Browse entries in the PDBbind-CN Database
HEADER TRANSCRIPTION/DNA 01-JUL-05 2A66 TITLE HUMAN LIVER RECEPTOR HOMOLOGUE DNA-BINDING DOMAIN (HLRH-1 DBD) IN TITLE 2 COMPLEX WITH DSDNA FROM THE HCYP7A1 PROMOTER COMPND MOL_ID: 1; COMPND 2 MOLECULE: 5'-D(*GP*TP*TP*CP*AP*AP*GP*GP*CP*CP*AP*G)-3'; COMPND 3 CHAIN: B; COMPND 4 MOL_ID: 2; COMPND 5 MOLECULE: 5'-D(*CP*TP*GP*GP*CP*CP*TP*TP*GP*AP*AP*C)-3'; COMPND 6 CHAIN: C; COMPND 7 MOL_ID: 3; COMPND 8 MOLECULE: ORPHAN NUCLEAR RECEPTOR NR5A2; COMPND 9 CHAIN: A; COMPND 10 FRAGMENT: RESIDUES 79-187, NR C4-TYPE; COMPND 11 SYNONYM: ALPHA-1-FETOPROTEIN TRANSCRIPTION FACTOR, HEPATOCYTIC COMPND 12 TRANSCRIPTION FACTOR, B1-BINDING FACTOR, HB1F, CYP7A1 PROMOTER COMPND 13 BINDING FACTOR; COMPND 14 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 OTHER_DETAILS: SYNTHESIZED OLIGONUCLEOTIDE BASED ON CYP7A1 GENE SOURCE 6 PROMOTER; SOURCE 7 MOL_ID: 2; SOURCE 8 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 9 ORGANISM_COMMON: HUMAN; SOURCE 10 ORGANISM_TAXID: 9606; SOURCE 11 OTHER_DETAILS: SYNTHESIZED OLIGONUCLEOTIDE BASED ON CYP7A1 GENE SOURCE 12 PROMOTER; SOURCE 13 MOL_ID: 3; SOURCE 14 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 15 ORGANISM_COMMON: HUMAN; SOURCE 16 ORGANISM_TAXID: 9606; SOURCE 17 GENE: NR5A2, B1F, CPF, FTF; SOURCE 18 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 19 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 20 EXPRESSION_SYSTEM_STRAIN: BL21(DE3) PLYSS; SOURCE 21 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 22 EXPRESSION_SYSTEM_PLASMID: PMALCH10T KEYWDS NUCLEAR RECEPTOR, PROTEIN-DNA COMPLEX, ZINC FINGER, DNA-BINDING KEYWDS 2 DOMAIN, TRANSCRIPTION FACTOR, FTZ-F1, C-TERMINAL EXTENSION, KEYWDS 3 TRANSCRIPTION-DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR I.H.SOLOMON,J.M.HAGER,R.SAFI,D.P.MCDONNELL,M.R.REDINBO,E.A.ORTLUND REVDAT 4 11-OCT-17 2A66 1 REMARK REVDAT 3 24-FEB-09 2A66 1 VERSN REVDAT 2 20-DEC-05 2A66 1 JRNL REVDAT 1 06-DEC-05 2A66 0 JRNL AUTH I.H.SOLOMON,J.M.HAGER,R.SAFI,D.P.MCDONNELL,M.R.REDINBO, JRNL AUTH 2 E.A.ORTLUND JRNL TITL CRYSTAL STRUCTURE OF THE HUMAN LRH-1 DBD-DNA COMPLEX REVEALS JRNL TITL 2 FTZ-F1 DOMAIN POSITIONING IS REQUIRED FOR RECEPTOR ACTIVITY. JRNL REF J.MOL.BIOL. V. 354 1091 2005 JRNL REFN ISSN 0022-2836 JRNL PMID 16289203 JRNL DOI 10.1016/J.JMB.2005.10.009 REMARK 2 REMARK 2 RESOLUTION. 2.20 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS 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) : 22.24 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 275996.630 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0000 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 96.9 REMARK 3 NUMBER OF REFLECTIONS : 8437 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) : 0.196 REMARK 3 FREE R VALUE : 0.226 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 7.700 REMARK 3 FREE R VALUE TEST SET COUNT : 648 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.009 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 12 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.20 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.26 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 92.30 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 577 REMARK 3 BIN R VALUE (WORKING SET) : 0.2240 REMARK 3 BIN FREE R VALUE : 0.2090 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 7.60 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 98 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.023 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 750 REMARK 3 NUCLEIC ACID ATOMS : 486 REMARK 3 HETEROGEN ATOMS : 6 REMARK 3 SOLVENT ATOMS : 86 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 23.10 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 34.85 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -0.66800 REMARK 3 B22 (A**2) : -0.66800 REMARK 3 B33 (A**2) : 1.33700 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.25 REMARK 3 ESD FROM SIGMAA (A) : 0.18 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) : 0.30 REMARK 3 ESD FROM C-V SIGMAA (A) : 0.22 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.005 REMARK 3 BOND ANGLES (DEGREES) : 1.000 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 19.30 REMARK 3 IMPROPER ANGLES (DEGREES) : 1.110 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) : 1.400 ; 1.500 REMARK 3 MAIN-CHAIN ANGLE (A**2) : 2.250 ; 2.000 REMARK 3 SIDE-CHAIN BOND (A**2) : 2.030 ; 2.000 REMARK 3 SIDE-CHAIN ANGLE (A**2) : 3.030 ; 2.500 REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : FLAT MODEL REMARK 3 KSOL : 0.36 REMARK 3 BSOL : 56.06 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 : CNS_TOPPAR:PROTEIN_REP.PARAM REMARK 3 PARAMETER FILE 2 : CNS_TOPPAR:DNA-RNA_REP.PARAM REMARK 3 PARAMETER FILE 3 : CNS_TOPPAR:WATER_REP.PARAM REMARK 3 PARAMETER FILE 4 : CNS_TOPPAR:ION.PARAM REMARK 3 PARAMETER FILE 5 : ACT.PAR REMARK 3 PARAMETER FILE 6 : NULL REMARK 3 TOPOLOGY FILE 1 : CNS_TOPPAR:PROTEIN.TOP REMARK 3 TOPOLOGY FILE 2 : CNS_TOPPAR:DNA-RNA.TOP REMARK 3 TOPOLOGY FILE 3 : CNS_TOPPAR:WATER.TOP REMARK 3 TOPOLOGY FILE 4 : CNS_TOPPAR:ION.TOP REMARK 3 TOPOLOGY FILE 5 : ACT.TOP REMARK 3 TOPOLOGY FILE 6 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 2A66 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 19-JUL-05. REMARK 100 THE DEPOSITION ID IS D_1000033536. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 22-MAR-05 REMARK 200 TEMPERATURE (KELVIN) : 100.0 REMARK 200 PH : 6.00 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 23-ID-D 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 : DCM REMARK 200 OPTICS : MIRRORS REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARMOSAIC 225 MM CCD REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO, HKL-2000 REMARK 200 DATA SCALING SOFTWARE : SCALEPACK, HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 8687 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.200 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 2.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.9 REMARK 200 DATA REDUNDANCY : 5.500 REMARK 200 R MERGE (I) : 0.07000 REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 27.6000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.20 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.28 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : 5.20 REMARK 200 R MERGE FOR SHELL (I) : 0.44100 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : 3.200 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: MOLREP REMARK 200 STARTING MODEL: PDB ENTRY: 1CIT REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 62.78 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.30 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: MAGNESIUM ACETATE, AMMONIUM ACETATE, REMARK 280 SODIUM CACODYLATE, PEG 8000, GLYCEROL, SODIUM AZIDE, HEXAAMINE REMARK 280 COBALT (III) TRICHLORIDE, PH 6.0, HANGING DROP, TEMPERATURE 295K, REMARK 280 PH 6.00 REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 43 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z+1/2 REMARK 290 3555 -Y,X,Z+3/4 REMARK 290 4555 Y,-X,Z+1/4 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 52.42500 REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 78.63750 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 26.21250 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 GLY A 75 REMARK 465 GLU A 76 REMARK 465 PHE A 77 REMARK 465 GLY A 78 REMARK 465 ASP A 79 REMARK 465 GLU A 80 REMARK 465 ASP A 81 REMARK 465 LEU A 82 REMARK 465 GLU A 83 REMARK 465 LYS A 179 REMARK 465 GLN A 180 REMARK 465 GLN A 181 REMARK 465 LYS A 182 REMARK 465 LYS A 183 REMARK 465 ALA A 184 REMARK 465 LEU A 185 REMARK 465 ILE A 186 REMARK 465 ARG A 187 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 173 CG CD CE NZ REMARK 470 ARG A 174 CG CD NE CZ NH1 NH2 REMARK 470 ARG A 176 CG CD NE CZ NH1 NH2 REMARK 470 LEU A 178 CG CD1 CD2 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 GLU A 124 -131.88 -85.90 REMARK 500 ASN A 127 25.07 -150.33 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 B 206 0.06 SIDE CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 401 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 103 SG REMARK 620 2 CYS A 89 SG 104.4 REMARK 620 3 CYS A 106 SG 99.2 111.2 REMARK 620 4 CYS A 86 SG 115.4 117.1 108.1 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 402 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 128 SG REMARK 620 2 CYS A 122 SG 93.5 REMARK 620 3 CYS A 141 SG 107.0 118.6 REMARK 620 4 CYS A 138 SG 110.5 105.4 118.8 REMARK 620 N 1 2 3 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN A 401 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN A 402 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ACT A 801 DBREF 2A66 A 79 187 UNP O00482 NR5A2_HUMAN 79 187 DBREF 2A66 B 201 212 PDB 2A66 2A66 201 212 DBREF 2A66 C 301 312 PDB 2A66 2A66 301 312 SEQADV 2A66 GLY A 75 UNP O00482 CLONING ARTIFACT SEQADV 2A66 GLU A 76 UNP O00482 CLONING ARTIFACT SEQADV 2A66 PHE A 77 UNP O00482 CLONING ARTIFACT SEQADV 2A66 GLY A 78 UNP O00482 CLONING ARTIFACT SEQRES 1 B 12 DG DT DT DC DA DA DG DG DC DC DA DG SEQRES 1 C 12 DC DT DG DG DC DC DT DT DG DA DA DC SEQRES 1 A 113 GLY GLU PHE GLY ASP GLU ASP LEU GLU GLU LEU CYS PRO SEQRES 2 A 113 VAL CYS GLY ASP LYS VAL SER GLY TYR HIS TYR GLY LEU SEQRES 3 A 113 LEU THR CYS GLU SER CYS LYS GLY PHE PHE LYS ARG THR SEQRES 4 A 113 VAL GLN ASN ASN LYS ARG TYR THR CYS ILE GLU ASN GLN SEQRES 5 A 113 ASN CYS GLN ILE ASP LYS THR GLN ARG LYS ARG CYS PRO SEQRES 6 A 113 TYR CYS ARG PHE GLN LYS CYS LEU SER VAL GLY MET LYS SEQRES 7 A 113 LEU GLU ALA VAL ARG ALA ASP ARG MET ARG GLY GLY ARG SEQRES 8 A 113 ASN LYS PHE GLY PRO MET TYR LYS ARG ASP ARG ALA LEU SEQRES 9 A 113 LYS GLN GLN LYS LYS ALA LEU ILE ARG HET ZN A 401 1 HET ZN A 402 1 HET ACT A 801 4 HETNAM ZN ZINC ION HETNAM ACT ACETATE ION FORMUL 4 ZN 2(ZN 2+) FORMUL 6 ACT C2 H3 O2 1- FORMUL 7 HOH *86(H2 O) HELIX 1 1 GLU A 104 ASN A 116 1 13 HELIX 2 2 CYS A 138 VAL A 149 1 12 HELIX 3 3 LYS A 152 VAL A 156 5 5 HELIX 4 4 PHE A 168 LEU A 178 1 11 SHEET 1 A 2 VAL A 93 HIS A 97 0 SHEET 2 A 2 LEU A 100 CYS A 103 -1 O LEU A 100 N HIS A 97 LINK ZN ZN A 401 SG CYS A 103 1555 1555 2.38 LINK ZN ZN A 401 SG CYS A 89 1555 1555 2.39 LINK ZN ZN A 401 SG CYS A 106 1555 1555 2.50 LINK ZN ZN A 401 SG CYS A 86 1555 1555 2.32 LINK ZN ZN A 402 SG CYS A 128 1555 1555 2.73 LINK ZN ZN A 402 SG CYS A 122 1555 1555 2.70 LINK ZN ZN A 402 SG CYS A 141 1555 1555 2.47 LINK ZN ZN A 402 SG CYS A 138 1555 1555 2.61 SITE 1 AC1 4 CYS A 86 CYS A 89 CYS A 103 CYS A 106 SITE 1 AC2 5 CYS A 122 CYS A 128 CYS A 138 CYS A 141 SITE 2 AC2 5 ACT A 801 SITE 1 AC3 6 CYS A 122 ILE A 123 GLU A 124 CYS A 128 SITE 2 AC3 6 CYS A 138 ZN A 402 CRYST1 40.770 40.770 104.850 90.00 90.00 90.00 P 43 4 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.024528 0.000000 0.000000 0.00000 SCALE2 0.000000 0.024528 0.000000 0.00000 SCALE3 0.000000 0.000000 0.009537 0.00000 ATOM 1 O5' DG B 201 16.338 26.471 -3.317 1.00 48.37 O ATOM 2 C5' DG B 201 16.276 26.902 -4.674 1.00 45.57 C ATOM 3 C4' DG B 201 17.482 26.432 -5.452 1.00 45.40 C ATOM 4 O4' DG B 201 18.675 26.649 -4.660 1.00 44.24 O ATOM 5 C3' DG B 201 17.487 24.949 -5.815 1.00 45.29 C ATOM 6 O3' DG B 201 18.095 24.792 -7.101 1.00 46.85 O ATOM 7 C2' DG B 201 18.329 24.322 -4.717 1.00 43.78 C ATOM 8 C1' DG B 201 19.334 25.415 -4.398 1.00 41.72 C ATOM 9 N9 DG B 201 19.773 25.442 -3.006 1.00 38.09 N ATOM 10 C8 DG B 201 18.973 25.401 -1.889 1.00 37.63 C ATOM 11 N7 DG B 201 19.648 25.486 -0.774 1.00 36.40 N ATOM 12 C5 DG B 201 20.972 25.580 -1.179 1.00 34.92 C ATOM 13 C6 DG B 201 22.156 25.707 -0.414 1.00 33.55 C ATOM 14 O6 DG B 201 22.276 25.771 0.812 1.00 34.63 O ATOM 15 N1 DG B 201 23.284 25.764 -1.224 1.00 32.96 N ATOM 16 C2 DG B 201 23.273 25.710 -2.596 1.00 33.31 C ATOM 17 N2 DG B 201 24.465 25.786 -3.202 1.00 31.32 N ATOM 18 N3 DG B 201 22.174 25.594 -3.322 1.00 34.35 N ATOM 19 C4 DG B 201 21.067 25.539 -2.553 1.00 34.97 C ATOM 20 P DT B 202 18.476 23.327 -7.639 1.00 48.15 P ATOM 21 OP1 DT B 202 18.398 23.372 -9.120 1.00 48.57 O ATOM 22 OP2 DT B 202 17.680 22.321 -6.890 1.00 49.38 O ATOM 23 O5' DT B 202 20.012 23.187 -7.253 1.00 45.26 O ATOM 24 C5' DT B 202 20.944 24.164 -7.699 1.00 45.64 C ATOM 25 C4' DT B 202 22.359 23.680 -7.491 1.00 44.97 C ATOM 26 O4' DT B 202 22.719 23.744 -6.092 1.00 43.87 O ATOM 27 C3' DT B 202 22.625 22.245 -7.937 1.00 45.11 C ATOM 28 O3' DT B 202 23.896 22.202 -8.588 1.00 47.03 O ATOM 29 C2' DT B 202 22.622 21.466 -6.630 1.00 43.76 C ATOM 30 C1' DT B 202 23.178 22.479 -5.643 1.00 41.24 C ATOM 31 N1 DT B 202 22.734 22.325 -4.245 1.00 39.40 N ATOM 32 C2 DT B 202 23.691 22.313 -3.254 1.00 36.90 C ATOM 33 O2 DT B 202 24.889 22.354 -3.480 1.00 37.53 O ATOM 34 N3 DT B 202 23.191 22.248 -1.981 1.00 36.56 N ATOM 35 C4 DT B 202 21.865 22.181 -1.607 1.00 36.58 C ATOM 36 O4 DT B 202 21.567 22.157 -0.418 1.00 36.27 O ATOM 37 C5 DT B 202 20.917 22.156 -2.695 1.00 36.92 C ATOM 38 C7 DT B 202 19.457 22.053 -2.383 1.00 37.09 C ATOM 39 C6 DT B 202 21.392 22.226 -3.944 1.00 38.45 C ATOM 40 P DT B 203 24.422 20.828 -9.227 1.00 48.12 P ATOM 41 OP1 DT B 203 24.799 21.083 -10.642 1.00 50.02 O ATOM 42 OP2 DT B 203 23.440 19.759 -8.904 1.00 47.13 O ATOM 43 O5' DT B 203 25.752 20.568 -8.398 1.00 48.34 O ATOM 44 C5' DT B 203 25.747 20.793 -6.999 1.00 46.63 C ATOM 45 C4' DT B 203 27.144 20.733 -6.434 1.00 44.41 C ATOM 46 O4' DT B 203 26.986 20.774 -5.002 1.00 43.41 O ATOM 47 C3' DT B 203 27.870 19.424 -6.710 1.00 42.93 C ATOM 48 O3' DT B 203 29.281 19.644 -6.590 1.00 43.02 O ATOM 49 C2' DT B 203 27.337 18.513 -5.619 1.00 42.39 C ATOM 50 C1' DT B 203 27.115 19.469 -4.453 1.00 40.78 C ATOM 51 N1 DT B 203 25.900 19.215 -3.658 1.00 38.31 N ATOM 52 C2 DT B 203 26.023 19.252 -2.292 1.00 34.36 C ATOM 53 O2 DT B 203 27.088 19.426 -1.728 1.00 34.17 O ATOM 54 N3 DT B 203 24.850 19.079 -1.609 1.00 33.62 N ATOM 55 C4 DT B 203 23.595 18.871 -2.141 1.00 33.56 C ATOM 56 O4 DT B 203 22.624 18.773 -1.397 1.00 33.77 O ATOM 57 C5 DT B 203 23.541 18.800 -3.581 1.00 34.49 C ATOM 58 C7 DT B 203 22.226 18.531 -4.243 1.00 32.07 C ATOM 59 C6 DT B 203 24.683 18.975 -4.262 1.00 35.81 C ATOM 60 P DC B 204 30.312 18.507 -7.067 1.00 44.27 P ATOM 61 OP1 DC B 204 31.678 19.082 -6.993 1.00 40.60 O ATOM 62 OP2 DC B 204 29.826 17.915 -8.343 1.00 41.70 O ATOM 63 O5' DC B 204 30.200 17.403 -5.928 1.00 40.96 O ATOM 64 C5' DC B 204 30.904 17.559 -4.703 1.00 37.77 C ATOM 65 C4' DC B 204 30.684 16.351 -3.826 1.00 36.27 C ATOM 66 O4' DC B 204 29.324 16.340 -3.332 1.00 33.57 O ATOM 67 C3' DC B 204 30.880 15.016 -4.546 1.00 34.67 C ATOM 68 O3' DC B 204 31.496 14.100 -3.646 1.00 34.66 O ATOM 69 C2' DC B 204 29.458 14.568 -4.836 1.00 32.35 C ATOM 70 C1' DC B 204 28.762 15.070 -3.592 1.00 31.27 C ATOM 71 N1 DC B 204 27.300 15.214 -3.634 1.00 30.93 N ATOM 72 C2 DC B 204 26.641 15.429 -2.427 1.00 29.22 C ATOM 73 O2 DC B 204 27.319 15.534 -1.395 1.00 25.45 O ATOM 74 N3 DC B 204 25.293 15.522 -2.410 1.00 27.94 N ATOM 75 C4 DC B 204 24.607 15.417 -3.546 1.00 28.77 C ATOM 76 N4 DC B 204 23.277 15.492 -3.475 1.00 27.86 N ATOM 77 C5 DC B 204 25.255 15.221 -4.803 1.00 29.81 C ATOM 78 C6 DC B 204 26.594 15.126 -4.801 1.00 30.66 C ATOM 79 P DA B 205 33.066 13.796 -3.776 1.00 35.84 P ATOM 80 OP1 DA B 205 33.758 15.102 -3.917 1.00 33.01 O ATOM 81 OP2 DA B 205 33.265 12.739 -4.804 1.00 34.54 O ATOM 82 O5' DA B 205 33.443 13.180 -2.357 1.00 33.46 O ATOM 83 C5' DA B 205 33.605 14.017 -1.212 1.00 32.35 C ATOM 84 C4' DA B 205 32.915 13.398 -0.018 1.00 29.05 C ATOM 85 O4' DA B 205 31.481 13.460 -0.204 1.00 28.49 O ATOM 86 C3' DA B 205 33.237 11.918 0.201 1.00 30.16 C ATOM 87 O3' DA B 205 33.175 11.628 1.601 1.00 28.95 O ATOM 88 C2' DA B 205 32.079 11.220 -0.487 1.00 27.14 C ATOM 89 C1' DA B 205 30.944 12.150 -0.113 1.00 27.07 C ATOM 90 N9 DA B 205 29.768 12.075 -0.976 1.00 26.76 N ATOM 91 C8 DA B 205 29.705 11.805 -2.324 1.00 26.74 C ATOM 92 N7 DA B 205 28.480 11.780 -2.799 1.00 26.57 N ATOM 93 C5 DA B 205 27.688 12.059 -1.692 1.00 25.20 C ATOM 94 C6 DA B 205 26.297 12.169 -1.528 1.00 24.61 C ATOM 95 N6 DA B 205 25.421 12.011 -2.526 1.00 22.75 N ATOM 96 N1 DA B 205 25.829 12.452 -0.290 1.00 22.96 N ATOM 97 C2 DA B 205 26.708 12.616 0.702 1.00 23.51 C ATOM 98 N3 DA B 205 28.038 12.539 0.673 1.00 25.75 N ATOM 99 C4 DA B 205 28.468 12.251 -0.566 1.00 25.11 C ATOM 100 P DA B 206 34.124 10.503 2.226 1.00 26.24 P ATOM 101 OP1 DA B 206 35.317 11.204 2.743 1.00 27.14 O ATOM 102 OP2 DA B 206 34.292 9.387 1.260 1.00 26.60 O ATOM 103 O5' DA B 206 33.262 9.928 3.443 1.00 28.95 O ATOM 104 C5' DA B 206 32.573 10.802 4.322 1.00 30.57 C ATOM 105 C4' DA B 206 31.206 10.257 4.673 1.00 29.81 C ATOM 106 O4' DA B 206 30.234 10.579 3.644 1.00 27.07 O ATOM 107 C3' DA B 206 31.120 8.743 4.902 1.00 30.78 C ATOM 108 O3' DA B 206 30.495 8.412 6.142 1.00 28.20 O ATOM 109 C2' DA B 206 30.198 8.267 3.798 1.00 32.74 C ATOM 110 C1' DA B 206 29.342 9.489 3.521 1.00 28.76 C ATOM 111 N9 DA B 206 28.831 9.443 2.152 1.00 25.46 N ATOM 112 C8 DA B 206 29.561 9.289 1.003 1.00 24.40 C ATOM 113 N7 DA B 206 28.827 9.129 -0.071 1.00 23.16 N ATOM 114 C5 DA B 206 27.526 9.211 0.399 1.00 22.37 C ATOM 115 C6 DA B 206 26.281 9.093 -0.240 1.00 20.37 C ATOM 116 N6 DA B 206 26.140 8.836 -1.538 1.00 22.01 N ATOM 117 N1 DA B 206 25.172 9.241 0.515 1.00 21.02 N ATOM 118 C2 DA B 206 25.316 9.483 1.820 1.00 17.07 C ATOM 119 N3 DA B 206 26.432 9.604 2.538 1.00 19.07 N ATOM 120 C4 DA B 206 27.514 9.450 1.761 1.00 21.75 C ATOM 121 P DG B 207 30.421 6.868 6.601 1.00 24.88 P ATOM 122 OP1 DG B 207 31.024 6.784 7.948 1.00 28.22 O ATOM 123 OP2 DG B 207 30.934 6.004 5.511 1.00 26.11 O ATOM 124 O5' DG B 207 28.864 6.590 6.747 1.00 24.99 O ATOM 125 C5' DG B 207 28.046 7.449 7.525 1.00 24.59 C ATOM 126 C4' DG B 207 26.599 7.052 7.369 1.00 27.97 C ATOM 127 O4' DG B 207 26.205 7.269 5.993 1.00 25.23 O ATOM 128 C3' DG B 207 26.325 5.574 7.658 1.00 28.09 C ATOM 129 O3' DG B 207 25.030 5.435 8.247 1.00 29.14 O ATOM 130 C2' DG B 207 26.345 4.944 6.278 1.00 26.58 C ATOM 131 C1' DG B 207 25.752 6.049 5.420 1.00 25.14 C ATOM 132 N9 DG B 207 26.196 6.013 4.030 1.00 24.33 N ATOM 133 C8 DG B 207 27.493 6.046 3.572 1.00 22.98 C ATOM 134 N7 DG B 207 27.577 5.978 2.271 1.00 21.01 N ATOM 135 C5 DG B 207 26.259 5.895 1.844 1.00 20.58 C ATOM 136 C6 DG B 207 25.723 5.782 0.537 1.00 19.71 C ATOM 137 O6 DG B 207 26.326 5.716 -0.542 1.00 18.52 O ATOM 138 N1 DG B 207 24.333 5.741 0.558 1.00 19.56 N ATOM 139 C2 DG B 207 23.557 5.787 1.689 1.00 21.53 C ATOM 140 N2 DG B 207 22.221 5.750 1.500 1.00 18.23 N ATOM 141 N3 DG B 207 24.046 5.868 2.913 1.00 21.30 N ATOM 142 C4 DG B 207 25.394 5.923 2.917 1.00 22.48 C ATOM 143 P DG B 208 24.433 3.971 8.534 1.00 30.43 P ATOM 144 OP1 DG B 208 23.602 4.087 9.763 1.00 31.79 O ATOM 145 OP2 DG B 208 25.527 2.967 8.481 1.00 29.66 O ATOM 146 O5' DG B 208 23.440 3.732 7.316 1.00 31.36 O ATOM 147 C5' DG B 208 22.356 4.630 7.099 1.00 31.22 C ATOM 148 C4' DG B 208 21.336 4.013 6.174 1.00 32.84 C ATOM 149 O4' DG B 208 21.820 4.014 4.811 1.00 30.37 O ATOM 150 C3' DG B 208 20.955 2.568 6.491 1.00 32.86 C ATOM 151 O3' DG B 208 19.546 2.422 6.298 1.00 37.79 O ATOM 152 C2' DG B 208 21.750 1.765 5.473 1.00 30.01 C ATOM 153 C1' DG B 208 21.798 2.700 4.275 1.00 27.08 C ATOM 154 N9 DG B 208 22.977 2.561 3.426 1.00 26.00 N ATOM 155 C8 DG B 208 24.293 2.582 3.827 1.00 25.18 C ATOM 156 N7 DG B 208 25.134 2.475 2.833 1.00 25.07 N ATOM 157 C5 DG B 208 24.327 2.370 1.708 1.00 23.63 C ATOM 158 C6 DG B 208 24.674 2.235 0.342 1.00 22.90 C ATOM 159 O6 DG B 208 25.797 2.183 -0.161 1.00 20.51 O ATOM 160 N1 DG B 208 23.544 2.159 -0.469 1.00 21.45 N ATOM 161 C2 DG B 208 22.246 2.204 -0.019 1.00 22.90 C ATOM 162 N2 DG B 208 21.290 2.109 -0.957 1.00 22.23 N ATOM 163 N3 DG B 208 21.910 2.332 1.255 1.00 20.42 N ATOM 164 C4 DG B 208 22.992 2.410 2.057 1.00 23.24 C ATOM 165 P DC B 209 18.869 0.970 6.379 1.00 42.17 P ATOM 166 OP1 DC B 209 17.478 1.167 6.865 1.00 41.88 O ATOM 167 OP2 DC B 209 19.775 0.039 7.100 1.00 42.34 O ATOM 168 O5' DC B 209 18.788 0.543 4.850 1.00 41.62 O ATOM 169 C5' DC B 209 18.116 1.379 3.914 1.00 40.66 C ATOM 170 C4' DC B 209 17.838 0.620 2.639 1.00 39.32 C ATOM 171 O4' DC B 209 19.030 0.532 1.825 1.00 37.43 O ATOM 172 C3' DC B 209 17.359 -0.813 2.854 1.00 39.83 C ATOM 173 O3' DC B 209 16.290 -1.091 1.949 1.00 42.44 O ATOM 174 C2' DC B 209 18.590 -1.654 2.553 1.00 35.98 C ATOM 175 C1' DC B 209 19.305 -0.823 1.500 1.00 33.90 C ATOM 176 N1 DC B 209 20.771 -0.970 1.446 1.00 29.68 N ATOM 177 C2 DC B 209 21.380 -1.139 0.196 1.00 27.90 C ATOM 178 O2 DC B 209 20.663 -1.260 -0.809 1.00 27.70 O ATOM 179 N3 DC B 209 22.730 -1.175 0.116 1.00 23.72 N ATOM 180 C4 DC B 209 23.465 -1.070 1.224 1.00 23.46 C ATOM 181 N4 DC B 209 24.798 -1.066 1.089 1.00 21.94 N ATOM 182 C5 DC B 209 22.868 -0.953 2.518 1.00 22.89 C ATOM 183 C6 DC B 209 21.532 -0.908 2.581 1.00 24.21 C ATOM 184 P DC B 210 15.418 -2.423 2.138 1.00 43.08 P ATOM 185 OP1 DC B 210 14.071 -2.164 1.577 1.00 43.91 O ATOM 186 OP2 DC B 210 15.563 -2.900 3.537 1.00 42.73 O ATOM 187 O5' DC B 210 16.141 -3.456 1.176 1.00 40.45 O ATOM 188 C5' DC B 210 16.205 -3.199 -0.217 1.00 38.60 C ATOM 189 C4' DC B 210 17.006 -4.278 -0.896 1.00 38.25 C ATOM 190 O4' DC B 210 18.418 -4.091 -0.633 1.00 34.78 O ATOM 191 C3' DC B 210 16.663 -5.685 -0.404 1.00 37.62 C ATOM 192 O3' DC B 210 16.647 -6.566 -1.522 1.00 41.92 O ATOM 193 C2' DC B 210 17.829 -6.027 0.508 1.00 35.18 C ATOM 194 C1' DC B 210 18.957 -5.328 -0.218 1.00 32.74 C ATOM 195 N1 DC B 210 20.198 -5.067 0.521 1.00 29.95 N ATOM 196 C2 DC B 210 21.383 -4.981 -0.212 1.00 28.85 C ATOM 197 O2 DC B 210 21.329 -5.112 -1.446 1.00 27.17 O ATOM 198 N3 DC B 210 22.552 -4.757 0.432 1.00 25.59 N ATOM 199 C4 DC B 210 22.563 -4.615 1.757 1.00 26.31 C ATOM 200 N4 DC B 210 23.742 -4.397 2.347 1.00 25.71 N ATOM 201 C5 DC B 210 21.367 -4.690 2.534 1.00 26.38 C ATOM 202 C6 DC B 210 20.215 -4.916 1.880 1.00 29.04 C ATOM 203 P DA B 211 15.285 -7.303 -1.938 1.00 42.01 P ATOM 204 OP1 DA B 211 14.210 -6.287 -2.070 1.00 45.09 O ATOM 205 OP2 DA B 211 15.099 -8.454 -1.015 1.00 41.68 O ATOM 206 O5' DA B 211 15.618 -7.850 -3.392 1.00 40.71 O ATOM 207 C5' DA B 211 15.887 -6.947 -4.459 1.00 38.41 C ATOM 208 C4' DA B 211 16.994 -7.489 -5.331 1.00 39.01 C ATOM 209 O4' DA B 211 18.277 -7.334 -4.677 1.00 36.18 O ATOM 210 C3' DA B 211 16.861 -8.974 -5.654 1.00 38.49 C ATOM 211 O3' DA B 211 17.277 -9.202 -6.999 1.00 40.05 O ATOM 212 C2' DA B 211 17.795 -9.637 -4.655 1.00 38.44 C ATOM 213 C1' DA B 211 18.895 -8.599 -4.471 1.00 35.34 C ATOM 214 N9 DA B 211 19.486 -8.580 -3.131 1.00 32.97 N ATOM 215 C8 DA B 211 18.826 -8.704 -1.933 1.00 32.26 C ATOM 216 N7 DA B 211 19.608 -8.614 -0.885 1.00 29.63 N ATOM 217 C5 DA B 211 20.871 -8.422 -1.426 1.00 28.92 C ATOM 218 C6 DA B 211 22.137 -8.246 -0.834 1.00 27.48 C ATOM 219 N6 DA B 211 22.341 -8.210 0.487 1.00 26.19 N ATOM 220 N1 DA B 211 23.199 -8.098 -1.656 1.00 27.11 N ATOM 221 C2 DA B 211 22.991 -8.115 -2.980 1.00 28.25 C ATOM 222 N3 DA B 211 21.849 -8.259 -3.654 1.00 29.63 N ATOM 223 C4 DA B 211 20.814 -8.411 -2.809 1.00 30.73 C ATOM 224 P DG B 212 17.244 -10.688 -7.603 1.00 43.62 P ATOM 225 OP1 DG B 212 17.064 -10.539 -9.072 1.00 42.40 O ATOM 226 OP2 DG B 212 16.284 -11.503 -6.819 1.00 43.42 O ATOM 227 O5' DG B 212 18.720 -11.226 -7.333 1.00 41.15 O ATOM 228 C5' DG B 212 19.837 -10.537 -7.883 1.00 39.01 C ATOM 229 C4' DG B 212 21.131 -11.196 -7.469 1.00 39.19 C ATOM 230 O4' DG B 212 21.464 -10.863 -6.097 1.00 37.83 O ATOM 231 C3' DG B 212 21.165 -12.723 -7.570 1.00 38.95 C ATOM 232 O3' DG B 212 22.346 -13.145 -8.246 1.00 42.89 O ATOM 233 C2' DG B 212 21.229 -13.176 -6.120 1.00 39.08 C ATOM 234 C1' DG B 212 21.966 -12.022 -5.460 1.00 36.25 C ATOM 235 N9 DG B 212 21.744 -11.891 -4.022 1.00 33.06 N ATOM 236 C8 DG B 212 20.544 -11.959 -3.356 1.00 32.12 C ATOM 237 N7 DG B 212 20.671 -11.855 -2.061 1.00 31.52 N ATOM 238 C5 DG B 212 22.034 -11.697 -1.860 1.00 29.19 C ATOM 239 C6 DG B 212 22.773 -11.546 -0.660 1.00 28.43 C ATOM 240 O6 DG B 212 22.362 -11.538 0.501 1.00 29.40 O ATOM 241 N1 DG B 212 24.132 -11.404 -0.910 1.00 29.41 N ATOM 242 C2 DG B 212 24.713 -11.420 -2.155 1.00 28.21 C ATOM 243 N2 DG B 212 26.052 -11.276 -2.187 1.00 22.81 N ATOM 244 N3 DG B 212 24.035 -11.570 -3.282 1.00 29.60 N ATOM 245 C4 DG B 212 22.709 -11.702 -3.061 1.00 29.59 C TER 246 DG B 212 ATOM 247 O5' DC C 301 30.509 -13.016 5.295 1.00 35.78 O ATOM 248 C5' DC C 301 31.103 -11.771 4.932 1.00 31.65 C ATOM 249 C4' DC C 301 31.286 -11.695 3.434 1.00 30.29 C ATOM 250 O4' DC C 301 30.034 -12.007 2.776 1.00 29.30 O ATOM 251 C3' DC C 301 31.702 -10.324 2.913 1.00 27.00 C ATOM 252 O3' DC C 301 32.583 -10.497 1.802 1.00 27.84 O ATOM 253 C2' DC C 301 30.386 -9.700 2.486 1.00 27.28 C ATOM 254 C1' DC C 301 29.579 -10.898 2.010 1.00 25.94 C ATOM 255 N1 DC C 301 28.126 -10.788 2.222 1.00 26.22 N ATOM 256 C2 DC C 301 27.257 -10.958 1.130 1.00 26.70 C ATOM 257 O2 DC C 301 27.734 -11.159 0.002 1.00 27.50 O ATOM 258 N3 DC C 301 25.921 -10.897 1.335 1.00 24.64 N ATOM 259 C4 DC C 301 25.446 -10.672 2.565 1.00 25.07 C ATOM 260 N4 DC C 301 24.120 -10.627 2.727 1.00 23.47 N ATOM 261 C5 DC C 301 26.307 -10.481 3.685 1.00 22.08 C ATOM 262 C6 DC C 301 27.625 -10.543 3.469 1.00 25.28 C ATOM 263 P DT C 302 33.225 -9.214 1.084 1.00 25.25 P ATOM 264 OP1 DT C 302 34.560 -9.625 0.599 1.00 24.11 O ATOM 265 OP2 DT C 302 33.094 -8.020 1.956 1.00 25.94 O ATOM 266 O5' DT C 302 32.271 -8.998 -0.164 1.00 26.85 O ATOM 267 C5' DT C 302 32.070 -10.045 -1.102 1.00 25.68 C ATOM 268 C4' DT C 302 31.238 -9.541 -2.254 1.00 26.42 C ATOM 269 O4' DT C 302 29.838 -9.511 -1.889 1.00 24.86 O ATOM 270 C3' DT C 302 31.603 -8.127 -2.704 1.00 24.04 C ATOM 271 O3' DT C 302 31.776 -8.113 -4.111 1.00 25.88 O ATOM 272 C2' DT C 302 30.414 -7.278 -2.274 1.00 23.67 C ATOM 273 C1' DT C 302 29.263 -8.271 -2.258 1.00 24.40 C ATOM 274 N1 DT C 302 28.181 -7.980 -1.289 1.00 24.87 N ATOM 275 C2 DT C 302 26.881 -7.965 -1.749 1.00 22.62 C ATOM 276 O2 DT C 302 26.588 -8.141 -2.909 1.00 24.24 O ATOM 277 N3 DT C 302 25.932 -7.735 -0.787 1.00 22.33 N ATOM 278 C4 DT C 302 26.145 -7.516 0.558 1.00 23.44 C ATOM 279 O4 DT C 302 25.188 -7.339 1.306 1.00 24.76 O ATOM 280 C5 DT C 302 27.530 -7.522 0.972 1.00 23.72 C ATOM 281 C7 DT C 302 27.855 -7.278 2.412 1.00 24.44 C ATOM 282 C6 DT C 302 28.467 -7.750 0.041 1.00 23.73 C ATOM 283 P DG C 303 32.604 -6.928 -4.800 1.00 24.20 P ATOM 284 OP1 DG C 303 33.329 -7.520 -5.944 1.00 24.83 O ATOM 285 OP2 DG C 303 33.352 -6.165 -3.777 1.00 23.76 O ATOM 286 O5' DG C 303 31.443 -5.997 -5.362 1.00 25.22 O ATOM 287 C5' DG C 303 30.473 -6.518 -6.270 1.00 24.65 C ATOM 288 C4' DG C 303 29.341 -5.533 -6.438 1.00 25.04 C ATOM 289 O4' DG C 303 28.518 -5.497 -5.245 1.00 24.60 O ATOM 290 C3' DG C 303 29.792 -4.089 -6.671 1.00 25.85 C ATOM 291 O3' DG C 303 28.871 -3.468 -7.562 1.00 25.20 O ATOM 292 C2' DG C 303 29.637 -3.456 -5.299 1.00 22.72 C ATOM 293 C1' DG C 303 28.376 -4.147 -4.826 1.00 23.93 C ATOM 294 N9 DG C 303 28.119 -4.139 -3.389 1.00 22.26 N ATOM 295 C8 DG C 303 29.030 -4.020 -2.363 1.00 22.89 C ATOM 296 N7 DG C 303 28.475 -4.075 -1.179 1.00 22.64 N ATOM 297 C5 DG C 303 27.122 -4.239 -1.443 1.00 20.60 C ATOM 298 C6 DG C 303 26.024 -4.369 -0.560 1.00 21.51 C ATOM 299 O6 DG C 303 26.024 -4.375 0.675 1.00 22.78 O ATOM 300 N1 DG C 303 24.822 -4.507 -1.254 1.00 20.98 N ATOM 301 C2 DG C 303 24.696 -4.522 -2.617 1.00 21.08 C ATOM 302 N2 DG C 303 23.449 -4.669 -3.098 1.00 22.64 N ATOM 303 N3 DG C 303 25.713 -4.403 -3.452 1.00 20.55 N ATOM 304 C4 DG C 303 26.887 -4.269 -2.801 1.00 21.44 C ATOM 305 P DG C 304 29.408 -2.559 -8.764 1.00 25.48 P ATOM 306 OP1 DG C 304 30.028 -3.468 -9.756 1.00 25.37 O ATOM 307 OP2 DG C 304 30.194 -1.418 -8.226 1.00 23.86 O ATOM 308 O5' DG C 304 28.055 -1.996 -9.379 1.00 26.09 O ATOM 309 C5' DG C 304 27.026 -2.893 -9.783 1.00 26.94 C ATOM 310 C4' DG C 304 25.672 -2.325 -9.434 1.00 28.31 C ATOM 311 O4' DG C 304 25.435 -2.383 -8.006 1.00 27.60 O ATOM 312 C3' DG C 304 25.484 -0.864 -9.833 1.00 29.04 C ATOM 313 O3' DG C 304 24.147 -0.700 -10.298 1.00 31.75 O ATOM 314 C2' DG C 304 25.694 -0.113 -8.527 1.00 26.96 C ATOM 315 C1' DG C 304 25.121 -1.087 -7.513 1.00 26.03 C ATOM 316 N9 DG C 304 25.665 -0.984 -6.161 1.00 25.92 N ATOM 317 C8 DG C 304 26.975 -0.783 -5.799 1.00 25.10 C ATOM 318 N7 DG C 304 27.153 -0.776 -4.503 1.00 26.14 N ATOM 319 C5 DG C 304 25.884 -0.975 -3.981 1.00 25.95 C ATOM 320 C6 DG C 304 25.445 -1.070 -2.629 1.00 28.19 C ATOM 321 O6 DG C 304 26.115 -1.002 -1.592 1.00 31.89 O ATOM 322 N1 DG C 304 24.072 -1.275 -2.552 1.00 26.66 N ATOM 323 C2 DG C 304 23.229 -1.385 -3.630 1.00 26.76 C ATOM 324 N2 DG C 304 21.936 -1.593 -3.347 1.00 27.35 N ATOM 325 N3 DG C 304 23.625 -1.300 -4.891 1.00 24.50 N ATOM 326 C4 DG C 304 24.953 -1.096 -4.992 1.00 24.63 C ATOM 327 P DC C 305 23.718 0.666 -11.012 1.00 34.69 P ATOM 328 OP1 DC C 305 22.998 0.254 -12.242 1.00 35.99 O ATOM 329 OP2 DC C 305 24.895 1.571 -11.113 1.00 32.63 O ATOM 330 O5' DC C 305 22.679 1.291 -9.981 1.00 34.17 O ATOM 331 C5' DC C 305 21.593 0.503 -9.505 1.00 34.83 C ATOM 332 C4' DC C 305 20.959 1.137 -8.290 1.00 35.28 C ATOM 333 O4' DC C 305 21.770 0.943 -7.101 1.00 34.75 O ATOM 334 C3' DC C 305 20.674 2.638 -8.383 1.00 36.48 C ATOM 335 O3' DC C 305 19.334 2.875 -7.950 1.00 40.31 O ATOM 336 C2' DC C 305 21.661 3.248 -7.397 1.00 34.68 C ATOM 337 C1' DC C 305 21.779 2.148 -6.357 1.00 32.71 C ATOM 338 N1 DC C 305 23.002 2.178 -5.529 1.00 29.44 N ATOM 339 C2 DC C 305 22.883 1.955 -4.153 1.00 27.57 C ATOM 340 O2 DC C 305 21.763 1.706 -3.682 1.00 25.41 O ATOM 341 N3 DC C 305 23.989 2.014 -3.373 1.00 27.88 N ATOM 342 C4 DC C 305 25.178 2.278 -3.921 1.00 26.90 C ATOM 343 N4 DC C 305 26.235 2.349 -3.113 1.00 21.51 N ATOM 344 C5 DC C 305 25.332 2.488 -5.324 1.00 25.54 C ATOM 345 C6 DC C 305 24.228 2.431 -6.082 1.00 27.98 C ATOM 346 P DC C 306 18.711 4.355 -8.023 1.00 42.13 P ATOM 347 OP1 DC C 306 17.408 4.232 -8.722 1.00 43.22 O ATOM 348 OP2 DC C 306 19.727 5.315 -8.531 1.00 40.66 O ATOM 349 O5' DC C 306 18.417 4.659 -6.487 1.00 42.69 O ATOM 350 C5' DC C 306 17.752 3.682 -5.685 1.00 39.43 C ATOM 351 C4' DC C 306 17.715 4.114 -4.239 1.00 38.04 C ATOM 352 O4' DC C 306 19.011 3.923 -3.617 1.00 35.47 O ATOM 353 C3' DC C 306 17.338 5.578 -4.021 1.00 36.95 C ATOM 354 O3' DC C 306 16.374 5.688 -2.979 1.00 40.21 O ATOM 355 C2' DC C 306 18.642 6.233 -3.598 1.00 35.63 C ATOM 356 C1' DC C 306 19.379 5.097 -2.911 1.00 32.85 C ATOM 357 N1 DC C 306 20.848 5.214 -2.960 1.00 30.64 N ATOM 358 C2 DC C 306 21.552 5.353 -1.758 1.00 27.03 C ATOM 359 O2 DC C 306 20.923 5.359 -0.692 1.00 29.36 O ATOM 360 N3 DC C 306 22.897 5.475 -1.788 1.00 26.68 N ATOM 361 C4 DC C 306 23.543 5.461 -2.956 1.00 26.14 C ATOM 362 N4 DC C 306 24.871 5.592 -2.934 1.00 21.31 N ATOM 363 C5 DC C 306 22.852 5.314 -4.200 1.00 25.98 C ATOM 364 C6 DC C 306 21.517 5.193 -4.155 1.00 27.60 C ATOM 365 P DT C 307 15.695 7.111 -2.677 1.00 42.86 P ATOM 366 OP1 DT C 307 14.277 6.858 -2.319 1.00 41.42 O ATOM 367 OP2 DT C 307 16.020 8.029 -3.800 1.00 40.37 O ATOM 368 O5' DT C 307 16.445 7.597 -1.357 1.00 39.49 O ATOM 369 C5' DT C 307 16.421 6.777 -0.191 1.00 36.12 C ATOM 370 C4' DT C 307 17.128 7.455 0.958 1.00 34.69 C ATOM 371 O4' DT C 307 18.561 7.446 0.756 1.00 32.87 O ATOM 372 C3' DT C 307 16.740 8.911 1.213 1.00 34.57 C ATOM 373 O3' DT C 307 16.624 9.104 2.623 1.00 37.17 O ATOM 374 C2' DT C 307 17.913 9.695 0.647 1.00 32.32 C ATOM 375 C1' DT C 307 19.085 8.757 0.896 1.00 29.46 C ATOM 376 N1 DT C 307 20.213 8.884 -0.051 1.00 27.06 N ATOM 377 C2 DT C 307 21.485 8.995 0.469 1.00 24.04 C ATOM 378 O2 DT C 307 21.715 9.063 1.663 1.00 25.17 O ATOM 379 N3 DT C 307 22.485 9.038 -0.470 1.00 23.74 N ATOM 380 C4 DT C 307 22.342 9.015 -1.843 1.00 23.20 C ATOM 381 O4 DT C 307 23.335 9.053 -2.560 1.00 25.59 O ATOM 382 C5 DT C 307 20.982 8.943 -2.321 1.00 24.79 C ATOM 383 C7 DT C 307 20.734 8.958 -3.797 1.00 25.59 C ATOM 384 C6 DT C 307 19.997 8.874 -1.414 1.00 23.53 C ATOM 385 P DT C 308 16.132 10.517 3.202 1.00 37.36 P ATOM 386 OP1 DT C 308 15.213 10.220 4.331 1.00 39.10 O ATOM 387 OP2 DT C 308 15.673 11.380 2.086 1.00 37.19 O ATOM 388 O5' DT C 308 17.468 11.130 3.803 1.00 37.07 O ATOM 389 C5' DT C 308 18.269 10.357 4.687 1.00 34.84 C ATOM 390 C4' DT C 308 19.540 11.096 5.030 1.00 33.75 C ATOM 391 O4' DT C 308 20.502 11.014 3.948 1.00 33.34 O ATOM 392 C3' DT C 308 19.361 12.581 5.345 1.00 31.66 C ATOM 393 O3' DT C 308 20.065 12.877 6.547 1.00 34.89 O ATOM 394 C2' DT C 308 19.989 13.284 4.148 1.00 31.71 C ATOM 395 C1' DT C 308 21.055 12.295 3.699 1.00 30.29 C ATOM 396 N1 DT C 308 21.438 12.347 2.268 1.00 27.01 N ATOM 397 C2 DT C 308 22.783 12.327 1.954 1.00 26.50 C ATOM 398 O2 DT C 308 23.670 12.302 2.797 1.00 27.68 O ATOM 399 N3 DT C 308 23.057 12.338 0.610 1.00 24.95 N ATOM 400 C4 DT C 308 22.147 12.370 -0.427 1.00 25.42 C ATOM 401 O4 DT C 308 22.542 12.354 -1.584 1.00 26.84 O ATOM 402 C5 DT C 308 20.759 12.416 -0.030 1.00 26.69 C ATOM 403 C7 DT C 308 19.705 12.485 -1.092 1.00 26.25 C ATOM 404 C6 DT C 308 20.478 12.400 1.281 1.00 25.08 C ATOM 405 P DG C 309 19.570 14.081 7.485 1.00 36.72 P ATOM 406 OP1 DG C 309 19.737 13.647 8.896 1.00 37.08 O ATOM 407 OP2 DG C 309 18.244 14.547 7.011 1.00 36.31 O ATOM 408 O5' DG C 309 20.645 15.218 7.196 1.00 34.71 O ATOM 409 C5' DG C 309 22.002 15.044 7.596 1.00 35.17 C ATOM 410 C4' DG C 309 22.864 16.117 6.976 1.00 35.91 C ATOM 411 O4' DG C 309 23.031 15.866 5.560 1.00 35.12 O ATOM 412 C3' DG C 309 22.281 17.527 7.088 1.00 37.39 C ATOM 413 O3' DG C 309 23.333 18.451 7.349 1.00 41.32 O ATOM 414 C2' DG C 309 21.710 17.781 5.705 1.00 34.02 C ATOM 415 C1' DG C 309 22.719 17.051 4.845 1.00 33.45 C ATOM 416 N9 DG C 309 22.278 16.676 3.505 1.00 30.14 N ATOM 417 C8 DG C 309 20.989 16.592 3.034 1.00 29.15 C ATOM 418 N7 DG C 309 20.927 16.243 1.778 1.00 29.43 N ATOM 419 C5 DG C 309 22.255 16.082 1.398 1.00 27.57 C ATOM 420 C6 DG C 309 22.818 15.709 0.147 1.00 26.00 C ATOM 421 O6 DG C 309 22.235 15.437 -0.909 1.00 25.62 O ATOM 422 N1 DG C 309 24.210 15.672 0.202 1.00 24.29 N ATOM 423 C2 DG C 309 24.963 15.959 1.315 1.00 25.66 C ATOM 424 N2 DG C 309 26.294 15.887 1.168 1.00 21.20 N ATOM 425 N3 DG C 309 24.449 16.298 2.489 1.00 25.54 N ATOM 426 C4 DG C 309 23.099 16.343 2.455 1.00 27.33 C ATOM 427 P DA C 310 23.233 19.428 8.615 1.00 42.52 P ATOM 428 OP1 DA C 310 22.981 18.573 9.802 1.00 42.65 O ATOM 429 OP2 DA C 310 22.295 20.534 8.290 1.00 43.91 O ATOM 430 O5' DA C 310 24.699 20.031 8.727 1.00 42.82 O ATOM 431 C5' DA C 310 25.810 19.181 8.987 1.00 42.27 C ATOM 432 C4' DA C 310 26.993 19.608 8.153 1.00 42.71 C ATOM 433 O4' DA C 310 26.734 19.325 6.759 1.00 42.81 O ATOM 434 C3' DA C 310 27.320 21.097 8.230 1.00 43.26 C ATOM 435 O3' DA C 310 28.739 21.253 8.233 1.00 46.03 O ATOM 436 C2' DA C 310 26.677 21.670 6.977 1.00 41.79 C ATOM 437 C1' DA C 310 26.760 20.517 5.985 1.00 40.07 C ATOM 438 N9 DA C 310 25.650 20.439 5.033 1.00 36.27 N ATOM 439 C8 DA C 310 24.320 20.701 5.264 1.00 35.60 C ATOM 440 N7 DA C 310 23.550 20.490 4.223 1.00 33.38 N ATOM 441 C5 DA C 310 24.433 20.069 3.236 1.00 30.12 C ATOM 442 C6 DA C 310 24.238 19.675 1.901 1.00 29.75 C ATOM 443 N6 DA C 310 23.041 19.622 1.312 1.00 26.44 N ATOM 444 N1 DA C 310 25.329 19.327 1.183 1.00 29.54 N ATOM 445 C2 DA C 310 26.527 19.364 1.779 1.00 30.14 C ATOM 446 N3 DA C 310 26.836 19.704 3.031 1.00 32.75 N ATOM 447 C4 DA C 310 25.730 20.049 3.715 1.00 32.57 C ATOM 448 P DA C 311 29.385 22.718 8.180 1.00 48.70 P ATOM 449 OP1 DA C 311 30.629 22.675 8.989 1.00 48.64 O ATOM 450 OP2 DA C 311 28.338 23.729 8.486 1.00 50.72 O ATOM 451 O5' DA C 311 29.797 22.857 6.651 1.00 47.75 O ATOM 452 C5' DA C 311 30.570 21.838 6.026 1.00 43.07 C ATOM 453 C4' DA C 311 30.836 22.199 4.586 1.00 40.70 C ATOM 454 O4' DA C 311 29.630 22.021 3.803 1.00 39.12 O ATOM 455 C3' DA C 311 31.273 23.649 4.384 1.00 39.42 C ATOM 456 O3' DA C 311 32.308 23.698 3.401 1.00 39.73 O ATOM 457 C2' DA C 311 30.008 24.335 3.891 1.00 38.07 C ATOM 458 C1' DA C 311 29.307 23.224 3.120 1.00 36.04 C ATOM 459 N9 DA C 311 27.848 23.328 3.072 1.00 31.97 N ATOM 460 C8 DA C 311 27.000 23.716 4.076 1.00 31.11 C ATOM 461 N7 DA C 311 25.732 23.696 3.737 1.00 30.02 N ATOM 462 C5 DA C 311 25.747 23.267 2.420 1.00 29.49 C ATOM 463 C6 DA C 311 24.721 23.028 1.496 1.00 28.57 C ATOM 464 N6 DA C 311 23.423 23.180 1.776 1.00 27.91 N ATOM 465 N1 DA C 311 25.073 22.613 0.260 1.00 30.08 N ATOM 466 C2 DA C 311 26.371 22.439 -0.011 1.00 29.19 C ATOM 467 N3 DA C 311 27.426 22.619 0.776 1.00 32.12 N ATOM 468 C4 DA C 311 27.043 23.040 1.994 1.00 30.27 C ATOM 469 P DC C 312 33.121 25.063 3.164 1.00 42.49 P ATOM 470 OP1 DC C 312 34.517 24.680 2.838 1.00 38.09 O ATOM 471 OP2 DC C 312 32.855 25.980 4.305 1.00 39.98 O ATOM 472 O5' DC C 312 32.440 25.658 1.851 1.00 39.48 O ATOM 473 C5' DC C 312 32.481 24.920 0.632 1.00 39.65 C ATOM 474 C4' DC C 312 31.550 25.521 -0.394 1.00 38.33 C ATOM 475 O4' DC C 312 30.171 25.212 -0.085 1.00 35.94 O ATOM 476 C3' DC C 312 31.630 27.042 -0.552 1.00 37.93 C ATOM 477 O3' DC C 312 32.292 27.496 -1.729 1.00 41.52 O ATOM 478 C2' DC C 312 30.200 27.527 -0.370 1.00 37.29 C ATOM 479 C1' DC C 312 29.362 26.274 -0.558 1.00 33.83 C ATOM 480 N1 DC C 312 28.120 26.294 0.231 1.00 31.26 N ATOM 481 C2 DC C 312 26.908 26.016 -0.410 1.00 28.80 C ATOM 482 O2 DC C 312 26.922 25.701 -1.606 1.00 33.04 O ATOM 483 N3 DC C 312 25.754 26.098 0.289 1.00 28.27 N ATOM 484 C4 DC C 312 25.780 26.439 1.581 1.00 26.19 C ATOM 485 N4 DC C 312 24.613 26.545 2.221 1.00 24.37 N ATOM 486 C5 DC C 312 27.003 26.694 2.270 1.00 26.10 C ATOM 487 C6 DC C 312 28.139 26.607 1.564 1.00 28.17 C TER 488 DC C 312 ATOM 489 N GLU A 84 39.120 7.118 -14.321 1.00 40.35 N ATOM 490 CA GLU A 84 40.401 6.626 -13.753 1.00 38.66 C ATOM 491 C GLU A 84 40.200 5.227 -13.166 1.00 37.34 C ATOM 492 O GLU A 84 39.078 4.715 -13.113 1.00 35.08 O ATOM 493 CB GLU A 84 40.899 7.591 -12.670 1.00 41.56 C ATOM 494 CG GLU A 84 42.307 7.296 -12.174 1.00 46.04 C ATOM 495 CD GLU A 84 43.303 7.145 -13.314 1.00 48.92 C ATOM 496 OE1 GLU A 84 43.455 8.104 -14.100 1.00 50.06 O ATOM 497 OE2 GLU A 84 43.929 6.066 -13.425 1.00 48.39 O ATOM 498 N LEU A 85 41.295 4.611 -12.737 1.00 34.72 N ATOM 499 CA LEU A 85 41.247 3.276 -12.167 1.00 33.21 C ATOM 500 C LEU A 85 41.418 3.277 -10.661 1.00 31.75 C ATOM 501 O LEU A 85 42.207 4.045 -10.105 1.00 30.77 O ATOM 502 CB LEU A 85 42.326 2.385 -12.788 1.00 35.35 C ATOM 503 CG LEU A 85 42.072 1.850 -14.199 1.00 36.84 C ATOM 504 CD1 LEU A 85 42.007 3.002 -15.178 1.00 36.63 C ATOM 505 CD2 LEU A 85 43.181 0.881 -14.581 1.00 38.93 C ATOM 506 N CYS A 86 40.663 2.403 -10.010 1.00 28.79 N ATOM 507 CA CYS A 86 40.717 2.256 -8.567 1.00 26.13 C ATOM 508 C CYS A 86 42.133 1.846 -8.194 1.00 25.34 C ATOM 509 O CYS A 86 42.659 0.868 -8.723 1.00 25.05 O ATOM 510 CB CYS A 86 39.740 1.168 -8.119 1.00 23.72 C ATOM 511 SG CYS A 86 39.722 0.896 -6.341 1.00 22.09 S ATOM 512 N PRO A 87 42.775 2.593 -7.285 1.00 25.77 N ATOM 513 CA PRO A 87 44.145 2.246 -6.880 1.00 26.12 C ATOM 514 C PRO A 87 44.229 0.887 -6.182 1.00 26.65 C ATOM 515 O PRO A 87 45.315 0.326 -6.028 1.00 26.64 O ATOM 516 CB PRO A 87 44.543 3.405 -5.961 1.00 24.30 C ATOM 517 CG PRO A 87 43.215 3.868 -5.393 1.00 23.78 C ATOM 518 CD PRO A 87 42.312 3.817 -6.604 1.00 24.72 C ATOM 519 N VAL A 88 43.078 0.351 -5.780 1.00 26.96 N ATOM 520 CA VAL A 88 43.054 -0.932 -5.089 1.00 27.00 C ATOM 521 C VAL A 88 42.833 -2.139 -5.997 1.00 28.29 C ATOM 522 O VAL A 88 43.591 -3.108 -5.936 1.00 27.90 O ATOM 523 CB VAL A 88 41.968 -0.957 -3.980 1.00 27.59 C ATOM 524 CG1 VAL A 88 41.932 -2.329 -3.314 1.00 26.81 C ATOM 525 CG2 VAL A 88 42.257 0.120 -2.938 1.00 27.14 C ATOM 526 N CYS A 89 41.806 -2.083 -6.842 1.00 26.97 N ATOM 527 CA CYS A 89 41.497 -3.214 -7.709 1.00 25.75 C ATOM 528 C CYS A 89 41.492 -2.923 -9.211 1.00 26.97 C ATOM 529 O CYS A 89 41.363 -3.851 -10.016 1.00 24.08 O ATOM 530 CB CYS A 89 40.138 -3.786 -7.329 1.00 25.16 C ATOM 531 SG CYS A 89 38.787 -2.712 -7.837 1.00 23.16 S ATOM 532 N GLY A 90 41.591 -1.648 -9.587 1.00 25.49 N ATOM 533 CA GLY A 90 41.606 -1.301 -11.001 1.00 27.33 C ATOM 534 C GLY A 90 40.250 -1.069 -11.649 1.00 28.26 C ATOM 535 O GLY A 90 40.172 -0.684 -12.821 1.00 30.55 O ATOM 536 N ASP A 91 39.177 -1.303 -10.903 1.00 26.76 N ATOM 537 CA ASP A 91 37.828 -1.109 -11.425 1.00 25.67 C ATOM 538 C ASP A 91 37.558 0.391 -11.616 1.00 26.22 C ATOM 539 O ASP A 91 38.345 1.235 -11.185 1.00 24.07 O ATOM 540 CB ASP A 91 36.811 -1.729 -10.456 1.00 26.28 C ATOM 541 CG ASP A 91 35.395 -1.774 -11.020 1.00 28.72 C ATOM 542 OD1 ASP A 91 35.222 -1.599 -12.248 1.00 27.14 O ATOM 543 OD2 ASP A 91 34.449 -2.001 -10.227 1.00 30.12 O ATOM 544 N LYS A 92 36.449 0.711 -12.274 1.00 25.45 N ATOM 545 CA LYS A 92 36.071 2.095 -12.533 1.00 27.60 C ATOM 546 C LYS A 92 35.848 2.912 -11.261 1.00 27.34 C ATOM 547 O LYS A 92 35.081 2.519 -10.382 1.00 27.07 O ATOM 548 CB LYS A 92 34.791 2.136 -13.370 1.00 29.44 C ATOM 549 CG LYS A 92 34.411 3.526 -13.837 1.00 33.24 C ATOM 550 CD LYS A 92 33.026 3.519 -14.464 1.00 39.92 C ATOM 551 CE LYS A 92 32.594 4.920 -14.872 1.00 42.34 C ATOM 552 NZ LYS A 92 31.153 4.961 -15.246 1.00 45.35 N ATOM 553 N VAL A 93 36.522 4.051 -11.168 1.00 25.58 N ATOM 554 CA VAL A 93 36.370 4.938 -10.019 1.00 26.88 C ATOM 555 C VAL A 93 34.982 5.575 -10.091 1.00 26.56 C ATOM 556 O VAL A 93 34.489 5.857 -11.185 1.00 27.26 O ATOM 557 CB VAL A 93 37.448 6.049 -10.044 1.00 28.79 C ATOM 558 CG1 VAL A 93 37.089 7.155 -9.072 1.00 30.38 C ATOM 559 CG2 VAL A 93 38.811 5.452 -9.688 1.00 25.97 C ATOM 560 N SER A 94 34.341 5.788 -8.942 1.00 25.05 N ATOM 561 CA SER A 94 33.010 6.402 -8.930 1.00 24.24 C ATOM 562 C SER A 94 33.001 7.758 -8.224 1.00 22.79 C ATOM 563 O SER A 94 31.986 8.449 -8.214 1.00 22.54 O ATOM 564 CB SER A 94 31.980 5.468 -8.270 1.00 22.57 C ATOM 565 OG SER A 94 32.306 5.211 -6.912 1.00 24.65 O ATOM 566 N GLY A 95 34.139 8.131 -7.645 1.00 22.56 N ATOM 567 CA GLY A 95 34.258 9.406 -6.953 1.00 22.04 C ATOM 568 C GLY A 95 35.266 9.291 -5.824 1.00 23.28 C ATOM 569 O GLY A 95 35.913 8.254 -5.687 1.00 21.36 O ATOM 570 N TYR A 96 35.429 10.344 -5.027 1.00 23.15 N ATOM 571 CA TYR A 96 36.356 10.259 -3.909 1.00 24.79 C ATOM 572 C TYR A 96 35.695 9.449 -2.809 1.00 25.06 C ATOM 573 O TYR A 96 34.519 9.639 -2.507 1.00 23.22 O ATOM 574 CB TYR A 96 36.723 11.644 -3.359 1.00 29.66 C ATOM 575 CG TYR A 96 37.649 12.430 -4.255 1.00 32.14 C ATOM 576 CD1 TYR A 96 37.143 13.305 -5.216 1.00 34.95 C ATOM 577 CD2 TYR A 96 39.031 12.276 -4.166 1.00 33.01 C ATOM 578 CE1 TYR A 96 37.990 14.010 -6.068 1.00 36.09 C ATOM 579 CE2 TYR A 96 39.889 12.976 -5.017 1.00 35.67 C ATOM 580 CZ TYR A 96 39.359 13.841 -5.964 1.00 36.22 C ATOM 581 OH TYR A 96 40.194 14.539 -6.809 1.00 37.73 O ATOM 582 N HIS A 97 36.452 8.529 -2.225 1.00 24.52 N ATOM 583 CA HIS A 97 35.932 7.707 -1.147 1.00 24.68 C ATOM 584 C HIS A 97 37.005 7.487 -0.094 1.00 24.59 C ATOM 585 O HIS A 97 38.018 6.819 -0.336 1.00 22.07 O ATOM 586 CB HIS A 97 35.431 6.360 -1.680 1.00 23.64 C ATOM 587 CG HIS A 97 34.311 6.486 -2.665 1.00 26.24 C ATOM 588 ND1 HIS A 97 33.086 7.025 -2.335 1.00 25.47 N ATOM 589 CD2 HIS A 97 34.246 6.185 -3.985 1.00 26.81 C ATOM 590 CE1 HIS A 97 32.315 7.053 -3.408 1.00 27.19 C ATOM 591 NE2 HIS A 97 32.995 6.550 -4.423 1.00 27.94 N ATOM 592 N TYR A 98 36.777 8.081 1.072 1.00 23.52 N ATOM 593 CA TYR A 98 37.688 7.955 2.196 1.00 23.46 C ATOM 594 C TYR A 98 39.129 8.361 1.905 1.00 25.10 C ATOM 595 O TYR A 98 40.058 7.596 2.168 1.00 25.88 O ATOM 596 CB TYR A 98 37.646 6.517 2.721 1.00 22.65 C ATOM 597 CG TYR A 98 36.233 6.023 2.936 1.00 23.24 C ATOM 598 CD1 TYR A 98 35.607 5.205 1.995 1.00 20.98 C ATOM 599 CD2 TYR A 98 35.495 6.434 4.049 1.00 23.04 C ATOM 600 CE1 TYR A 98 34.280 4.816 2.154 1.00 21.70 C ATOM 601 CE2 TYR A 98 34.167 6.049 4.216 1.00 23.01 C ATOM 602 CZ TYR A 98 33.567 5.242 3.263 1.00 22.12 C ATOM 603 OH TYR A 98 32.247 4.878 3.418 1.00 23.45 O ATOM 604 N GLY A 99 39.313 9.561 1.357 1.00 25.72 N ATOM 605 CA GLY A 99 40.656 10.049 1.095 1.00 27.68 C ATOM 606 C GLY A 99 41.108 10.138 -0.349 1.00 29.63 C ATOM 607 O GLY A 99 41.982 10.943 -0.671 1.00 29.67 O ATOM 608 N LEU A 100 40.531 9.317 -1.221 1.00 29.31 N ATOM 609 CA LEU A 100 40.913 9.332 -2.626 1.00 29.30 C ATOM 610 C LEU A 100 39.908 8.644 -3.540 1.00 28.33 C ATOM 611 O LEU A 100 38.950 8.021 -3.078 1.00 27.75 O ATOM 612 CB LEU A 100 42.294 8.686 -2.806 1.00 31.30 C ATOM 613 CG LEU A 100 42.634 7.377 -2.080 1.00 32.15 C ATOM 614 CD1 LEU A 100 41.421 6.493 -1.933 1.00 33.69 C ATOM 615 CD2 LEU A 100 43.728 6.661 -2.859 1.00 32.45 C ATOM 616 N LEU A 101 40.132 8.770 -4.843 1.00 26.79 N ATOM 617 CA LEU A 101 39.258 8.160 -5.834 1.00 25.61 C ATOM 618 C LEU A 101 39.339 6.640 -5.750 1.00 23.54 C ATOM 619 O LEU A 101 40.431 6.083 -5.717 1.00 24.00 O ATOM 620 CB LEU A 101 39.673 8.603 -7.239 1.00 26.76 C ATOM 621 CG LEU A 101 39.552 10.089 -7.580 1.00 28.28 C ATOM 622 CD1 LEU A 101 40.265 10.375 -8.899 1.00 27.67 C ATOM 623 CD2 LEU A 101 38.081 10.464 -7.670 1.00 28.52 C ATOM 624 N THR A 102 38.187 5.978 -5.696 1.00 20.96 N ATOM 625 CA THR A 102 38.136 4.516 -5.653 1.00 20.24 C ATOM 626 C THR A 102 36.863 4.065 -6.360 1.00 20.64 C ATOM 627 O THR A 102 35.994 4.882 -6.673 1.00 18.34 O ATOM 628 CB THR A 102 38.081 3.937 -4.197 1.00 21.73 C ATOM 629 OG1 THR A 102 36.779 4.160 -3.634 1.00 22.72 O ATOM 630 CG2 THR A 102 39.120 4.585 -3.309 1.00 21.12 C ATOM 631 N CYS A 103 36.754 2.763 -6.607 1.00 21.81 N ATOM 632 CA CYS A 103 35.564 2.217 -7.247 1.00 21.64 C ATOM 633 C CYS A 103 34.490 2.121 -6.166 1.00 21.98 C ATOM 634 O CYS A 103 34.792 2.236 -4.975 1.00 20.92 O ATOM 635 CB CYS A 103 35.846 0.826 -7.821 1.00 21.98 C ATOM 636 SG CYS A 103 36.006 -0.488 -6.598 1.00 24.98 S ATOM 637 N GLU A 104 33.247 1.911 -6.583 1.00 20.75 N ATOM 638 CA GLU A 104 32.127 1.810 -5.655 1.00 20.55 C ATOM 639 C GLU A 104 32.254 0.577 -4.754 1.00 21.20 C ATOM 640 O GLU A 104 31.969 0.650 -3.564 1.00 21.76 O ATOM 641 CB GLU A 104 30.807 1.757 -6.437 1.00 19.67 C ATOM 642 CG GLU A 104 29.524 1.965 -5.610 1.00 20.94 C ATOM 643 CD GLU A 104 29.355 3.395 -5.082 1.00 23.22 C ATOM 644 OE1 GLU A 104 30.034 4.322 -5.585 1.00 20.22 O ATOM 645 OE2 GLU A 104 28.523 3.592 -4.169 1.00 21.41 O ATOM 646 N SER A 105 32.706 -0.547 -5.304 1.00 20.13 N ATOM 647 CA SER A 105 32.823 -1.756 -4.491 1.00 20.28 C ATOM 648 C SER A 105 33.831 -1.590 -3.359 1.00 22.41 C ATOM 649 O SER A 105 33.570 -2.015 -2.227 1.00 20.33 O ATOM 650 CB SER A 105 33.197 -2.973 -5.352 1.00 20.51 C ATOM 651 OG SER A 105 34.529 -2.892 -5.843 1.00 23.49 O ATOM 652 N CYS A 106 34.978 -0.974 -3.653 1.00 20.90 N ATOM 653 CA CYS A 106 35.990 -0.786 -2.624 1.00 22.16 C ATOM 654 C CYS A 106 35.519 0.199 -1.554 1.00 21.58 C ATOM 655 O CYS A 106 35.875 0.073 -0.382 1.00 20.72 O ATOM 656 CB CYS A 106 37.329 -0.367 -3.248 1.00 19.37 C ATOM 657 SG CYS A 106 38.249 -1.807 -3.937 1.00 24.79 S ATOM 658 N LYS A 107 34.700 1.165 -1.949 1.00 21.59 N ATOM 659 CA LYS A 107 34.151 2.116 -0.983 1.00 21.28 C ATOM 660 C LYS A 107 33.255 1.321 -0.015 1.00 21.04 C ATOM 661 O LYS A 107 33.348 1.471 1.207 1.00 21.54 O ATOM 662 CB LYS A 107 33.324 3.183 -1.706 1.00 19.36 C ATOM 663 CG LYS A 107 32.234 3.826 -0.867 1.00 17.57 C ATOM 664 CD LYS A 107 31.088 4.292 -1.760 1.00 20.05 C ATOM 665 CE LYS A 107 29.907 4.832 -0.959 1.00 21.72 C ATOM 666 NZ LYS A 107 28.828 5.348 -1.857 1.00 20.38 N ATOM 667 N GLY A 108 32.395 0.474 -0.574 1.00 20.70 N ATOM 668 CA GLY A 108 31.499 -0.334 0.241 1.00 19.94 C ATOM 669 C GLY A 108 32.261 -1.277 1.159 1.00 22.22 C ATOM 670 O GLY A 108 31.924 -1.419 2.343 1.00 21.21 O ATOM 671 N PHE A 109 33.297 -1.911 0.611 1.00 20.30 N ATOM 672 CA PHE A 109 34.129 -2.852 1.347 1.00 20.53 C ATOM 673 C PHE A 109 34.835 -2.197 2.536 1.00 22.22 C ATOM 674 O PHE A 109 34.853 -2.746 3.644 1.00 22.36 O ATOM 675 CB PHE A 109 35.178 -3.470 0.416 1.00 19.14 C ATOM 676 CG PHE A 109 36.158 -4.378 1.122 1.00 19.31 C ATOM 677 CD1 PHE A 109 35.776 -5.650 1.539 1.00 16.45 C ATOM 678 CD2 PHE A 109 37.459 -3.950 1.381 1.00 17.65 C ATOM 679 CE1 PHE A 109 36.674 -6.486 2.207 1.00 19.80 C ATOM 680 CE2 PHE A 109 38.367 -4.777 2.046 1.00 19.88 C ATOM 681 CZ PHE A 109 37.974 -6.049 2.462 1.00 19.80 C ATOM 682 N PHE A 110 35.426 -1.031 2.303 1.00 22.07 N ATOM 683 CA PHE A 110 36.129 -0.310 3.363 1.00 21.13 C ATOM 684 C PHE A 110 35.135 0.115 4.455 1.00 20.46 C ATOM 685 O PHE A 110 35.409 -0.042 5.644 1.00 21.51 O ATOM 686 CB PHE A 110 36.831 0.917 2.781 1.00 20.17 C ATOM 687 CG PHE A 110 37.780 1.593 3.735 1.00 20.92 C ATOM 688 CD1 PHE A 110 39.008 1.017 4.045 1.00 22.57 C ATOM 689 CD2 PHE A 110 37.464 2.831 4.290 1.00 20.00 C ATOM 690 CE1 PHE A 110 39.916 1.671 4.892 1.00 22.74 C ATOM 691 CE2 PHE A 110 38.362 3.490 5.134 1.00 20.95 C ATOM 692 CZ PHE A 110 39.589 2.909 5.433 1.00 19.57 C ATOM 693 N LYS A 111 33.985 0.646 4.047 1.00 19.67 N ATOM 694 CA LYS A 111 32.949 1.075 4.989 1.00 20.14 C ATOM 695 C LYS A 111 32.506 -0.088 5.873 1.00 21.74 C ATOM 696 O LYS A 111 32.486 0.026 7.105 1.00 18.53 O ATOM 697 CB LYS A 111 31.732 1.627 4.242 1.00 22.15 C ATOM 698 CG LYS A 111 30.602 2.082 5.175 1.00 26.66 C ATOM 699 CD LYS A 111 29.382 2.562 4.407 1.00 27.16 C ATOM 700 CE LYS A 111 28.712 1.412 3.668 1.00 30.81 C ATOM 701 NZ LYS A 111 27.684 1.887 2.700 1.00 29.38 N ATOM 702 N ARG A 112 32.136 -1.194 5.227 1.00 21.70 N ATOM 703 CA ARG A 112 31.707 -2.416 5.909 1.00 24.19 C ATOM 704 C ARG A 112 32.762 -2.841 6.919 1.00 24.80 C ATOM 705 O ARG A 112 32.470 -3.067 8.095 1.00 27.30 O ATOM 706 CB ARG A 112 31.553 -3.568 4.910 1.00 25.68 C ATOM 707 CG ARG A 112 30.152 -3.898 4.497 1.00 28.33 C ATOM 708 CD ARG A 112 30.063 -5.362 4.063 1.00 29.54 C ATOM 709 NE ARG A 112 30.989 -5.701 2.983 1.00 27.50 N ATOM 710 CZ ARG A 112 30.916 -5.210 1.747 1.00 29.72 C ATOM 711 NH1 ARG A 112 29.959 -4.350 1.426 1.00 27.23 N ATOM 712 NH2 ARG A 112 31.798 -5.587 0.825 1.00 27.18 N ATOM 713 N THR A 113 33.991 -2.965 6.431 1.00 25.27 N ATOM 714 CA THR A 113 35.123 -3.388 7.249 1.00 25.30 C ATOM 715 C THR A 113 35.330 -2.527 8.493 1.00 27.27 C ATOM 716 O THR A 113 35.275 -3.027 9.616 1.00 26.83 O ATOM 717 CB THR A 113 36.429 -3.384 6.421 1.00 25.46 C ATOM 718 OG1 THR A 113 36.270 -4.226 5.269 1.00 24.87 O ATOM 719 CG2 THR A 113 37.592 -3.893 7.252 1.00 24.45 C ATOM 720 N VAL A 114 35.558 -1.232 8.296 1.00 27.33 N ATOM 721 CA VAL A 114 35.801 -0.337 9.417 1.00 26.49 C ATOM 722 C VAL A 114 34.619 -0.139 10.363 1.00 27.64 C ATOM 723 O VAL A 114 34.807 -0.088 11.576 1.00 28.40 O ATOM 724 CB VAL A 114 36.285 1.031 8.927 1.00 26.81 C ATOM 725 CG1 VAL A 114 36.644 1.922 10.116 1.00 26.32 C ATOM 726 CG2 VAL A 114 37.486 0.842 8.017 1.00 27.60 C ATOM 727 N GLN A 115 33.407 -0.027 9.828 1.00 27.25 N ATOM 728 CA GLN A 115 32.242 0.166 10.688 1.00 27.49 C ATOM 729 C GLN A 115 32.058 -0.942 11.723 1.00 28.85 C ATOM 730 O GLN A 115 31.705 -0.673 12.873 1.00 28.68 O ATOM 731 CB GLN A 115 30.951 0.248 9.868 1.00 25.93 C ATOM 732 CG GLN A 115 30.723 1.546 9.115 1.00 25.91 C ATOM 733 CD GLN A 115 29.310 1.625 8.556 1.00 28.52 C ATOM 734 OE1 GLN A 115 28.848 0.703 7.886 1.00 26.84 O ATOM 735 NE2 GLN A 115 28.614 2.727 8.839 1.00 29.01 N ATOM 736 N ASN A 116 32.293 -2.183 11.306 1.00 27.49 N ATOM 737 CA ASN A 116 32.095 -3.335 12.176 1.00 29.49 C ATOM 738 C ASN A 116 33.370 -3.968 12.711 1.00 28.60 C ATOM 739 O ASN A 116 33.338 -5.087 13.215 1.00 27.35 O ATOM 740 CB ASN A 116 31.275 -4.387 11.427 1.00 30.38 C ATOM 741 CG ASN A 116 30.073 -3.784 10.726 1.00 33.14 C ATOM 742 OD1 ASN A 116 29.131 -3.327 11.371 1.00 34.07 O ATOM 743 ND2 ASN A 116 30.111 -3.762 9.397 1.00 33.88 N ATOM 744 N ASN A 117 34.489 -3.261 12.591 1.00 29.29 N ATOM 745 CA ASN A 117 35.760 -3.770 13.086 1.00 30.36 C ATOM 746 C ASN A 117 36.022 -5.188 12.570 1.00 32.32 C ATOM 747 O ASN A 117 36.467 -6.062 13.321 1.00 31.15 O ATOM 748 CB ASN A 117 35.740 -3.772 14.619 1.00 29.86 C ATOM 749 CG ASN A 117 37.117 -3.948 15.226 1.00 30.29 C ATOM 750 OD1 ASN A 117 37.250 -4.091 16.443 1.00 35.02 O ATOM 751 ND2 ASN A 117 38.150 -3.927 14.390 1.00 27.71 N ATOM 752 N LYS A 118 35.740 -5.414 11.288 1.00 34.68 N ATOM 753 CA LYS A 118 35.948 -6.728 10.683 1.00 36.71 C ATOM 754 C LYS A 118 37.423 -7.094 10.705 1.00 37.31 C ATOM 755 O LYS A 118 38.281 -6.255 10.428 1.00 37.59 O ATOM 756 CB LYS A 118 35.448 -6.742 9.234 1.00 38.47 C ATOM 757 CG LYS A 118 33.963 -6.451 9.069 1.00 40.33 C ATOM 758 CD LYS A 118 33.097 -7.515 9.719 1.00 43.43 C ATOM 759 CE LYS A 118 31.620 -7.212 9.523 1.00 45.34 C ATOM 760 NZ LYS A 118 31.292 -7.017 8.078 1.00 48.87 N ATOM 761 N ARG A 119 37.712 -8.348 11.035 1.00 38.82 N ATOM 762 CA ARG A 119 39.086 -8.839 11.088 1.00 41.80 C ATOM 763 C ARG A 119 39.230 -10.019 10.137 1.00 42.42 C ATOM 764 O ARG A 119 38.618 -11.067 10.341 1.00 44.49 O ATOM 765 CB ARG A 119 39.433 -9.274 12.512 1.00 42.40 C ATOM 766 CG ARG A 119 39.346 -8.145 13.527 1.00 46.94 C ATOM 767 CD ARG A 119 40.500 -7.166 13.374 1.00 49.68 C ATOM 768 NE ARG A 119 40.285 -5.944 14.147 1.00 51.67 N ATOM 769 CZ ARG A 119 41.262 -5.184 14.630 1.00 52.34 C ATOM 770 NH1 ARG A 119 42.530 -5.520 14.426 1.00 52.45 N ATOM 771 NH2 ARG A 119 40.973 -4.085 15.316 1.00 52.54 N ATOM 772 N TYR A 120 40.038 -9.847 9.097 1.00 42.59 N ATOM 773 CA TYR A 120 40.235 -10.904 8.112 1.00 42.14 C ATOM 774 C TYR A 120 41.568 -11.612 8.295 1.00 43.42 C ATOM 775 O TYR A 120 42.454 -11.122 8.997 1.00 42.33 O ATOM 776 CB TYR A 120 40.169 -10.328 6.695 1.00 39.27 C ATOM 777 CG TYR A 120 38.983 -9.430 6.449 1.00 35.37 C ATOM 778 CD1 TYR A 120 39.158 -8.066 6.201 1.00 33.57 C ATOM 779 CD2 TYR A 120 37.686 -9.937 6.465 1.00 33.48 C ATOM 780 CE1 TYR A 120 38.068 -7.229 5.973 1.00 31.43 C ATOM 781 CE2 TYR A 120 36.587 -9.107 6.240 1.00 32.66 C ATOM 782 CZ TYR A 120 36.787 -7.755 5.993 1.00 30.84 C ATOM 783 OH TYR A 120 35.705 -6.933 5.763 1.00 30.18 O ATOM 784 N THR A 121 41.697 -12.768 7.651 1.00 45.40 N ATOM 785 CA THR A 121 42.920 -13.558 7.708 1.00 47.90 C ATOM 786 C THR A 121 43.245 -14.130 6.330 1.00 49.53 C ATOM 787 O THR A 121 42.405 -14.774 5.698 1.00 49.13 O ATOM 788 CB THR A 121 42.794 -14.725 8.710 1.00 47.81 C ATOM 789 OG1 THR A 121 41.709 -15.576 8.323 1.00 47.51 O ATOM 790 CG2 THR A 121 42.544 -14.199 10.113 1.00 47.77 C ATOM 791 N CYS A 122 44.466 -13.880 5.868 1.00 51.91 N ATOM 792 CA CYS A 122 44.917 -14.375 4.574 1.00 54.22 C ATOM 793 C CYS A 122 45.435 -15.793 4.730 1.00 56.58 C ATOM 794 O CYS A 122 46.190 -16.082 5.657 1.00 57.12 O ATOM 795 CB CYS A 122 46.037 -13.491 4.021 1.00 52.75 C ATOM 796 SG CYS A 122 46.942 -14.227 2.633 1.00 51.24 S ATOM 797 N ILE A 123 45.028 -16.674 3.824 1.00 59.35 N ATOM 798 CA ILE A 123 45.468 -18.062 3.868 1.00 62.35 C ATOM 799 C ILE A 123 46.793 -18.202 3.128 1.00 63.14 C ATOM 800 O ILE A 123 47.532 -19.164 3.332 1.00 63.71 O ATOM 801 CB ILE A 123 44.424 -19.006 3.230 1.00 63.56 C ATOM 802 CG1 ILE A 123 43.108 -18.929 4.012 1.00 64.13 C ATOM 803 CG2 ILE A 123 44.945 -20.437 3.230 1.00 64.54 C ATOM 804 CD1 ILE A 123 42.031 -19.872 3.504 1.00 65.43 C ATOM 805 N GLU A 124 47.091 -17.231 2.272 1.00 64.18 N ATOM 806 CA GLU A 124 48.332 -17.250 1.513 1.00 65.32 C ATOM 807 C GLU A 124 49.441 -16.619 2.348 1.00 65.90 C ATOM 808 O GLU A 124 49.601 -16.950 3.520 1.00 66.34 O ATOM 809 CB GLU A 124 48.164 -16.490 0.195 0.33 65.39 C ATOM 810 CG GLU A 124 48.618 -17.279 -1.021 0.33 65.86 C ATOM 811 CD GLU A 124 50.063 -17.723 -0.921 0.33 66.08 C ATOM 812 OE1 GLU A 124 50.954 -16.849 -0.908 0.33 66.36 O ATOM 813 OE2 GLU A 124 50.309 -18.946 -0.852 0.33 66.33 O ATOM 814 N ASN A 125 50.199 -15.704 1.753 1.00 66.51 N ATOM 815 CA ASN A 125 51.290 -15.058 2.470 1.00 66.21 C ATOM 816 C ASN A 125 51.082 -13.562 2.668 1.00 65.74 C ATOM 817 O ASN A 125 52.034 -12.781 2.630 1.00 65.54 O ATOM 818 CB ASN A 125 52.610 -15.313 1.742 1.00 67.67 C ATOM 819 CG ASN A 125 52.940 -16.789 1.644 1.00 68.66 C ATOM 820 OD1 ASN A 125 53.005 -17.488 2.655 1.00 69.60 O ATOM 821 ND2 ASN A 125 53.148 -17.271 0.423 1.00 69.16 N ATOM 822 N GLN A 126 49.830 -13.173 2.885 1.00 65.06 N ATOM 823 CA GLN A 126 49.475 -11.775 3.107 1.00 64.43 C ATOM 824 C GLN A 126 50.066 -10.832 2.059 1.00 63.87 C ATOM 825 O GLN A 126 50.509 -9.731 2.385 1.00 63.30 O ATOM 826 CB GLN A 126 49.929 -11.339 4.504 0.33 64.03 C ATOM 827 CG GLN A 126 49.371 -12.195 5.630 0.33 63.91 C ATOM 828 CD GLN A 126 49.802 -11.712 7.001 0.33 63.58 C ATOM 829 OE1 GLN A 126 50.993 -11.607 7.289 0.33 63.79 O ATOM 830 NE2 GLN A 126 48.831 -11.419 7.857 0.33 63.54 N ATOM 831 N ASN A 127 50.068 -11.268 0.801 1.00 63.39 N ATOM 832 CA ASN A 127 50.599 -10.452 -0.290 1.00 62.33 C ATOM 833 C ASN A 127 49.878 -10.772 -1.597 1.00 60.11 C ATOM 834 O ASN A 127 50.424 -10.581 -2.686 1.00 60.21 O ATOM 835 CB ASN A 127 52.101 -10.700 -0.458 1.00 64.38 C ATOM 836 CG ASN A 127 52.402 -12.055 -1.069 1.00 65.83 C ATOM 837 OD1 ASN A 127 51.937 -13.089 -0.582 1.00 66.45 O ATOM 838 ND2 ASN A 127 53.185 -12.056 -2.143 1.00 66.40 N ATOM 839 N CYS A 128 48.650 -11.265 -1.480 1.00 57.09 N ATOM 840 CA CYS A 128 47.849 -11.610 -2.647 1.00 54.47 C ATOM 841 C CYS A 128 47.651 -10.400 -3.560 1.00 51.67 C ATOM 842 O CYS A 128 47.528 -9.268 -3.091 1.00 51.49 O ATOM 843 CB CYS A 128 46.478 -12.146 -2.209 1.00 55.43 C ATOM 844 SG CYS A 128 46.512 -13.705 -1.270 1.00 55.17 S ATOM 845 N GLN A 129 47.630 -10.650 -4.866 1.00 48.37 N ATOM 846 CA GLN A 129 47.429 -9.594 -5.847 0.33 44.21 C ATOM 847 C GLN A 129 45.942 -9.278 -5.912 1.00 41.66 C ATOM 848 O GLN A 129 45.109 -10.182 -5.949 1.00 42.56 O ATOM 849 CB GLN A 129 47.922 -10.048 -7.223 0.33 44.53 C ATOM 850 CG GLN A 129 49.425 -10.251 -7.306 0.33 44.25 C ATOM 851 CD GLN A 129 50.195 -8.974 -7.035 0.33 44.45 C ATOM 852 OE1 GLN A 129 50.038 -7.979 -7.742 0.33 44.32 O ATOM 853 NE2 GLN A 129 51.033 -8.995 -6.005 0.33 44.51 N ATOM 854 N ILE A 130 45.606 -7.994 -5.912 1.00 37.56 N ATOM 855 CA ILE A 130 44.209 -7.590 -5.972 1.00 33.49 C ATOM 856 C ILE A 130 43.848 -7.018 -7.339 1.00 32.25 C ATOM 857 O ILE A 130 44.542 -6.147 -7.864 1.00 30.78 O ATOM 858 CB ILE A 130 43.882 -6.509 -4.916 1.00 31.11 C ATOM 859 CG1 ILE A 130 44.216 -7.014 -3.506 1.00 29.91 C ATOM 860 CG2 ILE A 130 42.416 -6.099 -5.037 1.00 29.23 C ATOM 861 CD1 ILE A 130 43.392 -8.206 -3.037 1.00 27.11 C ATOM 862 N ASP A 131 42.766 -7.523 -7.917 1.00 30.65 N ATOM 863 CA ASP A 131 42.279 -7.027 -9.199 1.00 29.78 C ATOM 864 C ASP A 131 40.763 -7.165 -9.214 1.00 29.11 C ATOM 865 O ASP A 131 40.176 -7.754 -8.300 1.00 27.07 O ATOM 866 CB ASP A 131 42.909 -7.778 -10.379 1.00 31.73 C ATOM 867 CG ASP A 131 42.666 -9.271 -10.333 1.00 35.62 C ATOM 868 OD1 ASP A 131 41.508 -9.699 -10.115 1.00 37.81 O ATOM 869 OD2 ASP A 131 43.643 -10.022 -10.539 1.00 37.80 O ATOM 870 N LYS A 132 40.127 -6.618 -10.242 1.00 27.11 N ATOM 871 CA LYS A 132 38.679 -6.663 -10.327 1.00 26.49 C ATOM 872 C LYS A 132 38.093 -8.059 -10.149 1.00 26.17 C ATOM 873 O LYS A 132 37.081 -8.217 -9.478 1.00 25.22 O ATOM 874 CB LYS A 132 38.206 -6.060 -11.656 1.00 27.57 C ATOM 875 CG LYS A 132 36.696 -5.891 -11.738 1.00 28.48 C ATOM 876 CD LYS A 132 36.256 -4.980 -12.890 1.00 28.29 C ATOM 877 CE LYS A 132 34.729 -4.836 -12.898 1.00 29.36 C ATOM 878 NZ LYS A 132 34.205 -3.891 -13.925 1.00 29.30 N ATOM 879 N THR A 133 38.731 -9.073 -10.730 1.00 27.10 N ATOM 880 CA THR A 133 38.219 -10.436 -10.625 1.00 27.73 C ATOM 881 C THR A 133 38.710 -11.240 -9.424 1.00 28.35 C ATOM 882 O THR A 133 38.264 -12.367 -9.225 1.00 27.40 O ATOM 883 CB THR A 133 38.524 -11.261 -11.910 1.00 28.72 C ATOM 884 OG1 THR A 133 39.944 -11.356 -12.101 1.00 28.95 O ATOM 885 CG2 THR A 133 37.888 -10.602 -13.132 1.00 29.16 C ATOM 886 N GLN A 134 39.617 -10.680 -8.625 1.00 30.84 N ATOM 887 CA GLN A 134 40.128 -11.403 -7.455 1.00 33.90 C ATOM 888 C GLN A 134 39.926 -10.693 -6.116 1.00 33.41 C ATOM 889 O GLN A 134 40.102 -11.298 -5.058 1.00 34.35 O ATOM 890 CB GLN A 134 41.621 -11.700 -7.622 1.00 35.80 C ATOM 891 CG GLN A 134 41.954 -12.569 -8.816 1.00 42.77 C ATOM 892 CD GLN A 134 43.399 -13.026 -8.806 1.00 46.44 C ATOM 893 OE1 GLN A 134 43.821 -13.764 -7.913 1.00 49.39 O ATOM 894 NE2 GLN A 134 44.169 -12.587 -9.797 1.00 45.41 N ATOM 895 N ARG A 135 39.557 -9.418 -6.160 1.00 32.50 N ATOM 896 CA ARG A 135 39.372 -8.633 -4.944 1.00 32.95 C ATOM 897 C ARG A 135 38.477 -9.328 -3.921 1.00 34.73 C ATOM 898 O ARG A 135 38.620 -9.131 -2.716 1.00 35.29 O ATOM 899 CB ARG A 135 38.796 -7.252 -5.294 1.00 32.03 C ATOM 900 CG ARG A 135 37.381 -7.286 -5.851 1.00 29.09 C ATOM 901 CD ARG A 135 36.972 -5.943 -6.454 1.00 25.60 C ATOM 902 NE ARG A 135 35.590 -5.980 -6.925 1.00 22.48 N ATOM 903 CZ ARG A 135 35.048 -5.095 -7.756 1.00 20.00 C ATOM 904 NH1 ARG A 135 35.768 -4.085 -8.226 1.00 17.78 N ATOM 905 NH2 ARG A 135 33.776 -5.222 -8.113 1.00 18.95 N ATOM 906 N LYS A 136 37.565 -10.156 -4.406 1.00 35.12 N ATOM 907 CA LYS A 136 36.637 -10.864 -3.541 1.00 37.81 C ATOM 908 C LYS A 136 37.235 -12.135 -2.920 1.00 39.02 C ATOM 909 O LYS A 136 36.696 -12.677 -1.949 1.00 39.65 O ATOM 910 CB LYS A 136 35.385 -11.195 -4.353 1.00 39.84 C ATOM 911 CG LYS A 136 34.221 -11.720 -3.558 1.00 43.08 C ATOM 912 CD LYS A 136 32.931 -11.512 -4.332 1.00 44.55 C ATOM 913 CE LYS A 136 32.980 -12.183 -5.693 1.00 45.98 C ATOM 914 NZ LYS A 136 31.775 -11.852 -6.499 1.00 49.46 N ATOM 915 N ARG A 137 38.360 -12.590 -3.469 1.00 37.46 N ATOM 916 CA ARG A 137 39.027 -13.798 -2.994 1.00 38.37 C ATOM 917 C ARG A 137 39.683 -13.656 -1.624 1.00 38.33 C ATOM 918 O ARG A 137 39.611 -14.572 -0.799 1.00 38.19 O ATOM 919 CB ARG A 137 40.075 -14.258 -4.013 0.33 38.37 C ATOM 920 CG ARG A 137 39.494 -14.661 -5.358 0.33 40.14 C ATOM 921 CD ARG A 137 38.510 -15.811 -5.210 0.33 41.35 C ATOM 922 NE ARG A 137 37.907 -16.184 -6.486 0.33 43.07 N ATOM 923 CZ ARG A 137 37.032 -17.174 -6.638 0.33 43.47 C ATOM 924 NH1 ARG A 137 36.654 -17.896 -5.591 0.33 43.94 N ATOM 925 NH2 ARG A 137 36.534 -17.442 -7.838 0.33 43.88 N ATOM 926 N CYS A 138 40.341 -12.528 -1.377 1.00 35.92 N ATOM 927 CA CYS A 138 40.976 -12.341 -0.081 1.00 35.94 C ATOM 928 C CYS A 138 40.722 -10.967 0.524 1.00 34.88 C ATOM 929 O CYS A 138 41.426 -10.005 0.225 1.00 34.60 O ATOM 930 CB CYS A 138 42.486 -12.584 -0.170 1.00 33.40 C ATOM 931 SG CYS A 138 43.306 -12.426 1.444 1.00 37.62 S ATOM 932 N PRO A 139 39.705 -10.859 1.389 1.00 34.48 N ATOM 933 CA PRO A 139 39.420 -9.561 2.005 1.00 33.64 C ATOM 934 C PRO A 139 40.600 -9.037 2.817 1.00 33.07 C ATOM 935 O PRO A 139 40.812 -7.827 2.895 1.00 32.32 O ATOM 936 CB PRO A 139 38.176 -9.838 2.856 1.00 33.37 C ATOM 937 CG PRO A 139 38.231 -11.332 3.088 1.00 35.94 C ATOM 938 CD PRO A 139 38.701 -11.863 1.772 1.00 33.14 C ATOM 939 N TYR A 140 41.376 -9.942 3.411 1.00 33.08 N ATOM 940 CA TYR A 140 42.529 -9.517 4.201 1.00 33.41 C ATOM 941 C TYR A 140 43.471 -8.669 3.351 1.00 30.60 C ATOM 942 O TYR A 140 43.791 -7.537 3.705 1.00 28.44 O ATOM 943 CB TYR A 140 43.309 -10.718 4.754 1.00 37.07 C ATOM 944 CG TYR A 140 44.557 -10.293 5.503 1.00 39.70 C ATOM 945 CD1 TYR A 140 44.490 -9.868 6.833 1.00 40.58 C ATOM 946 CD2 TYR A 140 45.792 -10.230 4.854 1.00 41.22 C ATOM 947 CE1 TYR A 140 45.620 -9.383 7.496 1.00 42.16 C ATOM 948 CE2 TYR A 140 46.928 -9.747 5.504 1.00 42.81 C ATOM 949 CZ TYR A 140 46.836 -9.322 6.822 1.00 44.56 C ATOM 950 OH TYR A 140 47.955 -8.817 7.450 1.00 44.82 O ATOM 951 N CYS A 141 43.922 -9.215 2.229 1.00 29.63 N ATOM 952 CA CYS A 141 44.821 -8.461 1.368 1.00 30.80 C ATOM 953 C CYS A 141 44.119 -7.285 0.706 1.00 28.15 C ATOM 954 O CYS A 141 44.750 -6.276 0.413 1.00 30.23 O ATOM 955 CB CYS A 141 45.450 -9.369 0.308 1.00 32.66 C ATOM 956 SG CYS A 141 46.990 -10.145 0.875 1.00 41.17 S ATOM 957 N ARG A 142 42.816 -7.396 0.473 1.00 25.65 N ATOM 958 CA ARG A 142 42.112 -6.281 -0.145 1.00 25.43 C ATOM 959 C ARG A 142 42.160 -5.117 0.842 1.00 26.04 C ATOM 960 O ARG A 142 42.472 -3.980 0.469 1.00 24.51 O ATOM 961 CB ARG A 142 40.662 -6.655 -0.462 1.00 24.42 C ATOM 962 CG ARG A 142 39.893 -5.566 -1.210 1.00 24.18 C ATOM 963 CD ARG A 142 38.444 -5.968 -1.425 1.00 23.71 C ATOM 964 NE ARG A 142 37.704 -5.014 -2.248 1.00 25.84 N ATOM 965 CZ ARG A 142 36.495 -5.255 -2.747 1.00 27.41 C ATOM 966 NH1 ARG A 142 35.901 -6.419 -2.502 1.00 26.39 N ATOM 967 NH2 ARG A 142 35.878 -4.345 -3.492 1.00 24.96 N ATOM 968 N PHE A 143 41.880 -5.412 2.110 1.00 26.80 N ATOM 969 CA PHE A 143 41.898 -4.385 3.151 1.00 28.51 C ATOM 970 C PHE A 143 43.304 -3.814 3.388 1.00 28.82 C ATOM 971 O PHE A 143 43.455 -2.609 3.626 1.00 25.65 O ATOM 972 CB PHE A 143 41.339 -4.935 4.465 1.00 27.88 C ATOM 973 CG PHE A 143 41.098 -3.874 5.502 1.00 32.35 C ATOM 974 CD1 PHE A 143 40.280 -2.783 5.220 1.00 30.91 C ATOM 975 CD2 PHE A 143 41.691 -3.958 6.758 1.00 33.05 C ATOM 976 CE1 PHE A 143 40.054 -1.788 6.172 1.00 32.43 C ATOM 977 CE2 PHE A 143 41.472 -2.968 7.720 1.00 33.80 C ATOM 978 CZ PHE A 143 40.651 -1.881 7.424 1.00 33.16 C ATOM 979 N GLN A 144 44.327 -4.669 3.331 1.00 28.41 N ATOM 980 CA GLN A 144 45.698 -4.186 3.516 1.00 30.48 C ATOM 981 C GLN A 144 45.994 -3.182 2.401 1.00 28.18 C ATOM 982 O GLN A 144 46.586 -2.127 2.630 1.00 27.83 O ATOM 983 CB GLN A 144 46.723 -5.327 3.427 1.00 32.44 C ATOM 984 CG GLN A 144 46.458 -6.534 4.317 1.00 40.34 C ATOM 985 CD GLN A 144 46.246 -6.171 5.777 1.00 44.56 C ATOM 986 OE1 GLN A 144 47.076 -5.496 6.394 1.00 46.33 O ATOM 987 NE2 GLN A 144 45.126 -6.626 6.341 1.00 45.42 N ATOM 988 N LYS A 145 45.577 -3.515 1.184 1.00 27.47 N ATOM 989 CA LYS A 145 45.818 -2.627 0.053 1.00 26.33 C ATOM 990 C LYS A 145 45.056 -1.312 0.233 1.00 26.24 C ATOM 991 O LYS A 145 45.600 -0.233 -0.043 1.00 26.24 O ATOM 992 CB LYS A 145 45.423 -3.312 -1.260 1.00 26.95 C ATOM 993 CG LYS A 145 45.947 -2.600 -2.508 1.00 30.15 C ATOM 994 CD LYS A 145 45.878 -3.495 -3.742 1.00 29.99 C ATOM 995 CE LYS A 145 46.370 -2.751 -4.990 1.00 31.49 C ATOM 996 NZ LYS A 145 46.240 -3.580 -6.228 1.00 29.64 N ATOM 997 N CYS A 146 43.812 -1.393 0.707 1.00 25.01 N ATOM 998 CA CYS A 146 43.020 -0.181 0.933 1.00 25.67 C ATOM 999 C CYS A 146 43.793 0.776 1.828 1.00 25.71 C ATOM 1000 O CYS A 146 43.871 1.972 1.556 1.00 25.71 O ATOM 1001 CB CYS A 146 41.681 -0.506 1.602 1.00 25.14 C ATOM 1002 SG CYS A 146 40.398 -1.160 0.515 1.00 27.99 S ATOM 1003 N LEU A 147 44.365 0.241 2.901 1.00 27.53 N ATOM 1004 CA LEU A 147 45.129 1.058 3.838 1.00 29.80 C ATOM 1005 C LEU A 147 46.420 1.535 3.193 1.00 30.26 C ATOM 1006 O LEU A 147 46.801 2.699 3.318 1.00 31.30 O ATOM 1007 CB LEU A 147 45.439 0.253 5.110 1.00 29.10 C ATOM 1008 CG LEU A 147 44.224 -0.013 6.007 1.00 29.48 C ATOM 1009 CD1 LEU A 147 44.600 -0.946 7.139 1.00 30.82 C ATOM 1010 CD2 LEU A 147 43.700 1.307 6.547 1.00 28.87 C ATOM 1011 N SER A 148 47.080 0.624 2.493 1.00 31.37 N ATOM 1012 CA SER A 148 48.329 0.932 1.819 1.00 33.87 C ATOM 1013 C SER A 148 48.199 2.108 0.858 1.00 33.78 C ATOM 1014 O SER A 148 49.009 3.036 0.892 1.00 34.49 O ATOM 1015 CB SER A 148 48.817 -0.295 1.052 1.00 34.88 C ATOM 1016 OG SER A 148 49.905 0.046 0.218 1.00 40.94 O ATOM 1017 N VAL A 149 47.176 2.077 0.008 1.00 32.57 N ATOM 1018 CA VAL A 149 46.983 3.146 -0.970 1.00 30.76 C ATOM 1019 C VAL A 149 46.542 4.471 -0.363 1.00 30.60 C ATOM 1020 O VAL A 149 46.514 5.489 -1.052 1.00 31.68 O ATOM 1021 CB VAL A 149 45.967 2.746 -2.060 1.00 30.51 C ATOM 1022 CG1 VAL A 149 46.483 1.537 -2.835 1.00 27.64 C ATOM 1023 CG2 VAL A 149 44.614 2.454 -1.432 1.00 29.99 C ATOM 1024 N GLY A 150 46.177 4.466 0.915 1.00 29.02 N ATOM 1025 CA GLY A 150 45.781 5.711 1.547 1.00 27.47 C ATOM 1026 C GLY A 150 44.348 5.904 2.021 1.00 27.01 C ATOM 1027 O GLY A 150 44.007 7.000 2.458 1.00 26.81 O ATOM 1028 N MET A 151 43.497 4.885 1.941 1.00 25.16 N ATOM 1029 CA MET A 151 42.127 5.065 2.415 1.00 26.27 C ATOM 1030 C MET A 151 42.159 5.363 3.913 1.00 25.73 C ATOM 1031 O MET A 151 42.860 4.701 4.675 1.00 26.61 O ATOM 1032 CB MET A 151 41.284 3.835 2.083 1.00 25.39 C ATOM 1033 CG MET A 151 40.950 3.782 0.595 1.00 24.11 C ATOM 1034 SD MET A 151 39.952 2.386 0.072 1.00 25.85 S ATOM 1035 CE MET A 151 38.286 2.999 0.420 1.00 19.34 C ATOM 1036 N LYS A 152 41.400 6.372 4.324 1.00 26.10 N ATOM 1037 CA LYS A 152 41.404 6.822 5.711 1.00 27.64 C ATOM 1038 C LYS A 152 40.333 6.324 6.672 1.00 25.04 C ATOM 1039 O LYS A 152 39.135 6.484 6.446 1.00 23.49 O ATOM 1040 CB LYS A 152 41.424 8.351 5.718 1.00 29.15 C ATOM 1041 CG LYS A 152 42.566 8.918 4.883 1.00 33.69 C ATOM 1042 CD LYS A 152 42.488 10.422 4.766 1.00 36.74 C ATOM 1043 CE LYS A 152 43.619 10.976 3.912 1.00 39.14 C ATOM 1044 NZ LYS A 152 44.960 10.551 4.424 1.00 39.58 N ATOM 1045 N LEU A 153 40.793 5.735 7.766 1.00 25.02 N ATOM 1046 CA LEU A 153 39.905 5.228 8.800 1.00 26.95 C ATOM 1047 C LEU A 153 39.081 6.363 9.409 1.00 25.77 C ATOM 1048 O LEU A 153 37.926 6.163 9.783 1.00 26.01 O ATOM 1049 CB LEU A 153 40.723 4.537 9.894 1.00 29.13 C ATOM 1050 CG LEU A 153 41.503 3.285 9.476 1.00 30.42 C ATOM 1051 CD1 LEU A 153 42.526 2.940 10.544 1.00 30.41 C ATOM 1052 CD2 LEU A 153 40.540 2.125 9.243 1.00 30.51 C ATOM 1053 N GLU A 154 39.668 7.556 9.490 1.00 26.33 N ATOM 1054 CA GLU A 154 38.974 8.705 10.070 1.00 28.42 C ATOM 1055 C GLU A 154 37.809 9.210 9.229 1.00 27.43 C ATOM 1056 O GLU A 154 37.005 10.009 9.713 1.00 28.70 O ATOM 1057 CB GLU A 154 39.943 9.867 10.314 1.00 29.13 C ATOM 1058 CG GLU A 154 41.325 9.434 10.741 1.00 35.57 C ATOM 1059 CD GLU A 154 42.237 9.170 9.556 1.00 39.22 C ATOM 1060 OE1 GLU A 154 42.924 10.120 9.118 1.00 41.49 O ATOM 1061 OE2 GLU A 154 42.254 8.022 9.056 1.00 38.52 O ATOM 1062 N ALA A 155 37.719 8.770 7.976 1.00 26.17 N ATOM 1063 CA ALA A 155 36.615 9.202 7.111 1.00 25.94 C ATOM 1064 C ALA A 155 35.360 8.362 7.382 1.00 23.81 C ATOM 1065 O ALA A 155 34.261 8.716 6.953 1.00 23.84 O ATOM 1066 CB ALA A 155 37.016 9.106 5.641 1.00 27.06 C ATOM 1067 N VAL A 156 35.533 7.244 8.085 1.00 22.03 N ATOM 1068 CA VAL A 156 34.409 6.377 8.463 1.00 20.58 C ATOM 1069 C VAL A 156 33.915 6.983 9.777 1.00 21.62 C ATOM 1070 O VAL A 156 34.689 7.114 10.724 1.00 20.56 O ATOM 1071 CB VAL A 156 34.876 4.928 8.703 1.00 19.40 C ATOM 1072 CG1 VAL A 156 33.689 4.041 9.084 1.00 19.45 C ATOM 1073 CG2 VAL A 156 35.547 4.402 7.459 1.00 19.19 C ATOM 1074 N ARG A 157 32.640 7.367 9.826 1.00 21.69 N ATOM 1075 CA ARG A 157 32.073 8.024 11.003 1.00 24.53 C ATOM 1076 C ARG A 157 31.594 7.120 12.140 1.00 25.54 C ATOM 1077 O ARG A 157 30.721 6.267 11.958 1.00 23.25 O ATOM 1078 CB ARG A 157 30.936 8.956 10.562 1.00 24.12 C ATOM 1079 CG ARG A 157 31.367 9.950 9.477 1.00 26.15 C ATOM 1080 CD ARG A 157 30.183 10.679 8.875 1.00 26.45 C ATOM 1081 NE ARG A 157 30.587 11.548 7.777 1.00 26.63 N ATOM 1082 CZ ARG A 157 29.747 12.284 7.056 1.00 26.83 C ATOM 1083 NH1 ARG A 157 28.446 12.255 7.314 1.00 27.09 N ATOM 1084 NH2 ARG A 157 30.210 13.056 6.080 1.00 28.24 N ATOM 1085 N ALA A 158 32.173 7.337 13.319 1.00 27.76 N ATOM 1086 CA ALA A 158 31.835 6.572 14.517 1.00 28.82 C ATOM 1087 C ALA A 158 30.356 6.702 14.859 1.00 28.89 C ATOM 1088 O ALA A 158 29.699 5.714 15.172 1.00 28.86 O ATOM 1089 CB ALA A 158 32.681 7.046 15.692 1.00 28.81 C ATOM 1090 N ASP A 159 29.835 7.922 14.795 1.00 29.75 N ATOM 1091 CA ASP A 159 28.432 8.167 15.109 1.00 32.52 C ATOM 1092 C ASP A 159 27.523 7.981 13.900 1.00 32.59 C ATOM 1093 O ASP A 159 26.362 8.387 13.919 1.00 32.05 O ATOM 1094 CB ASP A 159 28.258 9.581 15.683 1.00 35.55 C ATOM 1095 CG ASP A 159 28.769 10.667 14.744 1.00 39.26 C ATOM 1096 OD1 ASP A 159 28.863 11.834 15.184 1.00 40.32 O ATOM 1097 OD2 ASP A 159 29.074 10.361 13.569 1.00 41.12 O ATOM 1098 N ARG A 160 28.059 7.365 12.849 1.00 33.18 N ATOM 1099 CA ARG A 160 27.305 7.104 11.623 1.00 32.81 C ATOM 1100 C ARG A 160 26.446 8.277 11.153 1.00 31.78 C ATOM 1101 O ARG A 160 25.376 8.081 10.582 1.00 31.22 O ATOM 1102 CB ARG A 160 26.418 5.871 11.808 1.00 33.42 C ATOM 1103 CG ARG A 160 27.179 4.579 12.059 1.00 37.91 C ATOM 1104 CD ARG A 160 26.206 3.450 12.355 1.00 41.19 C ATOM 1105 NE ARG A 160 25.348 3.800 13.483 1.00 47.42 N ATOM 1106 CZ ARG A 160 24.237 3.153 13.818 1.00 49.86 C ATOM 1107 NH1 ARG A 160 23.832 2.103 13.111 1.00 50.33 N ATOM 1108 NH2 ARG A 160 23.525 3.564 14.861 1.00 51.09 N ATOM 1109 N MET A 161 26.922 9.493 11.390 1.00 32.88 N ATOM 1110 CA MET A 161 26.207 10.697 10.977 1.00 34.20 C ATOM 1111 C MET A 161 26.009 10.679 9.455 1.00 33.33 C ATOM 1112 O MET A 161 26.873 10.206 8.713 1.00 30.46 O ATOM 1113 CB MET A 161 27.009 11.930 11.391 1.00 37.21 C ATOM 1114 CG MET A 161 26.205 13.209 11.474 1.00 43.69 C ATOM 1115 SD MET A 161 27.264 14.590 11.946 1.00 51.37 S ATOM 1116 CE MET A 161 27.649 14.158 13.656 1.00 47.59 C ATOM 1117 N ARG A 162 24.874 11.200 9.001 1.00 33.59 N ATOM 1118 CA ARG A 162 24.543 11.223 7.578 1.00 34.51 C ATOM 1119 C ARG A 162 24.898 12.537 6.894 1.00 34.65 C ATOM 1120 O ARG A 162 25.031 13.576 7.541 1.00 35.81 O ATOM 1121 CB ARG A 162 23.046 10.970 7.389 1.00 35.96 C ATOM 1122 CG ARG A 162 22.533 9.701 8.044 1.00 38.93 C ATOM 1123 CD ARG A 162 23.022 8.451 7.326 1.00 41.90 C ATOM 1124 NE ARG A 162 22.034 7.924 6.385 1.00 45.47 N ATOM 1125 CZ ARG A 162 21.884 8.335 5.131 1.00 45.23 C ATOM 1126 NH1 ARG A 162 22.664 9.288 4.643 1.00 47.29 N ATOM 1127 NH2 ARG A 162 20.948 7.790 4.365 1.00 45.32 N ATOM 1128 N GLY A 163 25.048 12.470 5.574 1.00 33.65 N ATOM 1129 CA GLY A 163 25.341 13.643 4.768 1.00 33.10 C ATOM 1130 C GLY A 163 26.439 14.596 5.195 1.00 31.20 C ATOM 1131 O GLY A 163 27.455 14.194 5.761 1.00 32.35 O ATOM 1132 N GLY A 164 26.231 15.874 4.899 1.00 31.77 N ATOM 1133 CA GLY A 164 27.214 16.888 5.236 1.00 30.83 C ATOM 1134 C GLY A 164 28.512 16.731 4.462 1.00 30.85 C ATOM 1135 O GLY A 164 28.519 16.270 3.320 1.00 31.61 O ATOM 1136 N ARG A 165 29.617 17.098 5.096 1.00 30.33 N ATOM 1137 CA ARG A 165 30.931 17.019 4.472 1.00 32.58 C ATOM 1138 C ARG A 165 31.961 16.932 5.589 1.00 32.57 C ATOM 1139 O ARG A 165 31.883 17.692 6.552 1.00 31.99 O ATOM 1140 CB ARG A 165 31.180 18.286 3.651 1.00 33.92 C ATOM 1141 CG ARG A 165 32.333 18.203 2.665 1.00 37.82 C ATOM 1142 CD ARG A 165 31.801 18.245 1.241 1.00 38.80 C ATOM 1143 NE ARG A 165 31.151 16.996 0.869 1.00 41.22 N ATOM 1144 CZ ARG A 165 30.151 16.901 -0.003 1.00 42.14 C ATOM 1145 NH1 ARG A 165 29.672 17.987 -0.594 1.00 40.07 N ATOM 1146 NH2 ARG A 165 29.640 15.712 -0.294 1.00 41.82 N ATOM 1147 N ASN A 166 32.919 16.016 5.471 1.00 33.58 N ATOM 1148 CA ASN A 166 33.938 15.876 6.506 1.00 35.20 C ATOM 1149 C ASN A 166 35.113 16.841 6.333 1.00 37.37 C ATOM 1150 O ASN A 166 35.106 17.690 5.442 1.00 36.30 O ATOM 1151 CB ASN A 166 34.449 14.427 6.586 1.00 34.33 C ATOM 1152 CG ASN A 166 35.109 13.951 5.299 1.00 35.48 C ATOM 1153 OD1 ASN A 166 35.850 14.688 4.647 1.00 33.53 O ATOM 1154 ND2 ASN A 166 34.862 12.695 4.947 1.00 33.93 N ATOM 1155 N LYS A 167 36.120 16.701 7.192 1.00 40.81 N ATOM 1156 CA LYS A 167 37.294 17.569 7.168 1.00 44.44 C ATOM 1157 C LYS A 167 38.173 17.432 5.925 1.00 46.25 C ATOM 1158 O LYS A 167 39.107 18.211 5.739 1.00 46.34 O ATOM 1159 CB LYS A 167 38.148 17.331 8.420 1.00 45.14 C ATOM 1160 CG LYS A 167 38.762 15.941 8.513 1.00 48.46 C ATOM 1161 CD LYS A 167 39.615 15.791 9.770 1.00 49.95 C ATOM 1162 CE LYS A 167 40.245 14.404 9.855 1.00 52.04 C ATOM 1163 NZ LYS A 167 41.086 14.229 11.080 1.00 51.95 N ATOM 1164 N PHE A 168 37.883 16.447 5.078 1.00 47.81 N ATOM 1165 CA PHE A 168 38.664 16.243 3.861 1.00 49.27 C ATOM 1166 C PHE A 168 38.022 16.933 2.662 1.00 49.69 C ATOM 1167 O PHE A 168 38.511 16.824 1.535 1.00 48.15 O ATOM 1168 CB PHE A 168 38.822 14.748 3.563 1.00 49.46 C ATOM 1169 CG PHE A 168 39.530 13.992 4.643 1.00 51.57 C ATOM 1170 CD1 PHE A 168 38.812 13.371 5.663 1.00 51.30 C ATOM 1171 CD2 PHE A 168 40.920 13.928 4.664 1.00 51.66 C ATOM 1172 CE1 PHE A 168 39.470 12.698 6.689 1.00 52.70 C ATOM 1173 CE2 PHE A 168 41.587 13.259 5.687 1.00 52.88 C ATOM 1174 CZ PHE A 168 40.860 12.642 6.702 1.00 52.94 C ATOM 1175 N GLY A 169 36.926 17.641 2.916 1.00 50.82 N ATOM 1176 CA GLY A 169 36.230 18.341 1.855 1.00 53.25 C ATOM 1177 C GLY A 169 37.168 19.187 1.015 1.00 54.85 C ATOM 1178 O GLY A 169 37.266 18.987 -0.197 1.00 55.17 O ATOM 1179 N PRO A 170 37.872 20.149 1.629 1.00 55.93 N ATOM 1180 CA PRO A 170 38.802 21.007 0.888 1.00 56.89 C ATOM 1181 C PRO A 170 39.883 20.214 0.154 1.00 57.80 C ATOM 1182 O PRO A 170 40.202 20.512 -0.996 1.00 57.64 O ATOM 1183 CB PRO A 170 39.374 21.909 1.977 1.00 56.59 C ATOM 1184 CG PRO A 170 38.221 22.043 2.924 1.00 56.66 C ATOM 1185 CD PRO A 170 37.718 20.621 3.017 1.00 56.24 C ATOM 1186 N MET A 171 40.442 19.208 0.823 1.00 59.12 N ATOM 1187 CA MET A 171 41.481 18.375 0.222 1.00 60.53 C ATOM 1188 C MET A 171 41.035 17.862 -1.147 1.00 60.74 C ATOM 1189 O MET A 171 41.760 17.989 -2.136 1.00 60.96 O ATOM 1190 CB MET A 171 41.805 17.182 1.129 1.00 61.87 C ATOM 1191 CG MET A 171 42.811 16.204 0.525 1.00 63.75 C ATOM 1192 SD MET A 171 42.931 14.627 1.409 1.00 67.26 S ATOM 1193 CE MET A 171 44.304 14.952 2.523 1.00 66.04 C ATOM 1194 N TYR A 172 39.840 17.278 -1.197 1.00 60.22 N ATOM 1195 CA TYR A 172 39.304 16.750 -2.446 1.00 60.05 C ATOM 1196 C TYR A 172 39.205 17.849 -3.503 1.00 61.03 C ATOM 1197 O TYR A 172 39.456 17.611 -4.685 1.00 61.63 O ATOM 1198 CB TYR A 172 37.918 16.136 -2.224 1.00 57.71 C ATOM 1199 CG TYR A 172 37.883 14.968 -1.258 1.00 55.44 C ATOM 1200 CD1 TYR A 172 38.854 13.968 -1.299 1.00 53.53 C ATOM 1201 CD2 TYR A 172 36.842 14.833 -0.339 1.00 54.48 C ATOM 1202 CE1 TYR A 172 38.786 12.861 -0.452 1.00 52.39 C ATOM 1203 CE2 TYR A 172 36.763 13.729 0.511 1.00 52.12 C ATOM 1204 CZ TYR A 172 37.736 12.747 0.448 1.00 51.80 C ATOM 1205 OH TYR A 172 37.647 11.646 1.269 1.00 47.73 O ATOM 1206 N LYS A 173 38.831 19.050 -3.071 1.00 62.23 N ATOM 1207 CA LYS A 173 38.702 20.189 -3.975 1.00 63.09 C ATOM 1208 C LYS A 173 40.063 20.518 -4.585 1.00 63.48 C ATOM 1209 O LYS A 173 40.155 20.919 -5.745 1.00 63.38 O ATOM 1210 CB LYS A 173 38.157 21.400 -3.220 1.00 61.99 C ATOM 1211 N ARG A 174 41.116 20.337 -3.794 1.00 64.62 N ATOM 1212 CA ARG A 174 42.474 20.604 -4.249 1.00 66.43 C ATOM 1213 C ARG A 174 42.942 19.515 -5.212 1.00 67.52 C ATOM 1214 O ARG A 174 43.520 19.811 -6.260 1.00 67.53 O ATOM 1215 CB ARG A 174 43.418 20.688 -3.055 1.00 66.47 C ATOM 1216 N ASP A 175 42.693 18.258 -4.853 1.00 68.63 N ATOM 1217 CA ASP A 175 43.094 17.133 -5.691 1.00 69.95 C ATOM 1218 C ASP A 175 42.429 17.220 -7.064 1.00 70.55 C ATOM 1219 O ASP A 175 43.027 16.852 -8.078 1.00 70.73 O ATOM 1220 CB ASP A 175 42.731 15.807 -5.009 1.00 70.35 C ATOM 1221 CG ASP A 175 43.209 14.592 -5.794 1.00 72.03 C ATOM 1222 OD1 ASP A 175 42.638 14.305 -6.868 1.00 72.46 O ATOM 1223 OD2 ASP A 175 44.164 13.923 -5.340 1.00 72.57 O ATOM 1224 N ARG A 176 41.196 17.716 -7.092 1.00 71.03 N ATOM 1225 CA ARG A 176 40.456 17.850 -8.342 1.00 71.69 C ATOM 1226 C ARG A 176 41.126 18.870 -9.264 1.00 72.38 C ATOM 1227 O ARG A 176 41.366 18.593 -10.441 1.00 72.49 O ATOM 1228 CB ARG A 176 39.016 18.264 -8.056 1.00 70.74 C ATOM 1229 N ALA A 177 41.428 20.046 -8.722 1.00 72.57 N ATOM 1230 CA ALA A 177 42.068 21.106 -9.493 1.00 73.23 C ATOM 1231 C ALA A 177 43.356 20.618 -10.152 1.00 73.50 C ATOM 1232 O ALA A 177 43.427 20.488 -11.377 1.00 73.32 O ATOM 1233 CB ALA A 177 42.364 22.302 -8.589 1.00 72.26 C ATOM 1234 N LEU A 178 44.368 20.352 -9.331 1.00 73.79 N ATOM 1235 CA LEU A 178 45.662 19.878 -9.813 1.00 74.06 C ATOM 1236 C LEU A 178 45.508 18.830 -10.913 1.00 74.19 C ATOM 1237 O LEU A 178 46.095 19.030 -11.998 1.00 74.68 O ATOM 1238 CB LEU A 178 46.471 19.305 -8.653 1.00 73.60 C TER 1239 LEU A 178 HETATM 1240 ZN ZN A 401 38.322 -0.951 -6.289 1.00 23.18 ZN HETATM 1241 ZN ZN A 402 45.880 -12.342 1.014 1.00 57.83 ZN HETATM 1242 C ACT A 801 43.207 -16.015 1.091 1.00 61.04 C HETATM 1243 O ACT A 801 42.372 -16.020 2.143 1.00 61.41 O HETATM 1244 OXT ACT A 801 44.189 -15.306 1.103 1.00 60.53 O HETATM 1245 CH3 ACT A 801 42.921 -16.890 -0.101 1.00 60.86 C HETATM 1246 O HOH B 1 14.204 -10.028 -9.487 1.00 50.68 O HETATM 1247 O HOH B 7 22.544 -16.169 -10.771 1.00 57.24 O HETATM 1248 O HOH B 12 29.349 13.642 2.876 1.00 27.50 O HETATM 1249 O HOH B 22 21.706 -7.627 -6.055 1.00 37.66 O HETATM 1250 O HOH B 23 29.439 8.196 -2.318 1.00 25.05 O HETATM 1251 O HOH B 28 19.234 20.515 -5.597 1.00 35.22 O HETATM 1252 O HOH B 29 25.342 9.886 4.864 1.00 37.66 O HETATM 1253 O HOH B 31 23.039 6.500 10.534 1.00 33.45 O HETATM 1254 O HOH B 32 32.445 7.885 0.154 1.00 25.54 O HETATM 1255 O HOH B 34 23.962 17.783 -7.079 1.00 52.60 O HETATM 1256 O HOH B 35 28.134 10.657 -5.330 1.00 37.10 O HETATM 1257 O HOH B 37 29.796 5.239 9.660 1.00 23.79 O HETATM 1258 O HOH B 44 25.512 -12.340 -5.456 1.00 41.61 O HETATM 1259 O HOH B 49 30.161 9.242 -4.983 1.00 29.78 O HETATM 1260 O HOH B 50 27.119 23.560 -3.542 1.00 43.65 O HETATM 1261 O HOH B 54 19.566 3.899 1.343 1.00 35.84 O HETATM 1262 O HOH B 56 25.637 1.157 10.421 1.00 37.08 O HETATM 1263 O HOH B 66 26.249 1.307 6.510 1.00 33.45 O HETATM 1264 O HOH B 74 22.431 15.285 -6.303 1.00 44.08 O HETATM 1265 O HOH B 83 31.885 13.528 3.528 1.00 28.69 O HETATM 1266 O HOH B 85 19.202 -12.478 1.855 1.00 48.87 O HETATM 1267 O HOH B 86 18.362 2.029 -1.312 1.00 48.44 O HETATM 1268 O HOH B 89 27.338 -0.050 12.210 1.00 47.65 O HETATM 1269 O HOH C 4 32.523 -4.052 -10.264 1.00 21.35 O HETATM 1270 O HOH C 18 25.176 -4.277 -6.213 1.00 47.28 O HETATM 1271 O HOH C 20 36.557 -8.614 -0.629 1.00 23.13 O HETATM 1272 O HOH C 21 17.164 9.880 -2.858 1.00 37.82 O HETATM 1273 O HOH C 25 29.414 -0.523 -2.734 1.00 35.48 O HETATM 1274 O HOH C 27 24.067 8.947 -5.141 1.00 36.33 O HETATM 1275 O HOH C 30 29.903 -2.469 -12.075 1.00 33.49 O HETATM 1276 O HOH C 36 24.290 -13.541 4.970 1.00 53.34 O HETATM 1277 O HOH C 39 22.317 -4.830 -5.552 1.00 35.48 O HETATM 1278 O HOH C 40 22.014 -2.728 -6.873 1.00 35.28 O HETATM 1279 O HOH C 43 21.258 12.783 -4.298 1.00 31.75 O HETATM 1280 O HOH C 47 15.659 11.264 6.695 1.00 63.72 O HETATM 1281 O HOH C 48 32.875 -1.008 -8.076 1.00 20.32 O HETATM 1282 O HOH C 52 24.786 -7.177 4.109 1.00 33.23 O HETATM 1283 O HOH C 61 26.242 6.256 -5.337 1.00 37.59 O HETATM 1284 O HOH C 62 29.722 21.144 -0.152 1.00 45.61 O HETATM 1285 O HOH C 63 27.440 -1.668 -13.220 1.00 48.32 O HETATM 1286 O HOH C 64 23.728 24.143 5.415 1.00 42.04 O HETATM 1287 O HOH C 67 32.684 25.827 -3.652 1.00 35.18 O HETATM 1288 O HOH C 75 25.604 3.210 -9.131 1.00 45.49 O HETATM 1289 O HOH C 76 24.175 16.315 10.491 1.00 49.31 O HETATM 1290 O HOH C 84 29.045 1.651 -9.628 1.00 47.90 O HETATM 1291 O HOH C 87 19.274 0.629 -3.638 1.00 43.25 O HETATM 1292 O HOH A 802 30.610 6.244 1.931 1.00 20.43 O HETATM 1293 O HOH A 803 33.350 11.141 7.021 1.00 23.30 O HETATM 1294 O HOH A 804 34.839 -12.435 0.121 1.00 23.76 O HETATM 1295 O HOH A 805 32.348 10.244 -3.980 1.00 24.75 O HETATM 1296 O HOH A 806 32.334 -4.382 -1.778 1.00 16.50 O HETATM 1297 O HOH A 807 44.834 3.821 -9.949 1.00 36.27 O HETATM 1298 O HOH A 808 32.860 2.210 -9.191 1.00 28.19 O HETATM 1299 O HOH A 809 46.042 6.649 -14.691 1.00 57.39 O HETATM 1300 O HOH A 810 41.427 -5.354 -12.270 1.00 29.16 O HETATM 1301 O HOH A 811 37.028 -11.778 -6.698 1.00 37.53 O HETATM 1302 O HOH A 812 47.541 -6.243 -5.735 1.00 39.81 O HETATM 1303 O HOH A 813 32.336 -1.096 -12.560 1.00 36.16 O HETATM 1304 O HOH A 814 28.324 2.206 0.270 1.00 41.96 O HETATM 1305 O HOH A 815 43.690 5.588 7.989 1.00 40.27 O HETATM 1306 O HOH A 816 43.025 7.001 -6.697 1.00 26.78 O HETATM 1307 O HOH A 817 41.103 -12.814 3.623 1.00 48.20 O HETATM 1308 O HOH A 818 45.571 4.592 4.952 1.00 38.09 O HETATM 1309 O HOH A 819 31.337 -4.074 -13.729 1.00 28.31 O HETATM 1310 O HOH A 820 34.395 9.463 13.587 1.00 22.64 O HETATM 1311 O HOH A 821 19.442 5.926 3.073 1.00 42.99 O HETATM 1312 O HOH A 822 29.245 6.837 -5.032 1.00 34.22 O HETATM 1313 O HOH A 823 47.703 -5.847 0.398 1.00 41.31 O HETATM 1314 O HOH A 824 30.947 12.402 12.167 1.00 35.22 O HETATM 1315 O HOH A 825 40.428 -5.611 9.142 1.00 40.00 O HETATM 1316 O HOH A 826 47.980 -1.230 -8.150 1.00 45.05 O HETATM 1317 O HOH A 827 30.314 -9.323 -8.716 1.00 48.52 O HETATM 1318 O HOH A 828 39.282 -13.656 5.949 1.00 45.20 O HETATM 1319 O HOH A 829 47.029 24.173 -5.285 1.00 50.47 O HETATM 1320 O HOH A 830 33.467 11.801 12.232 1.00 39.67 O HETATM 1321 O HOH A 831 43.460 -12.077 -12.288 1.00 47.18 O HETATM 1322 O HOH A 832 47.166 5.945 -3.996 1.00 45.22 O HETATM 1323 O HOH A 833 26.330 16.030 8.253 1.00 40.88 O HETATM 1324 O HOH A 834 42.344 6.832 -9.201 1.00 34.98 O HETATM 1325 O HOH A 835 41.932 -2.437 -14.521 1.00 34.36 O HETATM 1326 O HOH A 836 38.672 -3.649 11.248 1.00 31.82 O HETATM 1327 O HOH A 837 48.206 -9.490 10.006 1.00 56.58 O HETATM 1328 O HOH A 838 35.627 14.984 9.974 1.00 53.07 O HETATM 1329 O HOH A 839 35.697 -9.899 -7.911 1.00 38.89 O HETATM 1330 O HOH A 840 29.390 16.201 8.598 1.00 43.16 O HETATM 1331 O HOH A 841 22.713 12.210 10.769 1.00 42.95 O CONECT 511 1240 CONECT 531 1240 CONECT 636 1240 CONECT 657 1240 CONECT 796 1241 CONECT 844 1241 CONECT 931 1241 CONECT 956 1241 CONECT 1240 511 531 636 657 CONECT 1241 796 844 931 956 CONECT 1242 1243 1244 1245 CONECT 1243 1242 CONECT 1244 1242 CONECT 1245 1242 MASTER 325 0 3 4 2 0 5 6 1328 3 14 11 END
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Related entries of code: 2a66
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
2a66
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
Orphan nuclear receptor NR5A2
Ligand Name
dsDNA from the hCYP7A1 Promoter
EC.Number
E.C.-.-.-.-
Resolution
2.2(Å)
Affinity (Kd/Ki/IC50)
Kd=122nM
Release Year
2005
Protein/NA Sequence
Check fasta file
Primary Reference
J. Mol. Biol. (2005) 354, pp. 1091-1102
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):
O00482
Entrez Gene ID
NCBI Entrez Gene ID:
2494
ASD
Information of known allosteric effects of PDB entries
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