
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
DNA mismatch repair protein mutH
Ligand Name
DNA sequence gCATGATCATGc
EC.Number
E.C.-.-.-.-
Resolution
2.2(Å)
Affinity (Kd/Ki/IC50)
Kd=3.5uM
Release Year
2005
Protein/NA Sequence
Check fasta file
Primary Reference
Molecular Cell. (2005) 20, pp. 155-166
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P44688
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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