Browse entries in the PDBbind-CN Database
HEADER METAL BINDING PROTEIN/DNA 08-MAY-12 4F2J TITLE CRYSTAL STRUCTURE OF ZNF217 BOUND TO DNA, P6522 CRYSTAL FORM COMPND MOL_ID: 1; COMPND 2 MOLECULE: 5'-D(*TP*TP*TP*GP*CP*AP*GP*AP*AP*TP*CP*GP*AP*TP*TP*CP*TP*GP COMPND 3 *CP*A)-3'; COMPND 4 CHAIN: A; COMPND 5 ENGINEERED: YES; COMPND 6 MOL_ID: 2; COMPND 7 MOLECULE: ZINC FINGER PROTEIN 217; COMPND 8 CHAIN: C; COMPND 9 FRAGMENT: ZINC FINGERS 6 AND 7 (UNP RESIDUES 469-523); COMPND 10 SYNONYM: TRANSCRIPTION FACTOR ZNF217; COMPND 11 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 MOL_ID: 2; SOURCE 4 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 5 ORGANISM_COMMON: HUMAN; SOURCE 6 ORGANISM_TAXID: 9606; SOURCE 7 GENE: ZNF217, ZABC1; SOURCE 8 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 9 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 10 EXPRESSION_SYSTEM_STRAIN: ROSETTA 2; SOURCE 11 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 12 EXPRESSION_SYSTEM_PLASMID: PMAL KEYWDS ZINC FINGER, TRANSCRIPTION FACTOR, DNA BINDING, NUCLEUS, METAL KEYWDS 2 BINDING PROTEIN-DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR M.S.VANDEVENNE,D.A.JACQUES,J.M.GUSS,J.P.MACKAY REVDAT 2 04-SEP-13 4F2J 1 JRNL REVDAT 1 27-FEB-13 4F2J 0 JRNL AUTH M.S.VANDEVENNE,D.A.JACQUES,C.ARTUZ,C.D.NGUYEN,A.H.KWAN, JRNL AUTH 2 D.J.SEGAL,J.M.MATTHEWS,M.CROSSLEY,J.M.GUSS,J.P.MACKAY JRNL TITL NEW INSIGHTS INTO DNA RECOGNITION BY ZINC FINGERS REVEALED JRNL TITL 2 BY STRUCTURAL ANALYSIS OF THE ONCOPROTEIN ZNF217 JRNL REF J.BIOL.CHEM. V. 288 10616 2013 JRNL REFN ISSN 0021-9258 JRNL PMID 23436653 JRNL DOI 10.1074/JBC.M112.441451 REMARK 2 REMARK 2 RESOLUTION. 2.64 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.5.0109 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.64 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 48.31 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.0 REMARK 3 NUMBER OF REFLECTIONS : 7467 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING + TEST SET) : 0.253 REMARK 3 R VALUE (WORKING SET) : 0.252 REMARK 3 FREE R VALUE : 0.264 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.600 REMARK 3 FREE R VALUE TEST SET COUNT : 344 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.64 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.71 REMARK 3 REFLECTION IN BIN (WORKING SET) : 508 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 99.07 REMARK 3 BIN R VALUE (WORKING SET) : 0.4220 REMARK 3 BIN FREE R VALUE SET COUNT : 22 REMARK 3 BIN FREE R VALUE : 0.4200 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 449 REMARK 3 NUCLEIC ACID ATOMS : 406 REMARK 3 HETEROGEN ATOMS : 2 REMARK 3 SOLVENT ATOMS : 0 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 96.52 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 5.31000 REMARK 3 B22 (A**2) : 5.31000 REMARK 3 B33 (A**2) : -7.97000 REMARK 3 B12 (A**2) : 2.66000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.327 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.247 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.285 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 32.121 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.924 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.969 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 917 ; 0.016 ; 0.021 REMARK 3 BOND LENGTHS OTHERS (A): 515 ; 0.002 ; 0.020 REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 1319 ; 2.318 ; 2.489 REMARK 3 BOND ANGLES OTHERS (DEGREES): 1253 ; 1.125 ; 3.000 REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 51 ; 5.450 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 27 ;29.747 ;21.111 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 79 ;16.056 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 5 ;14.995 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 137 ; 0.083 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 723 ; 0.008 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): 159 ; 0.001 ; 0.020 REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 258 ; 2.263 ; 2.000 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): 104 ; 0.569 ; 2.000 REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 411 ; 3.819 ; 3.000 REMARK 3 MAIN-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 659 ; 8.122 ; 4.000 REMARK 3 SIDE-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 908 ;10.185 ; 6.000 REMARK 3 SIDE-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 NCS RESTRAINTS STATISTICS REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : 2 REMARK 3 REMARK 3 TLS GROUP : 1 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 0 A 19 REMARK 3 ORIGIN FOR THE GROUP (A): 31.2256 38.2133 38.2300 REMARK 3 T TENSOR REMARK 3 T11: 0.4927 T22: 0.3269 REMARK 3 T33: 0.5350 T12: 0.2084 REMARK 3 T13: 0.0015 T23: -0.0822 REMARK 3 L TENSOR REMARK 3 L11: 8.1461 L22: 4.6998 REMARK 3 L33: 14.5824 L12: 5.1317 REMARK 3 L13: 9.1287 L23: 5.3321 REMARK 3 S TENSOR REMARK 3 S11: 0.0514 S12: 0.1885 S13: -0.3932 REMARK 3 S21: -0.0394 S22: 0.0519 S23: 0.0358 REMARK 3 S31: 1.2167 S32: 0.1555 S33: -0.1034 REMARK 3 REMARK 3 TLS GROUP : 2 REMARK 3 NUMBER OF COMPONENTS GROUP : 2 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : C 471 C 522 REMARK 3 RESIDUE RANGE : C 601 C 602 REMARK 3 ORIGIN FOR THE GROUP (A): 18.1557 42.2507 30.4185 REMARK 3 T TENSOR REMARK 3 T11: 0.4751 T22: 0.6739 REMARK 3 T33: 0.5634 T12: -0.1111 REMARK 3 T13: -0.1624 T23: -0.1764 REMARK 3 L TENSOR REMARK 3 L11: 7.4251 L22: 9.3960 REMARK 3 L33: 27.8988 L12: 0.0596 REMARK 3 L13: -2.5538 L23: 4.3468 REMARK 3 S TENSOR REMARK 3 S11: -0.3465 S12: -0.5084 S13: 0.0928 REMARK 3 S21: -0.1847 S22: -0.4259 S23: 0.7424 REMARK 3 S31: -0.2368 S32: -2.0778 S33: 0.7723 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.40 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE RIDING REMARK 3 POSITIONS U VALUES REMARK 4 REMARK 4 4F2J COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 18-MAY-12. REMARK 100 THE RCSB ID CODE IS RCSB072373. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 06-SEP-11; 15-SEP-11 REMARK 200 TEMPERATURE (KELVIN) : 100; 100 REMARK 200 PH : 7.0; 7.0 REMARK 200 NUMBER OF CRYSTALS USED : 2 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N; N REMARK 200 RADIATION SOURCE : ROTATING ANODE; NULL REMARK 200 BEAMLINE : NULL; NULL REMARK 200 X-RAY GENERATOR MODEL : RIGAKU MICROMAX-007 HF; NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M; M REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418; NULL REMARK 200 MONOCHROMATOR : OSMIC VARIMAX; OSMIC VARIMAX REMARK 200 OPTICS : NULL; NULL REMARK 200 REMARK 200 DETECTOR TYPE : IMAGE PLATE; IMAGE PLATE REMARK 200 DETECTOR MANUFACTURER : MAR SCANNER 345 MM PLATE; MAR REMARK 200 SCANNER 345 MM PLATE REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 7517 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.640 REMARK 200 RESOLUTION RANGE LOW (A) : 99.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 98.5 REMARK 200 DATA REDUNDANCY : 2.500 REMARK 200 R MERGE (I) : 0.09100 REMARK 200 R SYM (I) : NULL REMARK 200
FOR THE DATA SET : 9.3000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.64 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.68 REMARK 200 COMPLETENESS FOR SHELL (%) : 95.0 REMARK 200 DATA REDUNDANCY IN SHELL : 1.80 REMARK 200 R MERGE FOR SHELL (I) : 0.18800 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200
FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH; SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: SIRAS REMARK 200 SOFTWARE USED: SOLVE REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 71.87 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 4.37 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 20% PEG 3350, 0.2M SODIUM SULFATE, PH REMARK 280 7.0, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 293K. 20% PEG REMARK 280 3350, 0.2M SODIUM SULFATE, 10MM TRIMETHYLLEAD ACETATE, PH 7.0, REMARK 280 VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 293K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 65 2 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+2/3 REMARK 290 3555 -X+Y,-X,Z+1/3 REMARK 290 4555 -X,-Y,Z+1/2 REMARK 290 5555 Y,-X+Y,Z+1/6 REMARK 290 6555 X-Y,X,Z+5/6 REMARK 290 7555 Y,X,-Z+2/3 REMARK 290 8555 X-Y,-Y,-Z REMARK 290 9555 -X,-X+Y,-Z+1/3 REMARK 290 10555 -Y,-X,-Z+1/6 REMARK 290 11555 -X+Y,Y,-Z+1/2 REMARK 290 12555 X,X-Y,-Z+5/6 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 161.69467 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 80.84733 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 121.27100 REMARK 290 SMTRY1 5 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 5 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 40.42367 REMARK 290 SMTRY1 6 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 202.11833 REMARK 290 SMTRY1 7 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 7 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 161.69467 REMARK 290 SMTRY1 8 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 9 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 9 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 9 0.000000 0.000000 -1.000000 80.84733 REMARK 290 SMTRY1 10 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 10 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 10 0.000000 0.000000 -1.000000 40.42367 REMARK 290 SMTRY1 11 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 11 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 11 0.000000 0.000000 -1.000000 121.27100 REMARK 290 SMTRY1 12 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 12 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 12 0.000000 0.000000 -1.000000 202.11833 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TETRAMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TETRAMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 5120 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 13010 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -35.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: 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 350 BIOMT1 2 -0.500000 -0.866025 0.000000 85.39200 REMARK 350 BIOMT2 2 -0.866025 0.500000 0.000000 49.30109 REMARK 350 BIOMT3 2 0.000000 0.000000 -1.000000 80.84733 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLY C 467 REMARK 465 SER C 468 REMARK 465 SER C 469 REMARK 465 SER C 470 REMARK 465 LYS C 523 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. REMARK 500 REMARK 500 DISTANCE CUTOFF: REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE REMARK 500 OP1 DG A 11 NH2 ARG C 520 9765 1.99 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION REMARK 500 DC A 10 O3' DC A 10 C3' -0.059 REMARK 500 DT A 13 C2 DT A 13 N3 0.061 REMARK 500 DC A 15 O3' DC A 15 C3' -0.048 REMARK 500 DT A 16 C1' DT A 16 N1 0.088 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 DT A 0 C3' - O3' - P ANGL. DEV. = 7.8 DEGREES REMARK 500 DG A 3 O4' - C4' - C3' ANGL. DEV. = -2.5 DEGREES REMARK 500 DG A 6 O4' - C1' - C2' ANGL. DEV. = -6.1 DEGREES REMARK 500 DG A 6 O4' - C1' - N9 ANGL. DEV. = 4.5 DEGREES REMARK 500 DA A 5 C3' - O3' - P ANGL. DEV. = 11.2 DEGREES REMARK 500 DA A 7 O4' - C1' - N9 ANGL. DEV. = -7.6 DEGREES REMARK 500 DA A 8 O5' - C5' - C4' ANGL. DEV. = -5.1 DEGREES REMARK 500 DA A 8 C1' - O4' - C4' ANGL. DEV. = -7.0 DEGREES REMARK 500 DA A 8 O4' - C1' - N9 ANGL. DEV. = -4.6 DEGREES REMARK 500 DA A 12 O4' - C4' - C3' ANGL. DEV. = -2.6 DEGREES REMARK 500 DA A 12 O4' - C1' - C2' ANGL. DEV. = -6.2 DEGREES REMARK 500 DA A 12 C6 - N1 - C2 ANGL. DEV. = -4.0 DEGREES REMARK 500 DA A 12 C6 - C5 - N7 ANGL. DEV. = -4.3 DEGREES REMARK 500 DA A 12 N1 - C6 - N6 ANGL. DEV. = 5.9 DEGREES REMARK 500 DA A 12 C5 - C6 - N6 ANGL. DEV. = -7.3 DEGREES REMARK 500 DT A 13 O4' - C4' - C3' ANGL. DEV. = -10.9 DEGREES REMARK 500 DT A 13 O4' - C1' - C2' ANGL. DEV. = -5.8 DEGREES REMARK 500 DT A 13 C2 - N3 - C4 ANGL. DEV. = -4.4 DEGREES REMARK 500 DT A 13 N3 - C4 - O4 ANGL. DEV. = 6.0 DEGREES REMARK 500 DT A 13 C5 - C4 - O4 ANGL. DEV. = -7.3 DEGREES REMARK 500 DT A 14 O5' - P - OP1 ANGL. DEV. = 9.5 DEGREES REMARK 500 DT A 14 O5' - P - OP2 ANGL. DEV. = -7.0 DEGREES REMARK 500 DT A 14 C3' - C2' - C1' ANGL. DEV. = -5.6 DEGREES REMARK 500 DT A 14 O3' - P - OP2 ANGL. DEV. = 8.4 DEGREES REMARK 500 DC A 15 O4' - C4' - C3' ANGL. DEV. = -6.0 DEGREES REMARK 500 DC A 15 C4' - C3' - C2' ANGL. DEV. = -6.0 DEGREES REMARK 500 DT A 16 O4' - C4' - C3' ANGL. DEV. = -3.8 DEGREES REMARK 500 DT A 16 N3 - C4 - O4 ANGL. DEV. = 4.0 DEGREES REMARK 500 DT A 16 C4 - C5 - C7 ANGL. DEV. = -4.7 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 ARG C 481 -16.51 -47.35 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 C 602 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HIS C 493 NE2 REMARK 620 2 HIS C 489 NE2 105.9 REMARK 620 3 CYS C 473 SG 90.3 101.5 REMARK 620 4 CYS C 476 SG 136.0 109.8 106.7 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN C 601 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS C 504 SG REMARK 620 2 CYS C 501 SG 119.0 REMARK 620 3 HIS C 517 NE2 111.6 108.2 REMARK 620 4 HIS C 522 NE2 123.5 110.2 75.0 REMARK 620 N 1 2 3 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN C 601 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN C 602 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 3UK3 RELATED DB: PDB REMARK 900 CRYSTAL STRUCTURE OF ZNF217 BOUND TO DNA DBREF 4F2J C 469 523 UNP O75362 ZN217_HUMAN 469 523 DBREF 4F2J A 0 19 PDB 4F2J 4F2J 0 19 SEQADV 4F2J GLY C 467 UNP O75362 EXPRESSION TAG SEQADV 4F2J SER C 468 UNP O75362 EXPRESSION TAG SEQRES 1 A 20 DT DT DT DG DC DA DG DA DA DT DC DG DA SEQRES 2 A 20 DT DT DC DT DG DC DA SEQRES 1 C 57 GLY SER SER SER ARG GLU CYS SER TYR CYS GLY LYS PHE SEQRES 2 C 57 PHE ARG SER ASN TYR TYR LEU ASN ILE HIS LEU ARG THR SEQRES 3 C 57 HIS THR GLY GLU LYS PRO TYR LYS CYS GLU PHE CYS GLU SEQRES 4 C 57 TYR ALA ALA ALA GLN LYS THR SER LEU ARG TYR HIS LEU SEQRES 5 C 57 GLU ARG HIS HIS LYS HET ZN C 601 1 HET ZN C 602 1 HETNAM ZN ZINC ION FORMUL 3 ZN 2(ZN 2+) HELIX 1 1 SER C 482 GLY C 495 1 14 HELIX 2 2 GLN C 510 HIS C 522 1 13 SHEET 1 A 2 TYR C 499 LYS C 500 0 SHEET 2 A 2 ALA C 507 ALA C 508 -1 O ALA C 508 N TYR C 499 LINK NE2 HIS C 493 ZN ZN C 602 1555 1555 1.98 LINK NE2 HIS C 489 ZN ZN C 602 1555 1555 2.00 LINK SG CYS C 473 ZN ZN C 602 1555 1555 2.02 LINK SG CYS C 504 ZN ZN C 601 1555 1555 2.03 LINK SG CYS C 501 ZN ZN C 601 1555 1555 2.05 LINK NE2 HIS C 517 ZN ZN C 601 1555 1555 2.14 LINK SG CYS C 476 ZN ZN C 602 1555 1555 2.29 LINK NE2 HIS C 522 ZN ZN C 601 1555 1555 2.34 SITE 1 AC1 4 CYS C 501 CYS C 504 HIS C 517 HIS C 522 SITE 1 AC2 4 CYS C 473 CYS C 476 HIS C 489 HIS C 493 CRYST1 56.928 56.928 242.542 90.00 90.00 120.00 P 65 2 2 12 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.017566 0.010142 0.000000 0.00000 SCALE2 0.000000 0.020284 0.000000 0.00000 SCALE3 0.000000 0.000000 0.004123 0.00000 ATOM 1 O5' DT A 0 15.218 25.547 11.837 1.00129.25 O ANISOU 1 O5' DT A 0 21674 14073 13364 -4711 -2593 -2831 O ATOM 2 C5' DT A 0 14.363 26.619 11.458 1.00130.79 C ANISOU 2 C5' DT A 0 21521 14577 13598 -5109 -2755 -2411 C ATOM 3 C4' DT A 0 14.021 27.526 12.638 1.00129.84 C ANISOU 3 C4' DT A 0 20937 14486 13909 -4930 -2770 -2062 C ATOM 4 O4' DT A 0 14.006 26.754 13.875 1.00129.49 O ANISOU 4 O4' DT A 0 21000 14115 14084 -4729 -2653 -2102 O ATOM 5 C3' DT A 0 14.957 28.706 12.924 1.00119.74 C ANISOU 5 C3' DT A 0 19334 13455 12708 -4619 -2646 -1963 C ATOM 6 O3' DT A 0 14.109 29.787 13.369 1.00114.47 O ANISOU 6 O3' DT A 0 18251 12867 12374 -4656 -2935 -1636 O ATOM 7 C2' DT A 0 15.902 28.056 13.933 1.00115.40 C ANISOU 7 C2' DT A 0 18877 12694 12276 -4129 -2330 -2198 C ATOM 8 C1' DT A 0 14.879 27.348 14.807 1.00112.01 C ANISOU 8 C1' DT A 0 18530 11947 12083 -4264 -2439 -2075 C ATOM 9 N1 DT A 0 15.335 26.279 15.752 1.00112.55 N ANISOU 9 N1 DT A 0 18962 11586 12218 -4030 -2358 -2227 N ATOM 10 C2 DT A 0 14.355 25.698 16.547 1.00117.23 C ANISOU 10 C2 DT A 0 19662 11993 12887 -4401 -2496 -2032 C ATOM 11 O2 DT A 0 13.171 26.001 16.497 1.00125.79 O ANISOU 11 O2 DT A 0 20442 13362 13991 -4844 -2609 -1841 O ATOM 12 N3 DT A 0 14.797 24.731 17.413 1.00112.92 N ANISOU 12 N3 DT A 0 19594 10962 12349 -4294 -2558 -2092 N ATOM 13 C4 DT A 0 16.101 24.283 17.567 1.00112.62 C ANISOU 13 C4 DT A 0 19891 10565 12336 -3704 -2543 -2402 C ATOM 14 O4 DT A 0 16.416 23.414 18.378 1.00103.74 O ANISOU 14 O4 DT A 0 19271 8900 11247 -3612 -2758 -2432 O ATOM 15 C5 DT A 0 17.079 24.919 16.713 1.00112.49 C ANISOU 15 C5 DT A 0 19588 10899 12255 -3254 -2322 -2713 C ATOM 16 C7 DT A 0 18.516 24.485 16.819 1.00113.87 C ANISOU 16 C7 DT A 0 19936 10903 12425 -2567 -2285 -3210 C ATOM 17 C6 DT A 0 16.663 25.871 15.848 1.00108.86 C ANISOU 17 C6 DT A 0 18715 10949 11697 -3515 -2223 -2576 C ATOM 18 P DT A 1 14.470 30.939 14.421 1.00120.10 P ANISOU 18 P DT A 1 18547 13641 13443 -4259 -2941 -1473 P ATOM 19 OP1 DT A 1 13.734 32.161 14.040 1.00118.67 O ANISOU 19 OP1 DT A 1 18126 13537 13426 -4374 -3488 -1251 O ATOM 20 OP2 DT A 1 15.934 31.011 14.665 1.00110.08 O ANISOU 20 OP2 DT A 1 17363 12428 12034 -3970 -2591 -1576 O ATOM 21 O5' DT A 1 13.720 30.360 15.708 1.00120.45 O ANISOU 21 O5' DT A 1 18360 13605 13798 -4136 -2820 -1532 O ATOM 22 C5' DT A 1 12.304 30.302 15.769 1.00113.33 C ANISOU 22 C5' DT A 1 17178 12858 13023 -4413 -3085 -1529 C ATOM 23 C4' DT A 1 11.906 30.137 17.221 1.00107.13 C ANISOU 23 C4' DT A 1 16020 12231 12453 -4321 -2905 -1595 C ATOM 24 O4' DT A 1 12.626 29.005 17.755 1.00103.25 O ANISOU 24 O4' DT A 1 16004 11438 11789 -4350 -2570 -1608 O ATOM 25 C3' DT A 1 12.201 31.299 18.183 1.00100.24 C ANISOU 25 C3' DT A 1 14642 11523 11920 -3846 -2914 -1608 C ATOM 26 O3' DT A 1 11.016 31.535 18.908 1.00102.00 O ANISOU 26 O3' DT A 1 14232 12202 12322 -3929 -3046 -1799 O ATOM 27 C2' DT A 1 13.291 30.800 19.115 1.00 90.55 C ANISOU 27 C2' DT A 1 13658 10092 10654 -3634 -2490 -1576 C ATOM 28 C1' DT A 1 13.025 29.299 19.073 1.00 98.40 C ANISOU 28 C1' DT A 1 15133 10892 11363 -4073 -2367 -1593 C ATOM 29 N1 DT A 1 14.178 28.417 19.305 1.00 95.77 N ANISOU 29 N1 DT A 1 15383 10110 10896 -3893 -2162 -1615 N ATOM 30 C2 DT A 1 14.037 27.335 20.128 1.00102.54 C ANISOU 30 C2 DT A 1 16599 10730 11631 -4171 -2140 -1578 C ATOM 31 O2 DT A 1 13.001 27.067 20.697 1.00111.63 O ANISOU 31 O2 DT A 1 17574 12145 12696 -4690 -2196 -1498 O ATOM 32 N3 DT A 1 15.167 26.572 20.284 1.00104.46 N ANISOU 32 N3 DT A 1 17420 10455 11816 -3860 -2114 -1671 N ATOM 33 C4 DT A 1 16.407 26.758 19.698 1.00 99.90 C ANISOU 33 C4 DT A 1 16954 9745 11258 -3299 -2017 -1890 C ATOM 34 O4 DT A 1 17.357 25.986 19.905 1.00 86.73 O ANISOU 34 O4 DT A 1 15736 7659 9558 -2954 -2064 -2102 O ATOM 35 C5 DT A 1 16.478 27.911 18.820 1.00 96.70 C ANISOU 35 C5 DT A 1 16107 9761 10871 -3198 -1942 -1888 C ATOM 36 C7 DT A 1 17.759 28.254 18.102 1.00 98.44 C ANISOU 36 C7 DT A 1 16337 10106 10959 -2821 -1799 -2119 C ATOM 37 C6 DT A 1 15.375 28.666 18.664 1.00 92.54 C ANISOU 37 C6 DT A 1 15164 9560 10438 -3499 -2071 -1709 C ATOM 38 P DT A 2 10.746 32.902 19.653 1.00112.51 P ANISOU 38 P DT A 2 14849 13838 14061 -3426 -3307 -2005 P ATOM 39 OP1 DT A 2 9.332 33.296 19.449 1.00110.97 O ANISOU 39 OP1 DT A 2 14024 14119 14021 -3483 -3753 -2335 O ATOM 40 OP2 DT A 2 11.878 33.830 19.341 1.00102.91 O ANISOU 40 OP2 DT A 2 13915 12213 12972 -3014 -3449 -1802 O ATOM 41 O5' DT A 2 10.810 32.367 21.151 1.00108.95 O ANISOU 41 O5' DT A 2 14150 13699 13545 -3516 -2833 -2111 O ATOM 42 C5' DT A 2 9.803 31.476 21.555 1.00108.85 C ANISOU 42 C5' DT A 2 13913 14170 13274 -4115 -2694 -2252 C ATOM 43 C4' DT A 2 10.224 30.745 22.808 1.00107.16 C ANISOU 43 C4' DT A 2 13854 14027 12834 -4396 -2267 -2154 C ATOM 44 O4' DT A 2 11.453 30.006 22.613 1.00 97.68 O ANISOU 44 O4' DT A 2 13540 12061 11511 -4335 -2095 -1819 O ATOM 45 C3' DT A 2 10.498 31.656 23.992 1.00106.58 C ANISOU 45 C3' DT A 2 13203 14298 12993 -3958 -2147 -2355 C ATOM 46 O3' DT A 2 9.561 31.330 24.993 1.00113.05 O ANISOU 46 O3' DT A 2 13438 15965 13551 -4502 -1979 -2624 O ATOM 47 C2' DT A 2 11.940 31.342 24.401 1.00 98.89 C ANISOU 47 C2' DT A 2 12896 12678 11999 -3728 -1883 -2019 C ATOM 48 C1' DT A 2 12.021 29.915 23.903 1.00 94.56 C ANISOU 48 C1' DT A 2 13139 11699 11091 -4283 -1838 -1766 C ATOM 49 N1 DT A 2 13.353 29.353 23.722 1.00 82.37 N ANISOU 49 N1 DT A 2 12373 9404 9519 -4011 -1752 -1546 N ATOM 50 C2 DT A 2 13.759 28.240 24.449 1.00 94.43 C ANISOU 50 C2 DT A 2 14498 10579 10800 -4331 -1695 -1381 C ATOM 51 O2 DT A 2 13.092 27.672 25.292 1.00111.17 O ANISOU 51 O2 DT A 2 16615 12980 12644 -4986 -1687 -1307 O ATOM 52 N3 DT A 2 15.016 27.783 24.164 1.00 91.25 N ANISOU 52 N3 DT A 2 14732 9498 10442 -3896 -1716 -1334 N ATOM 53 C4 DT A 2 15.882 28.320 23.239 1.00 91.15 C ANISOU 53 C4 DT A 2 14727 9309 10597 -3303 -1682 -1448 C ATOM 54 O4 DT A 2 16.996 27.850 23.074 1.00 91.03 O ANISOU 54 O4 DT A 2 15158 8859 10568 -2928 -1681 -1532 O ATOM 55 C5 DT A 2 15.397 29.479 22.519 1.00 85.97 C ANISOU 55 C5 DT A 2 13510 9060 10097 -3186 -1719 -1501 C ATOM 56 C7 DT A 2 16.289 30.155 21.518 1.00 82.67 C ANISOU 56 C7 DT A 2 13128 8556 9725 -2784 -1729 -1546 C ATOM 57 C6 DT A 2 14.164 29.931 22.779 1.00 77.44 C ANISOU 57 C6 DT A 2 11883 8471 9070 -3484 -1809 -1546 C ATOM 58 P DG A 3 9.372 32.360 26.191 1.00121.68 P ANISOU 58 P DG A 3 13613 17780 14841 -4114 -1909 -3084 P ATOM 59 OP1 DG A 3 8.024 32.127 26.769 1.00126.23 O ANISOU 59 OP1 DG A 3 13329 19546 15086 -4746 -1834 -3571 O ATOM 60 OP2 DG A 3 9.804 33.695 25.698 1.00109.55 O ANISOU 60 OP2 DG A 3 11907 15855 13861 -3163 -2286 -3221 O ATOM 61 O5' DG A 3 10.424 31.804 27.242 1.00113.58 O ANISOU 61 O5' DG A 3 13127 16430 13597 -4299 -1518 -2719 O ATOM 62 C5' DG A 3 10.191 30.487 27.712 1.00120.05 C ANISOU 62 C5' DG A 3 14397 17362 13856 -5269 -1321 -2453 C ATOM 63 C4' DG A 3 11.385 29.999 28.494 1.00117.66 C ANISOU 63 C4' DG A 3 14816 16438 13450 -5267 -1149 -2049 C ATOM 64 O4' DG A 3 12.552 29.859 27.664 1.00107.80 O ANISOU 64 O4' DG A 3 14350 14136 12475 -4671 -1257 -1748 O ATOM 65 C3' DG A 3 11.864 30.971 29.549 1.00114.27 C ANISOU 65 C3' DG A 3 13853 16328 13235 -4760 -973 -2254 C ATOM 66 O3' DG A 3 11.116 30.754 30.734 1.00128.09 O ANISOU 66 O3' DG A 3 15077 19064 14525 -5523 -766 -2465 O ATOM 67 C2' DG A 3 13.350 30.648 29.684 1.00103.74 C ANISOU 67 C2' DG A 3 13385 14011 12019 -4377 -937 -1819 C ATOM 68 C1' DG A 3 13.611 29.647 28.580 1.00100.10 C ANISOU 68 C1' DG A 3 13788 12770 11474 -4524 -1129 -1526 C ATOM 69 N9 DG A 3 14.856 29.689 27.810 1.00 85.96 N ANISOU 69 N9 DG A 3 12553 10143 9967 -3817 -1201 -1384 N ATOM 70 C8 DG A 3 15.183 30.555 26.802 1.00 74.72 C ANISOU 70 C8 DG A 3 10934 8592 8866 -3203 -1266 -1493 C ATOM 71 N7 DG A 3 16.329 30.276 26.237 1.00 73.73 N ANISOU 71 N7 DG A 3 11354 7866 8795 -2817 -1278 -1388 N ATOM 72 C5 DG A 3 16.798 29.150 26.907 1.00 79.63 C ANISOU 72 C5 DG A 3 12714 8205 9336 -3040 -1295 -1244 C ATOM 73 C6 DG A 3 17.998 28.394 26.755 1.00 82.74 C ANISOU 73 C6 DG A 3 13787 7928 9724 -2689 -1396 -1227 C ATOM 74 O6 DG A 3 18.951 28.547 25.993 1.00 83.84 O ANISOU 74 O6 DG A 3 14034 7844 9977 -2144 -1379 -1382 O ATOM 75 N1 DG A 3 18.078 27.340 27.627 1.00 85.32 N ANISOU 75 N1 DG A 3 14705 7867 9844 -3051 -1595 -1065 N ATOM 76 C2 DG A 3 17.121 27.042 28.543 1.00 94.73 C ANISOU 76 C2 DG A 3 15854 9385 10756 -3846 -1620 -871 C ATOM 77 N2 DG A 3 17.400 25.975 29.294 1.00106.30 N ANISOU 77 N2 DG A 3 18100 10316 11974 -4237 -1942 -645 N ATOM 78 N3 DG A 3 15.988 27.721 28.705 1.00 96.44 N ANISOU 78 N3 DG A 3 15319 10424 10900 -4251 -1413 -944 N ATOM 79 C4 DG A 3 15.891 28.775 27.863 1.00 84.48 C ANISOU 79 C4 DG A 3 13204 9198 9698 -3723 -1283 -1166 C ATOM 80 P DC A 4 11.442 31.604 32.052 1.00136.69 P ANISOU 80 P DC A 4 15551 20709 15676 -5223 -541 -2751 P ATOM 81 OP1 DC A 4 10.175 31.690 32.815 1.00141.62 O ANISOU 81 OP1 DC A 4 15170 22790 15850 -5934 -372 -3311 O ATOM 82 OP2 DC A 4 12.218 32.826 31.696 1.00122.08 O ANISOU 82 OP2 DC A 4 13541 18347 14497 -4027 -674 -2885 O ATOM 83 O5' DC A 4 12.440 30.613 32.802 1.00126.68 O ANISOU 83 O5' DC A 4 15298 18763 14070 -5699 -456 -2127 O ATOM 84 C5' DC A 4 12.151 29.231 32.836 1.00127.54 C ANISOU 84 C5' DC A 4 16173 18681 13606 -6770 -569 -1710 C ATOM 85 C4' DC A 4 13.232 28.522 33.611 1.00126.47 C ANISOU 85 C4' DC A 4 17002 17758 13291 -6959 -669 -1191 C ATOM 86 O4' DC A 4 14.368 28.332 32.741 1.00112.76 O ANISOU 86 O4' DC A 4 16038 14772 12033 -6087 -889 -950 O ATOM 87 C3' DC A 4 13.770 29.289 34.818 1.00129.65 C ANISOU 87 C3' DC A 4 16967 18545 13749 -6669 -429 -1318 C ATOM 88 O3' DC A 4 14.181 28.375 35.813 1.00143.41 O ANISOU 88 O3' DC A 4 19499 20011 14981 -7479 -569 -851 O ATOM 89 C2' DC A 4 14.959 30.038 34.236 1.00115.74 C ANISOU 89 C2' DC A 4 15336 15931 12710 -5342 -461 -1319 C ATOM 90 C1' DC A 4 15.500 28.950 33.320 1.00108.57 C ANISOU 90 C1' DC A 4 15503 13922 11828 -5333 -789 -925 C ATOM 91 N1 DC A 4 16.379 29.435 32.232 1.00 95.91 N ANISOU 91 N1 DC A 4 14016 11640 10785 -4272 -840 -991 N ATOM 92 C2 DC A 4 17.616 28.812 31.997 1.00 93.39 C ANISOU 92 C2 DC A 4 14528 10358 10599 -3835 -1050 -769 C ATOM 93 O2 DC A 4 17.957 27.858 32.706 1.00 99.96 O ANISOU 93 O2 DC A 4 16076 10747 11156 -4252 -1296 -495 O ATOM 94 N3 DC A 4 18.411 29.282 31.001 1.00 83.95 N ANISOU 94 N3 DC A 4 13316 8791 9791 -2996 -1036 -903 N ATOM 95 C4 DC A 4 17.994 30.322 30.256 1.00 83.31 C ANISOU 95 C4 DC A 4 12583 9124 9948 -2681 -902 -1122 C ATOM 96 N4 DC A 4 18.778 30.761 29.263 1.00 74.59 N ANISOU 96 N4 DC A 4 11530 7720 9091 -2064 -919 -1196 N ATOM 97 C5 DC A 4 16.746 30.970 30.489 1.00 83.41 C ANISOU 97 C5 DC A 4 11845 9927 9918 -3011 -812 -1327 C ATOM 98 C6 DC A 4 15.980 30.499 31.476 1.00 88.50 C ANISOU 98 C6 DC A 4 12361 11077 10187 -3761 -745 -1314 C ATOM 99 P DA A 5 14.500 28.846 37.304 1.00153.07 P ANISOU 99 P DA A 5 20372 21834 15955 -7694 -340 -901 P ATOM 100 OP1 DA A 5 13.184 28.753 37.985 1.00157.79 O ANISOU 100 OP1 DA A 5 20238 23909 15807 -8937 -110 -1190 O ATOM 101 OP2 DA A 5 15.278 30.120 37.343 1.00135.98 O ANISOU 101 OP2 DA A 5 17637 19565 14465 -6399 -134 -1216 O ATOM 102 O5' DA A 5 15.457 27.645 37.790 1.00152.84 O ANISOU 102 O5' DA A 5 21772 20643 15656 -8141 -807 -184 O ATOM 103 C5' DA A 5 16.443 27.034 36.933 1.00144.05 C ANISOU 103 C5' DA A 5 21653 18090 14988 -7404 -1236 108 C ATOM 104 C4' DA A 5 17.879 27.308 37.372 1.00135.14 C ANISOU 104 C4' DA A 5 20869 16205 14274 -6485 -1337 223 C ATOM 105 O4' DA A 5 18.610 27.923 36.274 1.00127.15 O ANISOU 105 O4' DA A 5 19632 14709 13971 -5182 -1237 -42 O ATOM 106 C3' DA A 5 18.061 28.222 38.586 1.00132.57 C ANISOU 106 C3' DA A 5 19860 16636 13874 -6460 -971 88 C ATOM 107 O3' DA A 5 18.999 27.577 39.482 1.00137.10 O ANISOU 107 O3' DA A 5 21336 16482 14273 -6644 -1371 525 O ATOM 108 C2' DA A 5 18.428 29.567 37.949 1.00123.24 C ANISOU 108 C2' DA A 5 17804 15628 13395 -5189 -603 -366 C ATOM 109 C1' DA A 5 19.174 29.162 36.677 1.00117.40 C ANISOU 109 C1' DA A 5 17665 13843 13100 -4418 -877 -282 C ATOM 110 N9 DA A 5 19.132 30.118 35.551 1.00103.89 N ANISOU 110 N9 DA A 5 15321 12272 11882 -3596 -661 -629 N ATOM 111 C8 DA A 5 18.278 31.184 35.285 1.00101.45 C ANISOU 111 C8 DA A 5 14063 12764 11720 -3458 -400 -1014 C ATOM 112 N7 DA A 5 18.536 31.858 34.160 1.00 87.05 N ANISOU 112 N7 DA A 5 12038 10705 10332 -2722 -418 -1174 N ATOM 113 C5 DA A 5 19.640 31.185 33.664 1.00 79.61 C ANISOU 113 C5 DA A 5 11853 8906 9489 -2377 -590 -938 C ATOM 114 C6 DA A 5 20.401 31.389 32.512 1.00 75.23 C ANISOU 114 C6 DA A 5 11452 7910 9224 -1732 -651 -995 C ATOM 115 N6 DA A 5 20.142 32.348 31.617 1.00 56.86 N ANISOU 115 N6 DA A 5 8657 5822 7127 -1413 -605 -1173 N ATOM 116 N1 DA A 5 21.430 30.528 32.309 1.00 87.42 N ANISOU 116 N1 DA A 5 13670 8784 10763 -1473 -836 -903 N ATOM 117 C2 DA A 5 21.679 29.540 33.204 1.00 94.95 C ANISOU 117 C2 DA A 5 15226 9348 11502 -1790 -1069 -703 C ATOM 118 N3 DA A 5 21.032 29.233 34.337 1.00 91.78 N ANISOU 118 N3 DA A 5 14898 9196 10777 -2524 -1099 -498 N ATOM 119 C4 DA A 5 20.014 30.109 34.495 1.00 95.10 C ANISOU 119 C4 DA A 5 14515 10468 11151 -2810 -781 -653 C ATOM 120 P DG A 6 20.458 28.029 39.982 1.00134.00 P ANISOU 120 P DG A 6 21099 15485 14328 -5648 -1435 569 P ATOM 121 OP1 DG A 6 20.616 27.395 41.295 1.00134.77 O ANISOU 121 OP1 DG A 6 21853 15496 13857 -6571 -1774 998 O ATOM 122 OP2 DG A 6 20.717 29.488 39.851 1.00118.65 O ANISOU 122 OP2 DG A 6 18090 14110 12883 -4695 -888 128 O ATOM 123 O5' DG A 6 21.390 27.185 38.993 1.00134.77 O ANISOU 123 O5' DG A 6 22121 14251 14835 -4889 -1990 671 O ATOM 124 C5' DG A 6 22.776 27.077 39.257 1.00129.45 C ANISOU 124 C5' DG A 6 21899 12783 14502 -4063 -2312 716 C ATOM 125 C4' DG A 6 23.607 27.839 38.236 1.00119.27 C ANISOU 125 C4' DG A 6 20071 11391 13855 -2766 -2027 300 C ATOM 126 O4' DG A 6 22.854 28.765 37.392 1.00118.26 O ANISOU 126 O4' DG A 6 19055 11996 13883 -2628 -1477 11 O ATOM 127 C3' DG A 6 24.685 28.724 38.832 1.00113.26 C ANISOU 127 C3' DG A 6 18890 10753 13391 -2033 -1811 196 C ATOM 128 O3' DG A 6 25.849 28.439 38.112 1.00117.28 O ANISOU 128 O3' DG A 6 19667 10615 14281 -1085 -2081 -33 O ATOM 129 C2' DG A 6 24.235 30.139 38.521 1.00106.84 C ANISOU 129 C2' DG A 6 16997 10828 12770 -1788 -1153 -76 C ATOM 130 C1' DG A 6 23.682 29.895 37.130 1.00105.39 C ANISOU 130 C1' DG A 6 16798 10558 12685 -1709 -1149 -243 C ATOM 131 N9 DG A 6 22.941 31.022 36.556 1.00 91.44 N ANISOU 131 N9 DG A 6 14174 9500 11068 -1610 -727 -489 N ATOM 132 C8 DG A 6 21.829 31.604 37.099 1.00 91.65 C ANISOU 132 C8 DG A 6 13592 10323 10907 -2130 -477 -589 C ATOM 133 N7 DG A 6 21.345 32.595 36.393 1.00 88.82 N ANISOU 133 N7 DG A 6 12567 10378 10804 -1799 -291 -879 N ATOM 134 C5 DG A 6 22.184 32.684 35.302 1.00 83.80 C ANISOU 134 C5 DG A 6 12150 9222 10467 -1161 -379 -885 C ATOM 135 C6 DG A 6 22.135 33.585 34.204 1.00 86.82 C ANISOU 135 C6 DG A 6 12154 9706 11126 -731 -343 -1067 C ATOM 136 O6 DG A 6 21.334 34.509 33.951 1.00 69.70 O ANISOU 136 O6 DG A 6 9426 7971 9088 -702 -324 -1271 O ATOM 137 N1 DG A 6 23.173 33.334 33.322 1.00 86.59 N ANISOU 137 N1 DG A 6 12479 9222 11198 -308 -418 -1038 N ATOM 138 C2 DG A 6 24.103 32.344 33.480 1.00 83.91 C ANISOU 138 C2 DG A 6 12701 8395 10787 -155 -550 -972 C ATOM 139 N2 DG A 6 24.992 32.282 32.496 1.00 80.31 N ANISOU 139 N2 DG A 6 12348 7757 10410 291 -582 -1130 N ATOM 140 N3 DG A 6 24.166 31.496 34.500 1.00 90.95 N ANISOU 140 N3 DG A 6 14021 9026 11511 -433 -708 -809 N ATOM 141 C4 DG A 6 23.172 31.723 35.386 1.00 84.10 C ANISOU 141 C4 DG A 6 12889 8606 10460 -1013 -595 -712 C ATOM 142 P DA A 7 27.295 28.653 38.744 1.00119.02 P ANISOU 142 P DA A 7 19925 10548 14747 -334 -2246 -110 P ATOM 143 OP1 DA A 7 27.801 27.294 39.087 1.00118.02 O ANISOU 143 OP1 DA A 7 20864 9430 14550 -327 -3111 6 O ATOM 144 OP2 DA A 7 27.208 29.765 39.727 1.00103.90 O ANISOU 144 OP2 DA A 7 17378 9329 12771 -532 -1777 13 O ATOM 145 O5' DA A 7 28.157 29.177 37.513 1.00103.83 O ANISOU 145 O5' DA A 7 17489 8749 13213 654 -2005 -594 O ATOM 146 C5' DA A 7 28.220 28.374 36.370 1.00103.53 C ANISOU 146 C5' DA A 7 17787 8305 13245 945 -2289 -883 C ATOM 147 C4' DA A 7 28.754 29.249 35.286 1.00 98.33 C ANISOU 147 C4' DA A 7 16391 8190 12780 1535 -1829 -1276 C ATOM 148 O4' DA A 7 27.832 30.331 35.016 1.00 97.21 O ANISOU 148 O4' DA A 7 15647 8701 12588 1109 -1295 -1111 O ATOM 149 C3' DA A 7 30.054 29.894 35.707 1.00 95.99 C ANISOU 149 C3' DA A 7 15688 8135 12648 2160 -1714 -1463 C ATOM 150 O3' DA A 7 30.951 29.614 34.645 1.00104.83 O ANISOU 150 O3' DA A 7 16656 9318 13856 2826 -1792 -2029 O ATOM 151 C2' DA A 7 29.750 31.387 35.932 1.00 83.88 C ANISOU 151 C2' DA A 7 13434 7319 11118 1917 -1129 -1256 C ATOM 152 C1' DA A 7 28.506 31.576 35.097 1.00 87.13 C ANISOU 152 C1' DA A 7 13723 7938 11442 1448 -931 -1183 C ATOM 153 N9 DA A 7 27.454 32.408 35.629 1.00 83.19 N ANISOU 153 N9 DA A 7 12877 7835 10895 941 -670 -933 N ATOM 154 C8 DA A 7 26.643 32.162 36.692 1.00 86.35 C ANISOU 154 C8 DA A 7 13421 8265 11124 379 -713 -693 C ATOM 155 N7 DA A 7 25.756 33.113 36.878 1.00 89.63 N ANISOU 155 N7 DA A 7 13284 9238 11534 105 -437 -700 N ATOM 156 C5 DA A 7 25.993 34.029 35.854 1.00 80.13 C ANISOU 156 C5 DA A 7 11684 8217 10543 504 -303 -869 C ATOM 157 C6 DA A 7 25.391 35.264 35.456 1.00 78.48 C ANISOU 157 C6 DA A 7 10928 8417 10473 531 -188 -976 C ATOM 158 N6 DA A 7 24.361 35.854 36.063 1.00 69.52 N ANISOU 158 N6 DA A 7 9380 7694 9339 281 -134 -1072 N ATOM 159 N1 DA A 7 25.878 35.893 34.371 1.00 69.30 N ANISOU 159 N1 DA A 7 9657 7255 9420 811 -212 -1037 N ATOM 160 C2 DA A 7 26.901 35.299 33.742 1.00 81.89 C ANISOU 160 C2 DA A 7 11527 8640 10948 1049 -226 -1083 C ATOM 161 N3 DA A 7 27.551 34.146 34.005 1.00 73.75 N ANISOU 161 N3 DA A 7 10897 7280 9843 1201 -317 -1134 N ATOM 162 C4 DA A 7 27.033 33.572 35.081 1.00 75.31 C ANISOU 162 C4 DA A 7 11328 7304 9980 921 -402 -978 C ATOM 163 P DA A 8 32.495 29.992 34.837 1.00105.93 P ANISOU 163 P DA A 8 16351 9783 14114 3566 -1771 -2436 P ATOM 164 OP1 DA A 8 33.371 29.118 34.018 1.00 91.11 O ANISOU 164 OP1 DA A 8 14523 7801 12292 4294 -2131 -3178 O ATOM 165 OP2 DA A 8 32.625 30.185 36.291 1.00 92.10 O ANISOU 165 OP2 DA A 8 14775 7805 12414 3428 -1897 -2030 O ATOM 166 O5' DA A 8 32.582 31.456 34.232 1.00102.18 O ANISOU 166 O5' DA A 8 15065 10219 13540 3376 -1102 -2395 O ATOM 167 C5' DA A 8 32.139 31.588 32.929 1.00101.33 C ANISOU 167 C5' DA A 8 14780 10426 13293 3185 -891 -2558 C ATOM 168 C4' DA A 8 31.958 33.040 32.752 1.00 97.28 C ANISOU 168 C4' DA A 8 13751 10515 12695 2802 -459 -2268 C ATOM 169 O4' DA A 8 30.978 33.521 33.700 1.00101.10 O ANISOU 169 O4' DA A 8 14343 10783 13288 2395 -419 -1759 O ATOM 170 C3' DA A 8 33.241 33.771 33.066 1.00 99.18 C ANISOU 170 C3' DA A 8 13527 11268 12891 3082 -310 -2424 C ATOM 171 O3' DA A 8 33.688 34.269 31.829 1.00105.14 O ANISOU 171 O3' DA A 8 13873 12712 13362 2950 -85 -2699 O ATOM 172 C2' DA A 8 32.801 34.808 34.116 1.00100.52 C ANISOU 172 C2' DA A 8 13618 11402 13175 2769 -190 -1898 C ATOM 173 C1' DA A 8 31.312 34.890 33.841 1.00 94.97 C ANISOU 173 C1' DA A 8 13106 10477 12503 2303 -180 -1611 C ATOM 174 N9 DA A 8 30.416 35.349 34.871 1.00 80.39 N ANISOU 174 N9 DA A 8 11284 8485 10775 2022 -168 -1267 N ATOM 175 C8 DA A 8 30.219 34.727 36.062 1.00 88.72 C ANISOU 175 C8 DA A 8 12621 9219 11870 1981 -294 -1131 C ATOM 176 N7 DA A 8 29.324 35.308 36.826 1.00 75.84 N ANISOU 176 N7 DA A 8 10846 7714 10256 1639 -205 -927 N ATOM 177 C5 DA A 8 28.896 36.360 36.056 1.00 62.00 C ANISOU 177 C5 DA A 8 8734 6263 8562 1568 -100 -958 C ATOM 178 C6 DA A 8 27.930 37.336 36.335 1.00 59.93 C ANISOU 178 C6 DA A 8 8150 6232 8388 1371 -81 -931 C ATOM 179 N6 DA A 8 27.233 37.374 37.499 1.00 43.74 N ANISOU 179 N6 DA A 8 5976 4323 6320 1166 -37 -927 N ATOM 180 N1 DA A 8 27.734 38.277 35.394 1.00 57.10 N ANISOU 180 N1 DA A 8 7597 5993 8103 1381 -173 -965 N ATOM 181 C2 DA A 8 28.434 38.190 34.241 1.00 71.64 C ANISOU 181 C2 DA A 8 9552 7837 9833 1423 -187 -974 C ATOM 182 N3 DA A 8 29.376 37.319 33.869 1.00 73.55 N ANISOU 182 N3 DA A 8 9966 8048 9931 1584 -99 -1081 N ATOM 183 C4 DA A 8 29.562 36.415 34.849 1.00 69.91 C ANISOU 183 C4 DA A 8 9706 7354 9503 1728 -93 -1093 C ATOM 184 P DT A 9 34.905 35.294 31.822 1.00108.46 P ANISOU 184 P DT A 9 13723 13931 13555 2916 140 -2809 P ATOM 185 OP1 DT A 9 35.520 35.484 30.495 1.00 92.54 O ANISOU 185 OP1 DT A 9 11301 12769 11093 2702 331 -3228 O ATOM 186 OP2 DT A 9 35.765 34.900 32.967 1.00114.82 O ANISOU 186 OP2 DT A 9 14498 14567 14560 3469 -11 -2974 O ATOM 187 O5' DT A 9 34.075 36.607 32.114 1.00 87.45 O ANISOU 187 O5' DT A 9 11111 11170 10945 2341 210 -2147 O ATOM 188 C5' DT A 9 33.310 37.144 31.079 1.00 85.66 C ANISOU 188 C5' DT A 9 10933 11063 10550 1825 221 -1960 C ATOM 189 C4' DT A 9 32.832 38.474 31.593 1.00 85.34 C ANISOU 189 C4' DT A 9 10903 10899 10625 1489 122 -1466 C ATOM 190 O4' DT A 9 32.221 38.264 32.897 1.00 77.58 O ANISOU 190 O4' DT A 9 10068 9392 10017 1753 62 -1304 O ATOM 191 C3' DT A 9 33.936 39.506 31.834 1.00 84.00 C ANISOU 191 C3' DT A 9 10462 11210 10243 1317 158 -1380 C ATOM 192 O3' DT A 9 33.737 40.599 30.979 1.00 92.85 O ANISOU 192 O3' DT A 9 11641 12540 11096 687 -19 -1100 O ATOM 193 C2' DT A 9 33.734 39.906 33.296 1.00 85.50 C ANISOU 193 C2' DT A 9 10705 10983 10796 1568 83 -1143 C ATOM 194 C1' DT A 9 32.289 39.522 33.523 1.00 74.77 C ANISOU 194 C1' DT A 9 9594 9079 9737 1613 -21 -1036 C ATOM 195 N1 DT A 9 31.767 39.279 34.883 1.00 67.09 N ANISOU 195 N1 DT A 9 8688 7752 9053 1840 -25 -960 N ATOM 196 C2 DT A 9 30.660 40.002 35.265 1.00 72.55 C ANISOU 196 C2 DT A 9 9355 8279 9934 1702 -171 -827 C ATOM 197 O2 DT A 9 30.118 40.852 34.562 1.00 64.94 O ANISOU 197 O2 DT A 9 8375 7315 8985 1493 -395 -754 O ATOM 198 N3 DT A 9 30.209 39.696 36.518 1.00 65.57 N ANISOU 198 N3 DT A 9 8459 7264 9192 1807 -113 -832 N ATOM 199 C4 DT A 9 30.724 38.782 37.402 1.00 60.24 C ANISOU 199 C4 DT A 9 7920 6485 8483 1958 -5 -840 C ATOM 200 O4 DT A 9 30.223 38.580 38.507 1.00 56.78 O ANISOU 200 O4 DT A 9 7506 5993 8076 1875 16 -797 O ATOM 201 C5 DT A 9 31.868 38.081 36.953 1.00 65.42 C ANISOU 201 C5 DT A 9 8678 7151 9028 2194 20 -957 C ATOM 202 C7 DT A 9 32.460 37.065 37.877 1.00 64.62 C ANISOU 202 C7 DT A 9 8814 6802 8938 2442 -57 -998 C ATOM 203 C6 DT A 9 32.328 38.344 35.720 1.00 72.50 C ANISOU 203 C6 DT A 9 9457 8307 9781 2155 47 -1071 C ATOM 204 P DC A 10 34.777 41.803 30.848 1.00 96.76 P ANISOU 204 P DC A 10 11989 13590 11186 159 -100 -909 P ATOM 205 OP1 DC A 10 34.863 42.190 29.403 1.00 83.34 O ANISOU 205 OP1 DC A 10 10353 12389 8923 -610 -202 -839 O ATOM 206 OP2 DC A 10 35.976 41.396 31.641 1.00 82.82 O ANISOU 206 OP2 DC A 10 9857 12219 9393 564 177 -1213 O ATOM 207 O5' DC A 10 33.985 42.933 31.624 1.00 88.82 O ANISOU 207 O5' DC A 10 11273 11921 10555 118 -514 -468 O ATOM 208 C5' DC A 10 32.581 42.845 31.785 1.00 85.77 C ANISOU 208 C5' DC A 10 11098 10897 10592 345 -727 -400 C ATOM 209 C4' DC A 10 32.143 44.163 32.384 1.00 90.75 C ANISOU 209 C4' DC A 10 11898 11113 11468 286 -1217 -135 C ATOM 210 O4' DC A 10 31.514 43.984 33.691 1.00 90.53 O ANISOU 210 O4' DC A 10 11741 10748 11907 843 -1145 -277 O ATOM 211 C3' DC A 10 33.294 45.098 32.688 1.00 89.76 C ANISOU 211 C3' DC A 10 11775 11246 11082 -24 -1338 62 C ATOM 212 O3' DC A 10 32.840 46.376 32.794 1.00 94.98 O ANISOU 212 O3' DC A 10 12755 11447 11884 -219 -1994 318 O ATOM 213 C2' DC A 10 33.704 44.671 34.081 1.00 88.52 C ANISOU 213 C2' DC A 10 11351 11088 11195 543 -991 -112 C ATOM 214 C1' DC A 10 32.326 44.511 34.727 1.00 80.81 C ANISOU 214 C1' DC A 10 10408 9586 10710 971 -1109 -225 C ATOM 215 N1 DC A 10 32.319 43.576 35.905 1.00 71.82 N ANISOU 215 N1 DC A 10 9072 8440 9778 1437 -710 -421 N ATOM 216 C2 DC A 10 31.438 43.794 36.961 1.00 73.93 C ANISOU 216 C2 DC A 10 9258 8468 10365 1698 -794 -527 C ATOM 217 O2 DC A 10 30.670 44.762 36.921 1.00 75.98 O ANISOU 217 O2 DC A 10 9544 8513 10813 1696 -1216 -563 O ATOM 218 N3 DC A 10 31.459 42.945 38.020 1.00 69.98 N ANISOU 218 N3 DC A 10 8654 8008 9926 1927 -476 -633 N ATOM 219 C4 DC A 10 32.313 41.928 38.017 1.00 70.02 C ANISOU 219 C4 DC A 10 8707 8124 9775 2008 -206 -635 C ATOM 220 N4 DC A 10 32.299 41.107 39.056 1.00 67.63 N ANISOU 220 N4 DC A 10 8440 7741 9516 2166 -52 -677 N ATOM 221 C5 DC A 10 33.214 41.664 36.948 1.00 72.62 C ANISOU 221 C5 DC A 10 9045 8689 9859 1918 -138 -654 C ATOM 222 C6 DC A 10 33.188 42.510 35.926 1.00 68.00 C ANISOU 222 C6 DC A 10 8490 8220 9124 1578 -336 -545 C ATOM 223 P DG A 11 33.972 47.489 32.717 1.00108.12 P ANISOU 223 P DG A 11 14614 13344 13121 -860 -2311 649 P ATOM 224 OP1 DG A 11 33.695 48.040 31.379 1.00108.70 O ANISOU 224 OP1 DG A 11 15123 13357 12822 -1617 -2847 946 O ATOM 225 OP2 DG A 11 35.330 46.954 33.019 1.00 79.79 O ANISOU 225 OP2 DG A 11 10618 10516 9184 -914 -1701 517 O ATOM 226 O5' DG A 11 33.567 48.599 33.826 1.00104.50 O ANISOU 226 O5' DG A 11 14365 12217 13123 -524 -2888 715 O ATOM 227 C5' DG A 11 32.197 49.061 33.994 1.00 98.07 C ANISOU 227 C5' DG A 11 13734 10696 12832 -98 -3472 571 C ATOM 228 C4' DG A 11 31.973 49.515 35.431 1.00 90.16 C ANISOU 228 C4' DG A 11 12561 9411 12284 524 -3571 316 C ATOM 229 O4' DG A 11 32.091 48.400 36.365 1.00 86.50 O ANISOU 229 O4' DG A 11 11591 9336 11939 991 -2732 41 O ATOM 230 C3' DG A 11 33.012 50.507 35.918 1.00 84.78 C ANISOU 230 C3' DG A 11 12114 8685 11413 213 -3886 575 C ATOM 231 O3' DG A 11 32.369 51.505 36.654 1.00 83.23 O ANISOU 231 O3' DG A 11 12089 7876 11660 640 -4595 369 O ATOM 232 C2' DG A 11 33.986 49.685 36.766 1.00 69.54 C ANISOU 232 C2' DG A 11 9719 7354 9348 386 -3015 491 C ATOM 233 C1' DG A 11 33.016 48.716 37.383 1.00 69.00 C ANISOU 233 C1' DG A 11 9274 7263 9678 1061 -2574 85 C ATOM 234 N9 DG A 11 33.596 47.467 37.805 1.00 65.94 N ANISOU 234 N9 DG A 11 8541 7340 9174 1233 -1793 -10 N ATOM 235 C8 DG A 11 34.589 46.740 37.191 1.00 64.22 C ANISOU 235 C8 DG A 11 8218 7609 8572 973 -1382 75 C ATOM 236 N7 DG A 11 34.865 45.616 37.835 1.00 63.80 N ANISOU 236 N7 DG A 11 7907 7751 8582 1352 -874 -120 N ATOM 237 C5 DG A 11 34.010 45.631 38.931 1.00 49.24 C ANISOU 237 C5 DG A 11 6019 5591 7097 1725 -902 -255 C ATOM 238 C6 DG A 11 33.911 44.685 39.961 1.00 67.89 C ANISOU 238 C6 DG A 11 8240 7983 9573 2047 -555 -402 C ATOM 239 O6 DG A 11 34.585 43.629 40.074 1.00 56.47 O ANISOU 239 O6 DG A 11 6752 6694 8008 2168 -257 -437 O ATOM 240 N1 DG A 11 32.938 45.072 40.883 1.00 65.87 N ANISOU 240 N1 DG A 11 7905 7567 9557 2210 -669 -562 N ATOM 241 C2 DG A 11 32.178 46.219 40.806 1.00 73.86 C ANISOU 241 C2 DG A 11 8922 8378 10763 2240 -1117 -684 C ATOM 242 N2 DG A 11 31.307 46.406 41.808 1.00 73.38 N ANISOU 242 N2 DG A 11 8631 8360 10890 2469 -1142 -1014 N ATOM 243 N3 DG A 11 32.258 47.130 39.834 1.00 66.49 N ANISOU 243 N3 DG A 11 8218 7234 9810 2037 -1588 -537 N ATOM 244 C4 DG A 11 33.211 46.753 38.933 1.00 62.11 C ANISOU 244 C4 DG A 11 7784 6883 8931 1703 -1415 -266 C ATOM 245 P DA A 12 33.281 52.712 37.140 1.00 89.01 P ANISOU 245 P DA A 12 13217 8359 12244 309 -5162 642 P ATOM 246 OP1 DA A 12 32.615 54.007 36.942 1.00 74.86 O ANISOU 246 OP1 DA A 12 12032 5686 10726 355 -6429 627 O ATOM 247 OP2 DA A 12 34.634 52.456 36.625 1.00 86.10 O ANISOU 247 OP2 DA A 12 12872 8626 11217 -500 -4718 1087 O ATOM 248 O5' DA A 12 33.454 52.382 38.673 1.00 84.88 O ANISOU 248 O5' DA A 12 12172 8083 11995 958 -4570 271 O ATOM 249 C5' DA A 12 32.402 52.162 39.603 1.00 78.65 C ANISOU 249 C5' DA A 12 10977 7206 11701 1756 -4459 -317 C ATOM 250 C4' DA A 12 33.006 51.476 40.809 1.00 70.96 C ANISOU 250 C4' DA A 12 9549 6739 10672 1975 -3637 -429 C ATOM 251 O4' DA A 12 33.699 50.231 40.454 1.00 54.02 O ANISOU 251 O4' DA A 12 7196 5131 8198 1718 -2824 -191 O ATOM 252 C3' DA A 12 34.099 52.256 41.497 1.00 64.57 C ANISOU 252 C3' DA A 12 8919 5898 9715 1782 -3811 -217 C ATOM 253 O3' DA A 12 33.533 52.891 42.637 1.00 66.84 O ANISOU 253 O3' DA A 12 9076 5954 10366 2332 -4120 -690 O ATOM 254 C2' DA A 12 35.149 51.182 41.844 1.00 64.89 C ANISOU 254 C2' DA A 12 8625 6584 9445 1635 -2906 -30 C ATOM 255 C1' DA A 12 34.374 49.877 41.585 1.00 52.05 C ANISOU 255 C1' DA A 12 6689 5180 7908 1889 -2353 -239 C ATOM 256 N9 DA A 12 35.184 48.746 41.228 1.00 54.72 N ANISOU 256 N9 DA A 12 6867 5970 7953 1717 -1738 -70 N ATOM 257 C8 DA A 12 36.050 48.679 40.184 1.00 58.06 C ANISOU 257 C8 DA A 12 7383 6679 7998 1244 -1698 192 C ATOM 258 N7 DA A 12 36.716 47.548 40.085 1.00 63.15 N ANISOU 258 N7 DA A 12 7763 7772 8461 1313 -1149 129 N ATOM 259 C5 DA A 12 36.236 46.853 41.162 1.00 57.72 C ANISOU 259 C5 DA A 12 6926 6952 8053 1800 -886 -75 C ATOM 260 C6 DA A 12 36.599 45.579 41.590 1.00 45.62 C ANISOU 260 C6 DA A 12 5227 5605 6501 2072 -465 -195 C ATOM 261 N6 DA A 12 37.471 44.937 40.843 1.00 61.64 N ANISOU 261 N6 DA A 12 7138 7998 8284 2010 -278 -237 N ATOM 262 N1 DA A 12 36.019 45.069 42.700 1.00 47.22 N ANISOU 262 N1 DA A 12 5409 5637 6894 2344 -340 -304 N ATOM 263 C2 DA A 12 35.103 45.909 43.310 1.00 69.81 C ANISOU 263 C2 DA A 12 8268 8307 9947 2377 -552 -402 C ATOM 264 N3 DA A 12 34.681 47.167 43.004 1.00 52.86 N ANISOU 264 N3 DA A 12 6202 5965 7915 2301 -984 -430 N ATOM 265 C4 DA A 12 35.297 47.566 41.889 1.00 51.09 C ANISOU 265 C4 DA A 12 6143 5763 7506 1988 -1174 -200 C ATOM 266 P DT A 13 34.346 54.092 43.288 1.00 79.64 P ANISOU 266 P DT A 13 11043 7267 11950 2205 -4680 -564 P ATOM 267 OP1 DT A 13 33.452 55.276 43.489 1.00 67.75 O ANISOU 267 OP1 DT A 13 9800 5077 10866 2660 -5720 -1028 O ATOM 268 OP2 DT A 13 35.570 54.242 42.449 1.00 88.07 O ANISOU 268 OP2 DT A 13 12492 8448 12524 1379 -4714 115 O ATOM 269 O5' DT A 13 34.867 53.363 44.635 1.00 70.03 O ANISOU 269 O5' DT A 13 9313 6633 10663 2432 -3814 -707 O ATOM 270 C5' DT A 13 33.943 52.683 45.522 1.00 73.40 C ANISOU 270 C5' DT A 13 9211 7378 11298 2947 -3348 -1254 C ATOM 271 C4' DT A 13 34.429 51.373 46.168 1.00 58.85 C ANISOU 271 C4' DT A 13 7021 6117 9221 2868 -2420 -1120 C ATOM 272 O4' DT A 13 35.261 50.570 45.323 1.00 38.66 O ANISOU 272 O4' DT A 13 4565 3729 6395 2507 -2055 -643 O ATOM 273 C3' DT A 13 35.437 51.422 47.271 1.00 63.31 C ANISOU 273 C3' DT A 13 7530 6898 9625 2811 -2169 -991 C ATOM 274 O3' DT A 13 34.863 51.862 48.478 1.00 69.05 O ANISOU 274 O3' DT A 13 8026 7715 10493 3135 -2248 -1491 O ATOM 275 C2' DT A 13 35.889 49.963 47.400 1.00 56.81 C ANISOU 275 C2' DT A 13 6528 6474 8584 2698 -1455 -767 C ATOM 276 C1' DT A 13 35.573 49.379 46.040 1.00 45.04 C ANISOU 276 C1' DT A 13 5120 4920 7074 2572 -1406 -627 C ATOM 277 N1 DT A 13 36.680 48.650 45.332 1.00 34.28 N ANISOU 277 N1 DT A 13 3803 3770 5452 2333 -1121 -273 N ATOM 278 C2 DT A 13 37.041 47.330 45.593 1.00 62.36 C ANISOU 278 C2 DT A 13 7232 7557 8906 2432 -666 -246 C ATOM 279 O2 DT A 13 36.483 46.712 46.504 1.00 66.33 O ANISOU 279 O2 DT A 13 7664 8073 9465 2578 -474 -388 O ATOM 280 N3 DT A 13 38.090 46.788 44.780 1.00 40.22 N ANISOU 280 N3 DT A 13 4390 5006 5885 2316 -519 -96 N ATOM 281 C4 DT A 13 38.706 47.514 43.758 1.00 56.55 C ANISOU 281 C4 DT A 13 6500 7244 7741 1954 -711 57 C ATOM 282 O4 DT A 13 39.596 47.108 43.028 1.00 49.51 O ANISOU 282 O4 DT A 13 5457 6774 6579 1792 -556 74 O ATOM 283 C5 DT A 13 38.219 48.871 43.540 1.00 51.69 C ANISOU 283 C5 DT A 13 6141 6309 7191 1706 -1211 158 C ATOM 284 C7 DT A 13 38.819 49.764 42.491 1.00 44.21 C ANISOU 284 C7 DT A 13 5408 5471 5921 1098 -1573 432 C ATOM 285 C6 DT A 13 37.262 49.329 44.313 1.00 38.06 C ANISOU 285 C6 DT A 13 4474 4220 5768 1982 -1420 -32 C ATOM 286 P DT A 14 35.952 52.097 49.636 1.00 78.27 P ANISOU 286 P DT A 14 9204 9047 11486 3042 -2097 -1336 P ATOM 287 OP1 DT A 14 35.018 52.930 50.427 1.00 44.05 O ANISOU 287 OP1 DT A 14 4682 4684 7371 3429 -2457 -2016 O ATOM 288 OP2 DT A 14 37.340 52.526 49.251 1.00 64.98 O ANISOU 288 OP2 DT A 14 7840 7231 9620 2690 -2261 -795 O ATOM 289 O5' DT A 14 36.276 50.616 50.089 1.00 37.65 O ANISOU 289 O5' DT A 14 3857 4347 6101 2903 -1359 -1123 O ATOM 290 C5' DT A 14 35.307 50.044 50.950 1.00 57.17 C ANISOU 290 C5' DT A 14 6023 7172 8528 2985 -1056 -1521 C ATOM 291 C4' DT A 14 35.629 48.608 51.256 1.00 51.74 C ANISOU 291 C4' DT A 14 5352 6721 7585 2749 -558 -1211 C ATOM 292 O4' DT A 14 36.329 48.059 50.099 1.00 40.15 O ANISOU 292 O4' DT A 14 4094 5034 6128 2701 -530 -801 O ATOM 293 C3' DT A 14 36.632 48.450 52.404 1.00 62.58 C ANISOU 293 C3' DT A 14 6788 8237 8751 2636 -427 -997 C ATOM 294 O3' DT A 14 36.664 47.099 52.982 1.00 39.24 O ANISOU 294 O3' DT A 14 3920 5451 5540 2399 -126 -800 O ATOM 295 C2' DT A 14 37.935 48.676 51.639 1.00 55.19 C ANISOU 295 C2' DT A 14 6041 7071 7859 2660 -571 -594 C ATOM 296 C1' DT A 14 37.617 47.769 50.469 1.00 33.96 C ANISOU 296 C1' DT A 14 3404 4294 5203 2651 -445 -485 C ATOM 297 N1 DT A 14 38.500 47.948 49.356 1.00 47.16 N ANISOU 297 N1 DT A 14 5151 5901 6866 2611 -553 -248 N ATOM 298 C2 DT A 14 39.236 46.823 49.004 1.00 45.72 C ANISOU 298 C2 DT A 14 4967 5829 6574 2655 -357 -94 C ATOM 299 O2 DT A 14 39.153 45.723 49.540 1.00 69.67 O ANISOU 299 O2 DT A 14 8066 8841 9565 2739 -214 -85 O ATOM 300 N3 DT A 14 40.063 47.012 47.948 1.00 33.20 N ANISOU 300 N3 DT A 14 3323 4399 4893 2565 -408 9 N ATOM 301 C4 DT A 14 40.305 48.181 47.240 1.00 49.01 C ANISOU 301 C4 DT A 14 5366 6433 6823 2279 -657 106 C ATOM 302 O4 DT A 14 41.094 48.240 46.282 1.00 64.28 O ANISOU 302 O4 DT A 14 7215 8676 8532 2035 -660 201 O ATOM 303 C5 DT A 14 39.522 49.305 47.661 1.00 48.31 C ANISOU 303 C5 DT A 14 5438 6023 6896 2247 -981 34 C ATOM 304 C7 DT A 14 39.742 50.565 46.920 1.00 47.36 C ANISOU 304 C7 DT A 14 5546 5753 6697 1892 -1454 190 C ATOM 305 C6 DT A 14 38.660 49.160 48.709 1.00 51.79 C ANISOU 305 C6 DT A 14 5825 6353 7498 2490 -905 -208 C ATOM 306 P DC A 15 37.074 46.801 54.490 1.00 71.64 P ANISOU 306 P DC A 15 8076 9803 9343 2158 -25 -720 P ATOM 307 OP1 DC A 15 35.795 46.445 55.195 1.00 62.45 O ANISOU 307 OP1 DC A 15 6728 9096 7905 1805 175 -1058 O ATOM 308 OP2 DC A 15 37.799 48.068 54.870 1.00 46.98 O ANISOU 308 OP2 DC A 15 4873 6648 6328 2345 -221 -794 O ATOM 309 O5' DC A 15 38.073 45.529 54.379 1.00 37.65 O ANISOU 309 O5' DC A 15 4124 5236 4947 2120 -50 -230 O ATOM 310 C5' DC A 15 38.553 45.281 53.110 1.00 35.88 C ANISOU 310 C5' DC A 15 3946 4756 4931 2383 -116 -104 C ATOM 311 C4' DC A 15 39.191 43.891 53.194 1.00 54.57 C ANISOU 311 C4' DC A 15 6627 6902 7205 2412 -223 158 C ATOM 312 O4' DC A 15 40.195 43.769 52.134 1.00 49.35 O ANISOU 312 O4' DC A 15 5884 6154 6713 2777 -313 183 O ATOM 313 C3' DC A 15 40.079 43.527 54.390 1.00 52.70 C ANISOU 313 C3' DC A 15 6590 6630 6801 2361 -407 363 C ATOM 314 O3' DC A 15 40.511 42.235 54.234 1.00 66.25 O ANISOU 314 O3' DC A 15 8656 8003 8513 2489 -677 521 O ATOM 315 C2' DC A 15 41.184 44.551 54.095 1.00 55.22 C ANISOU 315 C2' DC A 15 6609 7101 7270 2652 -428 324 C ATOM 316 C1' DC A 15 41.420 44.336 52.608 1.00 56.08 C ANISOU 316 C1' DC A 15 6592 7168 7547 2908 -411 244 C ATOM 317 N1 DC A 15 41.853 45.492 51.697 1.00 43.51 N ANISOU 317 N1 DC A 15 4705 5807 6021 2924 -365 175 N ATOM 318 C2 DC A 15 42.767 45.159 50.707 1.00 44.91 C ANISOU 318 C2 DC A 15 4697 6181 6185 3102 -386 116 C ATOM 319 O2 DC A 15 43.268 43.977 50.715 1.00 76.97 O ANISOU 319 O2 DC A 15 8804 10176 10266 3409 -492 37 O ATOM 320 N3 DC A 15 43.168 46.155 49.852 1.00 46.12 N ANISOU 320 N3 DC A 15 4637 6626 6258 2902 -373 113 N ATOM 321 C4 DC A 15 42.652 47.398 49.967 1.00 60.35 C ANISOU 321 C4 DC A 15 6530 8324 8075 2623 -461 195 C ATOM 322 N4 DC A 15 43.039 48.342 49.116 1.00 70.00 N ANISOU 322 N4 DC A 15 7698 9732 9166 2306 -589 273 N ATOM 323 C5 DC A 15 41.670 47.735 50.919 1.00 43.67 C ANISOU 323 C5 DC A 15 4579 5934 6078 2622 -491 146 C ATOM 324 C6 DC A 15 41.302 46.748 51.766 1.00 57.05 C ANISOU 324 C6 DC A 15 6367 7541 7770 2737 -376 122 C ATOM 325 P DT A 16 41.370 41.400 55.279 1.00 83.00 P ANISOU 325 P DT A 16 11182 9858 10496 2493 -1107 761 P ATOM 326 OP1 DT A 16 40.401 40.462 55.891 1.00 80.71 O ANISOU 326 OP1 DT A 16 11414 9357 9897 1917 -1255 969 O ATOM 327 OP2 DT A 16 42.276 42.294 56.021 1.00 82.66 O ANISOU 327 OP2 DT A 16 10895 10076 10437 2583 -1098 776 O ATOM 328 O5' DT A 16 42.320 40.593 54.315 1.00 64.79 O ANISOU 328 O5' DT A 16 8898 7267 8453 3122 -1429 634 O ATOM 329 C5' DT A 16 42.971 41.336 53.290 1.00 75.15 C ANISOU 329 C5' DT A 16 9656 8944 9955 3501 -1198 373 C ATOM 330 C4' DT A 16 44.072 40.406 52.766 1.00 84.19 C ANISOU 330 C4' DT A 16 10766 9966 11257 4119 -1598 130 C ATOM 331 O4' DT A 16 45.042 41.045 51.866 1.00 91.89 O ANISOU 331 O4' DT A 16 11094 11530 12290 4432 -1409 -193 O ATOM 332 C3' DT A 16 44.993 39.862 53.829 1.00 71.61 C ANISOU 332 C3' DT A 16 9414 8137 9656 4356 -2128 201 C ATOM 333 O3' DT A 16 45.546 38.607 53.339 1.00 90.06 O ANISOU 333 O3' DT A 16 11937 10097 12184 4976 -2699 -100 O ATOM 334 C2' DT A 16 45.930 41.081 53.976 1.00 60.13 C ANISOU 334 C2' DT A 16 7354 7325 8167 4398 -1861 114 C ATOM 335 C1' DT A 16 46.067 41.701 52.592 1.00 64.78 C ANISOU 335 C1' DT A 16 7380 8444 8789 4474 -1465 -173 C ATOM 336 N1 DT A 16 45.888 43.258 52.425 1.00 68.73 N ANISOU 336 N1 DT A 16 7565 9392 9158 3998 -1026 -38 N ATOM 337 C2 DT A 16 46.548 43.857 51.374 1.00 72.63 C ANISOU 337 C2 DT A 16 7556 10480 9560 3978 -850 -251 C ATOM 338 O2 DT A 16 47.241 43.220 50.607 1.00 99.03 O ANISOU 338 O2 DT A 16 10577 14148 12903 4336 -926 -617 O ATOM 339 N3 DT A 16 46.407 45.216 51.214 1.00 58.72 N ANISOU 339 N3 DT A 16 5682 8967 7661 3491 -648 -74 N ATOM 340 C4 DT A 16 45.681 46.042 52.017 1.00 47.87 C ANISOU 340 C4 DT A 16 4586 7297 6305 3183 -620 180 C ATOM 341 O4 DT A 16 45.580 47.259 51.841 1.00 67.54 O ANISOU 341 O4 DT A 16 7048 9899 8713 2821 -596 284 O ATOM 342 C5 DT A 16 45.011 45.394 53.090 1.00 52.53 C ANISOU 342 C5 DT A 16 5537 7446 6976 3263 -694 281 C ATOM 343 C7 DT A 16 44.194 46.316 53.959 1.00 59.26 C ANISOU 343 C7 DT A 16 6554 8170 7794 2941 -626 389 C ATOM 344 C6 DT A 16 45.083 44.045 53.238 1.00 55.72 C ANISOU 344 C6 DT A 16 6138 7589 7445 3571 -881 232 C ATOM 345 P DG A 17 46.940 38.132 53.881 1.00 97.09 P ANISOU 345 P DG A 17 12759 10926 13205 5612 -3343 -347 P ATOM 346 OP1 DG A 17 47.190 36.701 53.578 1.00116.47 O ANISOU 346 OP1 DG A 17 15648 12727 15880 6241 -4147 -656 O ATOM 347 OP2 DG A 17 47.023 38.636 55.279 1.00 92.51 O ANISOU 347 OP2 DG A 17 12420 10296 12435 5163 -3398 97 O ATOM 348 O5' DG A 17 47.947 39.008 52.978 1.00102.03 O ANISOU 348 O5' DG A 17 12373 12534 13861 5956 -2905 -845 O ATOM 349 C5' DG A 17 48.014 38.801 51.562 1.00100.94 C ANISOU 349 C5' DG A 17 11791 12777 13786 6271 -2702 -1342 C ATOM 350 C4' DG A 17 49.396 38.467 50.982 1.00104.79 C ANISOU 350 C4' DG A 17 11551 13912 14353 7044 -2967 -2124 C ATOM 351 O4' DG A 17 50.002 39.704 50.527 1.00107.44 O ANISOU 351 O4' DG A 17 11073 15331 14418 6685 -2365 -2232 O ATOM 352 C3' DG A 17 50.475 37.862 51.856 1.00 97.19 C ANISOU 352 C3' DG A 17 10590 12779 13560 7708 -3720 -2408 C ATOM 353 O3' DG A 17 51.420 37.170 50.998 1.00116.85 O ANISOU 353 O3' DG A 17 12436 15772 16191 8607 -4067 -3376 O ATOM 354 C2' DG A 17 51.041 39.102 52.561 1.00 92.73 C ANISOU 354 C2' DG A 17 9614 12847 12771 7243 -3338 -2111 C ATOM 355 C1' DG A 17 50.853 40.217 51.524 1.00101.25 C ANISOU 355 C1' DG A 17 10094 14804 13573 6668 -2505 -2122 C ATOM 356 N9 DG A 17 50.250 41.474 51.999 1.00 91.26 N ANISOU 356 N9 DG A 17 9018 13546 12108 5821 -2016 -1458 N ATOM 357 C8 DG A 17 49.410 41.670 53.062 1.00 83.95 C ANISOU 357 C8 DG A 17 8765 11923 11209 5428 -2045 -862 C ATOM 358 N7 DG A 17 49.073 42.927 53.226 1.00 89.35 N ANISOU 358 N7 DG A 17 9384 12850 11716 4808 -1619 -526 N ATOM 359 C5 DG A 17 49.756 43.605 52.232 1.00 80.48 C ANISOU 359 C5 DG A 17 7609 12560 10410 4685 -1344 -802 C ATOM 360 C6 DG A 17 49.791 44.983 51.935 1.00 78.33 C ANISOU 360 C6 DG A 17 7128 12750 9885 4038 -1014 -590 C ATOM 361 O6 DG A 17 49.208 45.898 52.508 1.00 74.99 O ANISOU 361 O6 DG A 17 7029 12033 9429 3592 -923 -195 O ATOM 362 N1 DG A 17 50.582 45.278 50.844 1.00 76.13 N ANISOU 362 N1 DG A 17 6222 13371 9334 3886 -851 -926 N ATOM 363 C2 DG A 17 51.281 44.329 50.141 1.00 96.84 C ANISOU 363 C2 DG A 17 8330 16514 11950 4417 -936 -1543 C ATOM 364 N2 DG A 17 52.013 44.790 49.115 1.00104.88 N ANISOU 364 N2 DG A 17 8665 18621 12562 4062 -699 -1878 N ATOM 365 N3 DG A 17 51.279 43.020 50.419 1.00 99.49 N ANISOU 365 N3 DG A 17 8824 16367 12612 5208 -1301 -1855 N ATOM 366 C4 DG A 17 50.477 42.728 51.471 1.00 85.44 C ANISOU 366 C4 DG A 17 7800 13579 11084 5252 -1518 -1388 C ATOM 367 P DC A 18 52.934 36.910 51.523 1.00133.94 P ANISOU 367 P DC A 18 14017 18393 18482 9430 -4697 -4041 P ATOM 368 OP1 DC A 18 53.718 36.017 50.645 1.00126.18 O ANISOU 368 OP1 DC A 18 12405 17850 17687 10483 -5173 -5201 O ATOM 369 OP2 DC A 18 52.871 36.630 52.978 1.00110.57 O ANISOU 369 OP2 DC A 18 11902 14451 15660 9383 -5348 -3442 O ATOM 370 O5' DC A 18 53.502 38.402 51.378 1.00136.52 O ANISOU 370 O5' DC A 18 13440 20035 18398 8748 -3832 -3944 O ATOM 371 C5' DC A 18 53.861 38.924 50.104 1.00138.35 C ANISOU 371 C5' DC A 18 12727 21525 18313 8554 -3205 -4480 C ATOM 372 C4' DC A 18 54.819 40.083 50.281 1.00134.87 C ANISOU 372 C4' DC A 18 11478 22283 17484 8059 -2796 -4502 C ATOM 373 O4' DC A 18 54.040 41.170 50.813 1.00127.58 O ANISOU 373 O4' DC A 18 11128 20947 16402 7075 -2345 -3494 O ATOM 374 C3' DC A 18 55.988 39.837 51.242 1.00137.15 C ANISOU 374 C3' DC A 18 11419 22782 17910 8688 -3392 -4876 C ATOM 375 O3' DC A 18 57.252 39.798 50.527 1.00148.62 O ANISOU 375 O3' DC A 18 11577 25764 19126 9113 -3364 -5967 O ATOM 376 C2' DC A 18 55.865 40.964 52.264 1.00125.89 C ANISOU 376 C2' DC A 18 10345 21184 16302 7843 -3110 -3965 C ATOM 377 C1' DC A 18 54.888 41.926 51.627 1.00120.76 C ANISOU 377 C1' DC A 18 9941 20576 15365 6833 -2355 -3352 C ATOM 378 N1 DC A 18 53.995 42.606 52.578 1.00113.58 N ANISOU 378 N1 DC A 18 9877 18786 14493 6199 -2224 -2407 N ATOM 379 C2 DC A 18 53.703 43.951 52.362 1.00104.00 C ANISOU 379 C2 DC A 18 8630 17938 12946 5266 -1688 -1939 C ATOM 380 O2 DC A 18 54.204 44.524 51.385 1.00103.90 O ANISOU 380 O2 DC A 18 7970 18942 12565 4865 -1356 -2213 O ATOM 381 N3 DC A 18 52.877 44.581 53.238 1.00101.72 N ANISOU 381 N3 DC A 18 9038 16898 12713 4800 -1617 -1242 N ATOM 382 C4 DC A 18 52.356 43.911 54.275 1.00 99.00 C ANISOU 382 C4 DC A 18 9347 15629 12640 5095 -1957 -979 C ATOM 383 N4 DC A 18 51.546 44.570 55.111 1.00 92.02 N ANISOU 383 N4 DC A 18 9012 14225 11727 4591 -1827 -421 N ATOM 384 C5 DC A 18 52.641 42.532 54.503 1.00102.12 C ANISOU 384 C5 DC A 18 9888 15605 13309 5883 -2526 -1317 C ATOM 385 C6 DC A 18 53.452 41.926 53.636 1.00110.00 C ANISOU 385 C6 DC A 18 10243 17204 14349 6481 -2687 -2041 C ATOM 386 P DA A 19 58.690 40.042 51.226 1.00160.23 P ANISOU 386 P DA A 19 12197 28183 20499 9455 -3681 -6480 P ATOM 387 OP1 DA A 19 59.758 39.569 50.309 1.00166.94 O ANISOU 387 OP1 DA A 19 11713 30528 21188 10161 -3778 -7888 O ATOM 388 OP2 DA A 19 58.635 39.510 52.603 1.00160.94 O ANISOU 388 OP2 DA A 19 13148 26942 21058 9980 -4490 -6054 O ATOM 389 O5' DA A 19 58.766 41.631 51.368 1.00144.07 O ANISOU 389 O5' DA A 19 9966 26891 17882 8087 -2895 -5715 O ATOM 390 C5' DA A 19 58.284 42.442 50.305 1.00144.52 C ANISOU 390 C5' DA A 19 9864 27589 17456 7081 -2127 -5457 C ATOM 391 C4' DA A 19 58.615 43.882 50.593 1.00139.25 C ANISOU 391 C4' DA A 19 9048 27586 16273 5910 -1690 -4843 C ATOM 392 O4' DA A 19 57.530 44.506 51.329 1.00130.46 O ANISOU 392 O4' DA A 19 9086 25139 15345 5354 -1609 -3724 O ATOM 393 C3' DA A 19 59.893 44.005 51.413 1.00138.92 C ANISOU 393 C3' DA A 19 8329 28303 16149 6185 -2002 -5222 C ATOM 394 O3' DA A 19 60.875 44.676 50.642 1.00154.63 O ANISOU 394 O3' DA A 19 9165 32165 17422 5494 -1593 -5749 O ATOM 395 C2' DA A 19 59.497 44.748 52.677 1.00128.95 C ANISOU 395 C2' DA A 19 7963 26013 15018 5702 -2082 -4185 C ATOM 396 C1' DA A 19 58.088 45.269 52.389 1.00127.13 C ANISOU 396 C1' DA A 19 8697 24796 14812 5001 -1711 -3330 C ATOM 397 N9 DA A 19 57.199 45.172 53.548 1.00120.03 N ANISOU 397 N9 DA A 19 8871 22395 14342 5142 -1963 -2603 N ATOM 398 C8 DA A 19 56.922 44.044 54.280 1.00119.56 C ANISOU 398 C8 DA A 19 9322 21328 14776 6003 -2504 -2659 C ATOM 399 N7 DA A 19 56.096 44.251 55.277 1.00113.39 N ANISOU 399 N7 DA A 19 9443 19484 14154 5738 -2580 -1925 N ATOM 400 C5 DA A 19 55.815 45.609 55.190 1.00110.66 C ANISOU 400 C5 DA A 19 9150 19415 13480 4794 -2087 -1439 C ATOM 401 C6 DA A 19 54.987 46.456 55.953 1.00105.08 C ANISOU 401 C6 DA A 19 9138 18032 12754 4200 -1942 -745 C ATOM 402 N6 DA A 19 54.307 45.972 56.983 1.00103.78 N ANISOU 402 N6 DA A 19 9673 16924 12836 4401 -2187 -423 N ATOM 403 N1 DA A 19 54.891 47.770 55.631 1.00102.93 N ANISOU 403 N1 DA A 19 8830 18109 12168 3385 -1618 -452 N ATOM 404 C2 DA A 19 55.617 48.191 54.587 1.00106.96 C ANISOU 404 C2 DA A 19 8674 19653 12313 3020 -1422 -741 C ATOM 405 N3 DA A 19 56.428 47.489 53.787 1.00108.78 N ANISOU 405 N3 DA A 19 8122 20777 12431 3399 -1417 -1400 N ATOM 406 C4 DA A 19 56.486 46.193 54.139 1.00111.04 C ANISOU 406 C4 DA A 19 8422 20643 13127 4380 -1762 -1779 C TER 407 DA A 19 ATOM 408 N ARG C 471 21.650 38.048 13.605 1.00 98.29 N ANISOU 408 N ARG C 471 16893 11423 9031 -2677 -1232 -2044 N ATOM 409 CA ARG C 471 22.397 37.608 14.824 1.00 97.59 C ANISOU 409 CA ARG C 471 16428 11076 9575 -2564 -788 -1947 C ATOM 410 C ARG C 471 23.585 38.512 15.250 1.00 96.05 C ANISOU 410 C ARG C 471 16023 10869 9605 -2329 -477 -1581 C ATOM 411 O ARG C 471 24.433 38.104 16.060 1.00 94.38 O ANISOU 411 O ARG C 471 15484 10612 9764 -2157 -93 -1533 O ATOM 412 CB ARG C 471 22.882 36.188 14.631 1.00100.09 C ANISOU 412 CB ARG C 471 17145 11038 9848 -2629 -274 -2233 C ATOM 413 CG ARG C 471 21.761 35.210 14.241 1.00115.91 C ANISOU 413 CG ARG C 471 19498 12969 11573 -3138 -490 -2685 C ATOM 414 CD ARG C 471 22.290 33.860 13.687 1.00131.47 C ANISOU 414 CD ARG C 471 22305 14370 13276 -3204 73 -3028 C ATOM 415 NE ARG C 471 23.231 33.232 14.618 1.00138.74 N ANISOU 415 NE ARG C 471 23290 14824 14602 -2698 601 -2869 N ATOM 416 CZ ARG C 471 24.549 33.468 14.684 1.00140.09 C ANISOU 416 CZ ARG C 471 23275 15072 14882 -2022 1019 -2641 C ATOM 417 NH1 ARG C 471 25.161 34.315 13.859 1.00138.87 N ANISOU 417 NH1 ARG C 471 22945 15349 14472 -1933 1104 -2537 N ATOM 418 NH2 ARG C 471 25.279 32.840 15.598 1.00143.94 N ANISOU 418 NH2 ARG C 471 23748 15280 15663 -1439 1371 -2523 N ATOM 419 N GLU C 472 23.613 39.754 14.760 1.00 96.11 N ANISOU 419 N GLU C 472 16255 10938 9326 -2347 -668 -1336 N ATOM 420 CA GLU C 472 24.697 40.693 15.075 1.00 94.02 C ANISOU 420 CA GLU C 472 15909 10657 9157 -2425 -336 -1055 C ATOM 421 C GLU C 472 24.169 42.027 15.657 1.00 92.06 C ANISOU 421 C GLU C 472 15723 10264 8991 -2362 -775 -807 C ATOM 422 O GLU C 472 23.328 42.724 15.051 1.00 94.78 O ANISOU 422 O GLU C 472 16600 10486 8927 -2187 -1233 -699 O ATOM 423 CB GLU C 472 25.502 40.970 13.801 1.00100.75 C ANISOU 423 CB GLU C 472 17335 11534 9413 -2681 96 -990 C ATOM 424 CG GLU C 472 26.999 41.231 14.011 1.00103.08 C ANISOU 424 CG GLU C 472 17284 12099 9783 -2953 779 -929 C ATOM 425 CD GLU C 472 27.728 41.860 12.790 1.00108.15 C ANISOU 425 CD GLU C 472 18542 12820 9730 -3431 1259 -813 C ATOM 426 OE1 GLU C 472 27.234 41.799 11.632 1.00101.91 O ANISOU 426 OE1 GLU C 472 18524 11859 8337 -3430 1153 -803 O ATOM 427 OE2 GLU C 472 28.830 42.418 13.008 1.00111.36 O ANISOU 427 OE2 GLU C 472 18636 13548 10128 -3895 1774 -755 O ATOM 428 N CYS C 473 24.668 42.395 16.827 1.00 85.30 N ANISOU 428 N CYS C 473 14399 9427 8583 -2410 -658 -735 N ATOM 429 CA CYS C 473 24.254 43.645 17.420 1.00 86.03 C ANISOU 429 CA CYS C 473 14699 9271 8717 -2339 -991 -565 C ATOM 430 C CYS C 473 24.743 44.704 16.490 1.00 91.55 C ANISOU 430 C CYS C 473 16304 9621 8862 -2658 -815 -323 C ATOM 431 O CYS C 473 25.961 44.880 16.305 1.00 90.92 O ANISOU 431 O CYS C 473 16237 9630 8677 -3235 -243 -283 O ATOM 432 CB CYS C 473 24.849 43.856 18.816 1.00 85.43 C ANISOU 432 CB CYS C 473 14032 9304 9123 -2466 -843 -588 C ATOM 433 SG CYS C 473 24.528 45.447 19.505 1.00 83.59 S ANISOU 433 SG CYS C 473 14295 8619 8847 -2466 -1123 -458 S ATOM 434 N SER C 474 23.781 45.384 15.876 1.00 94.51 N ANISOU 434 N SER C 474 17438 9675 8796 -2271 -1296 -170 N ATOM 435 CA SER C 474 24.090 46.458 14.962 1.00 98.64 C ANISOU 435 CA SER C 474 19169 9670 8641 -2490 -1175 148 C ATOM 436 C SER C 474 24.811 47.638 15.637 1.00 99.63 C ANISOU 436 C SER C 474 19784 9270 8800 -2997 -875 307 C ATOM 437 O SER C 474 25.114 48.615 14.946 1.00106.69 O ANISOU 437 O SER C 474 21922 9547 9069 -3343 -682 599 O ATOM 438 CB SER C 474 22.803 46.944 14.278 1.00103.41 C ANISOU 438 CB SER C 474 20522 10073 8698 -1682 -1889 297 C ATOM 439 OG SER C 474 21.842 47.408 15.214 1.00100.57 O ANISOU 439 OG SER C 474 19909 9676 8627 -972 -2434 231 O ATOM 440 N TYR C 475 25.063 47.584 16.954 1.00 90.65 N ANISOU 440 N TYR C 475 17840 8320 8284 -3112 -829 114 N ATOM 441 CA TYR C 475 25.718 48.723 17.641 1.00 98.57 C ANISOU 441 CA TYR C 475 19343 8846 9261 -3725 -575 165 C ATOM 442 C TYR C 475 27.140 48.454 18.063 1.00 99.14 C ANISOU 442 C TYR C 475 18615 9501 9552 -4699 54 -24 C ATOM 443 O TYR C 475 28.026 49.283 17.844 1.00106.70 O ANISOU 443 O TYR C 475 20169 10229 10142 -5678 532 27 O ATOM 444 CB TYR C 475 25.015 49.131 18.920 1.00 93.78 C ANISOU 444 CB TYR C 475 18532 8054 9048 -3204 -1000 31 C ATOM 445 CG TYR C 475 23.603 49.557 18.792 1.00 97.21 C ANISOU 445 CG TYR C 475 19545 8104 9286 -2110 -1642 122 C ATOM 446 CD1 TYR C 475 23.268 50.885 18.642 1.00105.63 C ANISOU 446 CD1 TYR C 475 22069 8210 9854 -1811 -1802 329 C ATOM 447 CD2 TYR C 475 22.587 48.629 18.886 1.00101.77 C ANISOU 447 CD2 TYR C 475 19204 9331 10135 -1352 -2081 -42 C ATOM 448 CE1 TYR C 475 21.955 51.272 18.566 1.00115.20 C ANISOU 448 CE1 TYR C 475 23687 9241 10841 -535 -2442 375 C ATOM 449 CE2 TYR C 475 21.279 49.002 18.811 1.00103.76 C ANISOU 449 CE2 TYR C 475 19693 9556 10176 -318 -2688 -49 C ATOM 450 CZ TYR C 475 20.967 50.315 18.660 1.00112.20 C ANISOU 450 CZ TYR C 475 22073 9800 10758 208 -2897 157 C ATOM 451 OH TYR C 475 19.649 50.644 18.583 1.00127.70 O ANISOU 451 OH TYR C 475 24126 11930 12463 1483 -3547 112 O ATOM 452 N CYS C 476 27.328 47.334 18.746 1.00 95.26 N ANISOU 452 N CYS C 476 16799 9789 9605 -4428 39 -262 N ATOM 453 CA CYS C 476 28.619 46.982 19.309 1.00 97.58 C ANISOU 453 CA CYS C 476 16095 10875 10107 -5034 497 -483 C ATOM 454 C CYS C 476 29.346 45.992 18.435 1.00101.98 C ANISOU 454 C CYS C 476 16116 12096 10537 -5062 947 -556 C ATOM 455 O CYS C 476 30.527 45.723 18.644 1.00104.23 O ANISOU 455 O CYS C 476 15539 13219 10845 -5486 1396 -757 O ATOM 456 CB CYS C 476 28.448 46.391 20.709 1.00 93.24 C ANISOU 456 CB CYS C 476 14556 10748 10122 -4549 192 -665 C ATOM 457 SG CYS C 476 27.680 44.801 20.782 1.00 82.53 S ANISOU 457 SG CYS C 476 12587 9645 9125 -3551 -69 -693 S ATOM 458 N GLY C 477 28.632 45.431 17.464 1.00103.94 N ANISOU 458 N GLY C 477 16822 12072 10599 -4550 811 -451 N ATOM 459 CA GLY C 477 29.226 44.496 16.533 1.00105.82 C ANISOU 459 CA GLY C 477 16779 12804 10625 -4502 1258 -562 C ATOM 460 C GLY C 477 29.433 43.090 17.050 1.00101.25 C ANISOU 460 C GLY C 477 15233 12770 10469 -3833 1287 -795 C ATOM 461 O GLY C 477 29.869 42.234 16.317 1.00104.76 O ANISOU 461 O GLY C 477 15546 13531 10727 -3614 1655 -935 O ATOM 462 N LYS C 478 29.127 42.811 18.299 1.00 97.82 N ANISOU 462 N LYS C 478 14257 12382 10527 -3450 938 -835 N ATOM 463 CA LYS C 478 29.310 41.446 18.772 1.00 96.70 C ANISOU 463 CA LYS C 478 13498 12576 10670 -2757 990 -984 C ATOM 464 C LYS C 478 28.283 40.557 18.078 1.00 92.29 C ANISOU 464 C LYS C 478 13533 11497 10038 -2360 810 -1016 C ATOM 465 O LYS C 478 27.283 41.039 17.531 1.00 90.78 O ANISOU 465 O LYS C 478 13965 10857 9670 -2518 472 -931 O ATOM 466 CB LYS C 478 29.230 41.357 20.314 1.00 95.27 C ANISOU 466 CB LYS C 478 12729 12554 10916 -2482 678 -977 C ATOM 467 CG LYS C 478 30.340 42.160 21.046 1.00102.39 C ANISOU 467 CG LYS C 478 12932 14157 11815 -2958 826 -1053 C ATOM 468 CD LYS C 478 30.491 41.833 22.545 1.00109.30 C ANISOU 468 CD LYS C 478 13127 15418 12986 -2548 549 -1086 C ATOM 469 CE LYS C 478 31.837 42.374 23.119 1.00120.07 C ANISOU 469 CE LYS C 478 13552 17849 14219 -2999 728 -1285 C ATOM 470 NZ LYS C 478 32.465 41.524 24.205 1.00120.74 N ANISOU 470 NZ LYS C 478 12731 18758 14387 -2216 586 -1355 N ATOM 471 N PHE C 479 28.578 39.263 18.088 1.00 91.27 N ANISOU 471 N PHE C 479 13242 11471 9967 -1824 1040 -1172 N ATOM 472 CA PHE C 479 27.771 38.237 17.453 1.00 89.17 C ANISOU 472 CA PHE C 479 13591 10718 9570 -1591 982 -1311 C ATOM 473 C PHE C 479 27.119 37.420 18.527 1.00 82.37 C ANISOU 473 C PHE C 479 12686 9554 9056 -1273 737 -1314 C ATOM 474 O PHE C 479 27.768 37.110 19.501 1.00 83.30 O ANISOU 474 O PHE C 479 12357 9901 9393 -870 840 -1248 O ATOM 475 CB PHE C 479 28.678 37.301 16.647 1.00 95.71 C ANISOU 475 CB PHE C 479 14546 11719 10100 -1207 1558 -1530 C ATOM 476 CG PHE C 479 28.844 37.707 15.229 1.00102.50 C ANISOU 476 CG PHE C 479 15851 12658 10437 -1591 1816 -1605 C ATOM 477 CD1 PHE C 479 28.039 37.146 14.235 1.00114.43 C ANISOU 477 CD1 PHE C 479 18174 13714 11590 -1667 1722 -1781 C ATOM 478 CD2 PHE C 479 29.793 38.656 14.875 1.00107.52 C ANISOU 478 CD2 PHE C 479 16149 13859 10845 -1999 2173 -1524 C ATOM 479 CE1 PHE C 479 28.183 37.529 12.898 1.00117.11 C ANISOU 479 CE1 PHE C 479 19021 14152 11323 -1997 1941 -1830 C ATOM 480 CE2 PHE C 479 29.945 39.052 13.557 1.00109.89 C ANISOU 480 CE2 PHE C 479 17005 14198 10551 -2423 2476 -1545 C ATOM 481 CZ PHE C 479 29.136 38.487 12.563 1.00119.11 C ANISOU 481 CZ PHE C 479 19024 14897 11337 -2347 2338 -1675 C ATOM 482 N PHE C 480 25.871 37.004 18.327 1.00 80.32 N ANISOU 482 N PHE C 480 12894 8865 8759 -1480 442 -1414 N ATOM 483 CA PHE C 480 25.091 36.339 19.391 1.00 76.76 C ANISOU 483 CA PHE C 480 12445 8147 8574 -1446 255 -1417 C ATOM 484 C PHE C 480 24.367 35.100 18.951 1.00 79.25 C ANISOU 484 C PHE C 480 13457 7964 8690 -1632 350 -1678 C ATOM 485 O PHE C 480 23.670 35.121 17.954 1.00 90.76 O ANISOU 485 O PHE C 480 15226 9404 9856 -2040 189 -1896 O ATOM 486 CB PHE C 480 24.090 37.348 19.922 1.00 76.63 C ANISOU 486 CB PHE C 480 12080 8312 8724 -1761 -241 -1333 C ATOM 487 CG PHE C 480 24.758 38.594 20.513 1.00 76.44 C ANISOU 487 CG PHE C 480 11576 8602 8867 -1686 -318 -1119 C ATOM 488 CD1 PHE C 480 25.251 38.581 21.790 1.00 63.19 C ANISOU 488 CD1 PHE C 480 9462 7093 7453 -1473 -279 -1006 C ATOM 489 CD2 PHE C 480 24.955 39.718 19.754 1.00 84.04 C ANISOU 489 CD2 PHE C 480 12669 9642 9619 -1890 -390 -1047 C ATOM 490 CE1 PHE C 480 25.868 39.657 22.308 1.00 76.50 C ANISOU 490 CE1 PHE C 480 10764 9083 9220 -1562 -338 -909 C ATOM 491 CE2 PHE C 480 25.589 40.798 20.277 1.00 88.84 C ANISOU 491 CE2 PHE C 480 13033 10412 10309 -2018 -381 -911 C ATOM 492 CZ PHE C 480 26.039 40.767 21.554 1.00 84.33 C ANISOU 492 CZ PHE C 480 11941 10073 10029 -1900 -364 -882 C ATOM 493 N ARG C 481 24.504 34.017 19.693 1.00 79.37 N ANISOU 493 N ARG C 481 13828 7549 8779 -1378 599 -1669 N ATOM 494 CA ARG C 481 24.012 32.692 19.243 1.00 82.57 C ANISOU 494 CA ARG C 481 15217 7255 8900 -1628 845 -1957 C ATOM 495 C ARG C 481 22.588 32.598 18.669 1.00 81.29 C ANISOU 495 C ARG C 481 15254 7098 8535 -2593 551 -2292 C ATOM 496 O ARG C 481 22.251 31.597 18.065 1.00 88.58 O ANISOU 496 O ARG C 481 17031 7502 9126 -2986 765 -2631 O ATOM 497 CB ARG C 481 24.105 31.677 20.387 1.00 84.95 C ANISOU 497 CB ARG C 481 16052 6955 9270 -1340 1097 -1808 C ATOM 498 CG ARG C 481 23.025 31.850 21.475 1.00 90.80 C ANISOU 498 CG ARG C 481 16509 7789 10201 -1971 839 -1710 C ATOM 499 CD ARG C 481 23.424 31.195 22.818 1.00 96.02 C ANISOU 499 CD ARG C 481 17556 8025 10904 -1477 1061 -1380 C ATOM 500 NE ARG C 481 22.368 31.231 23.839 1.00 81.13 N ANISOU 500 NE ARG C 481 15535 6203 9088 -2184 948 -1318 N ATOM 501 CZ ARG C 481 22.372 30.487 24.948 1.00 91.70 C ANISOU 501 CZ ARG C 481 17525 7020 10298 -2072 1192 -1059 C ATOM 502 NH1 ARG C 481 23.369 29.633 25.215 1.00 94.76 N ANISOU 502 NH1 ARG C 481 18805 6729 10472 -1115 1490 -808 N ATOM 503 NH2 ARG C 481 21.360 30.582 25.801 1.00100.67 N ANISOU 503 NH2 ARG C 481 18465 8346 11439 -2852 1157 -1050 N ATOM 504 N SER C 482 21.742 33.594 18.893 1.00 78.98 N ANISOU 504 N SER C 482 14193 7433 8384 -2948 62 -2252 N ATOM 505 CA SER C 482 20.385 33.563 18.372 1.00 81.08 C ANISOU 505 CA SER C 482 14371 8037 8397 -3737 -298 -2619 C ATOM 506 C SER C 482 19.800 34.946 18.225 1.00 82.59 C ANISOU 506 C SER C 482 13729 9028 8624 -3624 -878 -2535 C ATOM 507 O SER C 482 20.289 35.934 18.821 1.00 76.86 O ANISOU 507 O SER C 482 12556 8456 8193 -3106 -971 -2186 O ATOM 508 CB SER C 482 19.497 32.826 19.349 1.00 85.60 C ANISOU 508 CB SER C 482 14980 8496 9047 -4387 -207 -2756 C ATOM 509 OG SER C 482 19.412 33.545 20.600 1.00 83.54 O ANISOU 509 OG SER C 482 13982 8589 9171 -4100 -342 -2441 O ATOM 510 N ASN C 483 18.707 34.994 17.478 1.00 89.46 N ANISOU 510 N ASN C 483 14440 10419 9131 -4101 -1288 -2893 N ATOM 511 CA ASN C 483 17.889 36.193 17.384 1.00 93.90 C ANISOU 511 CA ASN C 483 14260 11801 9617 -3853 -1917 -2870 C ATOM 512 C ASN C 483 17.244 36.460 18.733 1.00 90.57 C ANISOU 512 C ASN C 483 13094 11753 9565 -3870 -1999 -2832 C ATOM 513 O ASN C 483 17.308 37.559 19.249 1.00 86.78 O ANISOU 513 O ASN C 483 12208 11473 9290 -3266 -2220 -2568 O ATOM 514 CB ASN C 483 16.814 36.026 16.296 1.00104.64 C ANISOU 514 CB ASN C 483 15510 13854 10394 -4296 -2396 -3337 C ATOM 515 CG ASN C 483 16.506 37.331 15.586 1.00115.64 C ANISOU 515 CG ASN C 483 16655 15824 11458 -3595 -3030 -3177 C ATOM 516 OD1 ASN C 483 15.686 38.127 16.058 1.00118.31 O ANISOU 516 OD1 ASN C 483 16257 16858 11838 -3199 -3496 -3175 O ATOM 517 ND2 ASN C 483 17.169 37.561 14.440 1.00126.58 N ANISOU 517 ND2 ASN C 483 18761 16897 12437 -3363 -3016 -3036 N ATOM 518 N TYR C 484 16.630 35.433 19.310 1.00 93.11 N ANISOU 518 N TYR C 484 13363 12109 9905 -4638 -1753 -3120 N ATOM 519 CA TYR C 484 16.022 35.551 20.626 1.00 90.75 C ANISOU 519 CA TYR C 484 12414 12193 9874 -4783 -1701 -3109 C ATOM 520 C TYR C 484 16.888 36.403 21.507 1.00 83.30 C ANISOU 520 C TYR C 484 11386 10930 9334 -3956 -1627 -2621 C ATOM 521 O TYR C 484 16.427 37.422 22.034 1.00 83.12 O ANISOU 521 O TYR C 484 10700 11461 9422 -3520 -1939 -2579 O ATOM 522 CB TYR C 484 15.837 34.169 21.265 1.00 96.66 C ANISOU 522 CB TYR C 484 13658 12474 10593 -5721 -1145 -3270 C ATOM 523 CG TYR C 484 15.133 34.147 22.611 1.00100.32 C ANISOU 523 CG TYR C 484 13542 13375 11200 -6089 -979 -3289 C ATOM 524 CD1 TYR C 484 13.758 34.368 22.714 1.00112.27 C ANISOU 524 CD1 TYR C 484 14018 16125 12515 -6662 -1241 -3753 C ATOM 525 CD2 TYR C 484 15.843 33.863 23.779 1.00 92.05 C ANISOU 525 CD2 TYR C 484 12951 11628 10398 -5852 -546 -2874 C ATOM 526 CE1 TYR C 484 13.120 34.349 23.958 1.00119.78 C ANISOU 526 CE1 TYR C 484 14394 17581 13537 -7034 -990 -3805 C ATOM 527 CE2 TYR C 484 15.212 33.823 25.023 1.00 95.45 C ANISOU 527 CE2 TYR C 484 12958 12449 10860 -6228 -338 -2878 C ATOM 528 CZ TYR C 484 13.863 34.079 25.112 1.00111.83 C ANISOU 528 CZ TYR C 484 14006 15724 12762 -6845 -514 -3344 C ATOM 529 OH TYR C 484 13.267 34.041 26.350 1.00113.80 O ANISOU 529 OH TYR C 484 13812 16438 12989 -7240 -213 -3373 O ATOM 530 N TYR C 485 18.143 35.991 21.680 1.00 78.10 N ANISOU 530 N TYR C 485 11386 9448 8842 -3704 -1222 -2308 N ATOM 531 CA TYR C 485 19.003 36.685 22.629 1.00 71.51 C ANISOU 531 CA TYR C 485 10390 8449 8333 -3091 -1144 -1921 C ATOM 532 C TYR C 485 19.358 38.055 22.090 1.00 72.90 C ANISOU 532 C TYR C 485 10380 8807 8510 -2555 -1482 -1777 C ATOM 533 O TYR C 485 19.332 39.041 22.819 1.00 76.02 O ANISOU 533 O TYR C 485 10426 9390 9067 -2216 -1654 -1652 O ATOM 534 CB TYR C 485 20.272 35.906 23.008 1.00 66.89 C ANISOU 534 CB TYR C 485 10376 7192 7847 -2839 -684 -1660 C ATOM 535 CG TYR C 485 21.084 36.675 24.047 1.00 75.16 C ANISOU 535 CG TYR C 485 11065 8342 9150 -2309 -700 -1347 C ATOM 536 CD1 TYR C 485 20.750 36.649 25.393 1.00 72.39 C ANISOU 536 CD1 TYR C 485 10474 8124 8906 -2341 -668 -1258 C ATOM 537 CD2 TYR C 485 22.140 37.482 23.677 1.00 79.33 C ANISOU 537 CD2 TYR C 485 11485 8923 9734 -1911 -738 -1193 C ATOM 538 CE1 TYR C 485 21.459 37.378 26.325 1.00 65.44 C ANISOU 538 CE1 TYR C 485 9279 7410 8173 -1927 -734 -1047 C ATOM 539 CE2 TYR C 485 22.856 38.226 24.626 1.00 77.16 C ANISOU 539 CE2 TYR C 485 10844 8848 9624 -1625 -778 -1008 C ATOM 540 CZ TYR C 485 22.508 38.184 25.955 1.00 75.79 C ANISOU 540 CZ TYR C 485 10449 8800 9549 -1602 -814 -948 C ATOM 541 OH TYR C 485 23.236 38.946 26.916 1.00 77.35 O ANISOU 541 OH TYR C 485 10304 9255 9830 -1372 -895 -828 O ATOM 542 N LEU C 486 19.670 38.149 20.808 1.00 76.90 N ANISOU 542 N LEU C 486 11264 9196 8760 -2516 -1547 -1804 N ATOM 543 CA LEU C 486 19.967 39.453 20.265 1.00 75.88 C ANISOU 543 CA LEU C 486 11204 9114 8513 -2112 -1810 -1622 C ATOM 544 C LEU C 486 18.860 40.418 20.679 1.00 78.76 C ANISOU 544 C LEU C 486 11124 9950 8852 -1807 -2297 -1698 C ATOM 545 O LEU C 486 19.138 41.527 21.148 1.00 80.17 O ANISOU 545 O LEU C 486 11344 9994 9124 -1414 -2396 -1505 O ATOM 546 CB LEU C 486 20.145 39.390 18.756 1.00 76.13 C ANISOU 546 CB LEU C 486 11755 9062 8110 -2177 -1854 -1672 C ATOM 547 CG LEU C 486 20.447 40.688 17.963 1.00 84.36 C ANISOU 547 CG LEU C 486 13197 10018 8836 -1853 -2067 -1432 C ATOM 548 CD1 LEU C 486 21.423 41.637 18.677 1.00 78.52 C ANISOU 548 CD1 LEU C 486 12509 8979 8347 -1725 -1845 -1132 C ATOM 549 CD2 LEU C 486 20.921 40.401 16.491 1.00 77.96 C ANISOU 549 CD2 LEU C 486 13026 9069 7525 -2014 -1912 -1447 C ATOM 550 N ASN C 487 17.619 39.970 20.559 1.00 83.38 N ANISOU 550 N ASN C 487 11276 11133 9273 -2006 -2564 -2035 N ATOM 551 CA ASN C 487 16.477 40.802 20.885 1.00 91.33 C ANISOU 551 CA ASN C 487 11687 12836 10177 -1554 -3038 -2198 C ATOM 552 C ASN C 487 16.693 41.398 22.247 1.00 84.82 C ANISOU 552 C ASN C 487 10643 11875 9710 -1261 -2882 -2055 C ATOM 553 O ASN C 487 16.627 42.615 22.446 1.00 90.48 O ANISOU 553 O ASN C 487 11471 12527 10380 -585 -3133 -1946 O ATOM 554 CB ASN C 487 15.167 39.986 20.852 1.00101.20 C ANISOU 554 CB ASN C 487 12196 15017 11238 -2058 -3203 -2689 C ATOM 555 CG ASN C 487 13.930 40.837 21.175 1.00112.76 C ANISOU 555 CG ASN C 487 12795 17517 12533 -1429 -3703 -2944 C ATOM 556 OD1 ASN C 487 13.662 41.177 22.335 1.00108.65 O ANISOU 556 OD1 ASN C 487 11812 17213 12256 -1211 -3572 -2972 O ATOM 557 ND2 ASN C 487 13.178 41.185 20.137 1.00125.05 N ANISOU 557 ND2 ASN C 487 14129 19789 13594 -1027 -4292 -3152 N ATOM 558 N ILE C 488 16.980 40.503 23.169 1.00 79.16 N ANISOU 558 N ILE C 488 9782 11024 9270 -1766 -2451 -2057 N ATOM 559 CA ILE C 488 17.307 40.839 24.557 1.00 77.07 C ANISOU 559 CA ILE C 488 9357 10641 9284 -1613 -2245 -1926 C ATOM 560 C ILE C 488 18.541 41.738 24.703 1.00 72.15 C ANISOU 560 C ILE C 488 9212 9417 8783 -1275 -2189 -1612 C ATOM 561 O ILE C 488 18.482 42.776 25.370 1.00 77.51 O ANISOU 561 O ILE C 488 9864 10087 9497 -884 -2319 -1604 O ATOM 562 CB ILE C 488 17.526 39.508 25.340 1.00 76.13 C ANISOU 562 CB ILE C 488 9266 10367 9295 -2227 -1774 -1903 C ATOM 563 CG1 ILE C 488 16.177 38.950 25.861 1.00 84.93 C ANISOU 563 CG1 ILE C 488 9785 12199 10287 -2719 -1718 -2252 C ATOM 564 CG2 ILE C 488 18.490 39.677 26.413 1.00 68.32 C ANISOU 564 CG2 ILE C 488 8432 9024 8504 -2030 -1549 -1629 C ATOM 565 CD1 ILE C 488 16.146 37.391 26.089 1.00 72.17 C ANISOU 565 CD1 ILE C 488 8559 10275 8588 -3612 -1233 -2287 C ATOM 566 N HIS C 489 19.651 41.328 24.088 1.00 65.80 N ANISOU 566 N HIS C 489 8839 8172 7992 -1480 -1956 -1420 N ATOM 567 CA HIS C 489 20.902 42.068 24.185 1.00 64.80 C ANISOU 567 CA HIS C 489 9013 7685 7923 -1404 -1824 -1197 C ATOM 568 C HIS C 489 20.781 43.503 23.730 1.00 65.82 C ANISOU 568 C HIS C 489 9551 7602 7855 -1128 -2094 -1148 C ATOM 569 O HIS C 489 21.501 44.373 24.190 1.00 70.17 O ANISOU 569 O HIS C 489 10345 7886 8429 -1177 -2015 -1060 O ATOM 570 CB HIS C 489 22.003 41.395 23.368 1.00 65.46 C ANISOU 570 CB HIS C 489 9362 7559 7952 -1618 -1507 -1081 C ATOM 571 CG HIS C 489 23.149 42.302 23.006 1.00 56.27 C ANISOU 571 CG HIS C 489 8456 6228 6695 -1715 -1371 -935 C ATOM 572 ND1 HIS C 489 24.230 42.504 23.833 1.00 61.04 N ANISOU 572 ND1 HIS C 489 8795 6966 7433 -1834 -1165 -880 N ATOM 573 CD2 HIS C 489 23.398 43.019 21.877 1.00 64.81 C ANISOU 573 CD2 HIS C 489 10057 7090 7479 -1828 -1373 -852 C ATOM 574 CE1 HIS C 489 25.082 43.329 23.237 1.00 74.99 C ANISOU 574 CE1 HIS C 489 10826 8653 9013 -2149 -1012 -822 C ATOM 575 NE2 HIS C 489 24.615 43.631 22.035 1.00 62.60 N ANISOU 575 NE2 HIS C 489 9820 6793 7173 -2159 -1091 -770 N ATOM 576 N LEU C 490 19.862 43.753 22.834 1.00 67.99 N ANISOU 576 N LEU C 490 9988 7986 7858 -843 -2425 -1221 N ATOM 577 CA LEU C 490 19.710 45.086 22.329 1.00 75.68 C ANISOU 577 CA LEU C 490 11619 8614 8521 -409 -2699 -1109 C ATOM 578 C LEU C 490 19.134 46.031 23.372 1.00 79.04 C ANISOU 578 C LEU C 490 12007 9025 9001 110 -2891 -1221 C ATOM 579 O LEU C 490 19.417 47.239 23.356 1.00 83.26 O ANISOU 579 O LEU C 490 13351 8953 9332 356 -2947 -1103 O ATOM 580 CB LEU C 490 18.844 45.058 21.085 1.00 82.41 C ANISOU 580 CB LEU C 490 12655 9707 8951 -53 -3093 -1148 C ATOM 581 CG LEU C 490 19.594 44.483 19.880 1.00 81.19 C ANISOU 581 CG LEU C 490 12915 9353 8579 -526 -2868 -1014 C ATOM 582 CD1 LEU C 490 18.589 44.122 18.862 1.00 81.31 C ANISOU 582 CD1 LEU C 490 12860 9849 8183 -281 -3295 -1173 C ATOM 583 CD2 LEU C 490 20.641 45.474 19.322 1.00 79.07 C ANISOU 583 CD2 LEU C 490 13622 8382 8038 -681 -2641 -691 C ATOM 584 N ARG C 491 18.373 45.483 24.304 1.00 76.02 N ANISOU 584 N ARG C 491 10809 9241 8835 207 -2915 -1466 N ATOM 585 CA ARG C 491 17.752 46.310 25.299 1.00 78.45 C ANISOU 585 CA ARG C 491 11010 9655 9141 772 -3049 -1645 C ATOM 586 C ARG C 491 18.786 47.184 25.963 1.00 79.30 C ANISOU 586 C ARG C 491 11779 9045 9306 580 -2837 -1531 C ATOM 587 O ARG C 491 18.527 48.345 26.319 1.00 88.48 O ANISOU 587 O ARG C 491 13521 9814 10282 1119 -2975 -1615 O ATOM 588 CB ARG C 491 17.047 45.445 26.316 1.00 78.12 C ANISOU 588 CB ARG C 491 9990 10385 9306 610 -2915 -1904 C ATOM 589 CG ARG C 491 15.904 44.661 25.725 1.00 82.69 C ANISOU 589 CG ARG C 491 9854 11810 9752 606 -3107 -2140 C ATOM 590 CD ARG C 491 15.274 43.763 26.744 1.00 85.66 C ANISOU 590 CD ARG C 491 9385 12897 10264 159 -2832 -2390 C ATOM 591 NE ARG C 491 14.371 42.808 26.105 1.00 98.99 N ANISOU 591 NE ARG C 491 10448 15361 11801 -282 -2907 -2651 N ATOM 592 CZ ARG C 491 13.939 41.668 26.653 1.00101.64 C ANISOU 592 CZ ARG C 491 10277 16163 12178 -1114 -2553 -2834 C ATOM 593 NH1 ARG C 491 14.300 41.292 27.881 1.00 98.13 N ANISOU 593 NH1 ARG C 491 9887 15500 11900 -1469 -2113 -2723 N ATOM 594 NH2 ARG C 491 13.123 40.890 25.960 1.00106.21 N ANISOU 594 NH2 ARG C 491 10377 17434 12543 -1670 -2634 -3145 N ATOM 595 N THR C 492 19.983 46.651 26.118 1.00 72.56 N ANISOU 595 N THR C 492 10881 8043 8647 -175 -2503 -1383 N ATOM 596 CA THR C 492 20.970 47.411 26.859 1.00 74.41 C ANISOU 596 CA THR C 492 11514 7865 8891 -533 -2319 -1380 C ATOM 597 C THR C 492 21.590 48.524 26.064 1.00 76.56 C ANISOU 597 C THR C 492 12857 7370 8864 -738 -2288 -1241 C ATOM 598 O THR C 492 22.387 49.242 26.619 1.00 81.15 O ANISOU 598 O THR C 492 13852 7602 9379 -1221 -2118 -1307 O ATOM 599 CB THR C 492 22.110 46.523 27.390 1.00 69.47 C ANISOU 599 CB THR C 492 10341 7569 8487 -1178 -2017 -1315 C ATOM 600 OG1 THR C 492 22.910 46.061 26.316 1.00 72.38 O ANISOU 600 OG1 THR C 492 10788 7889 8823 -1548 -1838 -1132 O ATOM 601 CG2 THR C 492 21.522 45.303 28.060 1.00 85.69 C ANISOU 601 CG2 THR C 492 11639 10186 10734 -1034 -1983 -1361 C ATOM 602 N HIS C 493 21.312 48.618 24.766 1.00 78.39 N ANISOU 602 N HIS C 493 13579 7363 8841 -524 -2412 -1055 N ATOM 603 CA HIS C 493 21.652 49.822 24.006 1.00 86.26 C ANISOU 603 CA HIS C 493 15910 7470 9395 -597 -2391 -875 C ATOM 604 C HIS C 493 20.437 50.708 23.932 1.00 90.26 C ANISOU 604 C HIS C 493 17109 7602 9582 535 -2817 -913 C ATOM 605 O HIS C 493 20.535 51.910 24.100 1.00 99.62 O ANISOU 605 O HIS C 493 19501 7898 10450 696 -2803 -897 O ATOM 606 CB HIS C 493 22.059 49.495 22.578 1.00 87.98 C ANISOU 606 CB HIS C 493 16464 7611 9355 -914 -2280 -606 C ATOM 607 CG HIS C 493 23.160 48.492 22.465 1.00 81.66 C ANISOU 607 CG HIS C 493 14898 7320 8808 -1751 -1865 -601 C ATOM 608 ND1 HIS C 493 24.389 48.673 23.062 1.00 68.04 N ANISOU 608 ND1 HIS C 493 12998 5661 7193 -2589 -1476 -677 N ATOM 609 CD2 HIS C 493 23.240 47.331 21.766 1.00 74.54 C ANISOU 609 CD2 HIS C 493 13421 6914 7988 -1808 -1779 -568 C ATOM 610 CE1 HIS C 493 25.163 47.637 22.771 1.00 80.12 C ANISOU 610 CE1 HIS C 493 13759 7801 8880 -2949 -1189 -675 C ATOM 611 NE2 HIS C 493 24.488 46.806 21.995 1.00 71.46 N ANISOU 611 NE2 HIS C 493 12511 6864 7777 -2476 -1338 -605 N ATOM 612 N THR C 494 19.299 50.086 23.657 1.00 89.42 N ANISOU 612 N THR C 494 16251 8222 9502 1317 -3185 -1001 N ATOM 613 CA THR C 494 18.054 50.784 23.414 1.00100.84 C ANISOU 613 CA THR C 494 18069 9677 10570 2624 -3677 -1070 C ATOM 614 C THR C 494 17.530 51.472 24.658 1.00104.93 C ANISOU 614 C THR C 494 18587 10130 11151 3284 -3719 -1378 C ATOM 615 O THR C 494 16.974 52.549 24.579 1.00115.68 O ANISOU 615 O THR C 494 20933 10930 12090 4341 -3974 -1393 O ATOM 616 CB THR C 494 16.955 49.820 22.869 1.00102.16 C ANISOU 616 CB THR C 494 17073 11018 10726 3115 -4063 -1219 C ATOM 617 OG1 THR C 494 16.783 48.706 23.751 1.00102.56 O ANISOU 617 OG1 THR C 494 15749 11940 11279 2580 -3856 -1497 O ATOM 618 CG2 THR C 494 17.334 49.292 21.514 1.00 97.49 C ANISOU 618 CG2 THR C 494 16736 10404 9903 2662 -4091 -961 C ATOM 619 N GLY C 495 17.714 50.851 25.809 1.00101.13 N ANISOU 619 N GLY C 495 17117 10185 11121 2744 -3455 -1621 N ATOM 620 CA GLY C 495 17.190 51.404 27.042 1.00105.43 C ANISOU 620 CA GLY C 495 17568 10806 11684 3328 -3444 -1967 C ATOM 621 C GLY C 495 15.977 50.650 27.552 1.00106.89 C ANISOU 621 C GLY C 495 16302 12300 12012 3888 -3582 -2293 C ATOM 622 O GLY C 495 15.636 50.766 28.731 1.00105.92 O ANISOU 622 O GLY C 495 15763 12513 11968 4096 -3431 -2611 O ATOM 623 N GLU C 496 15.319 49.869 26.694 1.00109.01 N ANISOU 623 N GLU C 496 15786 13382 12251 4015 -3828 -2268 N ATOM 624 CA GLU C 496 14.180 49.078 27.162 1.00113.76 C ANISOU 624 CA GLU C 496 14917 15367 12940 4224 -3879 -2641 C ATOM 625 C GLU C 496 14.572 48.267 28.418 1.00109.19 C ANISOU 625 C GLU C 496 13678 15068 12743 3267 -3385 -2744 C ATOM 626 O GLU C 496 15.611 47.578 28.449 1.00100.18 O ANISOU 626 O GLU C 496 12684 13516 11863 2253 -3106 -2479 O ATOM 627 CB GLU C 496 13.617 48.158 26.067 1.00115.68 C ANISOU 627 CB GLU C 496 14412 16449 13094 4016 -4141 -2646 C ATOM 628 CG GLU C 496 12.150 47.708 26.320 1.00125.04 C ANISOU 628 CG GLU C 496 14124 19249 14138 4455 -4325 -3150 C ATOM 629 CD GLU C 496 11.686 46.527 25.437 1.00128.28 C ANISOU 629 CD GLU C 496 13670 20583 14486 3715 -4463 -3267 C ATOM 630 OE1 GLU C 496 12.512 45.941 24.678 1.00117.83 O ANISOU 630 OE1 GLU C 496 12911 18593 13266 2898 -4371 -2953 O ATOM 631 OE2 GLU C 496 10.479 46.185 25.514 1.00134.78 O ANISOU 631 OE2 GLU C 496 13218 22885 15109 3912 -4636 -3741 O ATOM 632 N LYS C 497 13.756 48.428 29.464 1.00112.74 N ANISOU 632 N LYS C 497 13480 16223 13133 3735 -3280 -3128 N ATOM 633 CA LYS C 497 13.865 47.670 30.706 1.00107.22 C ANISOU 633 CA LYS C 497 12147 15959 12631 2975 -2827 -3245 C ATOM 634 C LYS C 497 12.444 47.285 31.067 1.00112.64 C ANISOU 634 C LYS C 497 11564 18080 13154 3311 -2784 -3698 C ATOM 635 O LYS C 497 11.714 48.076 31.656 1.00117.54 O ANISOU 635 O LYS C 497 11970 19149 13542 4278 -2812 -4070 O ATOM 636 CB LYS C 497 14.473 48.523 31.813 1.00106.95 C ANISOU 636 CB LYS C 497 12825 15253 12556 3123 -2638 -3312 C ATOM 637 CG LYS C 497 15.967 48.797 31.659 1.00101.68 C ANISOU 637 CG LYS C 497 13177 13440 12018 2454 -2589 -2959 C ATOM 638 CD LYS C 497 16.470 49.727 32.770 1.00 93.66 C ANISOU 638 CD LYS C 497 12853 11877 10856 2518 -2449 -3156 C ATOM 639 CE LYS C 497 17.834 50.315 32.467 1.00 86.49 C ANISOU 639 CE LYS C 497 12990 9924 9948 1881 -2450 -2935 C ATOM 640 NZ LYS C 497 18.352 51.105 33.616 1.00 91.04 N ANISOU 640 NZ LYS C 497 14167 10093 10329 1686 -2312 -3215 N ATOM 641 N PRO C 498 12.029 46.081 30.672 1.00112.67 N ANISOU 641 N PRO C 498 10734 18854 13220 2494 -2689 -3726 N ATOM 642 CA PRO C 498 10.646 45.658 30.821 1.00122.03 C ANISOU 642 CA PRO C 498 10569 21614 14184 2553 -2641 -4223 C ATOM 643 C PRO C 498 10.351 44.896 32.095 1.00122.41 C ANISOU 643 C PRO C 498 9988 22302 14220 1694 -2019 -4407 C ATOM 644 O PRO C 498 9.182 44.748 32.449 1.00134.77 O ANISOU 644 O PRO C 498 10377 25298 15531 1760 -1864 -4905 O ATOM 645 CB PRO C 498 10.445 44.736 29.623 1.00121.75 C ANISOU 645 CB PRO C 498 10184 21934 14142 1845 -2843 -4176 C ATOM 646 CG PRO C 498 11.753 44.101 29.445 1.00113.03 C ANISOU 646 CG PRO C 498 10063 19543 13339 941 -2627 -3660 C ATOM 647 CD PRO C 498 12.794 45.121 29.863 1.00108.16 C ANISOU 647 CD PRO C 498 10497 17747 12853 1519 -2655 -3355 C ATOM 648 N TYR C 499 11.381 44.397 32.764 1.00112.73 N ANISOU 648 N TYR C 499 9496 20150 13186 900 -1659 -4021 N ATOM 649 CA TYR C 499 11.176 43.689 34.014 1.00114.01 C ANISOU 649 CA TYR C 499 9333 20767 13220 128 -1062 -4098 C ATOM 650 C TYR C 499 11.117 44.692 35.166 1.00118.62 C ANISOU 650 C TYR C 499 10023 21418 13628 923 -935 -4320 C ATOM 651 O TYR C 499 12.134 45.316 35.537 1.00113.13 O ANISOU 651 O TYR C 499 10279 19682 13023 1212 -1040 -4075 O ATOM 652 CB TYR C 499 12.274 42.650 34.249 1.00107.86 C ANISOU 652 CB TYR C 499 9357 19033 12592 -889 -780 -3570 C ATOM 653 CG TYR C 499 12.195 41.475 33.320 1.00105.35 C ANISOU 653 CG TYR C 499 9011 18677 12342 -1792 -728 -3447 C ATOM 654 CD1 TYR C 499 13.261 41.131 32.505 1.00 95.34 C ANISOU 654 CD1 TYR C 499 8548 16366 11309 -1927 -919 -3031 C ATOM 655 CD2 TYR C 499 11.028 40.713 33.244 1.00117.62 C ANISOU 655 CD2 TYR C 499 9712 21320 13660 -2579 -448 -3827 C ATOM 656 CE1 TYR C 499 13.166 40.037 31.624 1.00105.53 C ANISOU 656 CE1 TYR C 499 9945 17553 12600 -2722 -840 -2987 C ATOM 657 CE2 TYR C 499 10.920 39.634 32.375 1.00118.43 C ANISOU 657 CE2 TYR C 499 9917 21331 13752 -3545 -385 -3804 C ATOM 658 CZ TYR C 499 11.988 39.292 31.573 1.00110.22 C ANISOU 658 CZ TYR C 499 9834 19099 12946 -3564 -583 -3380 C ATOM 659 OH TYR C 499 11.858 38.215 30.723 1.00116.23 O ANISOU 659 OH TYR C 499 10821 19708 13634 -4494 -482 -3423 O ATOM 660 N LYS C 500 9.918 44.812 35.734 1.00127.30 N ANISOU 660 N LYS C 500 10096 23853 14421 1187 -674 -4850 N ATOM 661 CA LYS C 500 9.594 45.821 36.727 1.00131.12 C ANISOU 661 CA LYS C 500 10542 24635 14643 2150 -535 -5225 C ATOM 662 C LYS C 500 9.609 45.202 38.119 1.00130.37 C ANISOU 662 C LYS C 500 10377 24872 14284 1290 144 -5235 C ATOM 663 O LYS C 500 9.148 44.075 38.304 1.00131.45 O ANISOU 663 O LYS C 500 9932 25725 14288 146 595 -5222 O ATOM 664 CB LYS C 500 8.208 46.384 36.433 1.00144.12 C ANISOU 664 CB LYS C 500 10977 27761 16022 3218 -667 -5872 C ATOM 665 CG LYS C 500 7.943 46.699 34.959 1.00148.58 C ANISOU 665 CG LYS C 500 11382 28380 16693 3947 -1350 -5861 C ATOM 666 CD LYS C 500 6.458 47.015 34.753 1.00171.65 C ANISOU 666 CD LYS C 500 12754 33227 19239 4941 -1476 -6558 C ATOM 667 CE LYS C 500 6.127 47.299 33.286 1.00175.78 C ANISOU 667 CE LYS C 500 13073 33990 19726 5767 -2242 -6551 C ATOM 668 NZ LYS C 500 4.666 47.317 33.050 1.00186.67 N ANISOU 668 NZ LYS C 500 12604 37637 20685 6480 -2394 -7263 N ATOM 669 N CYS C 501 10.142 45.943 39.093 1.00128.84 N ANISOU 669 N CYS C 501 10906 24114 13933 1770 230 -5265 N ATOM 670 CA CYS C 501 10.191 45.482 40.479 1.00128.63 C ANISOU 670 CA CYS C 501 10953 24395 13524 1105 832 -5269 C ATOM 671 C CYS C 501 8.876 45.798 41.123 1.00138.85 C ANISOU 671 C CYS C 501 11168 27204 14385 1577 1283 -5954 C ATOM 672 O CYS C 501 8.364 46.922 41.015 1.00141.99 O ANISOU 672 O CYS C 501 11333 27917 14699 2949 1064 -6450 O ATOM 673 CB CYS C 501 11.316 46.160 41.265 1.00125.33 C ANISOU 673 CB CYS C 501 11707 22896 13017 1378 693 -5101 C ATOM 674 SG CYS C 501 11.313 45.816 43.069 1.00130.81 S ANISOU 674 SG CYS C 501 12578 24081 13041 837 1360 -5182 S ATOM 675 N GLU C 502 8.333 44.809 41.817 1.00143.68 N ANISOU 675 N GLU C 502 11197 28749 14648 467 1965 -5992 N ATOM 676 CA GLU C 502 7.037 44.987 42.452 1.00158.82 C ANISOU 676 CA GLU C 502 11868 32396 16081 706 2533 -6696 C ATOM 677 C GLU C 502 7.097 45.911 43.676 1.00162.87 C ANISOU 677 C GLU C 502 12804 32921 16157 1579 2796 -7045 C ATOM 678 O GLU C 502 6.058 46.301 44.214 1.00172.35 O ANISOU 678 O GLU C 502 13005 35555 16926 2152 3248 -7728 O ATOM 679 CB GLU C 502 6.393 43.628 42.804 1.00165.97 C ANISOU 679 CB GLU C 502 12076 34340 16646 -1010 3306 -6665 C ATOM 680 CG GLU C 502 7.044 42.810 43.925 1.00163.29 C ANISOU 680 CG GLU C 502 12812 33317 15912 -2187 3876 -6141 C ATOM 681 CD GLU C 502 6.172 41.623 44.341 1.00171.18 C ANISOU 681 CD GLU C 502 13180 35460 16401 -3852 4793 -6233 C ATOM 682 OE1 GLU C 502 5.844 40.791 43.473 1.00165.75 O ANISOU 682 OE1 GLU C 502 12102 34971 15907 -4851 4807 -6166 O ATOM 683 OE2 GLU C 502 5.803 41.522 45.532 1.00179.76 O ANISOU 683 OE2 GLU C 502 14228 37247 16825 -4267 5543 -6403 O ATOM 684 N PHE C 503 8.308 46.281 44.087 1.00154.97 N ANISOU 684 N PHE C 503 13223 30432 15225 1696 2506 -6648 N ATOM 685 CA PHE C 503 8.508 46.990 45.340 1.00158.10 C ANISOU 685 CA PHE C 503 14227 30728 15114 2189 2775 -6946 C ATOM 686 C PHE C 503 9.017 48.415 45.125 1.00154.88 C ANISOU 686 C PHE C 503 14720 29265 14861 3562 2196 -7203 C ATOM 687 O PHE C 503 8.488 49.349 45.721 1.00162.62 O ANISOU 687 O PHE C 503 15697 30643 15447 4636 2398 -7851 O ATOM 688 CB PHE C 503 9.459 46.188 46.236 1.00153.80 C ANISOU 688 CB PHE C 503 14622 29536 14279 1016 2992 -6357 C ATOM 689 CG PHE C 503 8.892 44.848 46.702 1.00160.31 C ANISOU 689 CG PHE C 503 14934 31267 14712 -342 3739 -6129 C ATOM 690 CD1 PHE C 503 7.805 44.796 47.576 1.00173.62 C ANISOU 690 CD1 PHE C 503 15801 34418 15748 -504 4561 -6666 C ATOM 691 CD2 PHE C 503 9.460 43.643 46.289 1.00154.36 C ANISOU 691 CD2 PHE C 503 14643 29849 14156 -1483 3689 -5395 C ATOM 692 CE1 PHE C 503 7.285 43.567 48.020 1.00177.01 C ANISOU 692 CE1 PHE C 503 15922 35616 15716 -1982 5354 -6451 C ATOM 693 CE2 PHE C 503 8.941 42.410 46.732 1.00158.72 C ANISOU 693 CE2 PHE C 503 15054 31005 14249 -2833 4445 -5168 C ATOM 694 CZ PHE C 503 7.855 42.380 47.600 1.00169.20 C ANISOU 694 CZ PHE C 503 15611 33765 14911 -3178 5293 -5685 C ATOM 695 N CYS C 504 10.030 48.589 44.282 1.00142.44 N ANISOU 695 N CYS C 504 14000 26329 13793 3498 1544 -6732 N ATOM 696 CA CYS C 504 10.532 49.925 43.984 1.00141.64 C ANISOU 696 CA CYS C 504 14942 25084 13791 4559 1052 -6947 C ATOM 697 C CYS C 504 10.559 50.115 42.484 1.00138.04 C ANISOU 697 C CYS C 504 14475 24103 13872 4987 490 -6708 C ATOM 698 O CYS C 504 10.236 49.197 41.730 1.00134.71 O ANISOU 698 O CYS C 504 13200 24243 13740 4433 455 -6416 O ATOM 699 CB CYS C 504 11.921 50.088 44.556 1.00133.82 C ANISOU 699 CB CYS C 504 15195 22924 12725 3880 850 -6649 C ATOM 700 SG CYS C 504 12.947 48.794 43.969 1.00124.92 S ANISOU 700 SG CYS C 504 14052 21370 12041 2528 604 -5766 S ATOM 701 N GLU C 505 10.963 51.305 42.055 1.00139.75 N ANISOU 701 N GLU C 505 15792 23168 14140 5891 74 -6837 N ATOM 702 CA GLU C 505 10.944 51.657 40.636 1.00138.06 C ANISOU 702 CA GLU C 505 15793 22379 14283 6479 -453 -6620 C ATOM 703 C GLU C 505 12.193 51.206 39.885 1.00125.29 C ANISOU 703 C GLU C 505 14801 19699 13105 5367 -790 -5942 C ATOM 704 O GLU C 505 12.365 51.541 38.719 1.00121.26 O ANISOU 704 O GLU C 505 14711 18534 12829 5705 -1200 -5712 O ATOM 705 CB GLU C 505 10.746 53.167 40.460 1.00147.46 C ANISOU 705 CB GLU C 505 18124 22692 15212 8033 -688 -7035 C ATOM 706 CG GLU C 505 9.651 53.782 41.341 1.00160.47 C ANISOU 706 CG GLU C 505 19386 25252 16332 9374 -317 -7803 C ATOM 707 CD GLU C 505 8.268 53.134 41.184 1.00168.80 C ANISOU 707 CD GLU C 505 18483 28341 17311 9899 -108 -8099 C ATOM 708 OE1 GLU C 505 8.076 52.270 40.300 1.00163.11 O ANISOU 708 OE1 GLU C 505 16795 28245 16934 9278 -313 -7738 O ATOM 709 OE2 GLU C 505 7.356 53.509 41.958 1.00181.41 O ANISOU 709 OE2 GLU C 505 19478 31003 18445 10906 291 -8768 O ATOM 710 N TYR C 506 13.066 50.460 40.550 1.00118.80 N ANISOU 710 N TYR C 506 14056 18766 12317 4138 -616 -5629 N ATOM 711 CA TYR C 506 14.166 49.806 39.861 1.00110.29 C ANISOU 711 CA TYR C 506 13235 17046 11625 3155 -868 -5018 C ATOM 712 C TYR C 506 13.592 48.902 38.821 1.00106.37 C ANISOU 712 C TYR C 506 11861 17112 11441 2998 -931 -4755 C ATOM 713 O TYR C 506 12.599 48.224 39.077 1.00106.52 O ANISOU 713 O TYR C 506 10872 18254 11348 2933 -623 -4925 O ATOM 714 CB TYR C 506 14.988 48.935 40.810 1.00109.14 C ANISOU 714 CB TYR C 506 13063 17045 11358 2104 -663 -4733 C ATOM 715 CG TYR C 506 15.787 47.828 40.120 1.00101.55 C ANISOU 715 CG TYR C 506 11947 15883 10754 1255 -798 -4111 C ATOM 716 CD1 TYR C 506 17.116 48.025 39.759 1.00 98.71 C ANISOU 716 CD1 TYR C 506 12206 14743 10556 843 -1107 -3834 C ATOM 717 CD2 TYR C 506 15.214 46.581 39.846 1.00 98.65 C ANISOU 717 CD2 TYR C 506 10842 16144 10497 832 -564 -3860 C ATOM 718 CE1 TYR C 506 17.856 47.012 39.134 1.00 90.16 C ANISOU 718 CE1 TYR C 506 10952 13556 9749 257 -1194 -3319 C ATOM 719 CE2 TYR C 506 15.946 45.565 39.218 1.00 90.14 C ANISOU 719 CE2 TYR C 506 9815 14747 9685 184 -652 -3334 C ATOM 720 CZ TYR C 506 17.264 45.789 38.870 1.00 87.50 C ANISOU 720 CZ TYR C 506 10046 13682 9518 15 -972 -3065 C ATOM 721 OH TYR C 506 17.999 44.797 38.264 1.00 79.06 O ANISOU 721 OH TYR C 506 8998 12379 8663 -439 -1026 -2599 O ATOM 722 N ALA C 507 14.260 48.857 37.673 1.00102.75 N ANISOU 722 N ALA C 507 11804 15921 11317 2776 -1283 -4372 N ATOM 723 CA ALA C 507 13.788 48.093 36.520 1.00100.74 C ANISOU 723 CA ALA C 507 10894 16069 11313 2635 -1418 -4160 C ATOM 724 C ALA C 507 14.952 47.392 35.831 1.00 94.28 C ANISOU 724 C ALA C 507 10451 14565 10805 1759 -1541 -3618 C ATOM 725 O ALA C 507 16.129 47.798 35.989 1.00 93.87 O ANISOU 725 O ALA C 507 11169 13706 10790 1467 -1631 -3438 O ATOM 726 CB ALA C 507 13.086 49.011 35.547 1.00105.76 C ANISOU 726 CB ALA C 507 11644 16647 11894 3773 -1791 -4370 C ATOM 727 N ALA C 508 14.621 46.356 35.055 1.00 90.69 N ANISOU 727 N ALA C 508 9428 14511 10520 1324 -1527 -3429 N ATOM 728 CA ALA C 508 15.643 45.492 34.455 1.00 83.09 C ANISOU 728 CA ALA C 508 8759 13013 9799 565 -1548 -2960 C ATOM 729 C ALA C 508 15.361 44.991 33.025 1.00 81.62 C ANISOU 729 C ALA C 508 8381 12861 9771 460 -1745 -2841 C ATOM 730 O ALA C 508 14.263 44.575 32.650 1.00 86.80 O ANISOU 730 O ALA C 508 8335 14295 10349 475 -1742 -3070 O ATOM 731 CB ALA C 508 15.897 44.319 35.358 1.00 80.77 C ANISOU 731 CB ALA C 508 8294 12965 9430 -171 -1168 -2764 C ATOM 732 N ALA C 509 16.411 45.038 32.236 1.00 77.42 N ANISOU 732 N ALA C 509 8445 11571 9401 278 -1901 -2523 N ATOM 733 CA ALA C 509 16.419 44.456 30.925 1.00 72.87 C ANISOU 733 CA ALA C 509 7860 10905 8922 59 -2032 -2367 C ATOM 734 C ALA C 509 16.527 42.923 30.951 1.00 69.90 C ANISOU 734 C ALA C 509 7260 10684 8615 -729 -1725 -2208 C ATOM 735 O ALA C 509 16.233 42.317 29.966 1.00 75.37 O ANISOU 735 O ALA C 509 7865 11458 9313 -979 -1784 -2212 O ATOM 736 CB ALA C 509 17.572 45.045 30.112 1.00 66.90 C ANISOU 736 CB ALA C 509 7865 9316 8237 78 -2194 -2101 C ATOM 737 N GLN C 510 16.924 42.276 32.040 1.00 69.91 N ANISOU 737 N GLN C 510 7312 10666 8586 -1098 -1402 -2071 N ATOM 738 CA GLN C 510 17.104 40.802 32.019 1.00 70.12 C ANISOU 738 CA GLN C 510 7492 10562 8589 -1749 -1083 -1856 C ATOM 739 C GLN C 510 16.619 40.111 33.317 1.00 73.87 C ANISOU 739 C GLN C 510 7869 11377 8820 -2155 -675 -1860 C ATOM 740 O GLN C 510 16.712 40.674 34.394 1.00 78.16 O ANISOU 740 O GLN C 510 8359 12102 9237 -1902 -635 -1895 O ATOM 741 CB GLN C 510 18.586 40.462 31.724 1.00 66.41 C ANISOU 741 CB GLN C 510 7590 9410 8231 -1705 -1094 -1480 C ATOM 742 CG GLN C 510 19.019 40.695 30.251 1.00 63.87 C ANISOU 742 CG GLN C 510 7451 8763 8054 -1598 -1309 -1448 C ATOM 743 CD GLN C 510 20.187 39.793 29.779 1.00 69.27 C ANISOU 743 CD GLN C 510 8563 8982 8775 -1683 -1143 -1162 C ATOM 744 OE1 GLN C 510 20.936 40.184 28.889 1.00 72.71 O ANISOU 744 OE1 GLN C 510 9139 9208 9280 -1547 -1250 -1104 O ATOM 745 NE2 GLN C 510 20.332 38.588 30.362 1.00 68.54 N ANISOU 745 NE2 GLN C 510 8757 8721 8563 -1854 -844 -988 N ATOM 746 N LYS C 511 16.100 38.896 33.239 1.00 78.95 N ANISOU 746 N LYS C 511 8613 12066 9317 -2872 -327 -1839 N ATOM 747 CA LYS C 511 15.473 38.322 34.435 1.00 84.42 C ANISOU 747 CA LYS C 511 9278 13126 9673 -3399 142 -1864 C ATOM 748 C LYS C 511 16.515 38.231 35.523 1.00 79.66 C ANISOU 748 C LYS C 511 9293 12063 8910 -3088 218 -1457 C ATOM 749 O LYS C 511 16.284 38.694 36.623 1.00 82.60 O ANISOU 749 O LYS C 511 9483 12850 9053 -2964 329 -1541 O ATOM 750 CB LYS C 511 14.794 36.944 34.198 1.00 90.33 C ANISOU 750 CB LYS C 511 10301 13833 10186 -4480 609 -1894 C ATOM 751 CG LYS C 511 13.403 37.017 33.527 1.00101.74 C ANISOU 751 CG LYS C 511 10788 16281 11588 -5040 610 -2471 C ATOM 752 CD LYS C 511 12.455 35.816 33.894 1.00120.30 C ANISOU 752 CD LYS C 511 13213 18978 13517 -6465 1270 -2655 C ATOM 753 CE LYS C 511 11.257 35.638 32.864 1.00129.18 C ANISOU 753 CE LYS C 511 13390 21122 14570 -7233 1186 -3282 C ATOM 754 NZ LYS C 511 10.082 34.836 33.379 1.00131.37 N ANISOU 754 NZ LYS C 511 13252 22287 14374 -8742 1848 -3679 N ATOM 755 N THR C 512 17.675 37.672 35.224 1.00 75.82 N ANISOU 755 N THR C 512 9483 10841 8485 -2869 132 -1059 N ATOM 756 CA THR C 512 18.610 37.353 36.300 1.00 76.75 C ANISOU 756 CA THR C 512 10159 10695 8307 -2545 185 -663 C ATOM 757 C THR C 512 18.785 38.569 37.189 1.00 75.11 C ANISOU 757 C THR C 512 9505 10992 8041 -2127 -59 -838 C ATOM 758 O THR C 512 18.780 38.483 38.408 1.00 83.12 O ANISOU 758 O THR C 512 10716 12220 8644 -2125 98 -734 O ATOM 759 CB THR C 512 19.972 36.897 35.757 1.00 77.63 C ANISOU 759 CB THR C 512 10754 10226 8517 -2030 -17 -315 C ATOM 760 OG1 THR C 512 19.823 35.595 35.162 1.00 81.16 O ANISOU 760 OG1 THR C 512 11935 10035 8867 -2370 310 -137 O ATOM 761 CG2 THR C 512 21.040 36.868 36.881 1.00 66.11 C ANISOU 761 CG2 THR C 512 9569 8836 6712 -1443 -163 13 C ATOM 762 N SER C 513 18.897 39.733 36.595 1.00 71.60 N ANISOU 762 N SER C 513 8593 10685 7926 -1807 -417 -1126 N ATOM 763 CA SER C 513 19.120 40.929 37.402 1.00 71.70 C ANISOU 763 CA SER C 513 8409 10995 7837 -1467 -628 -1351 C ATOM 764 C SER C 513 17.966 41.167 38.371 1.00 72.65 C ANISOU 764 C SER C 513 8268 11679 7656 -1588 -335 -1644 C ATOM 765 O SER C 513 18.170 41.376 39.572 1.00 83.21 O ANISOU 765 O SER C 513 9758 13244 8613 -1506 -266 -1650 O ATOM 766 CB SER C 513 19.310 42.136 36.494 1.00 70.52 C ANISOU 766 CB SER C 513 8079 10691 8023 -1182 -980 -1610 C ATOM 767 OG SER C 513 18.053 42.538 35.991 1.00 85.60 O ANISOU 767 OG SER C 513 9631 12859 10034 -1103 -944 -1937 O ATOM 768 N LEU C 514 16.741 41.149 37.888 1.00 69.89 N ANISOU 768 N LEU C 514 7446 11708 7399 -1774 -156 -1937 N ATOM 769 CA LEU C 514 15.640 41.313 38.832 1.00 78.31 C ANISOU 769 CA LEU C 514 8105 13531 8120 -1896 211 -2271 C ATOM 770 C LEU C 514 15.710 40.228 39.899 1.00 82.16 C ANISOU 770 C LEU C 514 9060 14035 8123 -2469 678 -1938 C ATOM 771 O LEU C 514 15.490 40.507 41.073 1.00 88.28 O ANISOU 771 O LEU C 514 9850 15223 8469 -2428 906 -2055 O ATOM 772 CB LEU C 514 14.269 41.248 38.146 1.00 84.52 C ANISOU 772 CB LEU C 514 8099 15025 8991 -2101 365 -2674 C ATOM 773 CG LEU C 514 13.047 41.473 39.027 1.00 90.62 C ANISOU 773 CG LEU C 514 8174 16874 9384 -2183 793 -3136 C ATOM 774 CD1 LEU C 514 13.147 42.863 39.643 1.00 88.01 C ANISOU 774 CD1 LEU C 514 7822 16643 8976 -1220 576 -3460 C ATOM 775 CD2 LEU C 514 11.723 41.299 38.251 1.00 98.30 C ANISOU 775 CD2 LEU C 514 8119 18836 10394 -2439 898 -3588 C ATOM 776 N ARG C 515 15.995 38.988 39.503 1.00 83.54 N ANISOU 776 N ARG C 515 9766 13695 8279 -2974 853 -1523 N ATOM 777 CA ARG C 515 16.071 37.909 40.483 1.00 89.95 C ANISOU 777 CA ARG C 515 11343 14313 8523 -3464 1320 -1121 C ATOM 778 C ARG C 515 17.091 38.288 41.528 1.00 88.18 C ANISOU 778 C ARG C 515 11544 13990 7971 -2853 1064 -869 C ATOM 779 O ARG C 515 16.804 38.245 42.725 1.00 95.20 O ANISOU 779 O ARG C 515 12647 15242 8284 -3003 1373 -845 O ATOM 780 CB ARG C 515 16.400 36.547 39.862 1.00 93.23 C ANISOU 780 CB ARG C 515 12605 13900 8916 -3905 1507 -681 C ATOM 781 CG ARG C 515 17.010 35.515 40.861 1.00105.51 C ANISOU 781 CG ARG C 515 15408 14862 9821 -3938 1792 -64 C ATOM 782 CD ARG C 515 16.937 34.034 40.369 1.00118.84 C ANISOU 782 CD ARG C 515 18224 15622 11306 -4572 2221 299 C ATOM 783 NE ARG C 515 17.401 33.857 38.987 1.00118.74 N ANISOU 783 NE ARG C 515 18177 15094 11844 -4320 1905 253 N ATOM 784 CZ ARG C 515 18.675 33.940 38.579 1.00122.24 C ANISOU 784 CZ ARG C 515 18819 15115 12511 -3321 1419 515 C ATOM 785 NH1 ARG C 515 19.666 34.192 39.441 1.00119.90 N ANISOU 785 NH1 ARG C 515 18700 14914 11942 -2455 1108 832 N ATOM 786 NH2 ARG C 515 18.966 33.787 37.283 1.00121.83 N ANISOU 786 NH2 ARG C 515 18696 14690 12904 -3209 1241 405 N ATOM 787 N TYR C 516 18.270 38.699 41.100 1.00 81.32 N ANISOU 787 N TYR C 516 10731 12772 7395 -2227 508 -737 N ATOM 788 CA TYR C 516 19.235 39.208 42.083 1.00 84.89 C ANISOU 788 CA TYR C 516 11364 13395 7496 -1723 178 -642 C ATOM 789 C TYR C 516 18.637 40.303 42.959 1.00 86.25 C ANISOU 789 C TYR C 516 11150 14185 7437 -1690 237 -1136 C ATOM 790 O TYR C 516 18.600 40.149 44.191 1.00 94.78 O ANISOU 790 O TYR C 516 12570 15573 7867 -1731 427 -1047 O ATOM 791 CB TYR C 516 20.512 39.731 41.421 1.00 81.49 C ANISOU 791 CB TYR C 516 10754 12778 7429 -1233 -407 -621 C ATOM 792 CG TYR C 516 21.526 40.325 42.375 1.00 81.61 C ANISOU 792 CG TYR C 516 10777 13181 7049 -876 -805 -654 C ATOM 793 CD1 TYR C 516 22.619 39.582 42.803 1.00 94.59 C ANISOU 793 CD1 TYR C 516 12765 14884 8289 -461 -1045 -208 C ATOM 794 CD2 TYR C 516 21.405 41.639 42.835 1.00 88.61 C ANISOU 794 CD2 TYR C 516 11360 14412 7898 -905 -970 -1177 C ATOM 795 CE1 TYR C 516 23.566 40.118 43.680 1.00100.52 C ANISOU 795 CE1 TYR C 516 13371 16232 8589 -173 -1491 -303 C ATOM 796 CE2 TYR C 516 22.339 42.187 43.725 1.00 92.91 C ANISOU 796 CE2 TYR C 516 11928 15374 7999 -757 -1349 -1299 C ATOM 797 CZ TYR C 516 23.422 41.421 44.149 1.00100.22 C ANISOU 797 CZ TYR C 516 13010 16559 8510 -437 -1637 -874 C ATOM 798 OH TYR C 516 24.368 41.932 45.024 1.00102.56 O ANISOU 798 OH TYR C 516 13182 17503 8283 -319 -2092 -1047 O ATOM 799 N HIS C 517 18.192 41.404 42.349 1.00 81.15 N ANISOU 799 N HIS C 517 9930 13672 7230 -1524 79 -1646 N ATOM 800 CA HIS C 517 17.697 42.553 43.149 1.00 85.35 C ANISOU 800 CA HIS C 517 10245 14669 7516 -1284 118 -2183 C ATOM 801 C HIS C 517 16.681 42.065 44.163 1.00 91.10 C ANISOU 801 C HIS C 517 10935 15999 7682 -1614 729 -2255 C ATOM 802 O HIS C 517 16.829 42.302 45.354 1.00 99.84 O ANISOU 802 O HIS C 517 12326 17408 8199 -1548 825 -2332 O ATOM 803 CB HIS C 517 17.110 43.629 42.241 1.00 85.41 C ANISOU 803 CB HIS C 517 9813 14637 8004 -925 -42 -2671 C ATOM 804 CG HIS C 517 16.233 44.628 42.925 1.00 89.44 C ANISOU 804 CG HIS C 517 10109 15629 8243 -532 147 -3270 C ATOM 805 ND1 HIS C 517 16.605 45.944 43.085 1.00 89.82 N ANISOU 805 ND1 HIS C 517 10486 15373 8269 -49 -153 -3670 N ATOM 806 CD2 HIS C 517 14.965 44.532 43.408 1.00 99.47 C ANISOU 806 CD2 HIS C 517 10876 17682 9234 -523 647 -3600 C ATOM 807 CE1 HIS C 517 15.619 46.607 43.673 1.00100.15 C ANISOU 807 CE1 HIS C 517 11604 17164 9285 403 135 -4207 C ATOM 808 NE2 HIS C 517 14.612 45.774 43.882 1.00 94.21 N ANISOU 808 NE2 HIS C 517 10228 17190 8378 154 624 -4186 N ATOM 809 N LEU C 518 15.676 41.337 43.710 1.00 92.43 N ANISOU 809 N LEU C 518 10771 16405 7944 -2091 1174 -2247 N ATOM 810 CA LEU C 518 14.695 40.787 44.635 1.00104.87 C ANISOU 810 CA LEU C 518 12281 18645 8922 -2653 1880 -2324 C ATOM 811 C LEU C 518 15.356 40.114 45.832 1.00107.80 C ANISOU 811 C LEU C 518 13584 18816 8559 -2850 2044 -1823 C ATOM 812 O LEU C 518 14.991 40.374 46.972 1.00114.88 O ANISOU 812 O LEU C 518 14558 20270 8822 -2897 2385 -2013 O ATOM 813 CB LEU C 518 13.738 39.798 43.927 1.00110.55 C ANISOU 813 CB LEU C 518 12665 19574 9766 -3491 2355 -2293 C ATOM 814 CG LEU C 518 12.612 40.424 43.079 1.00113.10 C ANISOU 814 CG LEU C 518 11798 20682 10493 -3359 2359 -2942 C ATOM 815 CD1 LEU C 518 11.747 39.357 42.422 1.00122.16 C ANISOU 815 CD1 LEU C 518 12591 22168 11657 -4412 2796 -2958 C ATOM 816 CD2 LEU C 518 11.746 41.391 43.923 1.00116.32 C ANISOU 816 CD2 LEU C 518 11494 22149 10553 -2902 2641 -3587 C ATOM 817 N GLU C 519 16.339 39.264 45.583 1.00107.04 N ANISOU 817 N GLU C 519 14233 17968 8469 -2844 1787 -1191 N ATOM 818 CA GLU C 519 16.890 38.477 46.663 1.00115.29 C ANISOU 818 CA GLU C 519 16277 18823 8705 -2902 1928 -633 C ATOM 819 C GLU C 519 17.619 39.368 47.623 1.00116.88 C ANISOU 819 C GLU C 519 16522 19384 8502 -2294 1491 -795 C ATOM 820 O GLU C 519 17.339 39.373 48.831 1.00127.00 O ANISOU 820 O GLU C 519 18160 21113 8981 -2424 1814 -809 O ATOM 821 CB GLU C 519 17.839 37.392 46.158 1.00116.46 C ANISOU 821 CB GLU C 519 17257 18096 8895 -2725 1687 61 C ATOM 822 CG GLU C 519 18.206 36.343 47.232 1.00130.95 C ANISOU 822 CG GLU C 519 20391 19618 9744 -2731 1935 747 C ATOM 823 CD GLU C 519 16.984 35.736 47.964 1.00148.11 C ANISOU 823 CD GLU C 519 23048 21984 11245 -3756 2883 789 C ATOM 824 OE1 GLU C 519 15.843 35.779 47.440 1.00153.81 O ANISOU 824 OE1 GLU C 519 23088 23033 12319 -4587 3401 348 O ATOM 825 OE2 GLU C 519 17.167 35.209 49.084 1.00159.14 O ANISOU 825 OE2 GLU C 519 25492 23304 11669 -3759 3120 1254 O ATOM 826 N ARG C 520 18.547 40.137 47.082 1.00108.55 N ANISOU 826 N ARG C 520 15130 18176 7938 -1744 791 -962 N ATOM 827 CA ARG C 520 19.342 41.011 47.905 1.00106.57 C ANISOU 827 CA ARG C 520 14916 18278 7300 -1339 317 -1202 C ATOM 828 C ARG C 520 18.573 42.150 48.564 1.00107.19 C ANISOU 828 C ARG C 520 14685 18875 7167 -1358 543 -1921 C ATOM 829 O ARG C 520 18.894 42.472 49.673 1.00114.53 O ANISOU 829 O ARG C 520 15945 20188 7381 -1254 448 -2043 O ATOM 830 CB ARG C 520 20.488 41.586 47.102 1.00101.96 C ANISOU 830 CB ARG C 520 14011 17464 7267 -997 -390 -1290 C ATOM 831 CG ARG C 520 21.084 42.779 47.739 1.00108.29 C ANISOU 831 CG ARG C 520 14701 18647 7798 -866 -816 -1802 C ATOM 832 CD ARG C 520 21.654 42.408 49.044 1.00127.25 C ANISOU 832 CD ARG C 520 17565 21555 9231 -726 -985 -1569 C ATOM 833 NE ARG C 520 23.080 42.580 49.016 1.00131.95 N ANISOU 833 NE ARG C 520 17981 22432 9720 -488 -1718 -1520 N ATOM 834 CZ ARG C 520 23.716 43.596 49.580 1.00145.23 C ANISOU 834 CZ ARG C 520 19513 24602 11066 -611 -2156 -2062 C ATOM 835 NH1 ARG C 520 23.077 44.560 50.252 1.00145.20 N ANISOU 835 NH1 ARG C 520 19696 24697 10777 -853 -1940 -2688 N ATOM 836 NH2 ARG C 520 25.020 43.628 49.482 1.00154.81 N ANISOU 836 NH2 ARG C 520 20379 26280 12164 -500 -2802 -2027 N ATOM 837 N HIS C 521 17.585 42.779 47.933 1.00105.39 N ANISOU 837 N HIS C 521 13868 18716 7459 -1373 810 -2427 N ATOM 838 CA HIS C 521 16.904 43.909 48.622 1.00112.62 C ANISOU 838 CA HIS C 521 14595 20113 8082 -1130 1022 -3159 C ATOM 839 C HIS C 521 15.478 43.709 49.108 1.00120.98 C ANISOU 839 C HIS C 521 15285 21891 8792 -1337 1829 -3446 C ATOM 840 O HIS C 521 14.876 44.682 49.539 1.00126.09 O ANISOU 840 O HIS C 521 15697 22961 9250 -939 2017 -4119 O ATOM 841 CB HIS C 521 16.888 45.162 47.760 1.00107.99 C ANISOU 841 CB HIS C 521 13711 19179 8142 -668 669 -3707 C ATOM 842 CG HIS C 521 18.231 45.561 47.278 1.00103.84 C ANISOU 842 CG HIS C 521 13471 18070 7914 -637 -21 -3579 C ATOM 843 ND1 HIS C 521 18.751 46.819 47.477 1.00109.54 N ANISOU 843 ND1 HIS C 521 14514 18551 8556 -471 -365 -4108 N ATOM 844 CD2 HIS C 521 19.170 44.861 46.608 1.00101.46 C ANISOU 844 CD2 HIS C 521 13178 17441 7932 -815 -378 -3033 C ATOM 845 CE1 HIS C 521 19.954 46.881 46.934 1.00110.92 C ANISOU 845 CE1 HIS C 521 14776 18375 8995 -694 -889 -3898 C ATOM 846 NE2 HIS C 521 20.232 45.704 46.399 1.00101.59 N ANISOU 846 NE2 HIS C 521 13336 17196 8067 -812 -913 -3250 N ATOM 847 N HIS C 522 14.930 42.494 49.043 1.00126.05 N ANISOU 847 N HIS C 522 15901 22697 9295 -1975 2348 -3007 N ATOM 848 CA HIS C 522 13.507 42.279 49.378 1.00134.17 C ANISOU 848 CA HIS C 522 16354 24619 10006 -2397 3198 -3359 C ATOM 849 C HIS C 522 13.215 40.855 49.890 1.00140.42 C ANISOU 849 C HIS C 522 17682 25496 10174 -3400 3867 -2768 C ATOM 850 O HIS C 522 13.996 40.266 50.636 1.00142.86 O ANISOU 850 O HIS C 522 19021 25392 9870 -3516 3789 -2186 O ATOM 851 CB HIS C 522 12.599 42.573 48.155 1.00130.91 C ANISOU 851 CB HIS C 522 14879 24506 10355 -2265 3231 -3784 C ATOM 852 CG HIS C 522 12.795 43.928 47.514 1.00121.64 C ANISOU 852 CG HIS C 522 13409 23064 9744 -1244 2622 -4287 C ATOM 853 ND1 HIS C 522 12.558 45.115 48.173 1.00121.67 N ANISOU 853 ND1 HIS C 522 13400 23380 9450 -493 2642 -4935 N ATOM 854 CD2 HIS C 522 13.140 44.272 46.246 1.00117.72 C ANISOU 854 CD2 HIS C 522 12765 21952 10013 -874 2046 -4241 C ATOM 855 CE1 HIS C 522 12.783 46.129 47.355 1.00118.62 C ANISOU 855 CE1 HIS C 522 13011 22450 9609 286 2097 -5228 C ATOM 856 NE2 HIS C 522 13.130 45.645 46.176 1.00112.92 N ANISOU 856 NE2 HIS C 522 12176 21202 9527 49 1733 -4797 N TER 857 HIS C 522 HETATM 858 ZN ZN C 601 12.745 46.786 44.170 1.00129.07 ZN ANISOU 858 ZN ZN C 601 13777 22740 12524 1147 1074 -5142 ZN HETATM 859 ZN ZN C 602 25.492 45.259 21.272 1.00 86.96 ZN ANISOU 859 ZN ZN C 602 13740 9475 9825 -2762 -882 -623 ZN CONECT 433 859 CONECT 457 859 CONECT 575 859 CONECT 611 859 CONECT 674 858 CONECT 700 858 CONECT 808 858 CONECT 856 858 CONECT 858 674 700 808 856 CONECT 859 433 457 575 611 MASTER 466 0 2 2 2 0 2 6 857 2 10 7 END
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Related entries of code: 4f2j
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4is1
RCSB PDB
PDBbind
20aa, >4IS1_2|Chain... at 90%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4f2j
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
20-mer DNA
Ligand Name
Zinc finger protein 217
EC.Number
E.C.-.-.-.-
Resolution
2.64(Å)
Affinity (Kd/Ki/IC50)
Kd=25nM
Release Year
2013
Protein/NA Sequence
Check fasta file
Primary Reference
(2013) J.Biol.Chem. Vol. 288: pp. 10616-10627
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):
O75362
Entrez Gene ID
NCBI Entrez Gene ID:
7764
ASD
Information of known allosteric effects of PDB entries
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