Browse entries in the PDBbind-CN Database
HEADER TRANSCRIPTION/DNA 11-JUL-01 1JK2 TITLE ZIF268 D20A MUTANT BOUND TO THE GCT DNA SITE COMPND MOL_ID: 1; COMPND 2 MOLECULE: 5'-D(*AP*GP*CP*GP*TP*GP*GP*GP*CP*TP*G)-3'; COMPND 3 CHAIN: B; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: 5'-D(*TP*CP*AP*GP*CP*CP*CP*AP*CP*GP*C)-3'; COMPND 7 CHAIN: C; COMPND 8 ENGINEERED: YES; COMPND 9 MOL_ID: 3; COMPND 10 MOLECULE: ZIF268; COMPND 11 CHAIN: A; COMPND 12 FRAGMENT: ZINC FINGERS (RESIDUES 333-421); COMPND 13 SYNONYM: EARLY GROWTH RESPONSE PROTEIN 1; COMPND 14 ENGINEERED: YES; COMPND 15 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 MOL_ID: 2; SOURCE 4 SYNTHETIC: YES; SOURCE 5 MOL_ID: 3; SOURCE 6 ORGANISM_SCIENTIFIC: MUS MUSCULUS; SOURCE 7 ORGANISM_COMMON: HOUSE MOUSE; SOURCE 8 ORGANISM_TAXID: 10090; SOURCE 9 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 10 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 11 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3); SOURCE 12 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 13 EXPRESSION_SYSTEM_PLASMID: PZIFD20A KEYWDS ZINC-FINGER, DOUBLE STRANDED DNA, PROTEIN-DNA COMPLEX, KEYWDS 2 TRANSCRIPTION/DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR J.C.MILLER,C.O.PABO REVDAT 3 24-FEB-09 1JK2 1 VERSN REVDAT 2 01-APR-03 1JK2 1 JRNL REVDAT 1 19-OCT-01 1JK2 0 JRNL AUTH J.C.MILLER,C.O.PABO JRNL TITL REARRANGEMENT OF SIDE-CHAINS IN A ZIF268 MUTANT JRNL TITL 2 HIGHLIGHTS THE COMPLEXITIES OF ZINC FINGER-DNA JRNL TITL 3 RECOGNITION. JRNL REF J.MOL.BIOL. V. 313 309 2001 JRNL REFN ISSN 0022-2836 JRNL PMID 11800559 JRNL DOI 10.1006/JMBI.2001.4975 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH M.ELROD-ERICKSON,M.A.ROULD,L.NEKLUDOVA,C.O.PABO REMARK 1 TITL ZIF268 PROTEIN-DNA COMPLEX REFINED AT 1.6 A: A REMARK 1 TITL 2 MODEL SYSTEM FOR UNDERSTANDING ZINC FINGER-DNA REMARK 1 TITL 3 INTERACTIONS REMARK 1 REF STRUCTURE V. 4 1171 1996 REMARK 1 REFN ISSN 0969-2126 REMARK 1 DOI 10.1016/S0969-2126(96)00125-6 REMARK 1 REFERENCE 2 REMARK 1 AUTH M.ELROD-ERICKSON,C.O.PABO REMARK 1 TITL BINDING STUDIES WITH MUTANTS OF ZIF268. REMARK 1 TITL 2 CONTRIBUTION OF INDIVIDUAL SIDE CHAINS TO BINDING REMARK 1 TITL 3 AFFINITY AND SPECIFICITY IN THE ZIF268 ZINC REMARK 1 TITL 4 FINGER-DNA COMPLEX REMARK 1 REF J.BIOL.CHEM. V. 274 19281 1999 REMARK 1 REFN ISSN 0021-9258 REMARK 1 DOI 10.1074/JBC.274.27.19281 REMARK 2 REMARK 2 RESOLUTION. 1.65 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.851 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.65 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 20.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 2.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 10000000.000 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0010 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 87.7 REMARK 3 NUMBER OF REFLECTIONS : 17401 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) : 0.230 REMARK 3 FREE R VALUE : 0.273 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 9.900 REMARK 3 FREE R VALUE TEST SET COUNT : 1714 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.007 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 6 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 1.65 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.75 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 65.90 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 1935 REMARK 3 BIN R VALUE (WORKING SET) : 0.3950 REMARK 3 BIN FREE R VALUE : 0.4340 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 10.00 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 215 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.030 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 748 REMARK 3 NUCLEIC ACID ATOMS : 481 REMARK 3 HETEROGEN ATOMS : 3 REMARK 3 SOLVENT ATOMS : 145 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 24.70 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 30.10 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 0.00000 REMARK 3 B22 (A**2) : 0.00000 REMARK 3 B33 (A**2) : 0.00000 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) : 0.24 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) : 0.29 REMARK 3 ESD FROM C-V SIGMAA (A) : 0.25 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.007 REMARK 3 BOND ANGLES (DEGREES) : 1.40 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 21.70 REMARK 3 IMPROPER ANGLES (DEGREES) : 1.41 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) : 0.970 ; 1.500 REMARK 3 MAIN-CHAIN ANGLE (A**2) : 1.690 ; 2.000 REMARK 3 SIDE-CHAIN BOND (A**2) : 1.130 ; 2.000 REMARK 3 SIDE-CHAIN ANGLE (A**2) : 1.930 ; 2.500 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 : PARHCSDX.PRO REMARK 3 PARAMETER FILE 2 : PARNDBX.DNA REMARK 3 PARAMETER FILE 3 : PARAM11.WAT REMARK 3 PARAMETER FILE 4 : NULL REMARK 3 TOPOLOGY FILE 1 : TOPHCSDX.PRO REMARK 3 TOPOLOGY FILE 2 : TOPNDBX.DNA REMARK 3 TOPOLOGY FILE 3 : TOPH11.WAT REMARK 3 TOPOLOGY FILE 4 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1JK2 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 13-JUL-01. REMARK 100 THE RCSB ID CODE IS RCSB013865. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 28-MAY-99 REMARK 200 TEMPERATURE (KELVIN) : 125 REMARK 200 PH : 8.0 REMARK 200 NUMBER OF CRYSTALS USED : 3 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N REMARK 200 RADIATION SOURCE : ROTATING ANODE REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : RIGAKU RU200 REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418 REMARK 200 MONOCHROMATOR : YALE MIRRORS REMARK 200 OPTICS : YALE MIRRORS REMARK 200 REMARK 200 DETECTOR TYPE : IMAGE PLATE REMARK 200 DETECTOR MANUFACTURER : RIGAKU RAXIS IV REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 18149 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.650 REMARK 200 RESOLUTION RANGE LOW (A) : 20.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 91.3 REMARK 200 DATA REDUNDANCY : NULL REMARK 200 R MERGE (I) : 0.05200 REMARK 200 R SYM (I) : NULL REMARK 200
FOR THE DATA SET : NULL REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.65 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.71 REMARK 200 COMPLETENESS FOR SHELL (%) : 75.1 REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200
FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: X-PLOR REMARK 200 STARTING MODEL: D20A BOUND TO THE WT SITE WITH THE APPROPRIATE REMARK 200 CHANGE TO THE DNA AND WITH WATERS AND SIDE CHAINS OF RESIDUES REMARK 200 18 AND 21 REMOVED REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 45.44 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.25 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 300 MM NACL, 10% PEG 1450, 25 MM REMARK 280 BIS-TRIS PROPANE, PH 8.0, VAPOR DIFFUSION, HANGING DROP, REMARK 280 TEMPERATURE 298K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: C 2 2 21 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 -X,Y,-Z+1/2 REMARK 290 4555 X,-Y,-Z REMARK 290 5555 X+1/2,Y+1/2,Z REMARK 290 6555 -X+1/2,-Y+1/2,Z+1/2 REMARK 290 7555 -X+1/2,Y+1/2,-Z+1/2 REMARK 290 8555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 65.78000 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 65.78000 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 0.00000 REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 21.80000 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 28.02500 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 6 -1.000000 0.000000 0.000000 21.80000 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 28.02500 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 65.78000 REMARK 290 SMTRY1 7 -1.000000 0.000000 0.000000 21.80000 REMARK 290 SMTRY2 7 0.000000 1.000000 0.000000 28.02500 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 65.78000 REMARK 290 SMTRY1 8 1.000000 0.000000 0.000000 21.80000 REMARK 290 SMTRY2 8 0.000000 -1.000000 0.000000 28.02500 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: 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 MET A 101 REMARK 465 GLU A 102 REMARK 465 GLN A 188 REMARK 465 LYS A 189 REMARK 465 ASP A 190 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 DC B 3 C3' - C2' - C1' ANGL. DEV. = -5.3 DEGREES REMARK 500 DT C 51 N1 - C1' - C2' ANGL. DEV. = 8.5 DEGREES REMARK 500 DC C 52 C4' - C3' - O3' ANGL. DEV. = -17.0 DEGREES REMARK 500 DC C 52 C3' - O3' - P ANGL. DEV. = -10.1 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ASP A 113 53.61 -111.50 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 DC B 3 0.07 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 201 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 107 SG REMARK 620 2 CYS A 112 SG 111.2 REMARK 620 3 HIS A 125 NE2 96.8 97.0 REMARK 620 4 HIS A 129 NE2 121.7 114.7 110.9 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 202 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 137 SG REMARK 620 2 CYS A 140 SG 115.7 REMARK 620 3 HIS A 153 NE2 108.1 106.8 REMARK 620 4 HIS A 157 NE2 105.6 117.5 101.9 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 203 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 165 SG REMARK 620 2 CYS A 168 SG 117.4 REMARK 620 3 HIS A 181 NE2 104.1 107.5 REMARK 620 4 HIS A 185 NE2 103.9 118.2 104.1 REMARK 620 N 1 2 3 REMARK 650 REMARK 650 HELIX REMARK 650 DETERMINATION METHOD: AUTHOR 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 201 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN A 202 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN A 203 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1AAY RELATED DB: PDB REMARK 900 WT ZIF268-DNA COPMLEX REMARK 900 RELATED ID: 1JK1 RELATED DB: PDB REMARK 900 ZIF268 D20A MUTANT BOUND TO WT DNA SITE DBREF 1JK2 A 101 190 UNP P08046 EGR1_MOUSE 333 421 DBREF 1JK2 B 1 11 PDB 1JK2 1JK2 1 11 DBREF 1JK2 C 51 61 PDB 1JK2 1JK2 51 61 SEQADV 1JK2 MET A 101 UNP P08046 CLONING ARTIFACT SEQADV 1JK2 ALA A 120 UNP P08046 ASP 351 ENGINEERED SEQRES 1 B 11 DA DG DC DG DT DG DG DG DC DT DG SEQRES 1 C 11 DT DC DA DG DC DC DC DA DC DG DC SEQRES 1 A 90 MET GLU ARG PRO TYR ALA CYS PRO VAL GLU SER CYS ASP SEQRES 2 A 90 ARG ARG PHE SER ARG SER ALA GLU LEU THR ARG HIS ILE SEQRES 3 A 90 ARG ILE HIS THR GLY GLN LYS PRO PHE GLN CYS ARG ILE SEQRES 4 A 90 CYS MET ARG ASN PHE SER ARG SER ASP HIS LEU THR THR SEQRES 5 A 90 HIS ILE ARG THR HIS THR GLY GLU LYS PRO PHE ALA CYS SEQRES 6 A 90 ASP ILE CYS GLY ARG LYS PHE ALA ARG SER ASP GLU ARG SEQRES 7 A 90 LYS ARG HIS THR LYS ILE HIS LEU ARG GLN LYS ASP HET ZN A 201 1 HET ZN A 202 1 HET ZN A 203 1 HETNAM ZN ZINC ION FORMUL 4 ZN 3(ZN 2+) FORMUL 7 HOH *145(H2 O) HELIX 1 1 SER A 119 THR A 130 1 12 HELIX 2 2 SER A 147 THR A 158 1 12 HELIX 3 3 SER A 175 HIS A 185 1 11 SHEET 1 A 2 TYR A 105 ALA A 106 0 SHEET 2 A 2 ARG A 115 PHE A 116 -1 N PHE A 116 O TYR A 105 SHEET 1 B 2 PHE A 135 GLN A 136 0 SHEET 2 B 2 ASN A 143 PHE A 144 -1 N PHE A 144 O PHE A 135 SHEET 1 C 2 PHE A 163 ALA A 164 0 SHEET 2 C 2 LYS A 171 PHE A 172 -1 O PHE A 172 N PHE A 163 LINK ZN ZN A 201 SG CYS A 107 1555 1555 2.26 LINK ZN ZN A 201 SG CYS A 112 1555 1555 2.50 LINK ZN ZN A 201 NE2 HIS A 125 1555 1555 2.47 LINK ZN ZN A 201 NE2 HIS A 129 1555 1555 1.88 LINK ZN ZN A 202 SG CYS A 137 1555 1555 2.32 LINK ZN ZN A 202 SG CYS A 140 1555 1555 2.22 LINK ZN ZN A 202 NE2 HIS A 153 1555 1555 2.09 LINK ZN ZN A 202 NE2 HIS A 157 1555 1555 2.10 LINK ZN ZN A 203 SG CYS A 165 1555 1555 2.39 LINK ZN ZN A 203 SG CYS A 168 1555 1555 2.25 LINK ZN ZN A 203 NE2 HIS A 181 1555 1555 2.06 LINK ZN ZN A 203 NE2 HIS A 185 1555 1555 2.01 SITE 1 AC1 4 CYS A 107 CYS A 112 HIS A 125 HIS A 129 SITE 1 AC2 4 CYS A 137 CYS A 140 HIS A 153 HIS A 157 SITE 1 AC3 4 CYS A 165 CYS A 168 HIS A 181 HIS A 185 CRYST1 43.600 56.050 131.560 90.00 90.00 90.00 C 2 2 21 8 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.022936 0.000000 0.000000 0.00000 SCALE2 0.000000 0.017841 0.000000 0.00000 SCALE3 0.000000 0.000000 0.007601 0.00000 ATOM 1 O5' DA B 1 12.156 24.612 40.576 1.00 22.13 O ATOM 2 C5' DA B 1 13.405 24.986 40.001 1.00 21.86 C ATOM 3 C4' DA B 1 14.570 24.207 40.569 1.00 22.66 C ATOM 4 O4' DA B 1 14.767 24.538 41.963 1.00 21.44 O ATOM 5 C3' DA B 1 14.412 22.685 40.520 1.00 23.18 C ATOM 6 O3' DA B 1 15.688 22.081 40.292 1.00 25.87 O ATOM 7 C2' DA B 1 13.943 22.343 41.917 1.00 21.66 C ATOM 8 C1' DA B 1 14.707 23.359 42.748 1.00 20.55 C ATOM 9 N9 DA B 1 14.021 23.696 43.983 1.00 18.90 N ATOM 10 C8 DA B 1 14.436 23.498 45.275 1.00 18.05 C ATOM 11 N7 DA B 1 13.584 23.927 46.172 1.00 17.44 N ATOM 12 C5 DA B 1 12.536 24.437 45.422 1.00 17.59 C ATOM 13 C6 DA B 1 11.326 25.039 45.782 1.00 17.03 C ATOM 14 N6 DA B 1 10.951 25.241 47.046 1.00 18.30 N ATOM 15 N1 DA B 1 10.501 25.433 44.787 1.00 17.61 N ATOM 16 C2 DA B 1 10.883 25.233 43.514 1.00 17.37 C ATOM 17 N3 DA B 1 12.000 24.683 43.050 1.00 17.36 N ATOM 18 C4 DA B 1 12.792 24.300 44.068 1.00 18.04 C ATOM 19 P DG B 2 15.771 20.549 39.796 1.00 28.40 P ATOM 20 OP1 DG B 2 17.095 20.338 39.148 1.00 27.65 O ATOM 21 OP2 DG B 2 14.506 20.278 39.034 1.00 27.54 O ATOM 22 O5' DG B 2 15.770 19.706 41.149 1.00 26.05 O ATOM 23 C5' DG B 2 16.924 19.698 41.993 1.00 24.13 C ATOM 24 C4' DG B 2 16.714 18.770 43.165 1.00 23.29 C ATOM 25 O4' DG B 2 15.921 19.380 44.210 1.00 21.68 O ATOM 26 C3' DG B 2 16.029 17.450 42.820 1.00 22.21 C ATOM 27 O3' DG B 2 16.712 16.409 43.524 1.00 23.32 O ATOM 28 C2' DG B 2 14.615 17.645 43.337 1.00 20.81 C ATOM 29 C1' DG B 2 14.854 18.514 44.558 1.00 19.59 C ATOM 30 N9 DG B 2 13.730 19.339 44.995 1.00 17.46 N ATOM 31 C8 DG B 2 12.753 19.916 44.221 1.00 15.99 C ATOM 32 N7 DG B 2 11.886 20.598 44.920 1.00 15.74 N ATOM 33 C5 DG B 2 12.320 20.465 46.235 1.00 15.01 C ATOM 34 C6 DG B 2 11.783 20.984 47.460 1.00 14.67 C ATOM 35 O6 DG B 2 10.791 21.688 47.635 1.00 14.47 O ATOM 36 N1 DG B 2 12.543 20.596 48.555 1.00 14.49 N ATOM 37 C2 DG B 2 13.672 19.824 48.493 1.00 14.35 C ATOM 38 N2 DG B 2 14.271 19.565 49.657 1.00 15.35 N ATOM 39 N3 DG B 2 14.178 19.340 47.376 1.00 15.11 N ATOM 40 C4 DG B 2 13.456 19.692 46.295 1.00 15.64 C ATOM 41 P DC B 3 16.374 14.872 43.216 1.00 22.34 P ATOM 42 OP1 DC B 3 17.635 14.120 43.386 1.00 22.43 O ATOM 43 OP2 DC B 3 15.609 14.770 41.951 1.00 20.73 O ATOM 44 O5' DC B 3 15.399 14.503 44.415 1.00 20.06 O ATOM 45 C5' DC B 3 15.779 14.759 45.771 1.00 17.78 C ATOM 46 C4' DC B 3 14.577 14.649 46.680 1.00 17.05 C ATOM 47 O4' DC B 3 13.769 15.853 46.670 1.00 16.08 O ATOM 48 C3' DC B 3 13.612 13.493 46.367 1.00 17.54 C ATOM 49 O3' DC B 3 13.252 12.844 47.586 1.00 18.49 O ATOM 50 C2' DC B 3 12.372 14.206 45.852 1.00 16.49 C ATOM 51 C1' DC B 3 12.444 15.395 46.777 1.00 15.05 C ATOM 52 N1 DC B 3 11.515 16.510 46.592 1.00 14.50 N ATOM 53 C2 DC B 3 11.179 17.285 47.720 1.00 13.77 C ATOM 54 O2 DC B 3 11.790 17.102 48.784 1.00 14.44 O ATOM 55 N3 DC B 3 10.205 18.213 47.618 1.00 14.21 N ATOM 56 C4 DC B 3 9.592 18.407 46.449 1.00 14.16 C ATOM 57 N4 DC B 3 8.594 19.287 46.415 1.00 14.42 N ATOM 58 C5 DC B 3 9.970 17.691 45.265 1.00 13.97 C ATOM 59 C6 DC B 3 10.931 16.763 45.382 1.00 13.45 C ATOM 60 P DG B 4 13.125 11.239 47.635 1.00 17.56 P ATOM 61 OP1 DG B 4 14.429 10.690 47.239 1.00 18.77 O ATOM 62 OP2 DG B 4 11.910 10.855 46.890 1.00 17.68 O ATOM 63 O5' DG B 4 12.879 10.962 49.184 1.00 17.44 O ATOM 64 C5' DG B 4 13.781 11.488 50.179 1.00 17.38 C ATOM 65 C4' DG B 4 13.011 11.943 51.398 1.00 17.32 C ATOM 66 O4' DG B 4 12.335 13.198 51.138 1.00 16.58 O ATOM 67 C3' DG B 4 11.934 10.959 51.852 1.00 17.72 C ATOM 68 O3' DG B 4 11.961 10.814 53.272 1.00 19.56 O ATOM 69 C2' DG B 4 10.640 11.605 51.392 1.00 17.01 C ATOM 70 C1' DG B 4 10.957 13.092 51.454 1.00 15.64 C ATOM 71 N9 DG B 4 10.207 13.879 50.478 1.00 14.54 N ATOM 72 C8 DG B 4 10.370 13.867 49.115 1.00 13.88 C ATOM 73 N7 DG B 4 9.531 14.646 48.492 1.00 13.98 N ATOM 74 C5 DG B 4 8.775 15.219 49.505 1.00 13.81 C ATOM 75 C6 DG B 4 7.703 16.152 49.437 1.00 13.75 C ATOM 76 O6 DG B 4 7.202 16.671 48.441 1.00 14.77 O ATOM 77 N1 DG B 4 7.212 16.467 50.704 1.00 14.10 N ATOM 78 C2 DG B 4 7.696 15.953 51.880 1.00 13.87 C ATOM 79 N2 DG B 4 7.102 16.376 52.998 1.00 14.29 N ATOM 80 N3 DG B 4 8.695 15.083 51.953 1.00 14.45 N ATOM 81 C4 DG B 4 9.181 14.762 50.736 1.00 13.61 C ATOM 82 P DT B 5 11.329 9.502 53.951 1.00 19.99 P ATOM 83 OP1 DT B 5 11.887 9.420 55.328 1.00 19.64 O ATOM 84 OP2 DT B 5 11.499 8.353 53.021 1.00 19.87 O ATOM 85 O5' DT B 5 9.780 9.848 54.018 1.00 19.42 O ATOM 86 C5' DT B 5 9.289 10.839 54.924 1.00 20.07 C ATOM 87 C4' DT B 5 7.800 11.018 54.749 1.00 20.98 C ATOM 88 O4' DT B 5 7.505 11.904 53.636 1.00 20.81 O ATOM 89 C3' DT B 5 6.997 9.734 54.502 1.00 21.59 C ATOM 90 O3' DT B 5 5.808 9.766 55.302 1.00 23.59 O ATOM 91 C2' DT B 5 6.598 9.855 53.037 1.00 20.38 C ATOM 92 C1' DT B 5 6.399 11.361 52.949 1.00 19.89 C ATOM 93 N1 DT B 5 6.322 11.975 51.604 1.00 18.53 N ATOM 94 C2 DT B 5 5.412 13.004 51.430 1.00 17.32 C ATOM 95 O2 DT B 5 4.737 13.457 52.342 1.00 17.44 O ATOM 96 N3 DT B 5 5.323 13.483 50.145 1.00 16.77 N ATOM 97 C4 DT B 5 6.041 13.053 49.043 1.00 16.72 C ATOM 98 O4 DT B 5 5.836 13.565 47.947 1.00 17.47 O ATOM 99 C5 DT B 5 7.005 11.987 49.301 1.00 17.19 C ATOM 100 C7 DT B 5 7.835 11.461 48.170 1.00 15.15 C ATOM 101 C6 DT B 5 7.101 11.518 50.556 1.00 17.22 C ATOM 102 P DG B 6 5.207 8.406 55.919 1.00 23.93 P ATOM 103 OP1 DG B 6 6.121 7.966 56.989 1.00 23.54 O ATOM 104 OP2 DG B 6 4.866 7.473 54.808 1.00 24.57 O ATOM 105 O5' DG B 6 3.842 8.892 56.573 1.00 23.54 O ATOM 106 C5' DG B 6 3.796 10.076 57.381 1.00 23.51 C ATOM 107 C4' DG B 6 2.518 10.838 57.116 1.00 23.97 C ATOM 108 O4' DG B 6 2.589 11.532 55.840 1.00 23.02 O ATOM 109 C3' DG B 6 1.278 9.950 57.054 1.00 25.48 C ATOM 110 O3' DG B 6 0.204 10.498 57.825 1.00 27.24 O ATOM 111 C2' DG B 6 0.930 9.907 55.574 1.00 24.15 C ATOM 112 C1' DG B 6 1.442 11.241 55.051 1.00 22.41 C ATOM 113 N9 DG B 6 1.861 11.198 53.647 1.00 20.94 N ATOM 114 C8 DG B 6 2.842 10.398 53.111 1.00 20.41 C ATOM 115 N7 DG B 6 3.014 10.582 51.830 1.00 18.55 N ATOM 116 C5 DG B 6 2.092 11.564 51.493 1.00 18.16 C ATOM 117 C6 DG B 6 1.833 12.182 50.244 1.00 17.17 C ATOM 118 O6 DG B 6 2.379 11.980 49.155 1.00 16.67 O ATOM 119 N1 DG B 6 0.821 13.127 50.344 1.00 16.85 N ATOM 120 C2 DG B 6 0.140 13.435 51.495 1.00 17.82 C ATOM 121 N2 DG B 6 -0.830 14.361 51.383 1.00 18.48 N ATOM 122 N3 DG B 6 0.380 12.874 52.670 1.00 18.89 N ATOM 123 C4 DG B 6 1.364 11.951 52.597 1.00 19.31 C ATOM 124 P DG B 7 -1.182 9.694 57.928 1.00 29.37 P ATOM 125 OP1 DG B 7 -1.715 9.843 59.310 1.00 29.93 O ATOM 126 OP2 DG B 7 -0.963 8.329 57.362 1.00 29.86 O ATOM 127 O5' DG B 7 -2.132 10.486 56.929 1.00 28.22 O ATOM 128 C5' DG B 7 -2.388 11.884 57.128 1.00 27.91 C ATOM 129 C4' DG B 7 -3.477 12.349 56.193 1.00 27.69 C ATOM 130 O4' DG B 7 -2.956 12.425 54.848 1.00 26.99 O ATOM 131 C3' DG B 7 -4.682 11.417 56.128 1.00 28.09 C ATOM 132 O3' DG B 7 -5.879 12.188 56.039 1.00 29.79 O ATOM 133 C2' DG B 7 -4.436 10.616 54.859 1.00 27.71 C ATOM 134 C1' DG B 7 -3.728 11.625 53.971 1.00 25.73 C ATOM 135 N9 DG B 7 -2.818 11.058 52.980 1.00 24.91 N ATOM 136 C8 DG B 7 -1.773 10.195 53.217 1.00 24.52 C ATOM 137 N7 DG B 7 -1.095 9.903 52.141 1.00 24.36 N ATOM 138 C5 DG B 7 -1.736 10.603 51.127 1.00 23.65 C ATOM 139 C6 DG B 7 -1.439 10.686 49.746 1.00 22.68 C ATOM 140 O6 DG B 7 -0.516 10.145 49.132 1.00 21.64 O ATOM 141 N1 DG B 7 -2.346 11.501 49.073 1.00 22.30 N ATOM 142 C2 DG B 7 -3.407 12.151 49.661 1.00 23.13 C ATOM 143 N2 DG B 7 -4.194 12.875 48.844 1.00 23.46 N ATOM 144 N3 DG B 7 -3.685 12.092 50.955 1.00 23.22 N ATOM 145 C4 DG B 7 -2.813 11.307 51.624 1.00 23.72 C ATOM 146 P DG B 8 -7.295 11.453 55.851 1.00 32.17 P ATOM 147 OP1 DG B 8 -8.329 12.317 56.480 1.00 32.94 O ATOM 148 OP2 DG B 8 -7.206 10.011 56.234 1.00 32.49 O ATOM 149 O5' DG B 8 -7.520 11.497 54.281 1.00 31.68 O ATOM 150 C5' DG B 8 -7.711 12.746 53.611 1.00 30.98 C ATOM 151 C4' DG B 8 -8.337 12.508 52.262 1.00 30.23 C ATOM 152 O4' DG B 8 -7.333 12.038 51.335 1.00 29.61 O ATOM 153 C3' DG B 8 -9.428 11.440 52.289 1.00 31.07 C ATOM 154 O3' DG B 8 -10.522 11.851 51.469 1.00 33.03 O ATOM 155 C2' DG B 8 -8.730 10.202 51.749 1.00 29.30 C ATOM 156 C1' DG B 8 -7.725 10.794 50.775 1.00 27.67 C ATOM 157 N9 DG B 8 -6.522 9.995 50.595 1.00 24.45 N ATOM 158 C8 DG B 8 -5.831 9.326 51.575 1.00 23.12 C ATOM 159 N7 DG B 8 -4.784 8.696 51.123 1.00 23.10 N ATOM 160 C5 DG B 8 -4.783 8.961 49.759 1.00 22.19 C ATOM 161 C6 DG B 8 -3.894 8.528 48.740 1.00 21.59 C ATOM 162 O6 DG B 8 -2.895 7.809 48.844 1.00 21.17 O ATOM 163 N1 DG B 8 -4.265 9.014 47.491 1.00 21.27 N ATOM 164 C2 DG B 8 -5.353 9.810 47.250 1.00 20.64 C ATOM 165 N2 DG B 8 -5.546 10.149 45.964 1.00 19.49 N ATOM 166 N3 DG B 8 -6.191 10.232 48.196 1.00 21.49 N ATOM 167 C4 DG B 8 -5.848 9.764 49.418 1.00 22.34 C ATOM 168 P DC B 9 -11.784 10.878 51.275 1.00 34.55 P ATOM 169 OP1 DC B 9 -12.960 11.738 50.997 1.00 33.93 O ATOM 170 OP2 DC B 9 -11.830 9.881 52.390 1.00 35.02 O ATOM 171 O5' DC B 9 -11.400 10.099 49.949 1.00 33.78 O ATOM 172 C5' DC B 9 -10.830 10.814 48.855 1.00 32.69 C ATOM 173 C4' DC B 9 -10.538 9.867 47.723 1.00 31.84 C ATOM 174 O4' DC B 9 -9.226 9.279 47.868 1.00 30.62 O ATOM 175 C3' DC B 9 -11.526 8.705 47.615 1.00 31.77 C ATOM 176 O3' DC B 9 -11.958 8.606 46.268 1.00 32.25 O ATOM 177 C2' DC B 9 -10.699 7.491 48.006 1.00 30.31 C ATOM 178 C1' DC B 9 -9.315 7.908 47.546 1.00 28.38 C ATOM 179 N1 DC B 9 -8.184 7.212 48.183 1.00 25.40 N ATOM 180 C2 DC B 9 -7.096 6.842 47.385 1.00 23.39 C ATOM 181 O2 DC B 9 -7.100 7.148 46.186 1.00 23.36 O ATOM 182 N3 DC B 9 -6.070 6.157 47.939 1.00 22.45 N ATOM 183 C4 DC B 9 -6.100 5.840 49.233 1.00 21.44 C ATOM 184 N4 DC B 9 -5.083 5.134 49.716 1.00 20.29 N ATOM 185 C5 DC B 9 -7.183 6.228 50.081 1.00 22.38 C ATOM 186 C6 DC B 9 -8.195 6.910 49.520 1.00 24.28 C ATOM 187 P DT B 10 -13.164 7.630 45.887 1.00 32.83 P ATOM 188 OP1 DT B 10 -14.337 8.453 45.514 1.00 32.74 O ATOM 189 OP2 DT B 10 -13.287 6.606 46.969 1.00 32.99 O ATOM 190 O5' DT B 10 -12.589 6.958 44.573 1.00 31.30 O ATOM 191 C5' DT B 10 -11.767 7.733 43.688 1.00 29.59 C ATOM 192 C4' DT B 10 -11.009 6.826 42.754 1.00 28.01 C ATOM 193 O4' DT B 10 -9.859 6.247 43.416 1.00 27.60 O ATOM 194 C3' DT B 10 -11.846 5.661 42.242 1.00 27.43 C ATOM 195 O3' DT B 10 -11.605 5.508 40.850 1.00 28.13 O ATOM 196 C2' DT B 10 -11.350 4.475 43.055 1.00 26.52 C ATOM 197 C1' DT B 10 -9.891 4.828 43.315 1.00 25.66 C ATOM 198 N1 DT B 10 -9.288 4.268 44.562 1.00 23.30 N ATOM 199 C2 DT B 10 -8.047 3.646 44.487 1.00 21.15 C ATOM 200 O2 DT B 10 -7.442 3.466 43.446 1.00 20.84 O ATOM 201 N3 DT B 10 -7.544 3.231 45.693 1.00 21.51 N ATOM 202 C4 DT B 10 -8.136 3.344 46.934 1.00 20.26 C ATOM 203 O4 DT B 10 -7.538 2.942 47.930 1.00 21.10 O ATOM 204 C5 DT B 10 -9.449 3.961 46.938 1.00 20.42 C ATOM 205 C7 DT B 10 -10.186 4.095 48.235 1.00 20.47 C ATOM 206 C6 DT B 10 -9.949 4.388 45.769 1.00 21.59 C ATOM 207 P DG B 11 -12.529 4.528 39.989 1.00 27.59 P ATOM 208 OP1 DG B 11 -12.605 5.033 38.597 1.00 27.29 O ATOM 209 OP2 DG B 11 -13.784 4.280 40.753 1.00 27.00 O ATOM 210 O5' DG B 11 -11.653 3.205 39.978 1.00 26.60 O ATOM 211 C5' DG B 11 -10.343 3.220 39.411 1.00 24.11 C ATOM 212 C4' DG B 11 -9.686 1.877 39.607 1.00 22.98 C ATOM 213 O4' DG B 11 -9.240 1.750 40.977 1.00 22.31 O ATOM 214 C3' DG B 11 -10.598 0.670 39.342 1.00 22.44 C ATOM 215 O3' DG B 11 -9.809 -0.374 38.763 1.00 23.15 O ATOM 216 C2' DG B 11 -10.956 0.198 40.740 1.00 21.65 C ATOM 217 C1' DG B 11 -9.637 0.471 41.437 1.00 20.61 C ATOM 218 N9 DG B 11 -9.630 0.476 42.893 1.00 18.78 N ATOM 219 C8 DG B 11 -10.601 0.958 43.740 1.00 17.60 C ATOM 220 N7 DG B 11 -10.319 0.770 45.001 1.00 17.39 N ATOM 221 C5 DG B 11 -9.082 0.134 44.990 1.00 17.09 C ATOM 222 C6 DG B 11 -8.270 -0.334 46.062 1.00 16.81 C ATOM 223 O6 DG B 11 -8.492 -0.276 47.284 1.00 17.82 O ATOM 224 N1 DG B 11 -7.094 -0.918 45.598 1.00 16.47 N ATOM 225 C2 DG B 11 -6.740 -1.034 44.275 1.00 16.26 C ATOM 226 N2 DG B 11 -5.560 -1.618 44.029 1.00 16.95 N ATOM 227 N3 DG B 11 -7.484 -0.608 43.271 1.00 16.90 N ATOM 228 C4 DG B 11 -8.636 -0.040 43.697 1.00 17.37 C TER 229 DG B 11 ATOM 230 O5'A DT C 51 -4.994 -4.313 55.132 0.50 25.47 O ATOM 231 O5'B DT C 51 -6.297 -9.437 53.285 0.50 35.18 O ATOM 232 C5'A DT C 51 -5.479 -5.378 54.321 0.50 25.09 C ATOM 233 C5'B DT C 51 -5.236 -8.466 53.382 0.50 34.62 C ATOM 234 C4'A DT C 51 -4.369 -5.930 53.461 0.50 24.96 C ATOM 235 C4'B DT C 51 -4.522 -8.240 52.067 0.50 34.12 C ATOM 236 O4'A DT C 51 -4.990 -6.492 52.282 0.50 25.11 O ATOM 237 O4'B DT C 51 -5.383 -7.505 51.168 0.50 34.21 O ATOM 238 C3'A DT C 51 -3.410 -4.851 52.967 0.50 25.14 C ATOM 239 C3'B DT C 51 -3.226 -7.434 52.164 0.50 33.95 C ATOM 240 O3'A DT C 51 -2.041 -5.227 53.015 0.50 25.64 O ATOM 241 O3'B DT C 51 -2.242 -8.030 51.294 0.50 33.91 O ATOM 242 C2'A DT C 51 -3.819 -4.582 51.534 0.50 24.50 C ATOM 243 C2'B DT C 51 -3.651 -6.017 51.776 0.50 33.41 C ATOM 244 C1'A DT C 51 -4.698 -5.739 51.114 0.50 23.60 C ATOM 245 C1'B DT C 51 -4.794 -6.263 50.795 0.50 33.07 C ATOM 246 N1 A DT C 51 -5.958 -5.164 50.635 0.50 22.68 N ATOM 247 N1 B DT C 51 -5.914 -5.280 50.587 0.50 32.28 N ATOM 248 C2 A DT C 51 -6.320 -5.307 49.316 0.50 21.95 C ATOM 249 C2 B DT C 51 -6.379 -5.303 49.278 0.50 31.75 C ATOM 250 O2 A DT C 51 -5.684 -5.973 48.510 0.50 22.04 O ATOM 251 O2 B DT C 51 -5.848 -5.954 48.395 0.50 31.75 O ATOM 252 N3 A DT C 51 -7.463 -4.633 48.971 0.50 21.36 N ATOM 253 N3 B DT C 51 -7.483 -4.550 49.048 0.50 31.17 N ATOM 254 C4 A DT C 51 -8.260 -3.855 49.789 0.50 21.26 C ATOM 255 C4 B DT C 51 -8.151 -3.748 49.979 0.50 31.13 C ATOM 256 O4 A DT C 51 -9.240 -3.278 49.323 0.50 21.43 O ATOM 257 O4 B DT C 51 -9.169 -3.131 49.651 0.50 31.04 O ATOM 258 C5 A DT C 51 -7.841 -3.786 51.168 0.50 21.49 C ATOM 259 C5 B DT C 51 -7.566 -3.718 51.317 0.50 31.21 C ATOM 260 C7 A DT C 51 -8.650 -2.986 52.137 0.50 21.08 C ATOM 261 C7 B DT C 51 -8.187 -2.850 52.368 0.50 30.93 C ATOM 262 C6 A DT C 51 -6.734 -4.445 51.517 0.50 21.77 C ATOM 263 C6 B DT C 51 -6.484 -4.481 51.546 0.50 31.63 C ATOM 264 P A DC C 52 -0.930 -4.137 52.621 0.50 26.15 P ATOM 265 P B DC C 52 -0.669 -7.822 51.587 0.50 33.77 P ATOM 266 OP1A DC C 52 0.350 -4.477 53.282 0.50 25.85 O ATOM 267 OP1B DC C 52 0.045 -9.118 51.646 0.50 33.75 O ATOM 268 OP2A DC C 52 -1.559 -2.814 52.871 0.50 24.81 O ATOM 269 OP2B DC C 52 -0.514 -6.844 52.698 0.50 34.08 O ATOM 270 O5'A DC C 52 -0.769 -4.316 51.046 0.50 25.87 O ATOM 271 O5'B DC C 52 -0.161 -7.098 50.274 0.50 33.25 O ATOM 272 C5'A DC C 52 -0.696 -5.630 50.454 0.50 26.75 C ATOM 273 C5'B DC C 52 -0.393 -5.705 50.112 0.50 32.46 C ATOM 274 C4'A DC C 52 -0.838 -5.538 48.950 0.50 27.26 C ATOM 275 C4'B DC C 52 -0.663 -5.409 48.663 0.50 31.77 C ATOM 276 O4'A DC C 52 -2.180 -5.115 48.602 0.50 26.25 O ATOM 277 O4'B DC C 52 -2.042 -5.030 48.453 0.50 31.15 O ATOM 278 C3'A DC C 52 0.104 -4.529 48.293 0.50 28.40 C ATOM 279 C3'B DC C 52 0.196 -4.285 48.107 0.50 31.72 C ATOM 280 O3'A DC C 52 0.548 -5.022 47.026 0.50 30.67 O ATOM 281 O3'B DC C 52 0.571 -5.035 46.990 0.50 31.29 O ATOM 282 C2'A DC C 52 -0.770 -3.301 48.110 0.50 27.10 C ATOM 283 C2'B DC C 52 -0.770 -3.124 47.934 0.50 31.14 C ATOM 284 C1'A DC C 52 -2.131 -3.915 47.836 0.50 25.28 C ATOM 285 C1'B DC C 52 -2.102 -3.819 47.725 0.50 30.26 C ATOM 286 N1 A DC C 52 -3.266 -3.073 48.248 0.50 22.93 N ATOM 287 N1 B DC C 52 -3.259 -3.069 48.209 0.50 28.80 N ATOM 288 C2 A DC C 52 -4.227 -2.718 47.293 0.50 21.77 C ATOM 289 C2 B DC C 52 -4.227 -2.676 47.281 0.50 28.07 C ATOM 290 O2 A DC C 52 -4.076 -3.095 46.117 0.50 20.69 O ATOM 291 O2 B DC C 52 -4.079 -2.997 46.088 0.50 27.27 O ATOM 292 N3 A DC C 52 -5.292 -1.971 47.677 0.50 20.88 N ATOM 293 N3 B DC C 52 -5.297 -1.968 47.696 0.50 27.49 N ATOM 294 C4 A DC C 52 -5.410 -1.577 48.950 0.50 20.48 C ATOM 295 C4 B DC C 52 -5.418 -1.658 48.997 0.50 27.22 C ATOM 296 N4 A DC C 52 -6.481 -0.853 49.289 0.50 19.40 N ATOM 297 N4 B DC C 52 -6.485 -0.948 49.382 0.50 26.40 N ATOM 298 C5 A DC C 52 -4.436 -1.911 49.934 0.50 20.96 C ATOM 299 C5 B DC C 52 -4.455 -2.057 49.966 0.50 27.52 C ATOM 300 C6 A DC C 52 -3.391 -2.651 49.544 0.50 22.09 C ATOM 301 C6 B DC C 52 -3.399 -2.751 49.534 0.50 28.30 C ATOM 302 P DA C 53 1.895 -4.434 46.367 1.00 33.04 P ATOM 303 OP1 DA C 53 2.752 -5.599 46.008 1.00 34.67 O ATOM 304 OP2 DA C 53 2.450 -3.366 47.257 1.00 33.31 O ATOM 305 O5' DA C 53 1.387 -3.770 45.012 1.00 31.80 O ATOM 306 C5' DA C 53 0.091 -3.181 44.936 1.00 29.31 C ATOM 307 C4' DA C 53 -0.116 -2.536 43.588 1.00 27.46 C ATOM 308 O4' DA C 53 -1.355 -1.811 43.699 1.00 27.21 O ATOM 309 C3' DA C 53 0.935 -1.486 43.232 1.00 27.16 C ATOM 310 O3' DA C 53 1.025 -1.353 41.804 1.00 27.44 O ATOM 311 C2' DA C 53 0.408 -0.233 43.905 1.00 26.25 C ATOM 312 C1' DA C 53 -1.101 -0.418 43.876 1.00 25.83 C ATOM 313 N9 DA C 53 -1.765 0.001 45.112 1.00 23.77 N ATOM 314 C8 DA C 53 -1.343 -0.170 46.409 1.00 23.19 C ATOM 315 N7 DA C 53 -2.171 0.321 47.302 1.00 22.83 N ATOM 316 C5 DA C 53 -3.209 0.846 46.542 1.00 21.71 C ATOM 317 C6 DA C 53 -4.403 1.491 46.891 1.00 20.71 C ATOM 318 N6 DA C 53 -4.777 1.722 48.149 1.00 20.67 N ATOM 319 N1 DA C 53 -5.215 1.893 45.889 1.00 21.11 N ATOM 320 C2 DA C 53 -4.849 1.652 44.630 1.00 20.50 C ATOM 321 N3 DA C 53 -3.758 1.044 44.174 1.00 21.80 N ATOM 322 C4 DA C 53 -2.970 0.660 45.194 1.00 22.09 C ATOM 323 P DG C 54 2.053 -0.296 41.141 1.00 26.62 P ATOM 324 OP1 DG C 54 2.254 -0.658 39.716 1.00 26.97 O ATOM 325 OP2 DG C 54 3.237 -0.159 42.030 1.00 26.98 O ATOM 326 O5' DG C 54 1.225 1.057 41.147 1.00 25.70 O ATOM 327 C5' DG C 54 0.026 1.182 40.369 1.00 23.83 C ATOM 328 C4' DG C 54 -0.533 2.576 40.514 1.00 23.27 C ATOM 329 O4' DG C 54 -1.245 2.728 41.769 1.00 22.09 O ATOM 330 C3' DG C 54 0.535 3.675 40.504 1.00 22.59 C ATOM 331 O3' DG C 54 0.019 4.797 39.808 1.00 23.47 O ATOM 332 C2' DG C 54 0.655 4.042 41.971 1.00 21.34 C ATOM 333 C1' DG C 54 -0.794 3.910 42.386 1.00 19.41 C ATOM 334 N9 DG C 54 -1.058 3.814 43.811 1.00 17.27 N ATOM 335 C8 DG C 54 -0.246 3.284 44.786 1.00 16.27 C ATOM 336 N7 DG C 54 -0.737 3.418 45.987 1.00 15.58 N ATOM 337 C5 DG C 54 -1.953 4.058 45.789 1.00 15.53 C ATOM 338 C6 DG C 54 -2.931 4.487 46.723 1.00 14.40 C ATOM 339 O6 DG C 54 -2.913 4.399 47.953 1.00 15.51 O ATOM 340 N1 DG C 54 -4.012 5.084 46.093 1.00 15.51 N ATOM 341 C2 DG C 54 -4.137 5.257 44.734 1.00 14.72 C ATOM 342 N2 DG C 54 -5.264 5.846 44.316 1.00 15.91 N ATOM 343 N3 DG C 54 -3.227 4.877 43.855 1.00 15.71 N ATOM 344 C4 DG C 54 -2.170 4.288 44.449 1.00 15.18 C ATOM 345 P DC C 55 0.817 5.406 38.563 1.00 23.35 P ATOM 346 OP1 DC C 55 0.319 4.770 37.323 1.00 24.56 O ATOM 347 OP2 DC C 55 2.262 5.386 38.875 1.00 23.93 O ATOM 348 O5' DC C 55 0.321 6.910 38.557 1.00 24.36 O ATOM 349 C5' DC C 55 0.106 7.596 39.785 1.00 23.72 C ATOM 350 C4' DC C 55 -1.266 8.215 39.785 1.00 22.93 C ATOM 351 O4' DC C 55 -2.039 7.517 40.793 1.00 22.07 O ATOM 352 C3' DC C 55 -1.225 9.682 40.197 1.00 23.07 C ATOM 353 O3' DC C 55 -1.651 10.579 39.189 1.00 24.68 O ATOM 354 C2' DC C 55 -2.114 9.798 41.418 1.00 22.85 C ATOM 355 C1' DC C 55 -2.625 8.409 41.730 1.00 21.13 C ATOM 356 N1 DC C 55 -2.130 8.054 43.072 1.00 18.45 N ATOM 357 C2 DC C 55 -2.932 8.344 44.159 1.00 17.27 C ATOM 358 O2 DC C 55 -4.044 8.846 43.953 1.00 17.89 O ATOM 359 N3 DC C 55 -2.483 8.080 45.406 1.00 17.06 N ATOM 360 C4 DC C 55 -1.279 7.542 45.577 1.00 16.14 C ATOM 361 N4 DC C 55 -0.880 7.302 46.820 1.00 16.02 N ATOM 362 C5 DC C 55 -0.434 7.225 44.478 1.00 16.18 C ATOM 363 C6 DC C 55 -0.897 7.488 43.252 1.00 16.76 C ATOM 364 P DC C 56 -1.090 12.085 39.210 1.00 24.45 P ATOM 365 OP1 DC C 56 -1.211 12.650 37.845 1.00 24.98 O ATOM 366 OP2 DC C 56 0.240 12.073 39.879 1.00 23.68 O ATOM 367 O5' DC C 56 -2.131 12.798 40.178 1.00 23.77 O ATOM 368 C5' DC C 56 -3.536 12.588 39.999 1.00 22.93 C ATOM 369 C4' DC C 56 -4.301 13.217 41.136 1.00 22.85 C ATOM 370 O4' DC C 56 -4.044 12.488 42.357 1.00 22.92 O ATOM 371 C3' DC C 56 -3.918 14.667 41.420 1.00 22.65 C ATOM 372 O3' DC C 56 -5.103 15.393 41.757 1.00 23.52 O ATOM 373 C2' DC C 56 -2.955 14.558 42.589 1.00 21.57 C ATOM 374 C1' DC C 56 -3.491 13.350 43.343 1.00 21.95 C ATOM 375 N1 DC C 56 -2.481 12.584 44.099 1.00 19.60 N ATOM 376 C2 DC C 56 -2.694 12.365 45.451 1.00 18.52 C ATOM 377 O2 DC C 56 -3.717 12.813 45.967 1.00 20.03 O ATOM 378 N3 DC C 56 -1.786 11.669 46.162 1.00 18.29 N ATOM 379 C4 DC C 56 -0.696 11.194 45.562 1.00 17.08 C ATOM 380 N4 DC C 56 0.177 10.519 46.300 1.00 17.34 N ATOM 381 C5 DC C 56 -0.453 11.397 44.177 1.00 18.04 C ATOM 382 C6 DC C 56 -1.360 12.096 43.490 1.00 18.54 C ATOM 383 P DC C 57 -5.073 17.000 41.835 1.00 24.33 P ATOM 384 OP1 DC C 57 -6.469 17.464 41.681 1.00 23.79 O ATOM 385 OP2 DC C 57 -4.020 17.522 40.937 1.00 23.96 O ATOM 386 O5' DC C 57 -4.630 17.255 43.337 1.00 23.67 O ATOM 387 C5' DC C 57 -5.428 16.716 44.387 1.00 23.99 C ATOM 388 C4' DC C 57 -4.789 16.962 45.727 1.00 23.82 C ATOM 389 O4' DC C 57 -3.784 15.965 46.024 1.00 22.98 O ATOM 390 C3' DC C 57 -4.131 18.327 45.923 1.00 24.05 C ATOM 391 O3' DC C 57 -4.799 18.996 46.987 1.00 26.35 O ATOM 392 C2' DC C 57 -2.691 17.990 46.299 1.00 23.26 C ATOM 393 C1' DC C 57 -2.807 16.572 46.838 1.00 21.36 C ATOM 394 N1 DC C 57 -1.588 15.750 46.774 1.00 19.11 N ATOM 395 C2 DC C 57 -1.155 15.114 47.940 1.00 18.44 C ATOM 396 O2 DC C 57 -1.822 15.252 48.983 1.00 18.10 O ATOM 397 N3 DC C 57 -0.027 14.365 47.906 1.00 17.43 N ATOM 398 C4 DC C 57 0.658 14.239 46.769 1.00 16.66 C ATOM 399 N4 DC C 57 1.760 13.498 46.793 1.00 16.05 N ATOM 400 C5 DC C 57 0.239 14.873 45.561 1.00 16.91 C ATOM 401 C6 DC C 57 -0.883 15.611 45.608 1.00 18.18 C ATOM 402 P DA C 58 -4.435 20.523 47.335 1.00 27.59 P ATOM 403 OP1 DA C 58 -5.679 21.176 47.848 1.00 27.93 O ATOM 404 OP2 DA C 58 -3.689 21.138 46.199 1.00 28.20 O ATOM 405 O5' DA C 58 -3.417 20.348 48.539 1.00 26.76 O ATOM 406 C5' DA C 58 -3.770 19.517 49.655 1.00 26.96 C ATOM 407 C4' DA C 58 -2.619 19.426 50.621 1.00 26.71 C ATOM 408 O4' DA C 58 -1.670 18.428 50.184 1.00 24.72 O ATOM 409 C3' DA C 58 -1.841 20.731 50.764 1.00 28.19 C ATOM 410 O3' DA C 58 -1.759 21.101 52.128 1.00 32.91 O ATOM 411 C2' DA C 58 -0.459 20.405 50.224 1.00 25.75 C ATOM 412 C1' DA C 58 -0.363 18.904 50.416 1.00 23.32 C ATOM 413 N9 DA C 58 0.533 18.259 49.457 1.00 20.03 N ATOM 414 C8 DA C 58 0.638 18.542 48.123 1.00 19.05 C ATOM 415 N7 DA C 58 1.584 17.878 47.516 1.00 18.30 N ATOM 416 C5 DA C 58 2.125 17.080 48.509 1.00 17.08 C ATOM 417 C6 DA C 58 3.173 16.153 48.502 1.00 16.33 C ATOM 418 N6 DA C 58 3.915 15.879 47.421 1.00 16.17 N ATOM 419 N1 DA C 58 3.451 15.518 49.658 1.00 16.42 N ATOM 420 C2 DA C 58 2.735 15.821 50.743 1.00 15.16 C ATOM 421 N3 DA C 58 1.740 16.686 50.878 1.00 16.87 N ATOM 422 C4 DA C 58 1.476 17.289 49.708 1.00 17.84 C ATOM 423 P DC C 59 -1.224 22.563 52.518 1.00 35.48 P ATOM 424 OP1 DC C 59 -2.327 23.255 53.245 1.00 35.58 O ATOM 425 OP2 DC C 59 -0.596 23.200 51.321 1.00 34.26 O ATOM 426 O5' DC C 59 -0.044 22.229 53.523 1.00 34.37 O ATOM 427 C5' DC C 59 -0.027 20.983 54.224 1.00 34.17 C ATOM 428 C4' DC C 59 1.389 20.631 54.598 1.00 33.98 C ATOM 429 O4' DC C 59 2.013 19.821 53.570 1.00 32.67 O ATOM 430 C3' DC C 59 2.287 21.854 54.802 1.00 34.62 C ATOM 431 O3' DC C 59 2.901 21.791 56.087 1.00 36.69 O ATOM 432 C2' DC C 59 3.316 21.747 53.683 1.00 33.30 C ATOM 433 C1' DC C 59 3.345 20.258 53.388 1.00 31.54 C ATOM 434 N1 DC C 59 3.763 19.898 52.018 1.00 29.82 N ATOM 435 C2 DC C 59 4.722 18.880 51.851 1.00 28.48 C ATOM 436 O2 DC C 59 5.170 18.297 52.858 1.00 28.16 O ATOM 437 N3 DC C 59 5.133 18.562 50.604 1.00 26.71 N ATOM 438 C4 DC C 59 4.635 19.211 49.553 1.00 26.30 C ATOM 439 N4 DC C 59 5.087 18.876 48.353 1.00 25.54 N ATOM 440 C5 DC C 59 3.652 20.238 49.691 1.00 26.98 C ATOM 441 C6 DC C 59 3.246 20.543 50.929 1.00 27.98 C ATOM 442 P DG C 60 3.780 23.026 56.628 1.00 37.69 P ATOM 443 OP1 DG C 60 3.226 23.378 57.962 1.00 38.30 O ATOM 444 OP2 DG C 60 3.916 24.083 55.582 1.00 37.88 O ATOM 445 O5' DG C 60 5.198 22.338 56.811 1.00 35.66 O ATOM 446 C5' DG C 60 5.279 20.924 57.068 1.00 33.40 C ATOM 447 C4' DG C 60 6.677 20.425 56.805 1.00 31.99 C ATOM 448 O4' DG C 60 6.812 19.899 55.461 1.00 29.88 O ATOM 449 C3' DG C 60 7.721 21.525 56.954 1.00 32.04 C ATOM 450 O3' DG C 60 8.731 21.151 57.872 1.00 34.24 O ATOM 451 C2' DG C 60 8.287 21.704 55.557 1.00 30.19 C ATOM 452 C1' DG C 60 8.005 20.380 54.871 1.00 27.44 C ATOM 453 N9 DG C 60 7.753 20.562 53.449 1.00 23.42 N ATOM 454 C8 DG C 60 6.802 21.379 52.892 1.00 22.43 C ATOM 455 N7 DG C 60 6.822 21.377 51.589 1.00 21.43 N ATOM 456 C5 DG C 60 7.839 20.487 51.262 1.00 20.13 C ATOM 457 C6 DG C 60 8.317 20.074 50.001 1.00 18.44 C ATOM 458 O6 DG C 60 7.909 20.398 48.883 1.00 18.84 O ATOM 459 N1 DG C 60 9.377 19.189 50.121 1.00 17.59 N ATOM 460 C2 DG C 60 9.900 18.749 51.307 1.00 17.84 C ATOM 461 N2 DG C 60 10.940 17.916 51.217 1.00 17.61 N ATOM 462 N3 DG C 60 9.445 19.104 52.493 1.00 19.06 N ATOM 463 C4 DG C 60 8.423 19.976 52.398 1.00 20.79 C ATOM 464 P DC C 61 9.690 22.281 58.471 1.00 35.82 P ATOM 465 OP1 DC C 61 9.904 21.939 59.900 1.00 36.80 O ATOM 466 OP2 DC C 61 9.159 23.624 58.096 1.00 35.66 O ATOM 467 O5' DC C 61 11.050 22.027 57.686 1.00 34.62 O ATOM 468 C5' DC C 61 11.697 20.749 57.771 1.00 31.52 C ATOM 469 C4' DC C 61 12.774 20.633 56.721 1.00 29.51 C ATOM 470 O4' DC C 61 12.183 20.557 55.397 1.00 28.07 O ATOM 471 C3' DC C 61 13.761 21.803 56.684 1.00 28.82 C ATOM 472 O3' DC C 61 15.052 21.242 56.431 1.00 29.27 O ATOM 473 C2' DC C 61 13.317 22.592 55.463 1.00 27.73 C ATOM 474 C1' DC C 61 12.878 21.458 54.555 1.00 26.15 C ATOM 475 N1 DC C 61 12.008 21.813 53.418 1.00 22.76 N ATOM 476 C2 DC C 61 12.329 21.298 52.157 1.00 21.40 C ATOM 477 O2 DC C 61 13.274 20.488 52.059 1.00 21.39 O ATOM 478 N3 DC C 61 11.603 21.683 51.082 1.00 19.22 N ATOM 479 C4 DC C 61 10.579 22.523 51.234 1.00 18.07 C ATOM 480 N4 DC C 61 9.921 22.895 50.147 1.00 16.16 N ATOM 481 C5 DC C 61 10.197 23.021 52.514 1.00 19.21 C ATOM 482 C6 DC C 61 10.934 22.645 53.570 1.00 21.01 C TER 483 DC C 61 ATOM 484 N ARG A 103 -15.363 8.763 60.500 1.00 88.02 N ATOM 485 CA ARG A 103 -14.180 8.154 61.099 1.00 87.55 C ATOM 486 C ARG A 103 -14.515 6.948 61.978 1.00 86.76 C ATOM 487 O ARG A 103 -14.471 7.036 63.208 1.00 86.74 O ATOM 488 CB ARG A 103 -13.410 9.188 61.926 1.00 88.28 C ATOM 489 CG ARG A 103 -12.386 10.013 61.152 1.00 89.07 C ATOM 490 CD ARG A 103 -12.979 11.164 60.345 1.00 89.34 C ATOM 491 NE ARG A 103 -11.943 12.147 60.011 1.00 89.65 N ATOM 492 CZ ARG A 103 -11.025 11.993 59.057 1.00 89.68 C ATOM 493 NH1 ARG A 103 -10.999 10.893 58.312 1.00 89.71 N ATOM 494 NH2 ARG A 103 -10.098 12.926 58.878 1.00 89.53 N ATOM 495 N PRO A 104 -14.847 5.802 61.355 1.00 85.99 N ATOM 496 CA PRO A 104 -15.195 4.556 62.052 1.00 85.40 C ATOM 497 C PRO A 104 -14.014 3.802 62.676 1.00 84.58 C ATOM 498 O PRO A 104 -14.214 2.814 63.388 1.00 84.91 O ATOM 499 CB PRO A 104 -15.851 3.725 60.949 1.00 85.48 C ATOM 500 CG PRO A 104 -15.100 4.145 59.738 1.00 85.71 C ATOM 501 CD PRO A 104 -15.036 5.649 59.900 1.00 85.93 C ATOM 502 N TYR A 105 -12.794 4.269 62.413 1.00 83.30 N ATOM 503 CA TYR A 105 -11.586 3.626 62.936 1.00 81.55 C ATOM 504 C TYR A 105 -10.584 4.665 63.465 1.00 79.42 C ATOM 505 O TYR A 105 -10.269 5.635 62.778 1.00 79.32 O ATOM 506 CB TYR A 105 -10.919 2.782 61.834 1.00 82.63 C ATOM 507 CG TYR A 105 -11.827 1.770 61.140 1.00 83.55 C ATOM 508 CD1 TYR A 105 -12.128 0.539 61.734 1.00 84.10 C ATOM 509 CD2 TYR A 105 -12.359 2.033 59.874 1.00 83.85 C ATOM 510 CE1 TYR A 105 -12.937 -0.409 61.078 1.00 84.38 C ATOM 511 CE2 TYR A 105 -13.167 1.096 59.212 1.00 84.19 C ATOM 512 CZ TYR A 105 -13.450 -0.122 59.817 1.00 84.29 C ATOM 513 OH TYR A 105 -14.232 -1.049 59.160 1.00 83.97 O ATOM 514 N ALA A 106 -10.082 4.456 64.681 1.00 76.47 N ATOM 515 CA ALA A 106 -9.116 5.377 65.285 1.00 73.51 C ATOM 516 C ALA A 106 -7.742 4.734 65.490 1.00 71.36 C ATOM 517 O ALA A 106 -7.563 3.537 65.252 1.00 70.80 O ATOM 518 CB ALA A 106 -9.650 5.911 66.609 1.00 73.69 C ATOM 519 N CYS A 107 -6.777 5.538 65.939 1.00 68.61 N ATOM 520 CA CYS A 107 -5.418 5.059 66.173 1.00 65.72 C ATOM 521 C CYS A 107 -5.172 4.621 67.619 1.00 65.66 C ATOM 522 O CYS A 107 -5.262 5.429 68.552 1.00 65.76 O ATOM 523 CB CYS A 107 -4.398 6.122 65.777 1.00 63.85 C ATOM 524 SG CYS A 107 -2.714 5.518 65.824 1.00 59.41 S ATOM 525 N PRO A 108 -4.798 3.341 67.806 1.00 65.03 N ATOM 526 CA PRO A 108 -4.505 2.666 69.076 1.00 64.51 C ATOM 527 C PRO A 108 -3.360 3.241 69.905 1.00 64.04 C ATOM 528 O PRO A 108 -3.454 3.290 71.131 1.00 64.00 O ATOM 529 CB PRO A 108 -4.202 1.241 68.635 1.00 64.62 C ATOM 530 CG PRO A 108 -3.637 1.421 67.269 1.00 64.96 C ATOM 531 CD PRO A 108 -4.582 2.420 66.678 1.00 64.87 C ATOM 532 N VAL A 109 -2.268 3.633 69.254 1.00 63.61 N ATOM 533 CA VAL A 109 -1.133 4.201 69.972 1.00 63.72 C ATOM 534 C VAL A 109 -1.647 5.404 70.751 1.00 65.32 C ATOM 535 O VAL A 109 -2.188 6.346 70.171 1.00 65.65 O ATOM 536 CB VAL A 109 -0.007 4.626 69.013 1.00 62.41 C ATOM 537 CG1 VAL A 109 1.188 5.128 69.791 1.00 61.84 C ATOM 538 CG2 VAL A 109 0.402 3.457 68.155 1.00 61.85 C ATOM 539 N GLU A 110 -1.555 5.317 72.076 1.00 67.43 N ATOM 540 CA GLU A 110 -2.027 6.377 72.971 1.00 68.81 C ATOM 541 C GLU A 110 -1.361 7.721 72.673 1.00 69.11 C ATOM 542 O GLU A 110 -1.965 8.778 72.881 1.00 69.50 O ATOM 543 CB GLU A 110 -1.816 5.972 74.442 1.00 69.39 C ATOM 544 CG GLU A 110 -2.496 6.873 75.488 1.00 70.15 C ATOM 545 CD GLU A 110 -1.570 7.927 76.103 1.00 70.45 C ATOM 546 OE1 GLU A 110 -0.329 7.785 76.013 1.00 70.57 O ATOM 547 OE2 GLU A 110 -2.092 8.897 76.698 1.00 70.82 O ATOM 548 N SER A 111 -0.136 7.676 72.150 1.00 68.94 N ATOM 549 CA SER A 111 0.597 8.893 71.813 1.00 68.96 C ATOM 550 C SER A 111 0.227 9.470 70.434 1.00 68.59 C ATOM 551 O SER A 111 1.031 10.164 69.802 1.00 69.16 O ATOM 552 CB SER A 111 2.113 8.655 71.926 1.00 69.52 C ATOM 553 OG SER A 111 2.539 7.523 71.181 1.00 70.07 O ATOM 554 N CYS A 112 -0.999 9.196 69.984 1.00 67.31 N ATOM 555 CA CYS A 112 -1.481 9.689 68.700 1.00 65.86 C ATOM 556 C CYS A 112 -3.000 9.851 68.650 1.00 65.74 C ATOM 557 O CYS A 112 -3.760 8.964 69.057 1.00 64.65 O ATOM 558 CB CYS A 112 -1.012 8.790 67.561 1.00 65.01 C ATOM 559 SG CYS A 112 -1.651 9.294 65.959 1.00 63.48 S ATOM 560 N ASP A 113 -3.426 10.983 68.100 1.00 66.13 N ATOM 561 CA ASP A 113 -4.836 11.307 67.995 1.00 67.06 C ATOM 562 C ASP A 113 -5.339 11.299 66.549 1.00 67.09 C ATOM 563 O ASP A 113 -5.938 12.272 66.093 1.00 67.29 O ATOM 564 CB ASP A 113 -5.075 12.682 68.625 1.00 67.75 C ATOM 565 CG ASP A 113 -6.502 12.867 69.099 1.00 68.41 C ATOM 566 OD1 ASP A 113 -7.380 13.174 68.260 1.00 68.64 O ATOM 567 OD2 ASP A 113 -6.742 12.706 70.317 1.00 68.54 O ATOM 568 N ARG A 114 -5.113 10.199 65.833 1.00 67.04 N ATOM 569 CA ARG A 114 -5.558 10.098 64.442 1.00 66.73 C ATOM 570 C ARG A 114 -6.813 9.256 64.228 1.00 66.54 C ATOM 571 O ARG A 114 -7.084 8.323 64.990 1.00 66.44 O ATOM 572 CB ARG A 114 -4.424 9.599 63.540 1.00 66.50 C ATOM 573 CG ARG A 114 -3.450 10.684 63.140 1.00 66.63 C ATOM 574 CD ARG A 114 -4.213 11.958 62.826 1.00 67.14 C ATOM 575 NE ARG A 114 -3.471 12.889 61.987 1.00 67.57 N ATOM 576 CZ ARG A 114 -3.751 13.112 60.706 1.00 67.82 C ATOM 577 NH1 ARG A 114 -3.033 13.981 60.011 1.00 67.77 N ATOM 578 NH2 ARG A 114 -4.754 12.468 60.119 1.00 67.71 N ATOM 579 N ARG A 115 -7.576 9.597 63.188 1.00 66.12 N ATOM 580 CA ARG A 115 -8.813 8.885 62.859 1.00 66.37 C ATOM 581 C ARG A 115 -8.984 8.751 61.334 1.00 66.01 C ATOM 582 O ARG A 115 -8.736 9.709 60.597 1.00 66.22 O ATOM 583 CB ARG A 115 -10.015 9.618 63.470 1.00 66.87 C ATOM 584 CG ARG A 115 -9.859 9.985 64.947 1.00 67.22 C ATOM 585 CD ARG A 115 -11.180 10.407 65.577 1.00 67.61 C ATOM 586 NE ARG A 115 -11.543 9.540 66.699 1.00 67.78 N ATOM 587 CZ ARG A 115 -12.129 8.350 66.576 1.00 67.95 C ATOM 588 NH1 ARG A 115 -12.436 7.865 65.376 1.00 67.93 N ATOM 589 NH2 ARG A 115 -12.387 7.629 67.658 1.00 67.75 N ATOM 590 N APHE A 116 -9.422 7.575 60.871 0.50 65.17 N ATOM 591 N BPHE A 116 -9.468 7.545 60.875 0.50 59.54 N ATOM 592 CA APHE A 116 -9.598 7.304 59.434 0.50 64.44 C ATOM 593 CA BPHE A 116 -9.566 7.298 59.428 0.50 59.72 C ATOM 594 C APHE A 116 -10.961 6.740 59.010 0.50 63.86 C ATOM 595 C BPHE A 116 -10.933 6.756 58.957 0.50 59.98 C ATOM 596 O APHE A 116 -11.683 6.146 59.813 0.50 64.10 O ATOM 597 O BPHE A 116 -11.562 5.982 59.661 0.50 60.25 O ATOM 598 CB APHE A 116 -8.493 6.358 58.940 0.50 64.33 C ATOM 599 CB BPHE A 116 -8.456 6.346 58.970 0.50 59.30 C ATOM 600 CG APHE A 116 -7.108 6.909 59.106 0.50 64.04 C ATOM 601 CG BPHE A 116 -7.070 6.902 59.148 0.50 58.81 C ATOM 602 CD1APHE A 116 -6.424 6.752 60.306 0.50 63.76 C ATOM 603 CD1BPHE A 116 -6.383 6.718 60.342 0.50 58.42 C ATOM 604 CD2APHE A 116 -6.500 7.622 58.077 0.50 63.91 C ATOM 605 CD2BPHE A 116 -6.454 7.617 58.122 0.50 58.59 C ATOM 606 CE1APHE A 116 -5.161 7.303 60.482 0.50 63.68 C ATOM 607 CE1BPHE A 116 -5.103 7.241 60.518 0.50 58.29 C ATOM 608 CE2APHE A 116 -5.235 8.176 58.245 0.50 63.66 C ATOM 609 CE2BPHE A 116 -5.172 8.145 58.290 0.50 58.26 C ATOM 610 CZ APHE A 116 -4.564 8.016 59.450 0.50 63.54 C ATOM 611 CZ BPHE A 116 -4.497 7.957 59.491 0.50 58.13 C ATOM 612 N ASER A 117 -11.275 6.905 57.724 0.50 62.72 N ATOM 613 N BSER A 117 -11.369 7.190 57.783 0.50 60.06 N ATOM 614 CA ASER A 117 -12.529 6.434 57.130 0.50 61.47 C ATOM 615 CA BSER A 117 -12.652 6.736 57.251 0.50 60.05 C ATOM 616 C ASER A 117 -12.500 4.941 56.805 0.50 60.34 C ATOM 617 C BSER A 117 -12.623 5.222 57.269 0.50 59.80 C ATOM 618 O ASER A 117 -13.506 4.239 56.934 0.50 60.37 O ATOM 619 O BSER A 117 -13.662 4.578 57.423 0.50 59.84 O ATOM 620 CB ASER A 117 -12.816 7.227 55.845 0.50 61.60 C ATOM 621 CB BSER A 117 -12.890 7.233 55.822 0.50 60.18 C ATOM 622 OG ASER A 117 -13.893 6.676 55.101 0.50 61.46 O ATOM 623 OG BSER A 117 -13.667 8.409 55.827 0.50 60.39 O ATOM 624 N AARG A 118 -11.331 4.467 56.394 0.50 58.83 N ATOM 625 N BARG A 118 -11.422 4.664 57.139 0.50 59.48 N ATOM 626 CA AARG A 118 -11.136 3.073 56.009 0.50 57.28 C ATOM 627 CA BARG A 118 -11.277 3.225 57.165 0.50 59.24 C ATOM 628 C AARG A 118 -10.170 2.324 56.924 0.50 56.41 C ATOM 629 C BARG A 118 -9.966 2.585 57.605 0.50 59.00 C ATOM 630 O AARG A 118 -9.538 2.920 57.799 0.50 56.45 O ATOM 631 O BARG A 118 -9.045 3.248 58.090 0.50 58.94 O ATOM 632 CB AARG A 118 -10.646 3.028 54.562 0.50 56.92 C ATOM 633 CB BARG A 118 -11.792 2.602 55.875 0.50 59.17 C ATOM 634 CG AARG A 118 -9.863 4.275 54.173 0.50 56.33 C ATOM 635 CG BARG A 118 -11.360 3.272 54.584 0.50 59.25 C ATOM 636 CD AARG A 118 -9.579 4.344 52.697 0.50 55.62 C ATOM 637 CD BARG A 118 -11.768 2.363 53.456 0.50 59.28 C ATOM 638 NE AARG A 118 -10.783 4.388 51.895 0.50 55.04 N ATOM 639 NE BARG A 118 -11.269 1.024 53.738 0.50 59.10 N ATOM 640 CZ AARG A 118 -11.564 5.454 51.777 0.50 54.66 C ATOM 641 CZ BARG A 118 -10.340 0.408 53.021 0.50 59.21 C ATOM 642 NH1AARG A 118 -11.275 6.591 52.405 0.50 54.31 N ATOM 643 NH1BARG A 118 -9.812 1.007 51.975 0.50 58.98 N ATOM 644 NH2AARG A 118 -12.664 5.363 51.056 0.50 54.45 N ATOM 645 NH2BARG A 118 -9.867 -0.769 53.419 0.50 59.16 N ATOM 646 N ASER A 119 -10.068 1.013 56.709 0.50 55.11 N ATOM 647 N BSER A 119 -9.906 1.277 57.382 0.50 58.58 N ATOM 648 CA ASER A 119 -9.194 0.150 57.498 0.50 53.82 C ATOM 649 CA BSER A 119 -8.807 0.423 57.799 0.50 58.17 C ATOM 650 C ASER A 119 -7.817 0.054 56.851 0.50 52.52 C ATOM 651 C BSER A 119 -7.560 0.304 56.925 0.50 57.64 C ATOM 652 O ASER A 119 -6.812 -0.159 57.536 0.50 52.56 O ATOM 653 O BSER A 119 -6.465 0.200 57.468 0.50 57.56 O ATOM 654 CB ASER A 119 -9.803 -1.253 57.633 0.50 54.25 C ATOM 655 CB BSER A 119 -9.376 -0.965 58.118 0.50 58.50 C ATOM 656 OG ASER A 119 -11.034 -1.222 58.337 0.50 54.53 O ATOM 657 OG BSER A 119 -10.679 -0.813 58.685 0.50 58.60 O ATOM 658 N AALA A 120 -7.776 0.205 55.530 0.50 50.65 N ATOM 659 N BALA A 120 -7.694 0.314 55.602 0.50 56.94 N ATOM 660 CA AALA A 120 -6.525 0.149 54.788 0.50 48.85 C ATOM 661 CA BALA A 120 -6.538 0.208 54.739 0.50 56.39 C ATOM 662 C AALA A 120 -5.699 1.383 55.122 0.50 47.59 C ATOM 663 C BALA A 120 -5.651 1.400 55.044 0.50 55.96 C ATOM 664 O AALA A 120 -4.470 1.363 55.048 0.50 46.94 O ATOM 665 O BALA A 120 -4.444 1.269 55.072 0.50 55.26 O ATOM 666 CB AALA A 120 -6.801 0.085 53.285 0.50 49.01 C ATOM 667 CB BALA A 120 -6.947 0.197 53.285 0.50 56.43 C ATOM 668 N GLU A 121 -6.400 2.450 55.501 1.00 46.15 N ATOM 669 CA GLU A 121 -5.777 3.722 55.860 1.00 45.40 C ATOM 670 C GLU A 121 -5.189 3.711 57.272 1.00 43.06 C ATOM 671 O GLU A 121 -4.123 4.278 57.518 1.00 42.14 O ATOM 672 CB GLU A 121 -6.793 4.863 55.683 1.00 46.36 C ATOM 673 CG GLU A 121 -6.718 5.575 54.320 1.00 47.51 C ATOM 674 CD GLU A 121 -6.246 4.672 53.179 1.00 48.47 C ATOM 675 OE1 GLU A 121 -6.883 3.638 52.886 1.00 48.56 O ATOM 676 OE2 GLU A 121 -5.216 4.999 52.564 1.00 50.08 O ATOM 677 N LEU A 122 -5.878 3.055 58.197 1.00 40.54 N ATOM 678 CA LEU A 122 -5.390 2.969 59.559 1.00 38.30 C ATOM 679 C LEU A 122 -4.184 2.017 59.592 1.00 36.18 C ATOM 680 O LEU A 122 -3.247 2.241 60.358 1.00 34.82 O ATOM 681 CB LEU A 122 -6.524 2.527 60.495 1.00 39.29 C ATOM 682 CG LEU A 122 -6.386 2.744 62.010 1.00 39.74 C ATOM 683 CD1 LEU A 122 -5.681 1.587 62.647 1.00 40.15 C ATOM 684 CD2 LEU A 122 -5.654 4.040 62.323 1.00 40.24 C ATOM 685 N THR A 123 -4.192 1.006 58.711 1.00 34.18 N ATOM 686 CA THR A 123 -3.101 0.019 58.587 1.00 32.78 C ATOM 687 C THR A 123 -1.836 0.639 57.965 1.00 32.12 C ATOM 688 O THR A 123 -0.707 0.299 58.352 1.00 31.17 O ATOM 689 CB THR A 123 -3.532 -1.226 57.739 1.00 32.91 C ATOM 690 OG1 THR A 123 -4.582 -1.929 58.414 1.00 32.72 O ATOM 691 CG2 THR A 123 -2.360 -2.179 57.494 1.00 31.66 C ATOM 692 N ARG A 124 -2.030 1.531 56.991 1.00 31.58 N ATOM 693 CA ARG A 124 -0.912 2.213 56.336 1.00 30.77 C ATOM 694 C ARG A 124 -0.315 3.231 57.319 1.00 30.86 C ATOM 695 O ARG A 124 0.898 3.390 57.409 1.00 30.03 O ATOM 696 CB ARG A 124 -1.390 2.934 55.075 1.00 30.09 C ATOM 697 CG ARG A 124 -0.279 3.649 54.309 1.00 29.64 C ATOM 698 CD ARG A 124 -0.816 4.398 53.092 1.00 28.41 C ATOM 699 NE ARG A 124 -1.713 5.493 53.459 1.00 26.44 N ATOM 700 CZ ARG A 124 -2.293 6.317 52.590 1.00 26.59 C ATOM 701 NH1 ARG A 124 -2.081 6.181 51.281 1.00 25.43 N ATOM 702 NH2 ARG A 124 -3.090 7.284 53.029 1.00 25.76 N ATOM 703 N HIS A 125 -1.191 3.897 58.063 1.00 31.26 N ATOM 704 CA HIS A 125 -0.808 4.898 59.046 1.00 31.67 C ATOM 705 C HIS A 125 0.026 4.302 60.167 1.00 31.82 C ATOM 706 O HIS A 125 1.034 4.877 60.571 1.00 31.83 O ATOM 707 CB HIS A 125 -2.074 5.546 59.628 1.00 31.86 C ATOM 708 CG HIS A 125 -1.831 6.348 60.867 1.00 31.83 C ATOM 709 ND1 HIS A 125 -0.972 7.424 60.899 1.00 31.76 N ATOM 710 CD2 HIS A 125 -2.325 6.224 62.120 1.00 32.10 C ATOM 711 CE1 HIS A 125 -0.944 7.930 62.117 1.00 32.09 C ATOM 712 NE2 HIS A 125 -1.759 7.220 62.878 1.00 32.86 N ATOM 713 N ILE A 126 -0.400 3.148 60.669 1.00 32.13 N ATOM 714 CA ILE A 126 0.297 2.478 61.764 1.00 32.58 C ATOM 715 C ILE A 126 1.800 2.329 61.530 1.00 32.28 C ATOM 716 O ILE A 126 2.567 2.282 62.489 1.00 31.58 O ATOM 717 CB ILE A 126 -0.391 1.102 62.089 1.00 33.27 C ATOM 718 CG1 ILE A 126 -1.374 1.280 63.243 1.00 33.48 C ATOM 719 CG2 ILE A 126 0.628 0.003 62.409 1.00 33.51 C ATOM 720 CD1 ILE A 126 -0.730 1.718 64.530 1.00 33.12 C ATOM 721 N ARG A 127 2.221 2.295 60.265 1.00 33.14 N ATOM 722 CA ARG A 127 3.636 2.162 59.918 1.00 33.69 C ATOM 723 C ARG A 127 4.458 3.324 60.464 1.00 32.08 C ATOM 724 O ARG A 127 5.672 3.195 60.658 1.00 31.56 O ATOM 725 CB ARG A 127 3.822 2.069 58.395 1.00 37.06 C ATOM 726 CG ARG A 127 3.340 0.773 57.774 1.00 40.32 C ATOM 727 CD ARG A 127 3.645 0.755 56.257 1.00 43.62 C ATOM 728 NE ARG A 127 3.420 -0.574 55.681 1.00 46.93 N ATOM 729 CZ ARG A 127 2.366 -0.920 54.939 1.00 48.35 C ATOM 730 NH1 ARG A 127 1.412 -0.034 54.654 1.00 48.46 N ATOM 731 NH2 ARG A 127 2.252 -2.173 54.506 1.00 49.28 N ATOM 732 N ILE A 128 3.803 4.474 60.641 1.00 31.01 N ATOM 733 CA ILE A 128 4.456 5.664 61.199 1.00 30.60 C ATOM 734 C ILE A 128 5.041 5.321 62.570 1.00 30.52 C ATOM 735 O ILE A 128 6.195 5.641 62.857 1.00 30.45 O ATOM 736 CB ILE A 128 3.441 6.824 61.326 1.00 30.60 C ATOM 737 CG1 ILE A 128 3.068 7.347 59.933 1.00 31.31 C ATOM 738 CG2 ILE A 128 3.999 7.939 62.191 1.00 30.87 C ATOM 739 CD1 ILE A 128 1.974 8.393 59.933 1.00 30.86 C ATOM 740 N HIS A 129 4.252 4.608 63.370 1.00 29.74 N ATOM 741 CA HIS A 129 4.640 4.198 64.713 1.00 29.19 C ATOM 742 C HIS A 129 5.507 2.932 64.763 1.00 29.63 C ATOM 743 O HIS A 129 6.383 2.828 65.612 1.00 30.25 O ATOM 744 CB HIS A 129 3.397 4.009 65.576 1.00 28.07 C ATOM 745 CG HIS A 129 2.445 5.165 65.538 1.00 27.01 C ATOM 746 ND1 HIS A 129 2.811 6.450 65.875 1.00 26.84 N ATOM 747 CD2 HIS A 129 1.129 5.221 65.220 1.00 26.61 C ATOM 748 CE1 HIS A 129 1.762 7.247 65.770 1.00 26.02 C ATOM 749 NE2 HIS A 129 0.729 6.526 65.374 1.00 26.13 N ATOM 750 N THR A 130 5.230 1.953 63.899 1.00 30.60 N ATOM 751 CA THR A 130 6.023 0.712 63.892 1.00 31.34 C ATOM 752 C THR A 130 7.340 0.879 63.142 1.00 31.95 C ATOM 753 O THR A 130 8.240 0.050 63.274 1.00 33.03 O ATOM 754 CB THR A 130 5.263 -0.529 63.307 1.00 31.18 C ATOM 755 OG1 THR A 130 5.072 -0.371 61.900 1.00 32.14 O ATOM 756 CG2 THR A 130 3.922 -0.716 63.971 1.00 31.17 C ATOM 757 N GLY A 131 7.437 1.942 62.342 1.00 32.20 N ATOM 758 CA GLY A 131 8.644 2.208 61.574 1.00 32.32 C ATOM 759 C GLY A 131 8.871 1.321 60.361 1.00 33.08 C ATOM 760 O GLY A 131 9.964 1.344 59.791 1.00 33.08 O ATOM 761 N GLN A 132 7.862 0.533 59.979 1.00 33.45 N ATOM 762 CA GLN A 132 7.955 -0.360 58.823 1.00 34.20 C ATOM 763 C GLN A 132 8.251 0.401 57.525 1.00 33.32 C ATOM 764 O GLN A 132 7.548 1.361 57.182 1.00 34.11 O ATOM 765 CB GLN A 132 6.632 -1.103 58.583 1.00 36.00 C ATOM 766 CG GLN A 132 6.148 -2.068 59.643 1.00 38.29 C ATOM 767 CD GLN A 132 4.676 -2.459 59.413 1.00 39.19 C ATOM 768 OE1 GLN A 132 3.833 -2.357 60.326 1.00 39.00 O ATOM 769 NE2 GLN A 132 4.355 -2.868 58.176 1.00 38.66 N ATOM 770 N LYS A 133 9.264 -0.074 56.798 1.00 31.89 N ATOM 771 CA LYS A 133 9.669 0.468 55.494 1.00 30.08 C ATOM 772 C LYS A 133 9.923 -0.760 54.601 1.00 29.04 C ATOM 773 O LYS A 133 11.076 -1.140 54.368 1.00 28.96 O ATOM 774 CB LYS A 133 10.938 1.314 55.626 1.00 29.58 C ATOM 775 CG LYS A 133 10.729 2.658 56.289 1.00 28.72 C ATOM 776 CD LYS A 133 12.025 3.428 56.269 1.00 29.94 C ATOM 777 CE LYS A 133 11.828 4.883 56.620 1.00 29.77 C ATOM 778 NZ LYS A 133 13.120 5.592 56.453 1.00 30.88 N ATOM 779 N PRO A 134 8.840 -1.394 54.102 1.00 28.55 N ATOM 780 CA PRO A 134 8.801 -2.588 53.247 1.00 28.15 C ATOM 781 C PRO A 134 9.385 -2.524 51.839 1.00 27.86 C ATOM 782 O PRO A 134 9.635 -3.569 51.241 1.00 27.84 O ATOM 783 CB PRO A 134 7.297 -2.896 53.149 1.00 27.85 C ATOM 784 CG PRO A 134 6.691 -2.201 54.311 1.00 28.13 C ATOM 785 CD PRO A 134 7.467 -0.918 54.350 1.00 28.48 C ATOM 786 N PHE A 135 9.569 -1.317 51.300 1.00 26.94 N ATOM 787 CA PHE A 135 10.041 -1.170 49.925 1.00 25.16 C ATOM 788 C PHE A 135 11.444 -0.643 49.811 1.00 24.51 C ATOM 789 O PHE A 135 11.701 0.491 50.179 1.00 25.89 O ATOM 790 CB PHE A 135 9.069 -0.287 49.167 1.00 24.81 C ATOM 791 CG PHE A 135 7.645 -0.634 49.431 1.00 24.40 C ATOM 792 CD1 PHE A 135 6.953 -0.035 50.480 1.00 24.12 C ATOM 793 CD2 PHE A 135 7.009 -1.607 48.677 1.00 24.33 C ATOM 794 CE1 PHE A 135 5.638 -0.402 50.778 1.00 23.67 C ATOM 795 CE2 PHE A 135 5.694 -1.985 48.962 1.00 24.28 C ATOM 796 CZ PHE A 135 5.008 -1.382 50.020 1.00 23.83 C ATOM 797 N GLN A 136 12.343 -1.455 49.263 1.00 23.55 N ATOM 798 CA GLN A 136 13.729 -1.060 49.120 1.00 23.43 C ATOM 799 C GLN A 136 14.134 -0.673 47.693 1.00 22.89 C ATOM 800 O GLN A 136 13.621 -1.225 46.716 1.00 22.40 O ATOM 801 CB GLN A 136 14.634 -2.174 49.644 1.00 23.67 C ATOM 802 CG GLN A 136 16.073 -1.758 49.835 1.00 25.10 C ATOM 803 CD GLN A 136 16.929 -2.890 50.381 1.00 26.89 C ATOM 804 OE1 GLN A 136 16.826 -4.042 49.912 1.00 27.95 O ATOM 805 NE2 GLN A 136 17.754 -2.590 51.398 1.00 26.73 N ATOM 806 N CYS A 137 15.006 0.332 47.597 1.00 22.83 N ATOM 807 CA CYS A 137 15.537 0.819 46.320 1.00 21.66 C ATOM 808 C CYS A 137 16.775 -0.024 46.066 1.00 22.53 C ATOM 809 O CYS A 137 17.686 -0.048 46.889 1.00 23.44 O ATOM 810 CB CYS A 137 15.922 2.301 46.411 1.00 20.40 C ATOM 811 SG CYS A 137 16.756 2.954 44.951 1.00 19.21 S ATOM 812 N ARG A 138 16.815 -0.714 44.934 1.00 23.14 N ATOM 813 CA ARG A 138 17.959 -1.559 44.629 1.00 24.08 C ATOM 814 C ARG A 138 19.185 -0.773 44.229 1.00 23.90 C ATOM 815 O ARG A 138 20.291 -1.297 44.239 1.00 23.70 O ATOM 816 CB ARG A 138 17.628 -2.550 43.523 1.00 25.43 C ATOM 817 CG ARG A 138 17.395 -1.907 42.192 1.00 26.20 C ATOM 818 CD ARG A 138 17.186 -2.955 41.135 1.00 27.79 C ATOM 819 NE ARG A 138 15.983 -3.749 41.361 1.00 27.66 N ATOM 820 CZ ARG A 138 15.819 -4.975 40.880 1.00 27.48 C ATOM 821 NH1 ARG A 138 14.698 -5.640 41.125 1.00 27.11 N ATOM 822 NH2 ARG A 138 16.790 -5.538 40.169 1.00 26.93 N ATOM 823 N ILE A 139 18.987 0.480 43.854 1.00 22.99 N ATOM 824 CA ILE A 139 20.105 1.303 43.443 1.00 23.69 C ATOM 825 C ILE A 139 20.891 1.852 44.633 1.00 24.14 C ATOM 826 O ILE A 139 22.106 1.667 44.704 1.00 24.75 O ATOM 827 CB ILE A 139 19.640 2.418 42.479 1.00 23.76 C ATOM 828 CG1 ILE A 139 19.019 1.767 41.232 1.00 23.10 C ATOM 829 CG2 ILE A 139 20.819 3.330 42.107 1.00 22.31 C ATOM 830 CD1 ILE A 139 18.141 2.675 40.419 1.00 24.82 C ATOM 831 N CYS A 140 20.207 2.459 45.600 1.00 24.48 N ATOM 832 CA CYS A 140 20.907 3.009 46.755 1.00 24.16 C ATOM 833 C CYS A 140 20.650 2.272 48.071 1.00 25.35 C ATOM 834 O CYS A 140 21.238 2.619 49.095 1.00 25.29 O ATOM 835 CB CYS A 140 20.585 4.484 46.917 1.00 23.70 C ATOM 836 SG CYS A 140 18.940 4.791 47.524 1.00 22.65 S ATOM 837 N MET A 141 19.770 1.273 48.040 1.00 26.51 N ATOM 838 CA MET A 141 19.438 0.453 49.215 1.00 28.23 C ATOM 839 C MET A 141 18.593 1.126 50.302 1.00 26.94 C ATOM 840 O MET A 141 18.324 0.526 51.346 1.00 26.00 O ATOM 841 CB MET A 141 20.697 -0.174 49.843 1.00 30.70 C ATOM 842 CG MET A 141 21.512 -1.028 48.878 1.00 34.32 C ATOM 843 SD MET A 141 20.442 -2.073 47.850 1.00 38.78 S ATOM 844 CE MET A 141 19.956 -3.312 49.035 1.00 37.62 C ATOM 845 N ARG A 142 18.166 2.359 50.056 1.00 25.12 N ATOM 846 CA ARG A 142 17.338 3.080 51.010 1.00 23.50 C ATOM 847 C ARG A 142 15.940 2.453 51.049 1.00 23.34 C ATOM 848 O ARG A 142 15.398 2.068 50.015 1.00 23.98 O ATOM 849 CB ARG A 142 17.257 4.555 50.603 1.00 22.17 C ATOM 850 CG ARG A 142 16.372 5.372 51.496 1.00 20.78 C ATOM 851 CD ARG A 142 16.492 6.842 51.203 1.00 19.80 C ATOM 852 NE ARG A 142 15.670 7.575 52.148 1.00 20.03 N ATOM 853 CZ ARG A 142 15.816 8.855 52.456 1.00 19.38 C ATOM 854 NH1 ARG A 142 16.753 9.587 51.882 1.00 19.14 N ATOM 855 NH2 ARG A 142 15.075 9.376 53.416 1.00 21.17 N ATOM 856 N ASN A 143 15.386 2.297 52.243 1.00 23.09 N ATOM 857 CA ASN A 143 14.058 1.713 52.378 1.00 22.73 C ATOM 858 C ASN A 143 13.011 2.810 52.474 1.00 21.86 C ATOM 859 O ASN A 143 13.282 3.897 52.969 1.00 21.82 O ATOM 860 CB ASN A 143 13.993 0.796 53.617 1.00 24.53 C ATOM 861 CG ASN A 143 15.031 -0.332 53.576 1.00 25.53 C ATOM 862 OD1 ASN A 143 16.140 -0.191 54.102 1.00 26.90 O ATOM 863 ND2 ASN A 143 14.688 -1.443 52.943 1.00 26.48 N ATOM 864 N PHE A 144 11.807 2.505 52.005 1.00 21.21 N ATOM 865 CA PHE A 144 10.693 3.447 52.029 1.00 21.30 C ATOM 866 C PHE A 144 9.433 2.818 52.597 1.00 22.20 C ATOM 867 O PHE A 144 9.208 1.614 52.466 1.00 23.42 O ATOM 868 CB PHE A 144 10.419 3.989 50.625 1.00 20.50 C ATOM 869 CG PHE A 144 11.574 4.690 50.035 1.00 19.77 C ATOM 870 CD1 PHE A 144 12.585 3.972 49.403 1.00 19.80 C ATOM 871 CD2 PHE A 144 11.689 6.069 50.147 1.00 20.24 C ATOM 872 CE1 PHE A 144 13.694 4.608 48.905 1.00 20.05 C ATOM 873 CE2 PHE A 144 12.794 6.721 49.654 1.00 20.50 C ATOM 874 CZ PHE A 144 13.800 5.988 49.026 1.00 20.66 C ATOM 875 N SER A 145 8.626 3.640 53.242 1.00 21.89 N ATOM 876 CA SER A 145 7.390 3.175 53.832 1.00 22.87 C ATOM 877 C SER A 145 6.352 2.877 52.761 1.00 23.15 C ATOM 878 O SER A 145 5.462 2.047 52.962 1.00 24.41 O ATOM 879 CB SER A 145 6.836 4.244 54.762 1.00 22.31 C ATOM 880 OG SER A 145 6.527 5.410 54.025 1.00 21.80 O ATOM 881 N ARG A 146 6.488 3.522 51.610 1.00 22.61 N ATOM 882 CA ARG A 146 5.510 3.362 50.538 1.00 22.20 C ATOM 883 C ARG A 146 6.049 3.057 49.148 1.00 21.32 C ATOM 884 O ARG A 146 7.095 3.576 48.741 1.00 21.57 O ATOM 885 CB ARG A 146 4.582 4.578 50.525 1.00 22.00 C ATOM 886 CG ARG A 146 3.485 4.442 51.567 1.00 22.82 C ATOM 887 CD ARG A 146 2.790 5.726 51.855 1.00 23.26 C ATOM 888 NE ARG A 146 2.244 6.343 50.661 1.00 23.15 N ATOM 889 CZ ARG A 146 1.374 7.342 50.680 1.00 22.69 C ATOM 890 NH1 ARG A 146 0.936 7.828 51.836 1.00 22.49 N ATOM 891 NH2 ARG A 146 0.998 7.903 49.543 1.00 22.67 N ATOM 892 N SER A 147 5.330 2.188 48.437 1.00 20.14 N ATOM 893 CA SER A 147 5.728 1.784 47.091 1.00 20.35 C ATOM 894 C SER A 147 5.712 2.929 46.094 1.00 19.38 C ATOM 895 O SER A 147 6.614 3.032 45.255 1.00 20.10 O ATOM 896 CB SER A 147 4.865 0.621 46.574 1.00 19.79 C ATOM 897 OG SER A 147 3.499 0.975 46.474 1.00 20.32 O ATOM 898 N ASP A 148 4.686 3.774 46.187 1.00 19.63 N ATOM 899 CA ASP A 148 4.546 4.926 45.295 1.00 19.58 C ATOM 900 C ASP A 148 5.673 5.940 45.480 1.00 18.93 C ATOM 901 O ASP A 148 6.144 6.528 44.512 1.00 19.32 O ATOM 902 CB ASP A 148 3.161 5.586 45.435 1.00 21.09 C ATOM 903 CG ASP A 148 2.809 5.996 46.881 1.00 21.97 C ATOM 904 OD1 ASP A 148 2.077 6.991 47.027 1.00 21.31 O ATOM 905 OD2 ASP A 148 3.218 5.325 47.858 1.00 23.17 O ATOM 906 N HIS A 149 6.126 6.106 46.722 1.00 18.68 N ATOM 907 CA HIS A 149 7.220 7.020 47.030 1.00 16.99 C ATOM 908 C HIS A 149 8.531 6.397 46.594 1.00 17.53 C ATOM 909 O HIS A 149 9.489 7.107 46.283 1.00 17.06 O ATOM 910 CB HIS A 149 7.252 7.357 48.517 1.00 16.21 C ATOM 911 CG HIS A 149 6.089 8.189 48.975 1.00 15.29 C ATOM 912 ND1 HIS A 149 5.342 8.967 48.117 1.00 15.89 N ATOM 913 CD2 HIS A 149 5.548 8.365 50.204 1.00 15.16 C ATOM 914 CE1 HIS A 149 4.390 9.583 48.795 1.00 14.86 C ATOM 915 NE2 HIS A 149 4.495 9.234 50.064 1.00 14.72 N ATOM 916 N LEU A 150 8.586 5.062 46.576 1.00 17.69 N ATOM 917 CA LEU A 150 9.792 4.381 46.119 1.00 16.38 C ATOM 918 C LEU A 150 9.946 4.618 44.613 1.00 15.50 C ATOM 919 O LEU A 150 11.033 4.935 44.136 1.00 14.69 O ATOM 920 CB LEU A 150 9.728 2.876 46.413 1.00 16.91 C ATOM 921 CG LEU A 150 10.840 2.059 45.734 1.00 17.19 C ATOM 922 CD1 LEU A 150 12.224 2.473 46.228 1.00 15.69 C ATOM 923 CD2 LEU A 150 10.592 0.565 45.948 1.00 17.48 C ATOM 924 N THR A 151 8.841 4.490 43.883 1.00 15.56 N ATOM 925 CA THR A 151 8.822 4.681 42.432 1.00 15.92 C ATOM 926 C THR A 151 9.357 6.049 42.028 1.00 15.82 C ATOM 927 O THR A 151 10.261 6.142 41.195 1.00 16.83 O ATOM 928 CB THR A 151 7.396 4.503 41.881 1.00 16.53 C ATOM 929 OG1 THR A 151 6.966 3.166 42.144 1.00 17.67 O ATOM 930 CG2 THR A 151 7.338 4.769 40.379 1.00 16.03 C ATOM 931 N THR A 152 8.829 7.104 42.644 1.00 15.32 N ATOM 932 CA THR A 152 9.288 8.451 42.326 1.00 16.03 C ATOM 933 C THR A 152 10.733 8.684 42.779 1.00 16.02 C ATOM 934 O THR A 152 11.498 9.348 42.082 1.00 16.12 O ATOM 935 CB THR A 152 8.341 9.536 42.879 1.00 16.33 C ATOM 936 OG1 THR A 152 8.251 9.431 44.300 1.00 17.24 O ATOM 937 CG2 THR A 152 6.950 9.389 42.273 1.00 16.98 C ATOM 938 N HIS A 153 11.118 8.109 43.922 1.00 15.60 N ATOM 939 CA HIS A 153 12.488 8.230 44.417 1.00 15.30 C ATOM 940 C HIS A 153 13.487 7.655 43.405 1.00 15.67 C ATOM 941 O HIS A 153 14.573 8.204 43.207 1.00 16.22 O ATOM 942 CB HIS A 153 12.663 7.499 45.757 1.00 14.95 C ATOM 943 CG HIS A 153 14.091 7.138 46.056 1.00 16.05 C ATOM 944 ND1 HIS A 153 15.009 8.048 46.533 1.00 15.52 N ATOM 945 CD2 HIS A 153 14.778 5.987 45.855 1.00 16.15 C ATOM 946 CE1 HIS A 153 16.199 7.480 46.605 1.00 15.59 C ATOM 947 NE2 HIS A 153 16.086 6.228 46.198 1.00 15.79 N ATOM 948 N ILE A 154 13.131 6.529 42.790 1.00 15.77 N ATOM 949 CA ILE A 154 14.014 5.882 41.827 1.00 15.60 C ATOM 950 C ILE A 154 14.328 6.787 40.641 1.00 15.76 C ATOM 951 O ILE A 154 15.410 6.700 40.049 1.00 16.06 O ATOM 952 CB ILE A 154 13.435 4.526 41.362 1.00 15.28 C ATOM 953 CG1 ILE A 154 13.472 3.528 42.534 1.00 15.47 C ATOM 954 CG2 ILE A 154 14.214 3.989 40.153 1.00 14.25 C ATOM 955 CD1 ILE A 154 12.566 2.318 42.346 1.00 14.81 C ATOM 956 N ARG A 155 13.397 7.686 40.328 1.00 16.99 N ATOM 957 CA ARG A 155 13.576 8.625 39.223 1.00 17.05 C ATOM 958 C ARG A 155 14.727 9.596 39.496 1.00 17.21 C ATOM 959 O ARG A 155 15.258 10.205 38.572 1.00 17.70 O ATOM 960 CB ARG A 155 12.273 9.374 38.930 1.00 17.56 C ATOM 961 CG ARG A 155 11.143 8.453 38.503 1.00 16.90 C ATOM 962 CD ARG A 155 9.898 9.192 38.047 1.00 17.60 C ATOM 963 NE ARG A 155 8.858 8.229 37.686 1.00 18.65 N ATOM 964 CZ ARG A 155 7.554 8.394 37.880 1.00 18.59 C ATOM 965 NH1 ARG A 155 7.080 9.506 38.426 1.00 18.04 N ATOM 966 NH2 ARG A 155 6.728 7.394 37.608 1.00 19.12 N ATOM 967 N THR A 156 15.134 9.716 40.757 1.00 17.38 N ATOM 968 CA THR A 156 16.252 10.584 41.111 1.00 17.72 C ATOM 969 C THR A 156 17.583 9.988 40.603 1.00 18.17 C ATOM 970 O THR A 156 18.545 10.712 40.359 1.00 17.38 O ATOM 971 CB THR A 156 16.317 10.867 42.645 1.00 17.55 C ATOM 972 OG1 THR A 156 16.734 9.699 43.355 1.00 17.89 O ATOM 973 CG2 THR A 156 14.953 11.321 43.170 1.00 16.99 C ATOM 974 N HIS A 157 17.607 8.669 40.409 1.00 18.35 N ATOM 975 CA HIS A 157 18.791 7.969 39.914 1.00 18.03 C ATOM 976 C HIS A 157 18.763 7.875 38.394 1.00 17.87 C ATOM 977 O HIS A 157 19.770 8.102 37.732 1.00 18.54 O ATOM 978 CB HIS A 157 18.845 6.530 40.440 1.00 17.57 C ATOM 979 CG HIS A 157 18.818 6.414 41.924 1.00 16.40 C ATOM 980 ND1 HIS A 157 19.699 7.087 42.738 1.00 17.02 N ATOM 981 CD2 HIS A 157 18.048 5.660 42.738 1.00 15.97 C ATOM 982 CE1 HIS A 157 19.476 6.749 43.995 1.00 17.50 C ATOM 983 NE2 HIS A 157 18.478 5.882 44.020 1.00 17.33 N ATOM 984 N THR A 158 17.615 7.466 37.860 1.00 18.36 N ATOM 985 CA THR A 158 17.439 7.291 36.421 1.00 19.40 C ATOM 986 C THR A 158 17.325 8.574 35.600 1.00 19.70 C ATOM 987 O THR A 158 17.670 8.585 34.423 1.00 20.39 O ATOM 988 CB THR A 158 16.208 6.426 36.114 1.00 19.34 C ATOM 989 OG1 THR A 158 15.018 7.132 36.499 1.00 18.73 O ATOM 990 CG2 THR A 158 16.294 5.093 36.878 1.00 20.42 C ATOM 991 N GLY A 159 16.838 9.641 36.230 1.00 19.86 N ATOM 992 CA GLY A 159 16.666 10.907 35.550 1.00 18.81 C ATOM 993 C GLY A 159 15.396 10.924 34.729 1.00 19.68 C ATOM 994 O GLY A 159 15.230 11.785 33.870 1.00 20.90 O ATOM 995 N GLU A 160 14.524 9.940 34.940 1.00 19.58 N ATOM 996 CA GLU A 160 13.261 9.867 34.216 1.00 19.76 C ATOM 997 C GLU A 160 12.372 11.026 34.672 1.00 20.04 C ATOM 998 O GLU A 160 12.186 11.233 35.881 1.00 19.84 O ATOM 999 CB GLU A 160 12.556 8.537 34.496 1.00 19.85 C ATOM 1000 CG GLU A 160 11.306 8.334 33.651 1.00 20.84 C ATOM 1001 CD GLU A 160 10.451 7.181 34.119 1.00 21.33 C ATOM 1002 OE1 GLU A 160 10.761 6.574 35.161 1.00 22.75 O ATOM 1003 OE2 GLU A 160 9.440 6.888 33.462 1.00 22.85 O ATOM 1004 N LYS A 161 11.824 11.764 33.702 1.00 19.44 N ATOM 1005 CA LYS A 161 10.959 12.918 33.973 1.00 19.53 C ATOM 1006 C LYS A 161 9.747 12.879 33.048 1.00 18.40 C ATOM 1007 O LYS A 161 9.727 13.537 32.015 1.00 19.01 O ATOM 1008 CB LYS A 161 11.747 14.218 33.795 1.00 19.48 C ATOM 1009 CG LYS A 161 12.862 14.381 34.824 1.00 20.98 C ATOM 1010 CD LYS A 161 13.640 15.667 34.618 1.00 22.93 C ATOM 1011 CE LYS A 161 14.786 15.777 35.615 1.00 24.41 C ATOM 1012 NZ LYS A 161 15.479 17.102 35.556 1.00 24.35 N ATOM 1013 N PRO A 162 8.692 12.146 33.455 1.00 17.88 N ATOM 1014 CA PRO A 162 7.437 11.958 32.710 1.00 17.33 C ATOM 1015 C PRO A 162 6.486 13.139 32.544 1.00 16.94 C ATOM 1016 O PRO A 162 5.634 13.110 31.665 1.00 17.69 O ATOM 1017 CB PRO A 162 6.723 10.844 33.497 1.00 16.90 C ATOM 1018 CG PRO A 162 7.776 10.271 34.416 1.00 17.90 C ATOM 1019 CD PRO A 162 8.633 11.448 34.754 1.00 17.05 C ATOM 1020 N PHE A 163 6.634 14.176 33.354 1.00 16.44 N ATOM 1021 CA PHE A 163 5.697 15.298 33.307 1.00 16.80 C ATOM 1022 C PHE A 163 6.273 16.610 32.771 1.00 16.51 C ATOM 1023 O PHE A 163 7.038 17.289 33.455 1.00 17.85 O ATOM 1024 CB PHE A 163 5.096 15.493 34.703 1.00 17.46 C ATOM 1025 CG PHE A 163 4.639 14.208 35.341 1.00 17.97 C ATOM 1026 CD1 PHE A 163 5.519 13.445 36.106 1.00 18.27 C ATOM 1027 CD2 PHE A 163 3.358 13.718 35.110 1.00 18.82 C ATOM 1028 CE1 PHE A 163 5.137 12.207 36.626 1.00 18.71 C ATOM 1029 CE2 PHE A 163 2.964 12.473 35.629 1.00 19.09 C ATOM 1030 CZ PHE A 163 3.861 11.720 36.385 1.00 18.61 C ATOM 1031 N ALA A 164 5.858 16.975 31.559 1.00 15.81 N ATOM 1032 CA ALA A 164 6.332 18.188 30.895 1.00 15.12 C ATOM 1033 C ALA A 164 5.353 19.351 31.015 1.00 14.79 C ATOM 1034 O ALA A 164 4.146 19.173 30.852 1.00 15.85 O ATOM 1035 CB ALA A 164 6.620 17.899 29.430 1.00 14.44 C ATOM 1036 N CYS A 165 5.880 20.542 31.293 1.00 14.68 N ATOM 1037 CA CYS A 165 5.055 21.733 31.411 1.00 15.09 C ATOM 1038 C CYS A 165 4.403 22.049 30.058 1.00 14.96 C ATOM 1039 O CYS A 165 5.066 22.032 29.015 1.00 15.32 O ATOM 1040 CB CYS A 165 5.898 22.919 31.883 1.00 14.87 C ATOM 1041 SG CYS A 165 5.024 24.515 31.902 1.00 16.58 S ATOM 1042 N ASP A 166 3.097 22.315 30.087 1.00 16.08 N ATOM 1043 CA ASP A 166 2.322 22.647 28.882 1.00 17.29 C ATOM 1044 C ASP A 166 2.785 23.945 28.214 1.00 17.15 C ATOM 1045 O ASP A 166 2.700 24.088 26.988 1.00 17.71 O ATOM 1046 CB ASP A 166 0.834 22.778 29.225 1.00 17.58 C ATOM 1047 CG ASP A 166 0.144 21.441 29.382 1.00 18.45 C ATOM 1048 OD1 ASP A 166 -0.942 21.402 29.990 1.00 18.86 O ATOM 1049 OD2 ASP A 166 0.665 20.432 28.878 1.00 19.68 O ATOM 1050 N ILE A 167 3.319 24.859 29.022 1.00 17.49 N ATOM 1051 CA ILE A 167 3.778 26.151 28.523 1.00 17.98 C ATOM 1052 C ILE A 167 5.226 26.229 28.019 1.00 17.64 C ATOM 1053 O ILE A 167 5.467 26.774 26.946 1.00 17.86 O ATOM 1054 CB ILE A 167 3.440 27.271 29.546 1.00 18.74 C ATOM 1055 CG1 ILE A 167 1.909 27.317 29.711 1.00 19.29 C ATOM 1056 CG2 ILE A 167 4.031 28.638 29.095 1.00 18.96 C ATOM 1057 CD1 ILE A 167 1.388 28.410 30.586 1.00 21.58 C ATOM 1058 N CYS A 168 6.178 25.644 28.741 1.00 17.12 N ATOM 1059 CA CYS A 168 7.576 25.702 28.299 1.00 17.19 C ATOM 1060 C CYS A 168 8.207 24.346 27.999 1.00 16.74 C ATOM 1061 O CYS A 168 9.327 24.279 27.500 1.00 17.47 O ATOM 1062 CB CYS A 168 8.437 26.441 29.324 1.00 15.90 C ATOM 1063 SG CYS A 168 8.709 25.517 30.838 1.00 17.21 S ATOM 1064 N GLY A 169 7.500 23.270 28.318 1.00 17.30 N ATOM 1065 CA GLY A 169 8.031 21.944 28.068 1.00 17.92 C ATOM 1066 C GLY A 169 9.041 21.418 29.082 1.00 18.20 C ATOM 1067 O GLY A 169 9.522 20.310 28.920 1.00 19.71 O ATOM 1068 N ARG A 170 9.385 22.192 30.109 1.00 18.17 N ATOM 1069 CA ARG A 170 10.329 21.731 31.135 1.00 17.76 C ATOM 1070 C ARG A 170 9.774 20.466 31.805 1.00 17.52 C ATOM 1071 O ARG A 170 8.607 20.426 32.207 1.00 17.13 O ATOM 1072 CB ARG A 170 10.571 22.825 32.185 1.00 18.77 C ATOM 1073 CG ARG A 170 11.576 22.439 33.239 1.00 19.79 C ATOM 1074 CD ARG A 170 12.013 23.636 34.044 1.00 21.96 C ATOM 1075 NE ARG A 170 12.893 23.239 35.142 1.00 24.43 N ATOM 1076 CZ ARG A 170 13.471 24.082 35.998 1.00 25.02 C ATOM 1077 NH1 ARG A 170 13.272 25.386 35.889 1.00 25.38 N ATOM 1078 NH2 ARG A 170 14.235 23.614 36.979 1.00 25.49 N ATOM 1079 N LYS A 171 10.616 19.445 31.934 1.00 17.42 N ATOM 1080 CA LYS A 171 10.199 18.158 32.505 1.00 17.47 C ATOM 1081 C LYS A 171 10.466 17.951 33.996 1.00 16.63 C ATOM 1082 O LYS A 171 11.428 18.478 34.550 1.00 16.88 O ATOM 1083 CB LYS A 171 10.840 17.016 31.705 1.00 18.85 C ATOM 1084 CG LYS A 171 10.451 16.950 30.229 1.00 20.58 C ATOM 1085 CD LYS A 171 11.332 15.939 29.513 1.00 23.60 C ATOM 1086 CE LYS A 171 10.752 15.498 28.187 1.00 25.41 C ATOM 1087 NZ LYS A 171 11.644 14.481 27.531 1.00 27.58 N ATOM 1088 N PHE A 172 9.599 17.168 34.637 1.00 15.02 N ATOM 1089 CA PHE A 172 9.708 16.880 36.063 1.00 14.53 C ATOM 1090 C PHE A 172 9.430 15.397 36.390 1.00 13.95 C ATOM 1091 O PHE A 172 8.638 14.738 35.722 1.00 13.14 O ATOM 1092 CB PHE A 172 8.731 17.768 36.842 1.00 15.04 C ATOM 1093 CG PHE A 172 8.971 19.246 36.658 1.00 14.93 C ATOM 1094 CD1 PHE A 172 8.411 19.926 35.581 1.00 14.53 C ATOM 1095 CD2 PHE A 172 9.786 19.947 37.542 1.00 15.48 C ATOM 1096 CE1 PHE A 172 8.664 21.289 35.386 1.00 14.47 C ATOM 1097 CE2 PHE A 172 10.045 21.316 37.356 1.00 15.00 C ATOM 1098 CZ PHE A 172 9.482 21.980 36.274 1.00 14.25 C ATOM 1099 N ALA A 173 10.084 14.897 37.436 1.00 14.59 N ATOM 1100 CA ALA A 173 9.928 13.513 37.887 1.00 15.87 C ATOM 1101 C ALA A 173 8.514 13.212 38.398 1.00 16.21 C ATOM 1102 O ALA A 173 7.996 12.106 38.181 1.00 17.62 O ATOM 1103 CB ALA A 173 10.971 13.181 38.985 1.00 14.93 C ATOM 1104 N ARG A 174 7.893 14.193 39.062 1.00 15.86 N ATOM 1105 CA ARG A 174 6.553 14.030 39.625 1.00 15.31 C ATOM 1106 C ARG A 174 5.558 15.059 39.100 1.00 16.64 C ATOM 1107 O ARG A 174 5.938 16.177 38.731 1.00 16.99 O ATOM 1108 CB ARG A 174 6.598 14.101 41.157 1.00 15.21 C ATOM 1109 CG ARG A 174 7.795 13.405 41.804 1.00 15.78 C ATOM 1110 CD ARG A 174 7.622 13.191 43.306 1.00 15.95 C ATOM 1111 NE ARG A 174 7.187 14.390 44.026 1.00 15.46 N ATOM 1112 CZ ARG A 174 7.672 14.795 45.198 1.00 14.92 C ATOM 1113 NH1 ARG A 174 8.627 14.110 45.811 1.00 15.63 N ATOM 1114 NH2 ARG A 174 7.175 15.881 45.777 1.00 13.83 N ATOM 1115 N SER A 175 4.279 14.681 39.095 1.00 16.28 N ATOM 1116 CA SER A 175 3.205 15.545 38.615 1.00 16.27 C ATOM 1117 C SER A 175 3.059 16.800 39.483 1.00 16.52 C ATOM 1118 O SER A 175 2.789 17.878 38.961 1.00 17.12 O ATOM 1119 CB SER A 175 1.867 14.789 38.577 1.00 15.49 C ATOM 1120 OG SER A 175 1.391 14.533 39.890 1.00 16.30 O ATOM 1121 N ASP A 176 3.239 16.661 40.794 1.00 16.30 N ATOM 1122 CA ASP A 176 3.111 17.808 41.696 1.00 15.81 C ATOM 1123 C ASP A 176 4.255 18.800 41.514 1.00 15.52 C ATOM 1124 O ASP A 176 4.101 19.988 41.810 1.00 15.25 O ATOM 1125 CB ASP A 176 2.990 17.366 43.164 1.00 16.14 C ATOM 1126 CG ASP A 176 4.225 16.667 43.666 1.00 16.55 C ATOM 1127 OD1 ASP A 176 4.839 17.163 44.630 1.00 17.38 O ATOM 1128 OD2 ASP A 176 4.595 15.617 43.101 1.00 17.21 O ATOM 1129 N GLU A 177 5.414 18.321 41.062 1.00 14.40 N ATOM 1130 CA GLU A 177 6.543 19.222 40.810 1.00 16.69 C ATOM 1131 C GLU A 177 6.158 20.081 39.611 1.00 16.21 C ATOM 1132 O GLU A 177 6.360 21.297 39.620 1.00 17.22 O ATOM 1133 CB GLU A 177 7.827 18.459 40.508 1.00 17.44 C ATOM 1134 CG GLU A 177 8.485 17.867 41.726 1.00 18.27 C ATOM 1135 CD GLU A 177 9.686 17.009 41.385 1.00 20.22 C ATOM 1136 OE1 GLU A 177 9.691 16.352 40.321 1.00 21.00 O ATOM 1137 OE2 GLU A 177 10.629 16.969 42.199 1.00 21.94 O ATOM 1138 N ARG A 178 5.584 19.447 38.591 1.00 15.70 N ATOM 1139 CA ARG A 178 5.147 20.191 37.419 1.00 16.46 C ATOM 1140 C ARG A 178 4.034 21.180 37.787 1.00 15.81 C ATOM 1141 O ARG A 178 4.039 22.319 37.320 1.00 13.98 O ATOM 1142 CB ARG A 178 4.659 19.261 36.298 1.00 16.82 C ATOM 1143 CG ARG A 178 4.156 20.069 35.096 1.00 18.54 C ATOM 1144 CD ARG A 178 3.496 19.245 34.025 1.00 19.75 C ATOM 1145 NE ARG A 178 2.474 18.362 34.561 1.00 22.09 N ATOM 1146 CZ ARG A 178 1.980 17.319 33.903 1.00 23.62 C ATOM 1147 NH1 ARG A 178 2.403 17.034 32.675 1.00 24.67 N ATOM 1148 NH2 ARG A 178 1.117 16.513 34.499 1.00 24.61 N ATOM 1149 N LYS A 179 3.113 20.755 38.658 1.00 16.24 N ATOM 1150 CA LYS A 179 1.989 21.599 39.075 1.00 16.85 C ATOM 1151 C LYS A 179 2.488 22.845 39.772 1.00 17.21 C ATOM 1152 O LYS A 179 1.984 23.936 39.529 1.00 18.60 O ATOM 1153 CB LYS A 179 1.011 20.859 39.995 1.00 17.28 C ATOM 1154 CG LYS A 179 -0.163 21.751 40.407 1.00 18.64 C ATOM 1155 CD LYS A 179 -1.020 21.166 41.504 1.00 19.03 C ATOM 1156 CE LYS A 179 -1.926 20.081 40.981 1.00 19.97 C ATOM 1157 NZ LYS A 179 -2.696 19.488 42.120 1.00 20.44 N ATOM 1158 N ARG A 180 3.482 22.677 40.633 1.00 16.92 N ATOM 1159 CA ARG A 180 4.065 23.798 41.345 1.00 16.99 C ATOM 1160 C ARG A 180 4.749 24.750 40.353 1.00 17.45 C ATOM 1161 O ARG A 180 4.668 25.966 40.481 1.00 17.74 O ATOM 1162 CB ARG A 180 5.074 23.283 42.363 1.00 16.38 C ATOM 1163 CG ARG A 180 5.666 24.369 43.228 1.00 15.50 C ATOM 1164 CD ARG A 180 6.605 23.800 44.271 1.00 14.55 C ATOM 1165 NE ARG A 180 7.741 23.121 43.663 1.00 13.37 N ATOM 1166 CZ ARG A 180 8.725 22.553 44.345 1.00 12.55 C ATOM 1167 NH1 ARG A 180 8.721 22.573 45.668 1.00 12.95 N ATOM 1168 NH2 ARG A 180 9.727 21.986 43.698 1.00 13.66 N ATOM 1169 N HIS A 181 5.392 24.178 39.342 1.00 17.62 N ATOM 1170 CA HIS A 181 6.092 24.955 38.334 1.00 16.51 C ATOM 1171 C HIS A 181 5.218 25.734 37.359 1.00 17.37 C ATOM 1172 O HIS A 181 5.521 26.886 37.048 1.00 18.25 O ATOM 1173 CB HIS A 181 7.018 24.044 37.529 1.00 15.40 C ATOM 1174 CG HIS A 181 7.429 24.622 36.210 1.00 15.21 C ATOM 1175 ND1 HIS A 181 8.557 25.396 36.056 1.00 14.65 N ATOM 1176 CD2 HIS A 181 6.835 24.578 34.994 1.00 14.87 C ATOM 1177 CE1 HIS A 181 8.643 25.807 34.805 1.00 14.67 C ATOM 1178 NE2 HIS A 181 7.609 25.326 34.138 1.00 15.28 N ATOM 1179 N THR A 182 4.179 25.093 36.824 1.00 16.90 N ATOM 1180 CA THR A 182 3.321 25.723 35.821 1.00 16.88 C ATOM 1181 C THR A 182 2.799 27.088 36.239 1.00 17.91 C ATOM 1182 O THR A 182 2.702 27.998 35.414 1.00 17.25 O ATOM 1183 CB THR A 182 2.145 24.813 35.406 1.00 16.62 C ATOM 1184 OG1 THR A 182 2.657 23.556 34.957 1.00 16.08 O ATOM 1185 CG2 THR A 182 1.350 25.444 34.263 1.00 16.25 C ATOM 1186 N LYS A 183 2.505 27.222 37.527 1.00 19.43 N ATOM 1187 CA LYS A 183 2.002 28.461 38.094 1.00 20.91 C ATOM 1188 C LYS A 183 2.945 29.649 37.880 1.00 20.80 C ATOM 1189 O LYS A 183 2.470 30.782 37.792 1.00 21.03 O ATOM 1190 CB LYS A 183 1.726 28.279 39.594 1.00 24.07 C ATOM 1191 CG LYS A 183 0.891 27.029 39.929 1.00 28.24 C ATOM 1192 CD LYS A 183 0.570 26.919 41.442 1.00 31.17 C ATOM 1193 CE LYS A 183 0.025 25.530 41.820 1.00 31.58 C ATOM 1194 NZ LYS A 183 -0.903 25.007 40.766 1.00 33.54 N ATOM 1195 N ILE A 184 4.256 29.409 37.740 1.00 19.67 N ATOM 1196 CA ILE A 184 5.193 30.524 37.553 1.00 20.24 C ATOM 1197 C ILE A 184 5.026 31.265 36.224 1.00 21.05 C ATOM 1198 O ILE A 184 5.571 32.351 36.037 1.00 21.91 O ATOM 1199 CB ILE A 184 6.684 30.127 37.781 1.00 19.76 C ATOM 1200 CG1 ILE A 184 7.301 29.522 36.522 1.00 19.85 C ATOM 1201 CG2 ILE A 184 6.804 29.195 38.974 1.00 20.00 C ATOM 1202 CD1 ILE A 184 8.794 29.250 36.633 1.00 18.87 C ATOM 1203 N HIS A 185 4.222 30.706 35.327 1.00 21.72 N ATOM 1204 CA HIS A 185 3.976 31.326 34.037 1.00 23.11 C ATOM 1205 C HIS A 185 2.881 32.387 34.106 1.00 25.36 C ATOM 1206 O HIS A 185 2.544 33.009 33.101 1.00 25.62 O ATOM 1207 CB HIS A 185 3.679 30.265 32.981 1.00 20.82 C ATOM 1208 CG HIS A 185 4.841 29.363 32.709 1.00 19.39 C ATOM 1209 ND1 HIS A 185 6.078 29.842 32.333 1.00 17.90 N ATOM 1210 CD2 HIS A 185 4.965 28.017 32.785 1.00 17.38 C ATOM 1211 CE1 HIS A 185 6.914 28.830 32.189 1.00 18.85 C ATOM 1212 NE2 HIS A 185 6.262 27.712 32.456 1.00 18.13 N ATOM 1213 N LEU A 186 2.305 32.548 35.292 1.00 28.37 N ATOM 1214 CA LEU A 186 1.294 33.573 35.541 1.00 32.30 C ATOM 1215 C LEU A 186 2.135 34.772 35.986 1.00 35.80 C ATOM 1216 O LEU A 186 2.020 35.870 35.441 1.00 36.69 O ATOM 1217 CB LEU A 186 0.377 33.161 36.696 1.00 30.65 C ATOM 1218 CG LEU A 186 -0.481 31.905 36.585 1.00 29.49 C ATOM 1219 CD1 LEU A 186 -1.236 31.737 37.876 1.00 28.91 C ATOM 1220 CD2 LEU A 186 -1.448 32.020 35.434 1.00 28.55 C ATOM 1221 N ARG A 187 2.987 34.507 36.983 1.00 39.80 N ATOM 1222 CA ARG A 187 3.925 35.462 37.582 1.00 42.86 C ATOM 1223 C ARG A 187 4.949 34.658 38.396 1.00 42.69 C ATOM 1224 O ARG A 187 6.051 34.354 37.928 1.00 42.45 O ATOM 1225 CB ARG A 187 3.207 36.469 38.505 1.00 45.09 C ATOM 1226 CG ARG A 187 4.133 37.560 39.082 1.00 47.87 C ATOM 1227 CD ARG A 187 4.436 37.393 40.590 1.00 50.30 C ATOM 1228 NE ARG A 187 5.101 36.130 40.939 1.00 52.54 N ATOM 1229 CZ ARG A 187 6.393 35.996 41.264 1.00 53.37 C ATOM 1230 NH1 ARG A 187 7.212 37.044 41.293 1.00 53.45 N ATOM 1231 NH2 ARG A 187 6.871 34.795 41.575 1.00 53.72 N TER 1232 ARG A 187 HETATM 1233 ZN ZN A 201 -1.089 6.972 65.237 1.00 40.79 ZN HETATM 1234 ZN ZN A 202 17.659 4.944 45.715 1.00 22.91 ZN HETATM 1235 ZN ZN A 203 6.977 25.841 32.244 1.00 18.46 ZN HETATM 1236 O HOH B 303 6.743 19.581 44.308 1.00 15.92 O HETATM 1237 O HOH B 308 9.523 8.521 51.119 1.00 15.74 O HETATM 1238 O HOH B 312 -11.553 -2.550 38.300 1.00 14.56 O HETATM 1239 O HOH B 317 13.417 6.662 53.592 1.00 17.57 O HETATM 1240 O HOH B 324 9.774 6.333 54.272 1.00 15.76 O HETATM 1241 O HOH B 330 -9.144 0.866 36.165 1.00 26.41 O HETATM 1242 O HOH B 332 -6.857 3.390 40.873 1.00 44.86 O HETATM 1243 O HOH B 342 14.707 15.029 38.969 1.00 36.38 O HETATM 1244 O HOH B 343 9.972 11.448 45.186 1.00 17.08 O HETATM 1245 O HOH B 344 5.322 12.390 45.656 1.00 24.85 O HETATM 1246 O HOH B 346 10.319 9.001 48.453 1.00 20.42 O HETATM 1247 O HOH B 350 8.672 6.898 56.546 1.00 25.88 O HETATM 1248 O HOH B 352 17.112 11.379 47.547 1.00 26.52 O HETATM 1249 O HOH B 356 -13.871 2.131 42.836 1.00 41.28 O HETATM 1250 O HOH B 359 -6.197 0.097 40.838 1.00 34.04 O HETATM 1251 O HOH B 360 1.784 6.838 54.703 1.00 23.84 O HETATM 1252 O HOH B 365 9.987 14.350 54.559 1.00 36.45 O HETATM 1253 O HOH B 367 10.860 8.298 57.692 1.00 25.67 O HETATM 1254 O HOH B 370 -0.255 14.523 54.830 1.00 26.87 O HETATM 1255 O HOH B 372 16.659 17.772 48.113 1.00 25.29 O HETATM 1256 O HOH B 388 -12.303 1.095 46.910 1.00 53.40 O HETATM 1257 O HOH B 390 5.111 5.090 57.674 1.00 24.24 O HETATM 1258 O HOH B 391 8.955 5.107 58.798 1.00 26.71 O HETATM 1259 O HOH B 395 8.405 26.871 45.005 1.00 24.95 O HETATM 1260 O HOH B 404 -8.049 12.246 47.382 1.00 33.90 O HETATM 1261 O HOH B 409 -8.022 8.531 43.686 1.00 52.68 O HETATM 1262 O HOH B 411 14.151 15.650 50.096 1.00 40.17 O HETATM 1263 O HOH B 414 -4.410 15.523 54.774 1.00 49.18 O HETATM 1264 O HOH B 415 -14.850 11.559 48.762 1.00 55.32 O HETATM 1265 O HOH B 418 -0.368 11.831 61.104 1.00 39.43 O HETATM 1266 O HOH B 423 -5.552 14.395 51.811 1.00 43.37 O HETATM 1267 O HOH B 429 -10.044 3.450 35.432 1.00 42.36 O HETATM 1268 O HOH B 438 17.517 13.814 49.094 1.00 30.27 O HETATM 1269 O HOH C 319 -2.201 1.215 50.045 1.00 33.46 O HETATM 1270 O HOH C 321 -3.921 16.150 50.632 1.00 30.98 O HETATM 1271 O HOH C 326 -2.440 16.993 39.042 1.00 29.50 O HETATM 1272 O HOH C 333 -4.121 -1.672 54.383 1.00 52.71 O HETATM 1273 O HOH C 338 5.314 -3.194 45.741 1.00 36.05 O HETATM 1274 O HOH C 339 -0.853 3.894 49.654 1.00 28.88 O HETATM 1275 O HOH C 340 4.814 20.906 46.000 1.00 22.51 O HETATM 1276 O HOH C 345 -3.441 0.328 41.360 1.00 22.09 O HETATM 1277 O HOH C 347 10.563 18.265 59.320 1.00 42.22 O HETATM 1278 O HOH C 348 0.657 17.195 53.472 1.00 24.96 O HETATM 1279 O HOH C 351 -6.897 14.010 45.958 1.00 34.83 O HETATM 1280 O HOH C 361 -0.813 21.149 46.235 1.00 23.41 O HETATM 1281 O HOH C 366 12.651 15.826 53.092 1.00 32.32 O HETATM 1282 O HOH C 371 3.849 5.872 41.273 1.00 28.72 O HETATM 1283 O HOH C 373 -4.595 21.412 43.539 1.00 27.46 O HETATM 1284 O HOH C 375 10.971 17.935 54.766 1.00 34.48 O HETATM 1285 O HOH C 376 1.196 3.055 48.113 1.00 28.67 O HETATM 1286 O HOH C 378 1.728 -1.054 47.095 1.00 26.05 O HETATM 1287 O HOH C 381 2.089 11.592 42.148 1.00 33.48 O HETATM 1288 O HOH C 384 0.763 19.213 44.976 1.00 23.24 O HETATM 1289 O HOH C 385 4.426 17.127 55.252 1.00 34.91 O HETATM 1290 O HOH C 389 -4.436 4.233 41.526 1.00 35.88 O HETATM 1291 O HOH C 398 6.541 22.736 47.724 1.00 27.16 O HETATM 1292 O HOH C 399 5.891 23.712 50.348 1.00 29.35 O HETATM 1293 O HOH C 403 -8.536 16.563 46.201 1.00 44.98 O HETATM 1294 O HOH C 405 -6.275 9.465 42.383 1.00 37.61 O HETATM 1295 O HOH C 420 2.494 -5.773 53.498 1.00 67.79 O HETATM 1296 O HOH C 424 -0.316 10.543 35.945 1.00 38.60 O HETATM 1297 O HOH C 426 -6.426 6.976 41.421 1.00 55.49 O HETATM 1298 O HOH C 432 2.525 1.720 36.916 1.00 45.81 O HETATM 1299 O HOH C 433 2.533 8.624 35.862 1.00 88.95 O HETATM 1300 O HOH C 434 -9.043 16.335 43.291 1.00 55.05 O HETATM 1301 O HOH C 439 -5.421 21.740 52.713 1.00 38.27 O HETATM 1302 O HOH C 443 10.205 26.366 50.410 1.00 58.61 O HETATM 1303 O HOH A 301 8.780 5.231 36.736 1.00 19.06 O HETATM 1304 O HOH A 302 1.728 22.275 32.707 1.00 14.75 O HETATM 1305 O HOH A 304 10.774 4.836 38.857 1.00 16.82 O HETATM 1306 O HOH A 305 13.491 19.598 30.656 1.00 23.83 O HETATM 1307 O HOH A 306 12.215 16.574 38.761 1.00 13.22 O HETATM 1308 O HOH A 307 7.038 32.533 32.098 1.00 20.66 O HETATM 1309 O HOH A 309 6.870 28.247 25.058 1.00 29.16 O HETATM 1310 O HOH A 310 12.239 14.653 42.166 1.00 17.37 O HETATM 1311 O HOH A 311 -0.727 17.719 43.225 1.00 18.00 O HETATM 1312 O HOH A 313 11.274 12.147 42.714 1.00 19.68 O HETATM 1313 O HOH A 314 4.007 11.911 39.996 1.00 15.85 O HETATM 1314 O HOH A 315 7.258 0.611 43.946 1.00 28.01 O HETATM 1315 O HOH A 316 5.685 9.697 45.420 1.00 15.18 O HETATM 1316 O HOH A 318 4.279 3.285 42.036 1.00 23.33 O HETATM 1317 O HOH A 320 3.047 19.190 28.379 1.00 16.25 O HETATM 1318 O HOH A 322 3.095 13.260 44.114 1.00 19.92 O HETATM 1319 O HOH A 323 12.953 5.369 36.733 1.00 18.48 O HETATM 1320 O HOH A 325 -8.016 2.274 50.491 1.00 43.38 O HETATM 1321 O HOH A 327 8.389 22.734 40.758 1.00 14.87 O HETATM 1322 O HOH A 328 7.784 6.286 51.460 1.00 15.90 O HETATM 1323 O HOH A 329 4.124 15.038 29.968 1.00 23.59 O HETATM 1324 O HOH A 331 8.682 25.418 40.469 1.00 20.08 O HETATM 1325 O HOH A 334 14.237 12.541 37.625 1.00 21.80 O HETATM 1326 O HOH A 335 19.815 -0.773 53.644 1.00 34.16 O HETATM 1327 O HOH A 336 6.225 0.469 41.419 1.00 50.10 O HETATM 1328 O HOH A 337 9.469 1.008 41.723 1.00 39.74 O HETATM 1329 O HOH A 341 3.081 32.632 39.873 1.00 26.36 O HETATM 1330 O HOH A 349 13.021 11.541 30.912 1.00 30.75 O HETATM 1331 O HOH A 353 2.650 1.393 49.758 1.00 25.34 O HETATM 1332 O HOH A 354 2.926 4.453 55.945 1.00 35.23 O HETATM 1333 O HOH A 355 -0.181 16.694 40.870 1.00 28.46 O HETATM 1334 O HOH A 357 1.303 35.408 31.752 1.00 25.90 O HETATM 1335 O HOH A 358 2.822 2.059 43.926 1.00 19.69 O HETATM 1336 O HOH A 362 12.009 19.394 40.968 1.00 29.95 O HETATM 1337 O HOH A 363 2.500 20.961 43.850 1.00 18.15 O HETATM 1338 O HOH A 364 16.943 3.570 54.760 1.00 23.35 O HETATM 1339 O HOH A 368 11.560 -2.214 57.668 1.00 27.50 O HETATM 1340 O HOH A 369 -3.304 6.566 55.800 1.00 22.34 O HETATM 1341 O HOH A 374 18.394 9.720 49.416 1.00 28.43 O HETATM 1342 O HOH A 377 4.335 9.365 39.138 1.00 30.46 O HETATM 1343 O HOH A 379 2.617 8.492 42.350 1.00 15.84 O HETATM 1344 O HOH A 380 2.642 9.217 45.321 1.00 29.89 O HETATM 1345 O HOH A 382 12.928 0.909 38.667 1.00 29.50 O HETATM 1346 O HOH A 383 6.556 14.495 27.936 1.00 32.40 O HETATM 1347 O HOH A 386 14.086 -8.133 42.714 1.00 50.61 O HETATM 1348 O HOH A 387 -10.247 0.818 49.436 1.00 41.41 O HETATM 1349 O HOH A 392 9.393 18.731 26.927 1.00 24.96 O HETATM 1350 O HOH A 393 10.374 2.119 39.435 1.00 32.61 O HETATM 1351 O HOH A 394 1.560 23.659 43.653 1.00 23.91 O HETATM 1352 O HOH A 396 7.845 27.425 42.211 1.00 23.21 O HETATM 1353 O HOH A 397 3.132 28.089 42.558 1.00 35.94 O HETATM 1354 O HOH A 400 21.114 3.824 51.894 1.00 47.32 O HETATM 1355 O HOH A 401 20.294 11.594 51.376 1.00 42.23 O HETATM 1356 O HOH A 402 15.402 -3.700 46.045 1.00 31.49 O HETATM 1357 O HOH A 406 14.352 -0.684 43.266 1.00 25.41 O HETATM 1358 O HOH A 407 -12.725 10.471 55.158 1.00 70.06 O HETATM 1359 O HOH A 408 -14.963 10.652 53.798 1.00100.00 O HETATM 1360 O HOH A 410 0.676 -1.928 59.338 1.00 40.29 O HETATM 1361 O HOH A 412 13.333 18.591 36.884 1.00 27.20 O HETATM 1362 O HOH A 413 20.037 7.786 48.369 1.00 27.45 O HETATM 1363 O HOH A 416 -6.900 11.192 58.964 1.00 40.78 O HETATM 1364 O HOH A 417 -1.120 15.177 58.196 1.00 47.21 O HETATM 1365 O HOH A 419 0.606 -4.206 57.628 1.00 53.93 O HETATM 1366 O HOH A 421 5.103 19.868 26.555 1.00 29.98 O HETATM 1367 O HOH A 422 9.288 7.829 31.079 1.00 49.12 O HETATM 1368 O HOH A 425 3.132 11.723 32.368 1.00 44.14 O HETATM 1369 O HOH A 427 1.380 -1.139 50.208 1.00 55.83 O HETATM 1370 O HOH A 428 0.548 18.045 36.695 1.00 22.88 O HETATM 1371 O HOH A 430 11.619 -1.469 42.619 1.00 43.22 O HETATM 1372 O HOH A 431 9.754 -2.982 45.258 1.00 52.14 O HETATM 1373 O HOH A 435 18.156 -4.060 46.609 1.00 62.19 O HETATM 1374 O HOH A 436 19.504 12.215 37.298 1.00 53.50 O HETATM 1375 O HOH A 437 22.053 9.846 36.059 1.00 39.93 O HETATM 1376 O HOH A 440 14.515 14.348 30.246 1.00 46.96 O HETATM 1377 O HOH A 441 16.053 22.258 33.576 1.00 46.07 O HETATM 1378 O HOH A 442 14.196 19.956 34.863 1.00 50.50 O HETATM 1379 O HOH A 444 11.451 27.063 34.472 1.00 25.59 O HETATM 1380 O HOH A 445 17.076 25.462 37.466 1.00 47.08 O CONECT 524 1233 CONECT 559 1233 CONECT 712 1233 CONECT 749 1233 CONECT 811 1234 CONECT 836 1234 CONECT 947 1234 CONECT 983 1234 CONECT 1041 1235 CONECT 1063 1235 CONECT 1178 1235 CONECT 1212 1235 CONECT 1233 524 559 712 749 CONECT 1234 811 836 947 983 CONECT 1235 1041 1063 1178 1212 MASTER 361 0 3 3 6 0 3 6 1377 3 15 9 END
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Related entries of code: 1jk2
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
No similar entries are found!
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
1jk2
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
Zif268 D20A Mutant
Ligand Name
GCT DNA site
EC.Number
E.C.-.-.-.-
Resolution
1.65(Å)
Affinity (Kd/Ki/IC50)
Kd=43pM
Release Year
2001
Protein/NA Sequence
Check fasta file
Primary Reference
Journal of molecular biology. (2001) 313, pp. 309-15
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):
P08046
Entrez Gene ID
NCBI Entrez Gene ID:
13653
ASD
Information of known allosteric effects of PDB entries
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Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
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姝e湪鐢宠涓
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