Browse entries in the PDBbind-CN Database
HEADER DNA BINDING PROTEIN/DNA 23-OCT-12 4HP1 TITLE CRYSTAL STRUCTURE OF TET3 IN COMPLEX WITH A NON-CPG DSDNA COMPND MOL_ID: 1; COMPND 2 MOLECULE: DNA (5'-D(*GP*CP*CP*AP*CP*(5CM)P*GP*GP*TP*GP*GP*C)-3'); COMPND 3 CHAIN: A, B; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: LOC100036628 PROTEIN; COMPND 7 CHAIN: C; COMPND 8 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 MOL_ID: 2; SOURCE 4 ORGANISM_SCIENTIFIC: XENOPUS (SILURANA) TROPICALIS; SOURCE 5 ORGANISM_COMMON: WESTERN CLAWED FROG; SOURCE 6 ORGANISM_TAXID: 8364; SOURCE 7 GENE: TET3, LOC100036628; SOURCE 8 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 9 EXPRESSION_SYSTEM_TAXID: 511693; SOURCE 10 EXPRESSION_SYSTEM_STRAIN: BL21-V2R-PRARE2; SOURCE 11 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 12 EXPRESSION_SYSTEM_PLASMID: PET28-MHL KEYWDS CXXC, DNA METHYLATION, STRUCTURAL GENOMICS, STRUCTURAL GENOMICS KEYWDS 2 CONSORTIUM, SGC, DNA BINDING PROTEIN-DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR X.CHAO,W.TEMPEL,C.BIAN,C.BOUNTRA,C.H.ARROWSMITH,A.M.EDWARDS,J.MIN, AUTHOR 2 STRUCTURAL GENOMICS CONSORTIUM (SGC) REVDAT 2 19-DEC-12 4HP1 1 JRNL REVDAT 1 05-DEC-12 4HP1 0 JRNL AUTH Y.XU,C.XU,A.KATO,W.TEMPEL,J.G.ABREU,C.BIAN,Y.HU,D.HU,B.ZHAO, JRNL AUTH 2 T.CEROVINA,J.DIAO,F.WU,H.H.HE,Q.CUI,E.CLARK,C.MA,A.BARBARA, JRNL AUTH 3 G.J.VEENSTRA,G.XU,U.B.KAISER,X.S.LIU,S.P.SUGRUE,X.HE,J.MIN, JRNL AUTH 4 Y.KATO,Y.G.SHI JRNL TITL TET3 CXXC DOMAIN AND DIOXYGENASE ACTIVITY COOPERATIVELY JRNL TITL 2 REGULATE KEY GENES FOR XENOPUS EYE AND NEURAL DEVELOPMENT. JRNL REF CELL(CAMBRIDGE,MASS.) V. 151 1200 2012 JRNL REFN ISSN 0092-8674 JRNL PMID 23217707 JRNL DOI 10.1016/J.CELL.2012.11.014 REMARK 2 REMARK 2 RESOLUTION. 2.25 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.7.0027 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) : 2.25 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 35.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.8 REMARK 3 NUMBER OF REFLECTIONS : 7736 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) : 0.221 REMARK 3 R VALUE (WORKING SET) : 0.220 REMARK 3 FREE R VALUE : 0.250 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.537 REMARK 3 FREE R VALUE TEST SET COUNT : 351 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) : 2.25 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.31 REMARK 3 REFLECTION IN BIN (WORKING SET) : 539 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 100.00 REMARK 3 BIN R VALUE (WORKING SET) : 0.4670 REMARK 3 BIN FREE R VALUE SET COUNT : 26 REMARK 3 BIN FREE R VALUE : 0.4660 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 383 REMARK 3 NUCLEIC ACID ATOMS : 487 REMARK 3 HETEROGEN ATOMS : 2 REMARK 3 SOLVENT ATOMS : 10 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 70.55 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -2.09200 REMARK 3 B22 (A**2) : -3.40600 REMARK 3 B33 (A**2) : 5.44800 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : -1.37500 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.241 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.198 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.189 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 14.195 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.964 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.954 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 944 ; 0.012 ; 0.015 REMARK 3 BOND LENGTHS OTHERS (A): 657 ; 0.003 ; 0.020 REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 1367 ; 1.377 ; 1.673 REMARK 3 BOND ANGLES OTHERS (DEGREES): 1518 ; 1.155 ; 3.011 REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 50 ; 5.478 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 15 ;33.295 ;22.000 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 80 ;15.397 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 5 ;17.228 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 128 ; 0.061 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 730 ; 0.008 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): 217 ; 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): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE REFINED 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 : 3 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 1 A 12 REMARK 3 ORIGIN FOR THE GROUP (A): 21.2959 0.3332 9.2652 REMARK 3 T TENSOR REMARK 3 T11: 0.4839 T22: 0.5631 REMARK 3 T33: 0.3110 T12: -0.2503 REMARK 3 T13: -0.0562 T23: -0.0483 REMARK 3 L TENSOR REMARK 3 L11: 9.2194 L22: 10.0492 REMARK 3 L33: 5.9178 L12: 4.6015 REMARK 3 L13: -0.7036 L23: -1.7156 REMARK 3 S TENSOR REMARK 3 S11: -0.4552 S12: 1.3601 S13: 0.0956 REMARK 3 S21: -0.5914 S22: 0.2957 S23: -0.4826 REMARK 3 S31: -0.1728 S32: 0.4087 S33: 0.1595 REMARK 3 REMARK 3 TLS GROUP : 2 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 1 B 12 REMARK 3 ORIGIN FOR THE GROUP (A): 22.0503 -1.0194 9.7846 REMARK 3 T TENSOR REMARK 3 T11: 0.4996 T22: 0.5766 REMARK 3 T33: 0.3125 T12: -0.2011 REMARK 3 T13: 0.0040 T23: -0.0722 REMARK 3 L TENSOR REMARK 3 L11: 15.9835 L22: 8.4588 REMARK 3 L33: 4.3401 L12: 7.2740 REMARK 3 L13: 0.6816 L23: -0.0316 REMARK 3 S TENSOR REMARK 3 S11: -0.0407 S12: -0.0128 S13: 0.1235 REMARK 3 S21: -0.0092 S22: -0.0616 S23: -0.4126 REMARK 3 S31: -0.3767 S32: 0.4751 S33: 0.1023 REMARK 3 REMARK 3 TLS GROUP : 3 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : C 59 C 109 REMARK 3 ORIGIN FOR THE GROUP (A): 17.0095 -2.4406 21.3559 REMARK 3 T TENSOR REMARK 3 T11: 0.5320 T22: 0.1555 REMARK 3 T33: 0.2993 T12: -0.1071 REMARK 3 T13: -0.0218 T23: -0.0365 REMARK 3 L TENSOR REMARK 3 L11: 4.5889 L22: 7.6649 REMARK 3 L33: 9.7911 L12: -0.4331 REMARK 3 L13: 1.7374 L23: -0.3340 REMARK 3 S TENSOR REMARK 3 S11: -0.2312 S12: 0.5210 S13: -0.1007 REMARK 3 S21: -0.0583 S22: 0.1989 S23: -0.2583 REMARK 3 S31: 0.0994 S32: 0.2059 S33: 0.0324 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK BULK SOLVENT REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.20 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 WITH TLS ADDED. COOT AND THE MOLPROBITY REMARK 3 SERVER WERE ALSO USED DURING REFINEMENT. REMARK 4 REMARK 4 4HP1 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 06-NOV-12. REMARK 100 THE RCSB ID CODE IS RCSB075740. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 26-JAN-12 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 7.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : CLSI REMARK 200 BEAMLINE : 08ID-1 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.97949 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARMOSAIC 300 MM CCD REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XDS REMARK 200 DATA SCALING SOFTWARE : SCALA REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 7738 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.250 REMARK 200 RESOLUTION RANGE LOW (A) : 35.510 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.9 REMARK 200 DATA REDUNDANCY : 4.120 REMARK 200 R MERGE (I) : 0.04600 REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 14.6771 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.25 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.37 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : 4.17 REMARK 200 R MERGE FOR SHELL (I) : 0.49000 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER REMARK 200 STARTING MODEL: UNPUBLISHED MODEL OF COMPLEX BETWEEN SAME PROTEIN REMARK 200 AND DNA FRAGMENT. THAT STRUCTURE WAS SOLVED BY A COMBINATION OF REMARK 200 ZINC-SAD (SHELXD/E) AND MOLECULAR REPLACEMENT IN "DENSITY" MODE REMARK 200 (MOLREP), USING IDEAL DNA (COOT) AND HUMAN MLL2 (CURRENTLY REMARK 200 UNPUBLISHED) AS SEARCH MODELS. REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 51.98 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.56 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 30% PEG-1500, 0.2M SODIUM CHLORIDE, REMARK 280 0.1M HEPES, 5% MPD, PH 7.5, VAPOR DIFFUSION, SITTING DROP, REMARK 280 TEMPERATURE 291K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: C 1 2 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,Y,-Z REMARK 290 3555 X+1/2,Y+1/2,Z REMARK 290 4555 -X+1/2,Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 3 1.000000 0.000000 0.000000 35.51350 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 19.75850 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 35.51350 REMARK 290 SMTRY2 4 0.000000 1.000000 0.000000 19.75850 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 300 REMARK: AUTHORS STATE THAT THE BIOLOGICAL ASSEMBLY IS UNKNOWN. 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 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TRIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 4080 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 7020 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -11.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: C, A, B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 MET C 40 REMARK 465 HIS C 41 REMARK 465 HIS C 42 REMARK 465 HIS C 43 REMARK 465 HIS C 44 REMARK 465 HIS C 45 REMARK 465 HIS C 46 REMARK 465 SER C 47 REMARK 465 SER C 48 REMARK 465 GLY C 49 REMARK 465 ARG C 50 REMARK 465 GLU C 51 REMARK 465 ASN C 52 REMARK 465 LEU C 53 REMARK 465 TYR C 54 REMARK 465 PHE C 55 REMARK 465 GLN C 56 REMARK 465 GLY C 57 REMARK 465 SER C 58 REMARK 465 LYS C 110 REMARK 465 GLY C 111 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 DG A 1 O5' REMARK 470 LYS C 60 CG CD CE NZ REMARK 470 LYS C 63 NZ REMARK 470 LYS C 74 CD CE NZ REMARK 470 ARG C 86 CG CD NE CZ NH1 NH2 REMARK 470 LYS C 94 NZ REMARK 470 LYS C 104 CD CE NZ REMARK 470 VAL C 106 CG1 CG2 REMARK 470 VAL C 107 CG1 CG2 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 201 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS C 98 SG REMARK 620 2 CYS C 71 SG 100.4 REMARK 620 3 CYS C 65 SG 108.8 116.1 REMARK 620 4 CYS C 68 SG 122.6 98.9 109.9 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN C 202 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS C 80 SG REMARK 620 2 CYS C 77 SG 111.5 REMARK 620 3 CYS C 83 SG 104.2 114.4 REMARK 620 4 CYS C 93 SG 117.2 107.0 102.4 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 201 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN C 202 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 4HP3 RELATED DB: PDB DBREF 4HP1 C 58 111 UNP A0JP82 A0JP82_XENTR 58 111 DBREF 4HP1 A 1 12 PDB 4HP1 4HP1 1 12 DBREF 4HP1 B 1 12 PDB 4HP1 4HP1 1 12 SEQADV 4HP1 MET C 40 UNP A0JP82 EXPRESSION TAG SEQADV 4HP1 HIS C 41 UNP A0JP82 EXPRESSION TAG SEQADV 4HP1 HIS C 42 UNP A0JP82 EXPRESSION TAG SEQADV 4HP1 HIS C 43 UNP A0JP82 EXPRESSION TAG SEQADV 4HP1 HIS C 44 UNP A0JP82 EXPRESSION TAG SEQADV 4HP1 HIS C 45 UNP A0JP82 EXPRESSION TAG SEQADV 4HP1 HIS C 46 UNP A0JP82 EXPRESSION TAG SEQADV 4HP1 SER C 47 UNP A0JP82 EXPRESSION TAG SEQADV 4HP1 SER C 48 UNP A0JP82 EXPRESSION TAG SEQADV 4HP1 GLY C 49 UNP A0JP82 EXPRESSION TAG SEQADV 4HP1 ARG C 50 UNP A0JP82 EXPRESSION TAG SEQADV 4HP1 GLU C 51 UNP A0JP82 EXPRESSION TAG SEQADV 4HP1 ASN C 52 UNP A0JP82 EXPRESSION TAG SEQADV 4HP1 LEU C 53 UNP A0JP82 EXPRESSION TAG SEQADV 4HP1 TYR C 54 UNP A0JP82 EXPRESSION TAG SEQADV 4HP1 PHE C 55 UNP A0JP82 EXPRESSION TAG SEQADV 4HP1 GLN C 56 UNP A0JP82 EXPRESSION TAG SEQADV 4HP1 GLY C 57 UNP A0JP82 EXPRESSION TAG SEQRES 1 A 12 DG DC DC DA DC 5CM DG DG DT DG DG DC SEQRES 1 B 12 DG DC DC DA DC 5CM DG DG DT DG DG DC SEQRES 1 C 72 MET HIS HIS HIS HIS HIS HIS SER SER GLY ARG GLU ASN SEQRES 2 C 72 LEU TYR PHE GLN GLY SER ASN LYS LYS ARG LYS ARG CYS SEQRES 3 C 72 GLY VAL CYS VAL PRO CYS LEU ARG LYS GLU PRO CYS GLY SEQRES 4 C 72 ALA CYS TYR ASN CYS VAL ASN ARG SER THR SER HIS GLN SEQRES 5 C 72 ILE CYS LYS MET ARG LYS CYS GLU GLN LEU LYS LYS LYS SEQRES 6 C 72 ARG VAL VAL PRO MET LYS GLY MODRES 4HP1 5CM A 6 DC MODRES 4HP1 5CM B 6 DC HET 5CM A 6 20 HET 5CM B 6 20 HET ZN C 201 1 HET ZN C 202 1 HETNAM 5CM 5-METHYL-2'-DEOXY-CYTIDINE-5'-MONOPHOSPHATE HETNAM ZN ZINC ION FORMUL 1 5CM 2(C10 H16 N3 O7 P) FORMUL 4 ZN 2(ZN 2+) FORMUL 6 HOH *10(H2 O) HELIX 1 1 CYS C 68 ARG C 73 1 6 HELIX 2 2 CYS C 80 ASN C 85 1 6 LINK O3' DC A 5 P 5CM A 6 1555 1555 1.61 LINK O3' 5CM A 6 P DG A 7 1555 1555 1.61 LINK O3' DC B 5 P 5CM B 6 1555 1555 1.59 LINK O3' 5CM B 6 P DG B 7 1555 1555 1.58 LINK SG CYS C 98 ZN ZN C 201 1555 1555 2.29 LINK SG CYS C 71 ZN ZN C 201 1555 1555 2.30 LINK SG CYS C 80 ZN ZN C 202 1555 1555 2.32 LINK SG CYS C 77 ZN ZN C 202 1555 1555 2.33 LINK SG CYS C 65 ZN ZN C 201 1555 1555 2.33 LINK SG CYS C 68 ZN ZN C 201 1555 1555 2.34 LINK SG CYS C 83 ZN ZN C 202 1555 1555 2.36 LINK SG CYS C 93 ZN ZN C 202 1555 1555 2.36 SITE 1 AC1 4 CYS C 65 CYS C 68 CYS C 71 CYS C 98 SITE 1 AC2 4 CYS C 77 CYS C 80 CYS C 83 CYS C 93 CRYST1 71.027 39.517 57.634 90.00 91.03 90.00 C 1 2 1 8 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.014079 0.000000 0.000253 0.00000 SCALE2 0.000000 0.025306 0.000000 0.00000 SCALE3 0.000000 0.000000 0.017354 0.00000 ATOM 1 C5' DG A 1 0.417 -3.455 4.959 1.00105.74 C ANISOU 1 C5' DG A 1 9570 16536 14071 -4357 -4853 2096 C ATOM 2 C4' DG A 1 0.791 -3.139 6.391 1.00100.02 C ANISOU 2 C4' DG A 1 8903 15240 13858 -3741 -4073 1818 C ATOM 3 O4' DG A 1 1.342 -4.314 7.028 1.00 94.31 O ANISOU 3 O4' DG A 1 8677 14361 12793 -3859 -3593 1141 O ATOM 4 C3' DG A 1 1.854 -2.070 6.564 1.00 96.13 C ANISOU 4 C3' DG A 1 8752 14489 13282 -3331 -3831 1882 C ATOM 5 O3' DG A 1 1.683 -1.464 7.844 1.00 95.11 O ANISOU 5 O3' DG A 1 8412 13859 13864 -2783 -3268 1833 O ATOM 6 C2' DG A 1 3.139 -2.870 6.508 1.00 90.02 C ANISOU 6 C2' DG A 1 8746 13742 11714 -3523 -3550 1285 C ATOM 7 C1' DG A 1 2.744 -4.161 7.211 1.00 87.62 C ANISOU 7 C1' DG A 1 8469 13333 11487 -3672 -3250 820 C ATOM 8 N9 DG A 1 3.395 -5.350 6.679 1.00 86.32 N ANISOU 8 N9 DG A 1 8834 13332 10632 -4097 -3255 329 N ATOM 9 C8 DG A 1 3.607 -5.663 5.356 1.00 90.13 C ANISOU 9 C8 DG A 1 9554 14238 10453 -4591 -3680 297 C ATOM 10 N7 DG A 1 4.217 -6.805 5.193 1.00 88.79 N ANISOU 10 N7 DG A 1 9868 14039 9826 -4867 -3465 -282 N ATOM 11 C5 DG A 1 4.418 -7.274 6.484 1.00 83.38 C ANISOU 11 C5 DG A 1 9245 12887 9548 -4528 -2940 -564 C ATOM 12 C6 DG A 1 5.032 -8.469 6.944 1.00 80.13 C ANISOU 12 C6 DG A 1 9247 12179 9020 -4585 -2551 -1116 C ATOM 13 O6 DG A 1 5.543 -9.375 6.282 1.00 81.45 O ANISOU 13 O6 DG A 1 9806 12388 8750 -4915 -2524 -1549 O ATOM 14 N1 DG A 1 5.019 -8.549 8.333 1.00 76.52 N ANISOU 14 N1 DG A 1 8725 11311 9037 -4215 -2145 -1134 N ATOM 15 C2 DG A 1 4.480 -7.605 9.172 1.00 75.55 C ANISOU 15 C2 DG A 1 8225 11082 9397 -3857 -2037 -773 C ATOM 16 N2 DG A 1 4.566 -7.864 10.483 1.00 73.14 N ANISOU 16 N2 DG A 1 7996 10416 9378 -3618 -1600 -887 N ATOM 17 N3 DG A 1 3.903 -6.489 8.757 1.00 78.02 N ANISOU 17 N3 DG A 1 8131 11604 9907 -3754 -2324 -327 N ATOM 18 C4 DG A 1 3.911 -6.388 7.411 1.00 81.96 C ANISOU 18 C4 DG A 1 8652 12501 9988 -4091 -2804 -203 C ATOM 19 P DC A 2 2.697 -0.363 8.417 1.00 92.70 P ANISOU 19 P DC A 2 8447 13142 13631 -2330 -2876 1792 P ATOM 20 OP1 DC A 2 1.815 0.746 8.861 1.00 96.83 O ANISOU 20 OP1 DC A 2 8361 13331 15096 -1895 -2783 2200 O ATOM 21 OP2 DC A 2 3.805 -0.099 7.456 1.00 90.41 O ANISOU 21 OP2 DC A 2 8634 13073 12643 -2530 -3164 1864 O ATOM 22 O5' DC A 2 3.344 -1.048 9.704 1.00 85.72 O ANISOU 22 O5' DC A 2 8020 11964 12584 -2212 -2196 1146 O ATOM 23 C5' DC A 2 2.535 -1.831 10.599 1.00 86.45 C ANISOU 23 C5' DC A 2 7892 11960 12995 -2227 -1854 909 C ATOM 24 C4' DC A 2 3.363 -2.334 11.756 1.00 80.74 C ANISOU 24 C4' DC A 2 7710 10967 11999 -2146 -1296 406 C ATOM 25 O4' DC A 2 4.049 -3.551 11.376 1.00 77.07 O ANISOU 25 O4' DC A 2 7679 10687 10913 -2490 -1420 100 O ATOM 26 C3' DC A 2 4.450 -1.379 12.236 1.00 77.89 C ANISOU 26 C3' DC A 2 7745 10319 11528 -1854 -1050 324 C ATOM 27 O3' DC A 2 4.576 -1.491 13.649 1.00 78.65 O ANISOU 27 O3' DC A 2 8068 10108 11706 -1712 -481 0 O ATOM 28 C2' DC A 2 5.689 -1.873 11.523 1.00 73.08 C ANISOU 28 C2' DC A 2 7627 9910 10229 -2075 -1286 171 C ATOM 29 C1' DC A 2 5.454 -3.372 11.456 1.00 72.38 C ANISOU 29 C1' DC A 2 7622 9990 9888 -2399 -1312 -95 C ATOM 30 N1 DC A 2 6.058 -4.051 10.295 1.00 70.83 N ANISOU 30 N1 DC A 2 7670 10093 9147 -2722 -1641 -201 N ATOM 31 C2 DC A 2 6.823 -5.207 10.505 1.00 68.18 C ANISOU 31 C2 DC A 2 7742 9684 8477 -2866 -1465 -610 C ATOM 32 O2 DC A 2 6.991 -5.613 11.666 1.00 67.59 O ANISOU 32 O2 DC A 2 7817 9322 8542 -2736 -1120 -787 O ATOM 33 N3 DC A 2 7.364 -5.845 9.440 1.00 66.91 N ANISOU 33 N3 DC A 2 7810 9752 7859 -3155 -1660 -795 N ATOM 34 C4 DC A 2 7.166 -5.371 8.208 1.00 70.73 C ANISOU 34 C4 DC A 2 8183 10598 8091 -3367 -2043 -573 C ATOM 35 N4 DC A 2 7.716 -6.033 7.188 1.00 73.36 N ANISOU 35 N4 DC A 2 8808 11170 7893 -3705 -2148 -834 N ATOM 36 C5 DC A 2 6.387 -4.200 7.966 1.00 74.03 C ANISOU 36 C5 DC A 2 8190 11130 8805 -3255 -2324 -60 C ATOM 37 C6 DC A 2 5.851 -3.583 9.027 1.00 73.49 C ANISOU 37 C6 DC A 2 7842 10761 9317 -2900 -2098 100 C ATOM 38 P DC A 3 5.498 -0.501 14.499 1.00 78.56 P ANISOU 38 P DC A 3 8453 9745 11649 -1460 -141 -153 P ATOM 39 OP1 DC A 3 4.682 -0.137 15.693 1.00 80.42 O ANISOU 39 OP1 DC A 3 8526 9693 12337 -1280 418 -293 O ATOM 40 OP2 DC A 3 6.103 0.565 13.638 1.00 74.99 O ANISOU 40 OP2 DC A 3 8020 9274 11197 -1347 -456 114 O ATOM 41 O5' DC A 3 6.660 -1.498 14.938 1.00 71.16 O ANISOU 41 O5' DC A 3 8095 8860 10083 -1665 -90 -474 O ATOM 42 C5' DC A 3 6.350 -2.742 15.592 1.00 67.54 C ANISOU 42 C5' DC A 3 7732 8433 9496 -1857 94 -673 C ATOM 43 C4' DC A 3 7.621 -3.519 15.824 1.00 63.29 C ANISOU 43 C4' DC A 3 7697 7885 8465 -1985 35 -865 C ATOM 44 O4' DC A 3 8.100 -4.043 14.566 1.00 62.71 O ANISOU 44 O4' DC A 3 7621 8037 8167 -2117 -345 -839 O ATOM 45 C3' DC A 3 8.786 -2.705 16.406 1.00 62.15 C ANISOU 45 C3' DC A 3 7922 7566 8124 -1859 123 -932 C ATOM 46 O3' DC A 3 9.424 -3.511 17.414 1.00 59.71 O ANISOU 46 O3' DC A 3 7997 7160 7531 -1983 254 -1086 O ATOM 47 C2' DC A 3 9.668 -2.424 15.194 1.00 59.18 C ANISOU 47 C2' DC A 3 7556 7352 7578 -1853 -235 -829 C ATOM 48 C1' DC A 3 9.461 -3.681 14.371 1.00 58.98 C ANISOU 48 C1' DC A 3 7445 7544 7418 -2052 -433 -881 C ATOM 49 N1 DC A 3 9.681 -3.592 12.923 1.00 58.63 N ANISOU 49 N1 DC A 3 7292 7770 7213 -2149 -753 -784 N ATOM 50 C2 DC A 3 10.313 -4.666 12.275 1.00 58.59 C ANISOU 50 C2 DC A 3 7455 7891 6916 -2332 -844 -987 C ATOM 51 O2 DC A 3 10.744 -5.607 12.956 1.00 56.96 O ANISOU 51 O2 DC A 3 7452 7505 6685 -2347 -691 -1186 O ATOM 52 N3 DC A 3 10.456 -4.636 10.928 1.00 58.31 N ANISOU 52 N3 DC A 3 7374 8148 6632 -2501 -1080 -954 N ATOM 53 C4 DC A 3 9.973 -3.604 10.228 1.00 60.35 C ANISOU 53 C4 DC A 3 7413 8591 6923 -2505 -1308 -636 C ATOM 54 N4 DC A 3 10.144 -3.611 8.902 1.00 62.10 N ANISOU 54 N4 DC A 3 7653 9153 6787 -2751 -1559 -576 N ATOM 55 C5 DC A 3 9.302 -2.511 10.860 1.00 60.95 C ANISOU 55 C5 DC A 3 7257 8488 7411 -2269 -1267 -361 C ATOM 56 C6 DC A 3 9.169 -2.553 12.195 1.00 60.51 C ANISOU 56 C6 DC A 3 7261 8126 7601 -2094 -946 -495 C ATOM 57 P DA A 4 10.453 -2.948 18.458 1.00 57.82 P ANISOU 57 P DA A 4 8175 6751 7043 -1977 362 -1169 P ATOM 58 OP1 DA A 4 10.360 -3.931 19.573 1.00 59.79 O ANISOU 58 OP1 DA A 4 8681 6939 7095 -2164 528 -1227 O ATOM 59 OP2 DA A 4 10.248 -1.491 18.717 1.00 55.33 O ANISOU 59 OP2 DA A 4 7842 6279 6902 -1833 554 -1196 O ATOM 60 O5' DA A 4 11.809 -3.207 17.664 1.00 52.76 O ANISOU 60 O5' DA A 4 7622 6208 6214 -1977 5 -1121 O ATOM 61 C5' DA A 4 12.214 -4.557 17.358 1.00 50.26 C ANISOU 61 C5' DA A 4 7339 5947 5811 -2069 -141 -1145 C ATOM 62 C4' DA A 4 13.438 -4.555 16.478 1.00 48.27 C ANISOU 62 C4' DA A 4 7078 5785 5475 -2021 -364 -1140 C ATOM 63 O4' DA A 4 13.079 -4.130 15.133 1.00 49.54 O ANISOU 63 O4' DA A 4 6998 6150 5674 -2002 -465 -1111 O ATOM 64 C3' DA A 4 14.548 -3.604 16.921 1.00 48.50 C ANISOU 64 C3' DA A 4 7260 5759 5406 -1980 -427 -1081 C ATOM 65 O3' DA A 4 15.810 -4.245 16.719 1.00 48.48 O ANISOU 65 O3' DA A 4 7278 5769 5370 -1978 -577 -1075 O ATOM 66 C2' DA A 4 14.398 -2.426 15.964 1.00 47.54 C ANISOU 66 C2' DA A 4 6966 5745 5350 -1910 -469 -1006 C ATOM 67 C1' DA A 4 14.034 -3.165 14.713 1.00 46.81 C ANISOU 67 C1' DA A 4 6671 5861 5253 -1946 -557 -1029 C ATOM 68 N9 DA A 4 13.455 -2.398 13.601 1.00 46.91 N ANISOU 68 N9 DA A 4 6473 6052 5296 -1949 -664 -885 N ATOM 69 C8 DA A 4 12.758 -1.215 13.602 1.00 47.56 C ANISOU 69 C8 DA A 4 6428 6066 5576 -1860 -666 -697 C ATOM 70 N7 DA A 4 12.375 -0.829 12.406 1.00 50.89 N ANISOU 70 N7 DA A 4 6647 6697 5990 -1909 -867 -495 N ATOM 71 C5 DA A 4 12.838 -1.834 11.565 1.00 48.93 C ANISOU 71 C5 DA A 4 6446 6705 5438 -2083 -955 -633 C ATOM 72 C6 DA A 4 12.762 -2.017 10.169 1.00 51.70 C ANISOU 72 C6 DA A 4 6722 7396 5524 -2287 -1153 -564 C ATOM 73 N6 DA A 4 12.146 -1.167 9.339 1.00 54.90 N ANISOU 73 N6 DA A 4 6950 7974 5936 -2353 -1399 -221 N ATOM 74 N1 DA A 4 13.339 -3.126 9.647 1.00 50.17 N ANISOU 74 N1 DA A 4 6658 7347 5056 -2445 -1087 -854 N ATOM 75 C2 DA A 4 13.947 -3.982 10.476 1.00 47.94 C ANISOU 75 C2 DA A 4 6508 6838 4868 -2348 -885 -1116 C ATOM 76 N3 DA A 4 14.074 -3.924 11.802 1.00 46.49 N ANISOU 76 N3 DA A 4 6389 6358 4914 -2174 -776 -1111 N ATOM 77 C4 DA A 4 13.502 -2.806 12.287 1.00 46.76 C ANISOU 77 C4 DA A 4 6352 6303 5110 -2073 -802 -892 C ATOM 78 P DC A 5 16.901 -4.401 17.881 1.00 49.22 P ANISOU 78 P DC A 5 7573 5732 5396 -2033 -706 -975 P ATOM 79 OP1 DC A 5 16.268 -5.055 19.057 1.00 48.67 O ANISOU 79 OP1 DC A 5 7725 5527 5237 -2145 -639 -940 O ATOM 80 OP2 DC A 5 17.725 -3.165 18.103 1.00 47.38 O ANISOU 80 OP2 DC A 5 7398 5520 5081 -2075 -805 -910 O ATOM 81 O5' DC A 5 17.775 -5.480 17.072 1.00 47.46 O ANISOU 81 O5' DC A 5 7156 5519 5356 -1940 -788 -999 O ATOM 82 C5' DC A 5 17.217 -6.766 16.720 1.00 47.80 C ANISOU 82 C5' DC A 5 7160 5471 5529 -1924 -703 -1110 C ATOM 83 C4' DC A 5 18.011 -7.417 15.607 1.00 49.55 C ANISOU 83 C4' DC A 5 7188 5711 5926 -1828 -659 -1260 C ATOM 84 O4' DC A 5 17.692 -6.790 14.345 1.00 50.10 O ANISOU 84 O4' DC A 5 7152 6050 5832 -1871 -569 -1400 O ATOM 85 C3' DC A 5 19.521 -7.294 15.726 1.00 51.05 C ANISOU 85 C3' DC A 5 7238 5871 6288 -1721 -756 -1148 C ATOM 86 O3' DC A 5 20.093 -8.417 15.017 1.00 54.54 O ANISOU 86 O3' DC A 5 7512 6175 7035 -1597 -616 -1325 O ATOM 87 C2' DC A 5 19.792 -5.954 15.065 1.00 48.42 C ANISOU 87 C2' DC A 5 6824 5811 5761 -1766 -739 -1143 C ATOM 88 C1' DC A 5 18.827 -6.002 13.897 1.00 48.55 C ANISOU 88 C1' DC A 5 6831 5999 5614 -1829 -583 -1343 C ATOM 89 N1 DC A 5 18.302 -4.727 13.340 1.00 45.73 N ANISOU 89 N1 DC A 5 6473 5871 5031 -1915 -610 -1258 N ATOM 90 C2 DC A 5 18.147 -4.629 11.947 1.00 47.49 C ANISOU 90 C2 DC A 5 6614 6356 5074 -2011 -537 -1357 C ATOM 91 O2 DC A 5 18.502 -5.582 11.234 1.00 49.23 O ANISOU 91 O2 DC A 5 6796 6616 5293 -2036 -387 -1598 O ATOM 92 N3 DC A 5 17.604 -3.510 11.418 1.00 46.01 N ANISOU 92 N3 DC A 5 6411 6350 4720 -2096 -626 -1181 N ATOM 93 C4 DC A 5 17.216 -2.515 12.216 1.00 46.69 C ANISOU 93 C4 DC A 5 6542 6300 4898 -2040 -718 -981 C ATOM 94 N4 DC A 5 16.700 -1.420 11.644 1.00 48.01 N ANISOU 94 N4 DC A 5 6657 6568 5013 -2085 -807 -772 N ATOM 95 C5 DC A 5 17.355 -2.587 13.634 1.00 44.72 C ANISOU 95 C5 DC A 5 6414 5785 4789 -1960 -716 -982 C ATOM 96 C6 DC A 5 17.872 -3.717 14.151 1.00 45.03 C ANISOU 96 C6 DC A 5 6486 5714 4909 -1924 -694 -1091 C HETATM 97 N1 5CM A 6 22.108 -3.980 12.115 1.00 54.17 N ANISOU 97 N1 5CM A 6 7028 7226 6325 -1882 -440 -1184 N HETATM 98 C2 5CM A 6 21.475 -3.117 11.171 1.00 53.09 C ANISOU 98 C2 5CM A 6 6976 7337 5858 -2039 -407 -1147 C HETATM 99 N3 5CM A 6 20.829 -1.989 11.574 1.00 51.91 N ANISOU 99 N3 5CM A 6 6959 7149 5613 -2097 -591 -927 N HETATM 100 C4 5CM A 6 20.784 -1.666 12.889 1.00 52.68 C ANISOU 100 C4 5CM A 6 7167 7001 5846 -2046 -746 -829 C HETATM 101 C5 5CM A 6 21.427 -2.549 13.880 1.00 53.31 C ANISOU 101 C5 5CM A 6 7221 6905 6126 -1962 -812 -864 C HETATM 102 C5A 5CM A 6 21.405 -2.247 15.378 1.00 53.16 C ANISOU 102 C5A 5CM A 6 7401 6677 6117 -2009 -1014 -747 C HETATM 103 C6 5CM A 6 22.062 -3.677 13.430 1.00 54.44 C ANISOU 103 C6 5CM A 6 7171 7062 6448 -1862 -684 -999 C HETATM 104 O2 5CM A 6 21.502 -3.378 9.934 1.00 54.25 O ANISOU 104 O2 5CM A 6 7083 7727 5800 -2144 -204 -1306 O HETATM 105 N4 5CM A 6 20.155 -0.540 13.305 1.00 55.17 N ANISOU 105 N4 5CM A 6 7628 7211 6120 -2091 -837 -691 N HETATM 106 C1' 5CM A 6 22.801 -5.222 11.651 1.00 58.84 C ANISOU 106 C1' 5CM A 6 7428 7754 7173 -1758 -197 -1424 C HETATM 107 C2' 5CM A 6 23.988 -5.725 12.494 1.00 62.33 C ANISOU 107 C2' 5CM A 6 7612 7971 8099 -1584 -282 -1294 C HETATM 108 C3' 5CM A 6 24.134 -7.151 12.021 1.00 66.54 C ANISOU 108 C3' 5CM A 6 8033 8307 8940 -1413 4 -1596 C HETATM 109 C4' 5CM A 6 22.708 -7.567 11.647 1.00 64.11 C ANISOU 109 C4' 5CM A 6 8061 7999 8298 -1525 56 -1821 C HETATM 110 O4' 5CM A 6 21.922 -6.347 11.645 1.00 60.13 O ANISOU 110 O4' 5CM A 6 7740 7747 7358 -1710 -131 -1644 O HETATM 111 O3' 5CM A 6 25.009 -7.186 10.877 1.00 72.19 O ANISOU 111 O3' 5CM A 6 8485 9203 9737 -1405 406 -1826 O HETATM 112 C5' 5CM A 6 22.081 -8.604 12.610 1.00 63.36 C ANISOU 112 C5' 5CM A 6 8112 7524 8435 -1430 -95 -1784 C HETATM 113 O5' 5CM A 6 22.406 -8.274 13.970 1.00 60.61 O ANISOU 113 O5' 5CM A 6 7763 7046 8220 -1384 -438 -1393 O HETATM 114 P 5CM A 6 21.611 -8.915 15.221 1.00 58.89 P ANISOU 114 P 5CM A 6 7796 6547 8033 -1408 -669 -1205 P HETATM 115 OP1 5CM A 6 21.574 -10.428 15.133 1.00 62.87 O ANISOU 115 OP1 5CM A 6 8271 6671 8946 -1276 -543 -1338 O HETATM 116 OP2 5CM A 6 22.195 -8.268 16.430 1.00 59.13 O ANISOU 116 OP2 5CM A 6 7845 6584 8036 -1458 -1011 -823 O ATOM 117 P DG A 7 26.223 -8.238 10.746 1.00 81.31 P ANISOU 117 P DG A 7 9213 10099 11581 -1126 718 -1983 P ATOM 118 OP1 DG A 7 25.768 -9.652 10.955 1.00 80.81 O ANISOU 118 OP1 DG A 7 9254 9598 11852 -942 807 -2207 O ATOM 119 OP2 DG A 7 27.354 -7.706 11.540 1.00 81.66 O ANISOU 119 OP2 DG A 7 8871 10135 12019 -1041 449 -1570 O ATOM 120 O5' DG A 7 26.576 -8.110 9.199 1.00 84.09 O ANISOU 120 O5' DG A 7 9493 10775 11681 -1264 1299 -2391 O ATOM 121 C5' DG A 7 25.580 -8.373 8.192 1.00 82.75 C ANISOU 121 C5' DG A 7 9713 10773 10955 -1491 1533 -2784 C ATOM 122 C4' DG A 7 25.657 -7.339 7.091 1.00 83.05 C ANISOU 122 C4' DG A 7 9827 11342 10384 -1821 1719 -2801 C ATOM 123 O4' DG A 7 25.041 -6.101 7.518 1.00 75.95 O ANISOU 123 O4' DG A 7 9099 10635 9123 -1983 1234 -2352 O ATOM 124 C3' DG A 7 27.071 -6.964 6.642 1.00 87.83 C ANISOU 124 C3' DG A 7 10008 12127 11234 -1798 2104 -2793 C ATOM 125 O3' DG A 7 27.048 -6.758 5.225 1.00 92.39 O ANISOU 125 O3' DG A 7 10757 13131 11216 -2133 2566 -3105 O ATOM 126 C2' DG A 7 27.358 -5.690 7.424 1.00 82.33 C ANISOU 126 C2' DG A 7 9187 11537 10554 -1851 1630 -2223 C ATOM 127 C1' DG A 7 25.989 -5.034 7.462 1.00 76.31 C ANISOU 127 C1' DG A 7 8897 10898 9200 -2065 1238 -2059 C ATOM 128 N9 DG A 7 25.727 -4.160 8.598 1.00 69.15 N ANISOU 128 N9 DG A 7 8046 9865 8363 -2041 713 -1624 N ATOM 129 C8 DG A 7 26.087 -4.363 9.908 1.00 67.82 C ANISOU 129 C8 DG A 7 7736 9382 8647 -1837 410 -1426 C ATOM 130 N7 DG A 7 25.665 -3.420 10.707 1.00 63.39 N ANISOU 130 N7 DG A 7 7359 8782 7942 -1932 17 -1126 N ATOM 131 C5 DG A 7 24.968 -2.553 9.876 1.00 61.61 C ANISOU 131 C5 DG A 7 7356 8801 7249 -2149 55 -1091 C ATOM 132 C6 DG A 7 24.280 -1.349 10.174 1.00 58.38 C ANISOU 132 C6 DG A 7 7177 8387 6616 -2285 -221 -830 C ATOM 133 O6 DG A 7 24.136 -0.797 11.268 1.00 59.05 O ANISOU 133 O6 DG A 7 7368 8256 6812 -2268 -502 -659 O ATOM 134 N1 DG A 7 23.720 -0.784 9.036 1.00 58.32 N ANISOU 134 N1 DG A 7 7295 8640 6221 -2475 -135 -780 N ATOM 135 C2 DG A 7 23.808 -1.307 7.771 1.00 62.89 C ANISOU 135 C2 DG A 7 7852 9520 6523 -2599 175 -986 C ATOM 136 N2 DG A 7 23.195 -0.613 6.798 1.00 64.74 N ANISOU 136 N2 DG A 7 8253 10024 6319 -2849 131 -820 N ATOM 137 N3 DG A 7 24.436 -2.436 7.480 1.00 65.85 N ANISOU 137 N3 DG A 7 8066 9908 7046 -2502 512 -1332 N ATOM 138 C4 DG A 7 24.990 -3.000 8.573 1.00 65.20 C ANISOU 138 C4 DG A 7 7793 9508 7469 -2243 434 -1353 C ATOM 139 P DG A 8 28.328 -6.333 4.391 1.00100.27 P ANISOU 139 P DG A 8 11404 14453 12241 -2256 3134 -3185 P ATOM 140 OP1 DG A 8 28.216 -7.020 3.076 1.00105.34 O ANISOU 140 OP1 DG A 8 12288 15304 12432 -2491 3793 -3808 O ATOM 141 OP2 DG A 8 29.549 -6.515 5.228 1.00102.73 O ANISOU 141 OP2 DG A 8 11096 14471 13462 -1886 3168 -3003 O ATOM 142 O5' DG A 8 28.100 -4.770 4.191 1.00 96.05 O ANISOU 142 O5' DG A 8 11026 14339 11126 -2618 2772 -2666 O ATOM 143 C5' DG A 8 26.905 -4.278 3.556 1.00 93.08 C ANISOU 143 C5' DG A 8 11161 14252 9951 -2970 2522 -2583 C ATOM 144 C4' DG A 8 27.015 -2.790 3.319 1.00 91.33 C ANISOU 144 C4' DG A 8 10969 14346 9383 -3267 2280 -2050 C ATOM 145 O4' DG A 8 26.708 -2.079 4.542 1.00 85.28 O ANISOU 145 O4' DG A 8 10165 13280 8957 -3080 1676 -1602 O ATOM 146 C3' DG A 8 28.399 -2.297 2.885 1.00 95.21 C ANISOU 146 C3' DG A 8 11083 15070 10020 -3398 2725 -1972 C ATOM 147 O3' DG A 8 28.236 -1.256 1.927 1.00 97.57 O ANISOU 147 O3' DG A 8 11624 15817 9630 -3874 2728 -1668 O ATOM 148 C2' DG A 8 29.006 -1.780 4.175 1.00 91.17 C ANISOU 148 C2' DG A 8 10206 14236 10197 -3138 2336 -1589 C ATOM 149 C1' DG A 8 27.790 -1.228 4.892 1.00 84.70 C ANISOU 149 C1' DG A 8 9758 13219 9204 -3111 1667 -1282 C ATOM 150 N9 DG A 8 27.878 -1.196 6.347 1.00 78.90 N ANISOU 150 N9 DG A 8 8880 12074 9022 -2821 1235 -1100 N ATOM 151 C8 DG A 8 28.477 -2.121 7.172 1.00 79.04 C ANISOU 151 C8 DG A 8 8584 11802 9644 -2494 1256 -1249 C ATOM 152 N7 DG A 8 28.372 -1.820 8.438 1.00 74.74 N ANISOU 152 N7 DG A 8 8052 10978 9368 -2378 762 -986 N ATOM 153 C5 DG A 8 27.660 -0.628 8.450 1.00 71.41 C ANISOU 153 C5 DG A 8 7960 10618 8553 -2606 470 -718 C ATOM 154 C6 DG A 8 27.245 0.186 9.540 1.00 68.25 C ANISOU 154 C6 DG A 8 7757 9978 8197 -2629 0 -453 C ATOM 155 O6 DG A 8 27.429 0.005 10.750 1.00 67.36 O ANISOU 155 O6 DG A 8 7608 9611 8374 -2510 -293 -389 O ATOM 156 N1 DG A 8 26.540 1.305 9.103 1.00 66.02 N ANISOU 156 N1 DG A 8 7760 9761 7563 -2838 -111 -248 N ATOM 157 C2 DG A 8 26.273 1.607 7.788 1.00 67.88 C ANISOU 157 C2 DG A 8 8083 10305 7403 -3039 108 -208 C ATOM 158 N2 DG A 8 25.582 2.732 7.567 1.00 67.06 N ANISOU 158 N2 DG A 8 8223 10168 7086 -3204 -109 99 N ATOM 159 N3 DG A 8 26.657 0.858 6.764 1.00 71.46 N ANISOU 159 N3 DG A 8 8411 11061 7680 -3094 524 -451 N ATOM 160 C4 DG A 8 27.340 -0.236 7.166 1.00 73.27 C ANISOU 160 C4 DG A 8 8357 11183 8298 -2855 723 -739 C ATOM 161 P DT A 9 29.450 -0.652 1.110 1.00105.04 P ANISOU 161 P DT A 9 12309 17155 10446 -4204 3264 -1567 P ATOM 162 OP1 DT A 9 29.053 -0.658 -0.319 1.00109.85 O ANISOU 162 OP1 DT A 9 13336 18282 10117 -4702 3603 -1720 O ATOM 163 OP2 DT A 9 30.714 -1.317 1.536 1.00107.35 O ANISOU 163 OP2 DT A 9 12001 17263 11522 -3885 3732 -1851 O ATOM 164 O5' DT A 9 29.463 0.860 1.609 1.00101.71 O ANISOU 164 O5' DT A 9 11873 16676 10096 -4353 2705 -848 O ATOM 165 C5' DT A 9 28.231 1.561 1.899 1.00 97.30 C ANISOU 165 C5' DT A 9 11713 15975 9280 -4392 2038 -462 C ATOM 166 C4' DT A 9 28.524 2.851 2.625 1.00 95.33 C ANISOU 166 C4' DT A 9 11351 15489 9378 -4429 1626 84 C ATOM 167 O4' DT A 9 28.502 2.630 4.065 1.00 89.41 O ANISOU 167 O4' DT A 9 10444 14257 9268 -4021 1278 23 O ATOM 168 C3' DT A 9 29.903 3.458 2.320 1.00100.42 C ANISOU 168 C3' DT A 9 11629 16332 10194 -4697 1982 271 C ATOM 169 O3' DT A 9 29.816 4.873 2.281 1.00101.15 O ANISOU 169 O3' DT A 9 11870 16367 10195 -5000 1638 861 O ATOM 170 C2' DT A 9 30.722 3.075 3.533 1.00 98.52 C ANISOU 170 C2' DT A 9 10925 15750 10756 -4343 1914 132 C ATOM 171 C1' DT A 9 29.673 3.217 4.614 1.00 91.20 C ANISOU 171 C1' DT A 9 10293 14387 9970 -4076 1281 225 C ATOM 172 N1 DT A 9 29.960 2.563 5.924 1.00 86.89 N ANISOU 172 N1 DT A 9 9504 13482 10026 -3698 1066 50 N ATOM 173 C2 DT A 9 29.523 3.204 7.066 1.00 81.37 C ANISOU 173 C2 DT A 9 8983 12413 9518 -3629 524 266 C ATOM 174 O2 DT A 9 28.913 4.265 7.046 1.00 79.26 O ANISOU 174 O2 DT A 9 9027 12037 9049 -3805 261 553 O ATOM 175 N3 DT A 9 29.822 2.553 8.238 1.00 78.59 N ANISOU 175 N3 DT A 9 8445 11799 9615 -3357 314 139 N ATOM 176 C4 DT A 9 30.507 1.360 8.380 1.00 80.64 C ANISOU 176 C4 DT A 9 8311 12075 10251 -3106 542 -109 C ATOM 177 O4 DT A 9 30.702 0.897 9.502 1.00 78.51 O ANISOU 177 O4 DT A 9 7916 11550 10365 -2903 235 -98 O ATOM 178 C5 DT A 9 30.944 0.747 7.143 1.00 85.02 C ANISOU 178 C5 DT A 9 8650 12947 10707 -3127 1162 -363 C ATOM 179 C7 DT A 9 31.687 -0.550 7.198 1.00 88.36 C ANISOU 179 C7 DT A 9 8613 13306 11652 -2809 1512 -673 C ATOM 180 C6 DT A 9 30.653 1.370 5.994 1.00 87.65 C ANISOU 180 C6 DT A 9 9218 13596 10488 -3445 1409 -301 C ATOM 181 P DG A 10 30.169 5.683 0.980 1.00108.10 P ANISOU 181 P DG A 10 12865 17701 10504 -5576 1920 1238 P ATOM 182 OP1 DG A 10 29.255 5.174 -0.068 1.00111.16 O ANISOU 182 OP1 DG A 10 13662 18455 10116 -5741 2016 1108 O ATOM 183 OP2 DG A 10 31.641 5.632 0.772 1.00111.43 O ANISOU 183 OP2 DG A 10 12791 18353 11192 -5749 2485 1144 O ATOM 184 O5' DG A 10 29.726 7.158 1.402 1.00107.05 O ANISOU 184 O5' DG A 10 12946 17200 10528 -5716 1314 1893 O ATOM 185 C5' DG A 10 28.490 7.384 2.135 1.00102.12 C ANISOU 185 C5' DG A 10 12609 16129 10061 -5408 731 1993 C ATOM 186 C4' DG A 10 28.590 8.609 3.020 1.00100.67 C ANISOU 186 C4' DG A 10 12436 15416 10395 -5417 330 2373 C ATOM 187 O4' DG A 10 29.045 8.246 4.341 1.00 95.72 O ANISOU 187 O4' DG A 10 11577 14454 10337 -5108 239 2034 O ATOM 188 C3' DG A 10 29.541 9.699 2.552 1.00106.49 C ANISOU 188 C3' DG A 10 13070 16224 11167 -5898 447 2836 C ATOM 189 O3' DG A 10 28.988 10.928 2.999 1.00109.60 O ANISOU 189 O3' DG A 10 13715 16077 11849 -5936 -17 3277 O ATOM 190 C2' DG A 10 30.850 9.342 3.241 1.00105.18 C ANISOU 190 C2' DG A 10 12425 16065 11473 -5865 690 2538 C ATOM 191 C1' DG A 10 30.396 8.688 4.550 1.00 98.15 C ANISOU 191 C1' DG A 10 11531 14788 10972 -5364 391 2137 C ATOM 192 N9 DG A 10 31.174 7.530 5.000 1.00 95.58 N ANISOU 192 N9 DG A 10 10782 14612 10921 -5123 643 1691 N ATOM 193 C8 DG A 10 31.884 6.643 4.224 1.00 98.08 C ANISOU 193 C8 DG A 10 10764 15381 11121 -5146 1203 1435 C ATOM 194 N7 DG A 10 32.440 5.686 4.918 1.00 96.06 N ANISOU 194 N7 DG A 10 10125 15059 11313 -4827 1286 1091 N ATOM 195 C5 DG A 10 32.060 5.946 6.228 1.00 90.29 C ANISOU 195 C5 DG A 10 9531 13871 10903 -4636 716 1140 C ATOM 196 C6 DG A 10 32.362 5.248 7.429 1.00 87.20 C ANISOU 196 C6 DG A 10 8905 13242 10985 -4329 470 943 C ATOM 197 O6 DG A 10 33.041 4.224 7.577 1.00 87.84 O ANISOU 197 O6 DG A 10 8543 13419 11414 -4101 683 719 O ATOM 198 N1 DG A 10 31.777 5.859 8.535 1.00 82.76 N ANISOU 198 N1 DG A 10 8683 12270 10491 -4311 -70 1047 N ATOM 199 C2 DG A 10 31.009 7.000 8.494 1.00 82.24 C ANISOU 199 C2 DG A 10 9074 11976 10197 -4497 -295 1275 C ATOM 200 N2 DG A 10 30.540 7.441 9.669 1.00 80.35 N ANISOU 200 N2 DG A 10 9124 11313 10091 -4447 -713 1255 N ATOM 201 N3 DG A 10 30.721 7.658 7.382 1.00 84.43 N ANISOU 201 N3 DG A 10 9518 12411 10149 -4727 -111 1518 N ATOM 202 C4 DG A 10 31.272 7.077 6.295 1.00 89.71 C ANISOU 202 C4 DG A 10 9910 13549 10623 -4812 366 1453 C ATOM 203 P DG A 11 29.673 12.334 2.812 1.00121.25 P ANISOU 203 P DG A 11 15197 17333 13536 -6404 -88 3842 P ATOM 204 OP1 DG A 11 28.552 13.283 2.590 1.00122.62 O ANISOU 204 OP1 DG A 11 15758 17103 13727 -6399 -500 4352 O ATOM 205 OP2 DG A 11 30.806 12.278 1.847 1.00127.43 O ANISOU 205 OP2 DG A 11 15725 18686 14005 -6873 392 3978 O ATOM 206 O5' DG A 11 30.297 12.587 4.252 1.00115.46 O ANISOU 206 O5' DG A 11 14285 16105 13478 -6277 -259 3575 O ATOM 207 C5' DG A 11 29.479 12.498 5.435 1.00107.18 C ANISOU 207 C5' DG A 11 13432 14540 12748 -5855 -596 3279 C ATOM 208 C4' DG A 11 30.274 12.936 6.641 1.00104.02 C ANISOU 208 C4' DG A 11 12919 13753 12849 -5958 -759 3116 C ATOM 209 O4' DG A 11 31.037 11.809 7.133 1.00 99.60 O ANISOU 209 O4' DG A 11 11972 13525 12346 -5811 -616 2697 O ATOM 210 C3' DG A 11 31.289 14.052 6.375 1.00107.44 C ANISOU 210 C3' DG A 11 13242 14084 13495 -6513 -743 3521 C ATOM 211 O3' DG A 11 31.327 14.945 7.483 1.00108.47 O ANISOU 211 O3' DG A 11 13583 13554 14075 -6618 -1070 3469 O ATOM 212 C2' DG A 11 32.589 13.299 6.176 1.00107.31 C ANISOU 212 C2' DG A 11 12668 14631 13471 -6677 -425 3366 C ATOM 213 C1' DG A 11 32.419 12.105 7.104 1.00100.84 C ANISOU 213 C1' DG A 11 11722 13854 12736 -6206 -502 2826 C ATOM 214 N9 DG A 11 33.135 10.893 6.705 1.00 98.01 N ANISOU 214 N9 DG A 11 10871 14054 12312 -6077 -122 2583 N ATOM 215 C8 DG A 11 33.547 10.535 5.441 1.00100.04 C ANISOU 215 C8 DG A 11 10898 14847 12265 -6230 387 2666 C ATOM 216 N7 DG A 11 34.190 9.398 5.415 1.00 98.87 N ANISOU 216 N7 DG A 11 10288 15036 12241 -6023 716 2329 N ATOM 217 C5 DG A 11 34.208 8.983 6.740 1.00 94.53 C ANISOU 217 C5 DG A 11 9650 14168 12099 -5725 324 2093 C ATOM 218 C6 DG A 11 34.773 7.822 7.333 1.00 92.73 C ANISOU 218 C6 DG A 11 8962 14036 12234 -5401 375 1780 C ATOM 219 O6 DG A 11 35.389 6.899 6.787 1.00 94.92 O ANISOU 219 O6 DG A 11 8776 14655 12633 -5257 847 1589 O ATOM 220 N1 DG A 11 34.564 7.798 8.709 1.00 88.70 N ANISOU 220 N1 DG A 11 8580 13143 11976 -5250 -176 1703 N ATOM 221 C2 DG A 11 33.905 8.769 9.426 1.00 86.78 C ANISOU 221 C2 DG A 11 8857 12473 11643 -5394 -625 1810 C ATOM 222 N2 DG A 11 33.812 8.569 10.747 1.00 84.57 N ANISOU 222 N2 DG A 11 8682 11912 11537 -5285 -1068 1664 N ATOM 223 N3 DG A 11 33.375 9.854 8.885 1.00 87.94 N ANISOU 223 N3 DG A 11 9400 12456 11557 -5639 -621 2049 N ATOM 224 C4 DG A 11 33.562 9.896 7.548 1.00 92.95 C ANISOU 224 C4 DG A 11 9903 13466 11946 -5790 -179 2224 C ATOM 225 P DC A 12 32.279 16.214 7.526 1.00117.81 P ANISOU 225 P DC A 12 14733 14427 15602 -7221 -1158 3819 P ATOM 226 OP1 DC A 12 31.532 17.352 8.112 1.00120.51 O ANISOU 226 OP1 DC A 12 15578 13931 16277 -7231 -1437 3892 O ATOM 227 OP2 DC A 12 33.012 16.401 6.238 1.00122.38 O ANISOU 227 OP2 DC A 12 15034 15493 15969 -7631 -847 4286 O ATOM 228 O5' DC A 12 33.305 15.703 8.628 1.00116.70 O ANISOU 228 O5' DC A 12 14242 14401 15696 -7316 -1278 3416 O ATOM 229 C5' DC A 12 32.841 15.152 9.877 1.00109.15 C ANISOU 229 C5' DC A 12 13460 13219 14789 -6972 -1523 2924 C ATOM 230 C4' DC A 12 33.983 14.503 10.627 1.00108.47 C ANISOU 230 C4' DC A 12 12909 13440 14864 -7115 -1654 2712 C ATOM 231 O4' DC A 12 34.152 13.142 10.182 1.00104.70 O ANISOU 231 O4' DC A 12 12000 13554 14225 -6750 -1391 2582 O ATOM 232 C3' DC A 12 35.351 15.138 10.440 1.00113.80 C ANISOU 232 C3' DC A 12 13160 14244 15836 -7722 -1677 3007 C ATOM 233 O3' DC A 12 35.534 16.281 11.290 1.00119.98 O ANISOU 233 O3' DC A 12 14277 14439 16869 -8174 -2045 3000 O ATOM 234 C2' DC A 12 36.291 14.000 10.797 1.00112.17 C ANISOU 234 C2' DC A 12 12298 14553 15768 -7620 -1689 2848 C ATOM 235 C1' DC A 12 35.508 12.737 10.402 1.00105.22 C ANISOU 235 C1' DC A 12 11419 13971 14586 -6977 -1409 2612 C ATOM 236 N1 DC A 12 35.997 12.081 9.169 1.00103.48 N ANISOU 236 N1 DC A 12 10704 14324 14288 -6900 -875 2729 N ATOM 237 C2 DC A 12 36.640 10.836 9.264 1.00101.27 C ANISOU 237 C2 DC A 12 9834 14437 14205 -6619 -709 2530 C ATOM 238 O2 DC A 12 36.773 10.310 10.380 1.00 97.96 O ANISOU 238 O2 DC A 12 9318 13895 14007 -6449 -1094 2349 O ATOM 239 N3 DC A 12 37.089 10.238 8.137 1.00102.99 N ANISOU 239 N3 DC A 12 9623 15138 14369 -6553 -117 2543 N ATOM 240 C4 DC A 12 36.934 10.840 6.955 1.00106.32 C ANISOU 240 C4 DC A 12 10219 15732 14445 -6822 263 2779 C ATOM 241 N4 DC A 12 37.404 10.218 5.870 1.00109.72 N ANISOU 241 N4 DC A 12 10269 16676 14745 -6812 907 2727 N ATOM 242 C5 DC A 12 36.289 12.106 6.831 1.00106.93 C ANISOU 242 C5 DC A 12 10884 15438 14305 -7126 17 3085 C ATOM 243 C6 DC A 12 35.840 12.685 7.953 1.00104.81 C ANISOU 243 C6 DC A 12 10998 14618 14205 -7122 -529 3033 C TER 244 DC A 12 ATOM 245 O5' DG B 1 44.758 2.012 10.617 1.00121.22 O ANISOU 245 O5' DG B 1 7868 18643 19545 -4680 -515 391 O ATOM 246 C5' DG B 1 43.495 1.341 10.655 1.00116.60 C ANISOU 246 C5' DG B 1 7845 17813 18642 -4303 -498 330 C ATOM 247 C4' DG B 1 42.536 2.093 11.545 1.00111.84 C ANISOU 247 C4' DG B 1 8107 17219 17168 -4525 -964 523 C ATOM 248 O4' DG B 1 42.127 3.325 10.900 1.00108.11 O ANISOU 248 O4' DG B 1 8242 16793 16040 -4867 -633 298 O ATOM 249 C3' DG B 1 41.241 1.349 11.857 1.00107.93 C ANISOU 249 C3' DG B 1 8123 16508 16377 -4166 -1069 549 C ATOM 250 O3' DG B 1 40.845 1.666 13.186 1.00109.96 O ANISOU 250 O3' DG B 1 8739 16871 16169 -4392 -1706 846 O ATOM 251 C2' DG B 1 40.261 1.931 10.856 1.00101.90 C ANISOU 251 C2' DG B 1 8052 15676 14990 -4187 -537 191 C ATOM 252 C1' DG B 1 40.706 3.372 10.831 1.00101.43 C ANISOU 252 C1' DG B 1 8176 15760 14600 -4704 -563 191 C ATOM 253 N9 DG B 1 40.343 4.132 9.639 1.00 97.96 N ANISOU 253 N9 DG B 1 8104 15314 13800 -4887 -60 -1 N ATOM 254 C8 DG B 1 40.665 3.840 8.335 1.00 99.05 C ANISOU 254 C8 DG B 1 7971 15609 14052 -4886 534 -203 C ATOM 255 N7 DG B 1 40.225 4.730 7.488 1.00 97.45 N ANISOU 255 N7 DG B 1 8213 15450 13364 -5195 796 -198 N ATOM 256 C5 DG B 1 39.582 5.671 8.280 1.00 94.53 C ANISOU 256 C5 DG B 1 8395 14816 12706 -5331 362 -24 C ATOM 257 C6 DG B 1 38.910 6.871 7.923 1.00 93.08 C ANISOU 257 C6 DG B 1 8766 14427 12171 -5629 345 105 C ATOM 258 O6 DG B 1 38.746 7.358 6.797 1.00 94.19 O ANISOU 258 O6 DG B 1 9055 14643 12087 -5886 644 231 O ATOM 259 N1 DG B 1 38.405 7.528 9.043 1.00 91.01 N ANISOU 259 N1 DG B 1 8863 13850 11866 -5664 -86 98 N ATOM 260 C2 DG B 1 38.532 7.090 10.339 1.00 90.71 C ANISOU 260 C2 DG B 1 8715 13846 11903 -5534 -460 6 C ATOM 261 N2 DG B 1 37.984 7.869 11.284 1.00 89.95 N ANISOU 261 N2 DG B 1 9002 13519 11653 -5697 -761 -119 N ATOM 262 N3 DG B 1 39.150 5.971 10.685 1.00 92.23 N ANISOU 262 N3 DG B 1 8417 14283 12342 -5304 -541 42 N ATOM 263 C4 DG B 1 39.649 5.318 9.612 1.00 94.39 C ANISOU 263 C4 DG B 1 8289 14720 12855 -5169 -116 18 C ATOM 264 P DC B 2 39.798 0.764 13.958 1.00110.53 P ANISOU 264 P DC B 2 9118 16841 16035 -4136 -2029 1066 P ATOM 265 OP1 DC B 2 40.566 0.166 15.088 1.00115.80 O ANISOU 265 OP1 DC B 2 9210 17685 17103 -4255 -2737 1638 O ATOM 266 OP2 DC B 2 39.047 -0.112 13.006 1.00108.06 O ANISOU 266 OP2 DC B 2 8905 16217 15934 -3648 -1535 823 O ATOM 267 O5' DC B 2 38.757 1.828 14.519 1.00106.75 O ANISOU 267 O5' DC B 2 9500 16468 14590 -4467 -2105 869 O ATOM 268 C5' DC B 2 39.199 2.901 15.358 1.00109.98 C ANISOU 268 C5' DC B 2 10013 17150 14622 -5024 -2447 861 C ATOM 269 C4' DC B 2 38.124 3.954 15.449 1.00105.96 C ANISOU 269 C4' DC B 2 10270 16535 13452 -5218 -2246 440 C ATOM 270 O4' DC B 2 37.906 4.553 14.150 1.00101.51 O ANISOU 270 O4' DC B 2 9902 15661 13005 -5077 -1704 181 O ATOM 271 C3' DC B 2 36.762 3.431 15.902 1.00102.71 C ANISOU 271 C3' DC B 2 10330 16081 12614 -5016 -2250 382 C ATOM 272 O3' DC B 2 36.212 4.372 16.819 1.00105.84 O ANISOU 272 O3' DC B 2 11173 16617 12421 -5451 -2372 57 O ATOM 273 C2' DC B 2 35.963 3.356 14.611 1.00 96.86 C ANISOU 273 C2' DC B 2 9859 14956 11986 -4589 -1701 166 C ATOM 274 C1' DC B 2 36.523 4.536 13.847 1.00 96.46 C ANISOU 274 C1' DC B 2 9817 14779 12052 -4825 -1454 -17 C ATOM 275 N1 DC B 2 36.391 4.491 12.379 1.00 91.98 N ANISOU 275 N1 DC B 2 9258 14016 11672 -4587 -973 -68 N ATOM 276 C2 DC B 2 35.680 5.510 11.725 1.00 88.85 C ANISOU 276 C2 DC B 2 9309 13362 11086 -4691 -738 -216 C ATOM 277 O2 DC B 2 35.134 6.394 12.405 1.00 88.40 O ANISOU 277 O2 DC B 2 9602 13135 10850 -4892 -888 -389 O ATOM 278 N3 DC B 2 35.601 5.498 10.375 1.00 86.70 N ANISOU 278 N3 DC B 2 9038 13043 10860 -4612 -360 -170 N ATOM 279 C4 DC B 2 36.206 4.531 9.679 1.00 87.07 C ANISOU 279 C4 DC B 2 8665 13301 11117 -4441 -113 -149 C ATOM 280 N4 DC B 2 36.103 4.559 8.348 1.00 85.87 N ANISOU 280 N4 DC B 2 8539 13227 10861 -4488 297 -177 N ATOM 281 C5 DC B 2 36.944 3.489 10.319 1.00 89.80 C ANISOU 281 C5 DC B 2 8500 13788 11831 -4255 -286 -97 C ATOM 282 C6 DC B 2 37.021 3.517 11.656 1.00 91.77 C ANISOU 282 C6 DC B 2 8750 14074 12044 -4338 -766 25 C ATOM 283 P DC B 3 35.150 3.931 17.899 1.00108.20 P ANISOU 283 P DC B 3 11811 17170 12128 -5555 -2552 16 P ATOM 284 OP1 DC B 3 35.533 4.532 19.196 1.00113.43 O ANISOU 284 OP1 DC B 3 12493 18331 12272 -6247 -2937 -110 O ATOM 285 OP2 DC B 3 34.940 2.462 17.787 1.00107.65 O ANISOU 285 OP2 DC B 3 11517 17098 12287 -5140 -2671 504 O ATOM 286 O5' DC B 3 33.792 4.606 17.426 1.00104.76 O ANISOU 286 O5' DC B 3 11940 16339 11523 -5363 -2062 -518 O ATOM 287 C5' DC B 3 33.760 5.898 16.796 1.00104.11 C ANISOU 287 C5' DC B 3 12049 15863 11641 -5447 -1766 -914 C ATOM 288 C4' DC B 3 32.448 6.055 16.068 1.00 99.24 C ANISOU 288 C4' DC B 3 11801 14807 11098 -5065 -1381 -1129 C ATOM 289 O4' DC B 3 32.637 5.792 14.651 1.00 94.46 O ANISOU 289 O4' DC B 3 11081 13939 10870 -4703 -1159 -851 O ATOM 290 C3' DC B 3 31.359 5.078 16.523 1.00 96.12 C ANISOU 290 C3' DC B 3 11573 14564 10384 -4830 -1370 -1099 C ATOM 291 O3' DC B 3 30.107 5.741 16.520 1.00 98.16 O ANISOU 291 O3' DC B 3 12183 14512 10599 -4761 -1089 -1547 O ATOM 292 C2' DC B 3 31.399 4.005 15.460 1.00 91.09 C ANISOU 292 C2' DC B 3 10763 13801 10044 -4343 -1270 -695 C ATOM 293 C1' DC B 3 31.659 4.858 14.240 1.00 88.95 C ANISOU 293 C1' DC B 3 10514 13175 10107 -4282 -1011 -756 C ATOM 294 N1 DC B 3 32.152 4.178 13.023 1.00 84.83 N ANISOU 294 N1 DC B 3 9742 12622 9865 -4012 -837 -490 N ATOM 295 C2 DC B 3 31.963 4.811 11.788 1.00 82.85 C ANISOU 295 C2 DC B 3 9612 12132 9731 -3983 -562 -494 C ATOM 296 O2 DC B 3 31.400 5.917 11.761 1.00 83.23 O ANISOU 296 O2 DC B 3 9939 11893 9790 -4124 -538 -627 O ATOM 297 N3 DC B 3 32.399 4.205 10.660 1.00 81.32 N ANISOU 297 N3 DC B 3 9195 12035 9667 -3850 -330 -356 N ATOM 298 C4 DC B 3 33.004 3.016 10.732 1.00 81.66 C ANISOU 298 C4 DC B 3 8858 12269 9898 -3666 -331 -291 C ATOM 299 N4 DC B 3 33.422 2.457 9.594 1.00 82.71 N ANISOU 299 N4 DC B 3 8733 12490 10200 -3570 -2 -321 N ATOM 300 C5 DC B 3 33.206 2.347 11.974 1.00 82.60 C ANISOU 300 C5 DC B 3 8807 12504 10072 -3620 -676 -185 C ATOM 301 C6 DC B 3 32.770 2.958 13.085 1.00 84.07 C ANISOU 301 C6 DC B 3 9266 12727 9948 -3838 -936 -251 C ATOM 302 P DA B 4 29.478 6.116 17.907 1.00105.92 P ANISOU 302 P DA B 4 13349 15782 11111 -5168 -1091 -2070 P ATOM 303 OP1 DA B 4 30.555 6.642 18.789 1.00110.53 O ANISOU 303 OP1 DA B 4 13794 16745 11456 -5760 -1358 -2210 O ATOM 304 OP2 DA B 4 28.662 4.950 18.330 1.00103.70 O ANISOU 304 OP2 DA B 4 13128 15812 10459 -5011 -1116 -1876 O ATOM 305 O5' DA B 4 28.506 7.329 17.569 1.00108.40 O ANISOU 305 O5' DA B 4 13885 15485 11815 -5080 -722 -2658 O ATOM 306 C5' DA B 4 29.012 8.540 16.982 1.00109.22 C ANISOU 306 C5' DA B 4 13957 15079 12461 -5176 -667 -2796 C ATOM 307 C4' DA B 4 28.224 8.882 15.738 1.00105.87 C ANISOU 307 C4' DA B 4 13613 14008 12602 -4733 -475 -2621 C ATOM 308 O4' DA B 4 28.542 7.958 14.670 1.00 99.94 O ANISOU 308 O4' DA B 4 12781 13383 11806 -4410 -543 -1969 O ATOM 309 C3' DA B 4 26.706 8.821 15.896 1.00105.42 C ANISOU 309 C3' DA B 4 13695 13723 12634 -4466 -243 -2943 C ATOM 310 O3' DA B 4 26.161 9.907 15.141 1.00110.33 O ANISOU 310 O3' DA B 4 14320 13577 14022 -4316 -134 -3011 O ATOM 311 C2' DA B 4 26.350 7.440 15.359 1.00 97.45 C ANISOU 311 C2' DA B 4 12699 13015 11311 -4088 -290 -2425 C ATOM 312 C1' DA B 4 27.364 7.261 14.244 1.00 94.68 C ANISOU 312 C1' DA B 4 12231 12645 11098 -4010 -417 -1863 C ATOM 313 N9 DA B 4 27.762 5.887 13.930 1.00 89.44 N ANISOU 313 N9 DA B 4 11453 12385 10144 -3818 -499 -1447 N ATOM 314 C8 DA B 4 27.973 4.837 14.791 1.00 88.30 C ANISOU 314 C8 DA B 4 11219 12697 9632 -3859 -645 -1369 C ATOM 315 N7 DA B 4 28.390 3.743 14.199 1.00 84.76 N ANISOU 315 N7 DA B 4 10594 12381 9226 -3628 -691 -983 N ATOM 316 C5 DA B 4 28.486 4.104 12.862 1.00 80.76 C ANISOU 316 C5 DA B 4 10087 11606 8990 -3484 -517 -872 C ATOM 317 C6 DA B 4 28.885 3.393 11.717 1.00 77.50 C ANISOU 317 C6 DA B 4 9510 11237 8700 -3297 -392 -633 C ATOM 318 N6 DA B 4 29.270 2.118 11.737 1.00 77.47 N ANISOU 318 N6 DA B 4 9263 11420 8751 -3125 -416 -498 N ATOM 319 N1 DA B 4 28.860 4.042 10.533 1.00 76.13 N ANISOU 319 N1 DA B 4 9398 10903 8624 -3341 -232 -550 N ATOM 320 C2 DA B 4 28.465 5.322 10.510 1.00 79.20 C ANISOU 320 C2 DA B 4 9972 10982 9137 -3501 -265 -601 C ATOM 321 N3 DA B 4 28.080 6.102 11.521 1.00 83.18 N ANISOU 321 N3 DA B 4 10598 11279 9725 -3613 -357 -880 N ATOM 322 C4 DA B 4 28.110 5.423 12.683 1.00 84.63 C ANISOU 322 C4 DA B 4 10747 11750 9658 -3619 -448 -1061 C ATOM 323 P DC B 5 24.604 10.136 14.995 1.00112.60 P ANISOU 323 P DC B 5 14626 13390 14764 -3981 74 -3262 P ATOM 324 OP1 DC B 5 24.358 11.603 14.851 1.00114.77 O ANISOU 324 OP1 DC B 5 14799 12823 15986 -4049 146 -3587 O ATOM 325 OP2 DC B 5 23.921 9.368 16.071 1.00110.92 O ANISOU 325 OP2 DC B 5 14463 13690 13989 -4016 249 -3705 O ATOM 326 O5' DC B 5 24.317 9.408 13.605 1.00107.30 O ANISOU 326 O5' DC B 5 13979 12705 14084 -3592 -59 -2461 O ATOM 327 C5' DC B 5 24.762 9.985 12.352 1.00102.07 C ANISOU 327 C5' DC B 5 13278 11683 13821 -3593 -222 -1883 C ATOM 328 C4' DC B 5 24.274 9.154 11.187 1.00 94.03 C ANISOU 328 C4' DC B 5 12296 10834 12594 -3318 -292 -1289 C ATOM 329 O4' DC B 5 24.887 7.849 11.224 1.00 86.09 O ANISOU 329 O4' DC B 5 11314 10494 10900 -3290 -268 -1170 O ATOM 330 C3' DC B 5 22.757 8.910 11.141 1.00 90.49 C ANISOU 330 C3' DC B 5 11847 10178 12354 -2990 -235 -1373 C ATOM 331 O3' DC B 5 22.244 9.453 9.920 1.00 94.28 O ANISOU 331 O3' DC B 5 12270 10247 13303 -2916 -427 -807 O ATOM 332 C2' DC B 5 22.616 7.390 11.234 1.00 82.83 C ANISOU 332 C2' DC B 5 10956 9837 10678 -2834 -171 -1321 C ATOM 333 C1' DC B 5 23.966 6.893 10.766 1.00 78.93 C ANISOU 333 C1' DC B 5 10458 9746 9784 -3001 -232 -1011 C ATOM 334 N1 DC B 5 24.396 5.589 11.287 1.00 71.83 N ANISOU 334 N1 DC B 5 9543 9375 8375 -2952 -191 -1075 N ATOM 335 C2 DC B 5 24.876 4.629 10.394 1.00 68.32 C ANISOU 335 C2 DC B 5 9038 9223 7697 -2879 -175 -762 C ATOM 336 O2 DC B 5 24.861 4.879 9.183 1.00 69.20 O ANISOU 336 O2 DC B 5 9157 9274 7862 -2916 -167 -471 O ATOM 337 N3 DC B 5 25.314 3.442 10.872 1.00 65.53 N ANISOU 337 N3 DC B 5 8587 9210 7100 -2808 -170 -788 N ATOM 338 C4 DC B 5 25.299 3.207 12.187 1.00 67.01 C ANISOU 338 C4 DC B 5 8769 9542 7147 -2872 -247 -982 C ATOM 339 N4 DC B 5 25.735 2.021 12.617 1.00 66.87 N ANISOU 339 N4 DC B 5 8612 9811 6985 -2824 -331 -848 N ATOM 340 C5 DC B 5 24.838 4.177 13.119 1.00 69.58 C ANISOU 340 C5 DC B 5 9197 9731 7506 -3039 -237 -1332 C ATOM 341 C6 DC B 5 24.411 5.348 12.632 1.00 72.40 C ANISOU 341 C6 DC B 5 9617 9655 8236 -3045 -176 -1432 C HETATM 342 N1 5CM B 6 21.349 3.699 8.732 1.00 70.89 N ANISOU 342 N1 5CM B 6 9548 9309 8078 -2343 -177 -478 N HETATM 343 C2 5CM B 6 21.979 2.412 8.508 1.00 66.81 C ANISOU 343 C2 5CM B 6 9001 9181 7201 -2327 -77 -489 C HETATM 344 N3 5CM B 6 22.335 1.599 9.557 1.00 62.73 N ANISOU 344 N3 5CM B 6 8433 8817 6583 -2257 -33 -685 N HETATM 345 C4 5CM B 6 22.091 2.016 10.826 1.00 64.60 C ANISOU 345 C4 5CM B 6 8698 8986 6861 -2287 -60 -903 C HETATM 346 C5 5CM B 6 21.433 3.346 11.031 1.00 66.36 C ANISOU 346 C5 5CM B 6 8966 8860 7389 -2323 -58 -1064 C HETATM 347 C5A 5CM B 6 21.124 3.882 12.367 1.00 68.89 C ANISOU 347 C5A 5CM B 6 9285 9131 7757 -2426 23 -1494 C HETATM 348 C6 5CM B 6 21.095 4.117 9.970 1.00 68.79 C ANISOU 348 C6 5CM B 6 9273 8875 7987 -2308 -131 -825 C HETATM 349 O2 5CM B 6 22.216 2.014 7.336 1.00 65.21 O ANISOU 349 O2 5CM B 6 8782 9181 6811 -2418 -32 -317 O HETATM 350 N4 5CM B 6 22.440 1.224 11.884 1.00 64.76 N ANISOU 350 N4 5CM B 6 8664 9252 6687 -2329 -93 -970 N HETATM 351 C1' 5CM B 6 20.963 4.556 7.593 1.00 77.74 C ANISOU 351 C1' 5CM B 6 10412 9959 9165 -2445 -338 -83 C HETATM 352 C2' 5CM B 6 19.638 5.294 7.821 1.00 83.41 C ANISOU 352 C2' 5CM B 6 11062 10208 10422 -2278 -457 -85 C HETATM 353 C3' 5CM B 6 19.693 6.345 6.781 1.00 88.82 C ANISOU 353 C3' 5CM B 6 11694 10620 11432 -2472 -714 457 C HETATM 354 C4' 5CM B 6 21.172 6.708 6.710 1.00 89.86 C ANISOU 354 C4' 5CM B 6 11872 10887 11382 -2751 -651 504 C HETATM 355 O4' 5CM B 6 21.896 5.610 7.326 1.00 83.58 O ANISOU 355 O4' 5CM B 6 11125 10538 10090 -2695 -410 111 O HETATM 356 O3' 5CM B 6 19.241 5.682 5.640 1.00 91.98 O ANISOU 356 O3' 5CM B 6 12128 11380 11440 -2556 -839 843 O HETATM 357 C5' 5CM B 6 21.478 8.016 7.437 1.00 94.44 C ANISOU 357 C5' 5CM B 6 12375 10894 12612 -2811 -690 343 C HETATM 358 O5' 5CM B 6 20.569 8.195 8.542 1.00 96.02 O ANISOU 358 O5' 5CM B 6 12503 10743 13237 -2550 -578 -188 O HETATM 359 P 5CM B 6 20.692 9.439 9.575 1.00100.06 P ANISOU 359 P 5CM B 6 12902 10648 14467 -2605 -489 -696 P HETATM 360 OP1 5CM B 6 20.370 10.726 8.853 1.00104.29 O ANISOU 360 OP1 5CM B 6 13263 10432 15930 -2651 -755 -250 O HETATM 361 OP2 5CM B 6 19.928 9.053 10.823 1.00100.78 O ANISOU 361 OP2 5CM B 6 12957 10809 14526 -2429 -209 -1430 O ATOM 362 P DG B 7 18.666 6.391 4.354 1.00 96.24 P ANISOU 362 P DG B 7 12589 11815 12161 -2789 -1235 1597 P ATOM 363 OP1 DG B 7 19.809 7.068 3.684 1.00 96.66 O ANISOU 363 OP1 DG B 7 12685 11981 12060 -3200 -1305 1995 O ATOM 364 OP2 DG B 7 17.403 7.136 4.659 1.00 96.01 O ANISOU 364 OP2 DG B 7 12341 11146 12990 -2532 -1476 1723 O ATOM 365 O5' DG B 7 18.296 5.076 3.539 1.00 90.18 O ANISOU 365 O5' DG B 7 11912 11710 10640 -2889 -1190 1618 O ATOM 366 C5' DG B 7 19.314 4.105 3.201 1.00 83.98 C ANISOU 366 C5' DG B 7 11247 11516 9143 -3078 -882 1343 C ATOM 367 C4' DG B 7 18.797 2.704 3.419 1.00 77.39 C ANISOU 367 C4' DG B 7 10445 10941 8018 -2871 -685 902 C ATOM 368 O4' DG B 7 19.096 2.269 4.769 1.00 71.80 O ANISOU 368 O4' DG B 7 9730 10030 7521 -2535 -453 405 O ATOM 369 C3' DG B 7 17.280 2.534 3.260 1.00 76.38 C ANISOU 369 C3' DG B 7 10258 10704 8058 -2738 -926 1059 C ATOM 370 O3' DG B 7 17.041 1.266 2.689 1.00 77.18 O ANISOU 370 O3' DG B 7 10413 11270 7642 -2846 -798 838 O ATOM 371 C2' DG B 7 16.790 2.475 4.691 1.00 72.06 C ANISOU 371 C2' DG B 7 9648 9739 7990 -2307 -796 654 C ATOM 372 C1' DG B 7 17.919 1.690 5.310 1.00 66.79 C ANISOU 372 C1' DG B 7 9069 9276 7032 -2269 -470 228 C ATOM 373 N9 DG B 7 18.020 1.715 6.767 1.00 60.92 N ANISOU 373 N9 DG B 7 8304 8299 6541 -2035 -327 -128 N ATOM 374 C8 DG B 7 17.478 2.634 7.634 1.00 61.03 C ANISOU 374 C8 DG B 7 8243 7925 7019 -1903 -356 -247 C ATOM 375 N7 DG B 7 17.749 2.377 8.886 1.00 58.22 N ANISOU 375 N7 DG B 7 7900 7599 6620 -1837 -176 -627 N ATOM 376 C5 DG B 7 18.481 1.197 8.844 1.00 54.43 C ANISOU 376 C5 DG B 7 7481 7471 5728 -1875 -94 -648 C ATOM 377 C6 DG B 7 19.050 0.429 9.895 1.00 52.77 C ANISOU 377 C6 DG B 7 7268 7444 5336 -1876 0 -837 C ATOM 378 O6 DG B 7 19.007 0.638 11.123 1.00 50.70 O ANISOU 378 O6 DG B 7 7000 7201 5062 -1920 46 -1049 O ATOM 379 N1 DG B 7 19.730 -0.683 9.405 1.00 49.54 N ANISOU 379 N1 DG B 7 6826 7234 4764 -1877 29 -756 N ATOM 380 C2 DG B 7 19.841 -1.016 8.080 1.00 51.17 C ANISOU 380 C2 DG B 7 7026 7532 4883 -1924 62 -664 C ATOM 381 N2 DG B 7 20.529 -2.135 7.804 1.00 51.29 N ANISOU 381 N2 DG B 7 6939 7679 4868 -1915 177 -757 N ATOM 382 N3 DG B 7 19.324 -0.305 7.093 1.00 53.24 N ANISOU 382 N3 DG B 7 7341 7772 5116 -2020 -20 -490 N ATOM 383 C4 DG B 7 18.657 0.776 7.545 1.00 55.65 C ANISOU 383 C4 DG B 7 7655 7803 5683 -1967 -139 -422 C ATOM 384 P DG B 8 16.247 1.004 1.353 1.00 81.80 P ANISOU 384 P DG B 8 10996 12294 7789 -3225 -1058 1182 P ATOM 385 OP1 DG B 8 16.846 1.854 0.275 1.00 86.34 O ANISOU 385 OP1 DG B 8 11601 13179 8025 -3739 -1251 1726 O ATOM 386 OP2 DG B 8 14.766 1.052 1.632 1.00 79.92 O ANISOU 386 OP2 DG B 8 10621 11773 7971 -2987 -1347 1352 O ATOM 387 O5' DG B 8 16.682 -0.511 1.127 1.00 77.49 O ANISOU 387 O5' DG B 8 10522 12172 6748 -3306 -652 550 O ATOM 388 C5' DG B 8 18.072 -0.904 1.162 1.00 74.44 C ANISOU 388 C5' DG B 8 10150 11950 6182 -3373 -253 158 C ATOM 389 C4' DG B 8 18.193 -2.348 1.593 1.00 70.69 C ANISOU 389 C4' DG B 8 9628 11449 5781 -3151 79 -470 C ATOM 390 O4' DG B 8 18.250 -2.434 3.038 1.00 67.25 O ANISOU 390 O4' DG B 8 9154 10528 5870 -2681 101 -566 O ATOM 391 C3' DG B 8 17.034 -3.247 1.178 1.00 70.42 C ANISOU 391 C3' DG B 8 9605 11552 5598 -3217 8 -626 C ATOM 392 O3' DG B 8 17.566 -4.544 0.974 1.00 72.35 O ANISOU 392 O3' DG B 8 9779 11912 5798 -3259 398 -1254 O ATOM 393 C2' DG B 8 16.125 -3.227 2.391 1.00 66.89 C ANISOU 393 C2' DG B 8 9131 10619 5664 -2765 -160 -520 C ATOM 394 C1' DG B 8 17.125 -3.143 3.537 1.00 62.90 C ANISOU 394 C1' DG B 8 8595 9805 5496 -2466 26 -663 C ATOM 395 N9 DG B 8 16.659 -2.439 4.720 1.00 59.61 N ANISOU 395 N9 DG B 8 8170 9025 5451 -2176 -117 -490 N ATOM 396 C8 DG B 8 15.955 -1.259 4.767 1.00 60.53 C ANISOU 396 C8 DG B 8 8267 8960 5769 -2149 -363 -162 C ATOM 397 N7 DG B 8 15.713 -0.855 5.986 1.00 55.68 N ANISOU 397 N7 DG B 8 7607 8037 5508 -1903 -334 -256 N ATOM 398 C5 DG B 8 16.295 -1.826 6.791 1.00 52.02 C ANISOU 398 C5 DG B 8 7166 7628 4968 -1810 -125 -543 C ATOM 399 C6 DG B 8 16.347 -1.935 8.208 1.00 49.65 C ANISOU 399 C6 DG B 8 6845 7216 4801 -1675 -34 -706 C ATOM 400 O6 DG B 8 15.887 -1.168 9.052 1.00 49.48 O ANISOU 400 O6 DG B 8 6788 7046 4966 -1614 -27 -782 O ATOM 401 N1 DG B 8 17.053 -3.064 8.610 1.00 48.54 N ANISOU 401 N1 DG B 8 6690 7173 4579 -1669 60 -798 N ATOM 402 C2 DG B 8 17.611 -3.990 7.759 1.00 51.90 C ANISOU 402 C2 DG B 8 7079 7687 4954 -1718 135 -863 C ATOM 403 N2 DG B 8 18.240 -5.025 8.340 1.00 51.59 N ANISOU 403 N2 DG B 8 6933 7591 5075 -1659 189 -917 N ATOM 404 N3 DG B 8 17.562 -3.904 6.435 1.00 52.13 N ANISOU 404 N3 DG B 8 7134 7862 4810 -1865 154 -880 N ATOM 405 C4 DG B 8 16.898 -2.801 6.026 1.00 53.49 C ANISOU 405 C4 DG B 8 7364 8036 4921 -1932 -10 -659 C ATOM 406 P DT B 9 16.742 -5.709 0.281 1.00 75.33 P ANISOU 406 P DT B 9 10146 12514 5962 -3480 472 -1656 P ATOM 407 OP1 DT B 9 17.776 -6.417 -0.515 1.00 78.40 O ANISOU 407 OP1 DT B 9 10435 13221 6130 -3788 944 -2292 O ATOM 408 OP2 DT B 9 15.520 -5.153 -0.369 1.00 75.27 O ANISOU 408 OP2 DT B 9 10220 12791 5586 -3761 47 -1195 O ATOM 409 O5' DT B 9 16.271 -6.589 1.524 1.00 72.03 O ANISOU 409 O5' DT B 9 9656 11525 6186 -2985 486 -1809 O ATOM 410 C5' DT B 9 17.214 -7.024 2.525 1.00 70.07 C ANISOU 410 C5' DT B 9 9288 10877 6457 -2632 688 -1972 C ATOM 411 C4' DT B 9 16.484 -7.495 3.763 1.00 67.53 C ANISOU 411 C4' DT B 9 8946 10138 6574 -2287 536 -1814 C ATOM 412 O4' DT B 9 16.022 -6.358 4.548 1.00 63.38 O ANISOU 412 O4' DT B 9 8509 9537 6034 -2130 284 -1361 O ATOM 413 C3' DT B 9 15.235 -8.343 3.493 1.00 68.81 C ANISOU 413 C3' DT B 9 9110 10290 6743 -2377 465 -1950 C ATOM 414 O3' DT B 9 15.232 -9.444 4.387 1.00 72.06 O ANISOU 414 O3' DT B 9 9402 10290 7687 -2158 534 -2056 O ATOM 415 C2' DT B 9 14.095 -7.404 3.836 1.00 65.91 C ANISOU 415 C2' DT B 9 8818 9968 6254 -2317 147 -1496 C ATOM 416 C1' DT B 9 14.720 -6.640 4.983 1.00 61.14 C ANISOU 416 C1' DT B 9 8223 9149 5858 -2047 136 -1259 C ATOM 417 N1 DT B 9 14.074 -5.365 5.385 1.00 58.60 N ANISOU 417 N1 DT B 9 7923 8794 5545 -1960 -70 -921 N ATOM 418 C2 DT B 9 14.087 -5.049 6.733 1.00 55.67 C ANISOU 418 C2 DT B 9 7529 8219 5404 -1749 -42 -862 C ATOM 419 O2 DT B 9 14.623 -5.749 7.577 1.00 53.55 O ANISOU 419 O2 DT B 9 7241 7860 5242 -1674 64 -943 O ATOM 420 N3 DT B 9 13.462 -3.869 7.051 1.00 54.63 N ANISOU 420 N3 DT B 9 7357 7997 5403 -1674 -156 -703 N ATOM 421 C4 DT B 9 12.831 -2.998 6.185 1.00 59.46 C ANISOU 421 C4 DT B 9 7912 8616 6062 -1743 -372 -469 C ATOM 422 O4 DT B 9 12.314 -1.966 6.622 1.00 60.98 O ANISOU 422 O4 DT B 9 7987 8585 6595 -1620 -453 -365 O ATOM 423 C5 DT B 9 12.844 -3.396 4.787 1.00 61.47 C ANISOU 423 C5 DT B 9 8215 9158 5981 -2012 -491 -377 C ATOM 424 C7 DT B 9 12.185 -2.512 3.774 1.00 64.77 C ANISOU 424 C7 DT B 9 8555 9676 6377 -2198 -840 45 C ATOM 425 C6 DT B 9 13.457 -4.545 4.463 1.00 59.87 C ANISOU 425 C6 DT B 9 8086 9122 5540 -2127 -293 -675 C ATOM 426 P DG B 10 15.435 -10.905 3.807 1.00 81.90 P ANISOU 426 P DG B 10 10488 11345 9283 -2271 788 -2621 P ATOM 427 OP1 DG B 10 16.696 -10.924 2.997 1.00 80.02 O ANISOU 427 OP1 DG B 10 10139 11246 9019 -2398 1112 -3062 O ATOM 428 OP2 DG B 10 14.136 -11.332 3.195 1.00 83.74 O ANISOU 428 OP2 DG B 10 10783 11734 9300 -2516 692 -2761 O ATOM 429 O5' DG B 10 15.650 -11.740 5.146 1.00 77.13 O ANISOU 429 O5' DG B 10 9724 10189 9391 -1967 723 -2398 O ATOM 430 C5' DG B 10 16.730 -11.424 6.039 1.00 75.36 C ANISOU 430 C5' DG B 10 9404 9806 9421 -1748 681 -2108 C ATOM 431 C4' DG B 10 16.329 -11.705 7.469 1.00 72.75 C ANISOU 431 C4' DG B 10 9054 9250 9338 -1616 428 -1593 C ATOM 432 O4' DG B 10 15.546 -10.613 7.997 1.00 67.68 O ANISOU 432 O4' DG B 10 8624 8927 8162 -1642 281 -1292 O ATOM 433 C3' DG B 10 15.484 -12.951 7.685 1.00 73.71 C ANISOU 433 C3' DG B 10 9081 9042 9882 -1664 375 -1585 C ATOM 434 O3' DG B 10 15.890 -13.450 8.946 1.00 76.24 O ANISOU 434 O3' DG B 10 9251 9079 10634 -1578 170 -1082 O ATOM 435 C2' DG B 10 14.056 -12.418 7.671 1.00 68.99 C ANISOU 435 C2' DG B 10 8685 8767 8761 -1787 284 -1482 C ATOM 436 C1' DG B 10 14.210 -11.040 8.298 1.00 65.78 C ANISOU 436 C1' DG B 10 8415 8676 7900 -1716 198 -1190 C ATOM 437 N9 DG B 10 13.311 -9.989 7.827 1.00 61.99 N ANISOU 437 N9 DG B 10 8068 8513 6971 -1771 164 -1215 N ATOM 438 C8 DG B 10 12.942 -9.728 6.528 1.00 63.75 C ANISOU 438 C8 DG B 10 8340 8929 6951 -1905 176 -1443 C ATOM 439 N7 DG B 10 12.187 -8.669 6.414 1.00 62.08 N ANISOU 439 N7 DG B 10 8175 8920 6490 -1914 44 -1267 N ATOM 440 C5 DG B 10 12.095 -8.173 7.707 1.00 57.82 C ANISOU 440 C5 DG B 10 7620 8308 6040 -1763 35 -1054 C ATOM 441 C6 DG B 10 11.411 -7.035 8.208 1.00 56.67 C ANISOU 441 C6 DG B 10 7440 8229 5862 -1689 -16 -925 C ATOM 442 O6 DG B 10 10.732 -6.205 7.586 1.00 58.87 O ANISOU 442 O6 DG B 10 7662 8564 6140 -1690 -140 -856 O ATOM 443 N1 DG B 10 11.563 -6.913 9.585 1.00 55.15 N ANISOU 443 N1 DG B 10 7233 8024 5698 -1647 79 -876 N ATOM 444 C2 DG B 10 12.290 -7.767 10.378 1.00 55.19 C ANISOU 444 C2 DG B 10 7257 7991 5722 -1697 110 -786 C ATOM 445 N2 DG B 10 12.321 -7.479 11.686 1.00 54.59 N ANISOU 445 N2 DG B 10 7169 8052 5518 -1776 160 -699 N ATOM 446 N3 DG B 10 12.931 -8.832 9.923 1.00 56.96 N ANISOU 446 N3 DG B 10 7466 8051 6123 -1708 85 -787 N ATOM 447 C4 DG B 10 12.790 -8.973 8.588 1.00 57.92 C ANISOU 447 C4 DG B 10 7602 8156 6247 -1724 97 -1000 C ATOM 448 P DG B 11 15.456 -14.823 9.514 1.00 84.80 P ANISOU 448 P DG B 11 10147 9686 12387 -1628 26 -823 P ATOM 449 OP1 DG B 11 16.568 -15.186 10.458 1.00 88.99 O ANISOU 449 OP1 DG B 11 10425 9925 13460 -1534 -203 -314 O ATOM 450 OP2 DG B 11 15.040 -15.753 8.428 1.00 84.81 O ANISOU 450 OP2 DG B 11 10051 9364 12806 -1688 231 -1403 O ATOM 451 O5' DG B 11 14.164 -14.438 10.353 1.00 79.71 O ANISOU 451 O5' DG B 11 9704 9405 11177 -1803 -115 -432 O ATOM 452 C5' DG B 11 14.303 -13.828 11.634 1.00 76.20 C ANISOU 452 C5' DG B 11 9322 9273 10358 -1881 -291 92 C ATOM 453 C4' DG B 11 12.947 -13.460 12.177 1.00 72.74 C ANISOU 453 C4' DG B 11 9019 9211 9408 -2073 -266 203 C ATOM 454 O4' DG B 11 12.379 -12.408 11.368 1.00 68.54 O ANISOU 454 O4' DG B 11 8633 8956 8450 -1983 -89 -231 O ATOM 455 C3' DG B 11 11.917 -14.598 12.179 1.00 74.37 C ANISOU 455 C3' DG B 11 9126 9178 9950 -2238 -300 307 C ATOM 456 O3' DG B 11 11.393 -14.752 13.498 1.00 77.21 O ANISOU 456 O3' DG B 11 9464 9800 10069 -2527 -417 844 O ATOM 457 C2' DG B 11 10.844 -14.125 11.208 1.00 71.38 C ANISOU 457 C2' DG B 11 8839 8992 9288 -2216 -126 -172 C ATOM 458 C1' DG B 11 10.995 -12.625 11.271 1.00 67.41 C ANISOU 458 C1' DG B 11 8475 8907 8230 -2106 -45 -290 C ATOM 459 N9 DG B 11 10.515 -11.884 10.115 1.00 63.65 N ANISOU 459 N9 DG B 11 8062 8569 7551 -2018 30 -671 N ATOM 460 C8 DG B 11 10.700 -12.195 8.791 1.00 62.97 C ANISOU 460 C8 DG B 11 7989 8365 7569 -2010 56 -1015 C ATOM 461 N7 DG B 11 10.184 -11.311 7.982 1.00 61.40 N ANISOU 461 N7 DG B 11 7845 8430 7054 -2020 36 -1162 N ATOM 462 C5 DG B 11 9.643 -10.349 8.822 1.00 58.36 C ANISOU 462 C5 DG B 11 7442 8228 6504 -1951 21 -952 C ATOM 463 C6 DG B 11 8.947 -9.153 8.519 1.00 57.08 C ANISOU 463 C6 DG B 11 7236 8255 6197 -1894 -33 -947 C ATOM 464 O6 DG B 11 8.669 -8.684 7.412 1.00 60.11 O ANISOU 464 O6 DG B 11 7612 8737 6488 -1932 -165 -988 O ATOM 465 N1 DG B 11 8.570 -8.473 9.672 1.00 55.87 N ANISOU 465 N1 DG B 11 7002 8178 6048 -1832 67 -869 N ATOM 466 C2 DG B 11 8.824 -8.895 10.954 1.00 57.62 C ANISOU 466 C2 DG B 11 7232 8444 6214 -1917 187 -769 C ATOM 467 N2 DG B 11 8.378 -8.105 11.936 1.00 58.43 N ANISOU 467 N2 DG B 11 7242 8733 6224 -1944 346 -834 N ATOM 468 N3 DG B 11 9.467 -10.013 11.249 1.00 59.29 N ANISOU 468 N3 DG B 11 7499 8529 6497 -2012 143 -610 N ATOM 469 C4 DG B 11 9.843 -10.686 10.142 1.00 60.50 C ANISOU 469 C4 DG B 11 7687 8463 6836 -1977 66 -726 C ATOM 470 P DC B 12 10.582 -16.028 13.954 1.00 80.38 P ANISOU 470 P DC B 12 9721 9965 10853 -2813 -542 1250 P ATOM 471 OP1 DC B 12 11.149 -16.503 15.249 1.00 83.37 O ANISOU 471 OP1 DC B 12 10002 10393 11279 -3093 -838 2044 O ATOM 472 OP2 DC B 12 10.521 -16.936 12.781 1.00 83.65 O ANISOU 472 OP2 DC B 12 10033 9774 11974 -2664 -507 869 O ATOM 473 O5' DC B 12 9.113 -15.473 14.205 1.00 79.45 O ANISOU 473 O5' DC B 12 9658 10366 10160 -3010 -332 1092 O ATOM 474 C5' DC B 12 8.861 -14.553 15.274 1.00 78.21 C ANISOU 474 C5' DC B 12 9558 10847 9308 -3216 -216 1212 C ATOM 475 C4' DC B 12 7.778 -13.573 14.886 1.00 74.38 C ANISOU 475 C4' DC B 12 9069 10683 8509 -3121 75 684 C ATOM 476 O4' DC B 12 8.015 -13.030 13.577 1.00 69.59 O ANISOU 476 O4' DC B 12 8530 9838 8071 -2742 90 228 O ATOM 477 C3' DC B 12 6.375 -14.158 14.810 1.00 75.10 C ANISOU 477 C3' DC B 12 8991 10813 8729 -3320 169 670 C ATOM 478 O3' DC B 12 5.703 -14.072 16.075 1.00 79.75 O ANISOU 478 O3' DC B 12 9476 11931 8894 -3734 342 891 O ATOM 479 C2' DC B 12 5.689 -13.300 13.752 1.00 71.44 C ANISOU 479 C2' DC B 12 8479 10367 8297 -3031 295 128 C ATOM 480 C1' DC B 12 6.803 -12.421 13.184 1.00 67.45 C ANISOU 480 C1' DC B 12 8153 9763 7712 -2705 245 -84 C ATOM 481 N1 DC B 12 6.804 -12.286 11.709 1.00 64.07 N ANISOU 481 N1 DC B 12 7758 9102 7482 -2476 153 -390 N ATOM 482 C2 DC B 12 6.288 -11.114 11.138 1.00 61.94 C ANISOU 482 C2 DC B 12 7431 8996 7107 -2312 189 -632 C ATOM 483 O2 DC B 12 5.852 -10.223 11.886 1.00 61.70 O ANISOU 483 O2 DC B 12 7290 9196 6955 -2295 350 -688 O ATOM 484 N3 DC B 12 6.283 -10.981 9.792 1.00 59.89 N ANISOU 484 N3 DC B 12 7203 8644 6907 -2224 43 -800 N ATOM 485 C4 DC B 12 6.756 -11.966 9.022 1.00 61.15 C ANISOU 485 C4 DC B 12 7453 8593 7186 -2304 -36 -896 C ATOM 486 N4 DC B 12 6.725 -11.794 7.696 1.00 61.63 N ANISOU 486 N4 DC B 12 7550 8713 7153 -2338 -148 -1112 N ATOM 487 C5 DC B 12 7.283 -13.169 9.576 1.00 62.06 C ANISOU 487 C5 DC B 12 7588 8425 7566 -2399 -12 -774 C ATOM 488 C6 DC B 12 7.282 -13.288 10.911 1.00 63.63 C ANISOU 488 C6 DC B 12 7750 8688 7739 -2477 34 -439 C TER 489 DC B 12 ATOM 490 N ASN C 59 24.067 -18.488 10.853 1.00108.26 N ANISOU 490 N ASN C 59 19356 10451 11324 3330 1326 -5020 N ATOM 491 CA ASN C 59 23.107 -18.172 11.939 1.00102.47 C ANISOU 491 CA ASN C 59 18574 9425 10934 2713 925 -4602 C ATOM 492 C ASN C 59 22.073 -17.120 11.505 1.00 97.80 C ANISOU 492 C ASN C 59 17817 9160 10181 1965 861 -4342 C ATOM 493 O ASN C 59 22.106 -16.620 10.359 1.00 99.03 O ANISOU 493 O ASN C 59 17938 9744 9942 1898 1094 -4457 O ATOM 494 CB ASN C 59 23.860 -17.715 13.220 1.00 99.23 C ANISOU 494 CB ASN C 59 17525 9195 10982 2907 929 -4265 C ATOM 495 CG ASN C 59 24.187 -18.878 14.158 1.00102.90 C ANISOU 495 CG ASN C 59 18370 9012 11711 3369 675 -4352 C ATOM 496 OD1 ASN C 59 24.800 -19.868 13.753 1.00110.59 O ANISOU 496 OD1 ASN C 59 19725 9711 12581 4006 744 -4740 O ATOM 497 ND2 ASN C 59 23.779 -18.759 15.410 1.00 99.34 N ANISOU 497 ND2 ASN C 59 17867 8304 11572 3081 384 -3990 N ATOM 498 N LYS C 60 21.149 -16.809 12.420 1.00 91.27 N ANISOU 498 N LYS C 60 16916 8128 9633 1442 549 -3992 N ATOM 499 CA LYS C 60 20.068 -15.894 12.151 1.00 86.50 C ANISOU 499 CA LYS C 60 16160 7767 8939 797 424 -3741 C ATOM 500 C LYS C 60 20.226 -14.664 13.015 1.00 81.19 C ANISOU 500 C LYS C 60 14815 7481 8552 628 493 -3303 C ATOM 501 O LYS C 60 21.105 -14.597 13.903 1.00 79.69 O ANISOU 501 O LYS C 60 14307 7330 8641 945 580 -3192 O ATOM 502 CB LYS C 60 18.715 -16.561 12.443 1.00 86.10 C ANISOU 502 CB LYS C 60 16573 7181 8959 300 8 -3718 C ATOM 503 N LYS C 61 19.368 -13.694 12.773 1.00 76.62 N ANISOU 503 N LYS C 61 14047 7164 7900 149 412 -3065 N ATOM 504 CA LYS C 61 19.381 -12.496 13.525 1.00 71.48 C ANISOU 504 CA LYS C 61 12872 6808 7479 -28 440 -2682 C ATOM 505 C LYS C 61 19.110 -12.826 14.995 1.00 69.10 C ANISOU 505 C LYS C 61 12554 6151 7550 -72 243 -2498 C ATOM 506 O LYS C 61 18.438 -13.804 15.311 1.00 68.89 O ANISOU 506 O LYS C 61 12928 5667 7578 -187 35 -2578 O ATOM 507 CB LYS C 61 18.339 -11.532 13.006 1.00 69.60 C ANISOU 507 CB LYS C 61 12546 6807 7091 -482 323 -2485 C ATOM 508 CG LYS C 61 18.330 -11.359 11.476 1.00 73.58 C ANISOU 508 CG LYS C 61 13243 7584 7129 -510 430 -2662 C ATOM 509 CD LYS C 61 17.665 -10.054 11.020 1.00 72.63 C ANISOU 509 CD LYS C 61 12921 7803 6871 -849 357 -2374 C ATOM 510 CE LYS C 61 16.645 -9.518 12.044 1.00 69.49 C ANISOU 510 CE LYS C 61 12298 7293 6810 -1139 89 -2073 C ATOM 511 NZ LYS C 61 15.833 -8.405 11.510 1.00 69.45 N ANISOU 511 NZ LYS C 61 12183 7546 6657 -1399 -55 -1843 N ATOM 512 N ARG C 62 19.655 -12.014 15.878 1.00 66.13 N ANISOU 512 N ARG C 62 11754 5973 7396 -5 305 -2249 N ATOM 513 CA ARG C 62 19.467 -12.205 17.312 1.00 64.85 C ANISOU 513 CA ARG C 62 11594 5529 7516 -25 138 -2054 C ATOM 514 C ARG C 62 18.142 -11.595 17.760 1.00 62.07 C ANISOU 514 C ARG C 62 11198 5173 7211 -488 -4 -1801 C ATOM 515 O ARG C 62 17.684 -10.588 17.183 1.00 59.44 O ANISOU 515 O ARG C 62 10651 5158 6773 -710 26 -1698 O ATOM 516 CB ARG C 62 20.619 -11.554 18.084 1.00 63.42 C ANISOU 516 CB ARG C 62 10995 5578 7522 238 215 -1917 C ATOM 517 CG ARG C 62 21.954 -12.246 17.878 1.00 67.66 C ANISOU 517 CG ARG C 62 11471 6144 8091 765 336 -2147 C ATOM 518 CD ARG C 62 23.038 -11.608 18.724 1.00 67.69 C ANISOU 518 CD ARG C 62 10995 6402 8322 966 333 -1991 C ATOM 519 NE ARG C 62 23.220 -10.197 18.390 1.00 65.78 N ANISOU 519 NE ARG C 62 10311 6625 8056 681 465 -1815 N ATOM 520 CZ ARG C 62 24.047 -9.364 19.023 1.00 66.14 C ANISOU 520 CZ ARG C 62 9914 6929 8286 686 434 -1651 C ATOM 521 NH1 ARG C 62 24.126 -8.088 18.638 1.00 65.04 N ANISOU 521 NH1 ARG C 62 9476 7130 8106 360 539 -1483 N ATOM 522 NH2 ARG C 62 24.788 -9.786 20.040 1.00 68.09 N ANISOU 522 NH2 ARG C 62 10051 7070 8749 996 256 -1644 N ATOM 523 N LYS C 63 17.538 -12.194 18.799 1.00 63.07 N ANISOU 523 N LYS C 63 11528 4949 7483 -608 -148 -1685 N ATOM 524 CA LYS C 63 16.305 -11.662 19.408 1.00 61.75 C ANISOU 524 CA LYS C 63 11252 4824 7383 -993 -225 -1435 C ATOM 525 C LYS C 63 16.601 -11.049 20.777 1.00 60.52 C ANISOU 525 C LYS C 63 10921 4701 7371 -891 -208 -1197 C ATOM 526 O LYS C 63 17.575 -11.397 21.426 1.00 61.73 O ANISOU 526 O LYS C 63 11143 4714 7596 -587 -223 -1212 O ATOM 527 CB LYS C 63 15.210 -12.764 19.542 1.00 63.58 C ANISOU 527 CB LYS C 63 11834 4689 7634 -1322 -363 -1447 C ATOM 528 CG LYS C 63 14.840 -13.515 18.222 1.00 66.73 C ANISOU 528 CG LYS C 63 12518 4967 7867 -1473 -467 -1726 C ATOM 529 CD LYS C 63 13.502 -14.270 18.321 1.00 67.91 C ANISOU 529 CD LYS C 63 12874 4859 8066 -1981 -651 -1675 C ATOM 530 CE LYS C 63 13.370 -15.369 17.262 1.00 73.59 C ANISOU 530 CE LYS C 63 14078 5252 8631 -2093 -826 -2003 C ATOM 531 N ARG C 64 15.750 -10.115 21.194 1.00 59.22 N ANISOU 531 N ARG C 64 10541 4731 7227 -1111 -198 -993 N ATOM 532 CA ARG C 64 15.801 -9.532 22.548 1.00 58.17 C ANISOU 532 CA ARG C 64 10330 4603 7166 -1045 -188 -786 C ATOM 533 C ARG C 64 15.807 -10.631 23.623 1.00 59.65 C ANISOU 533 C ARG C 64 10858 4418 7387 -1010 -232 -718 C ATOM 534 O ARG C 64 15.344 -11.722 23.382 1.00 59.54 O ANISOU 534 O ARG C 64 11117 4133 7369 -1166 -267 -772 O ATOM 535 CB ARG C 64 14.584 -8.625 22.765 1.00 58.91 C ANISOU 535 CB ARG C 64 10221 4910 7249 -1273 -148 -620 C ATOM 536 CG ARG C 64 13.242 -9.390 22.776 1.00 63.76 C ANISOU 536 CG ARG C 64 10905 5440 7879 -1605 -145 -564 C ATOM 537 CD ARG C 64 12.066 -8.449 22.554 1.00 65.55 C ANISOU 537 CD ARG C 64 10799 5993 8112 -1767 -119 -455 C ATOM 538 NE ARG C 64 11.771 -7.663 23.743 1.00 66.60 N ANISOU 538 NE ARG C 64 10825 6227 8250 -1657 -2 -282 N ATOM 539 CZ ARG C 64 11.126 -8.131 24.825 1.00 73.27 C ANISOU 539 CZ ARG C 64 11738 7003 9096 -1774 124 -135 C ATOM 540 NH1 ARG C 64 10.713 -9.396 24.877 1.00 76.07 N ANISOU 540 NH1 ARG C 64 12268 7150 9484 -2063 128 -108 N ATOM 541 NH2 ARG C 64 10.906 -7.324 25.870 1.00 75.65 N ANISOU 541 NH2 ARG C 64 11981 7425 9338 -1613 256 -12 N ATOM 542 N CYS C 65 16.298 -10.307 24.820 1.00 58.37 N ANISOU 542 N CYS C 65 10727 4218 7231 -834 -259 -584 N ATOM 543 CA CYS C 65 16.459 -11.315 25.863 1.00 60.23 C ANISOU 543 CA CYS C 65 11349 4087 7448 -751 -329 -488 C ATOM 544 C CYS C 65 15.214 -11.460 26.718 1.00 59.13 C ANISOU 544 C CYS C 65 11352 3880 7233 -1067 -221 -260 C ATOM 545 O CYS C 65 14.926 -12.526 27.182 1.00 60.46 O ANISOU 545 O CYS C 65 11890 3711 7370 -1188 -236 -165 O ATOM 546 CB CYS C 65 17.682 -11.008 26.733 1.00 62.17 C ANISOU 546 CB CYS C 65 11598 4325 7696 -385 -465 -459 C ATOM 547 SG CYS C 65 17.427 -9.846 28.056 1.00 60.17 S ANISOU 547 SG CYS C 65 11294 4241 7325 -409 -462 -258 S ATOM 548 N GLY C 66 14.488 -10.371 26.923 1.00 57.52 N ANISOU 548 N GLY C 66 10859 4001 6993 -1187 -97 -166 N ATOM 549 CA GLY C 66 13.192 -10.428 27.618 1.00 59.05 C ANISOU 549 CA GLY C 66 11063 4254 7119 -1478 83 36 C ATOM 550 C GLY C 66 13.279 -10.211 29.110 1.00 61.43 C ANISOU 550 C GLY C 66 11584 4509 7245 -1349 157 221 C ATOM 551 O GLY C 66 12.255 -10.119 29.783 1.00 64.41 O ANISOU 551 O GLY C 66 11939 5012 7522 -1542 378 396 O ATOM 552 N VAL C 67 14.499 -10.099 29.635 1.00 60.58 N ANISOU 552 N VAL C 67 11668 4265 7083 -1015 -25 179 N ATOM 553 CA VAL C 67 14.718 -10.147 31.084 1.00 61.54 C ANISOU 553 CA VAL C 67 12141 4260 6980 -880 -38 348 C ATOM 554 C VAL C 67 15.616 -9.029 31.660 1.00 60.26 C ANISOU 554 C VAL C 67 11930 4232 6731 -563 -208 276 C ATOM 555 O VAL C 67 15.758 -8.909 32.875 1.00 65.06 O ANISOU 555 O VAL C 67 12851 4771 7096 -442 -247 390 O ATOM 556 CB VAL C 67 15.262 -11.543 31.495 1.00 63.90 C ANISOU 556 CB VAL C 67 12925 4114 7239 -822 -193 437 C ATOM 557 CG1 VAL C 67 14.259 -12.652 31.114 1.00 64.80 C ANISOU 557 CG1 VAL C 67 13198 4016 7404 -1231 -38 542 C ATOM 558 CG2 VAL C 67 16.614 -11.821 30.856 1.00 63.86 C ANISOU 558 CG2 VAL C 67 12877 3980 7405 -487 -483 231 C ATOM 559 N CYS C 68 16.213 -8.236 30.802 1.00 57.07 N ANISOU 559 N CYS C 68 11180 4004 6499 -469 -320 97 N ATOM 560 CA CYS C 68 16.989 -7.102 31.229 1.00 57.41 C ANISOU 560 CA CYS C 68 11150 4163 6498 -280 -498 29 C ATOM 561 C CYS C 68 16.010 -5.929 31.447 1.00 55.58 C ANISOU 561 C CYS C 68 10829 4134 6153 -351 -308 49 C ATOM 562 O CYS C 68 14.845 -5.991 31.003 1.00 55.49 O ANISOU 562 O CYS C 68 10666 4247 6168 -523 -53 96 O ATOM 563 CB CYS C 68 18.059 -6.748 30.167 1.00 57.66 C ANISOU 563 CB CYS C 68 10834 4304 6767 -210 -666 -136 C ATOM 564 SG CYS C 68 17.431 -6.064 28.617 1.00 55.02 S ANISOU 564 SG CYS C 68 10107 4215 6582 -416 -479 -223 S ATOM 565 N VAL C 69 16.451 -4.890 32.128 1.00 53.58 N ANISOU 565 N VAL C 69 10674 3906 5778 -205 -454 2 N ATOM 566 CA VAL C 69 15.541 -3.793 32.453 1.00 54.87 C ANISOU 566 CA VAL C 69 10849 4199 5798 -174 -282 -6 C ATOM 567 C VAL C 69 14.928 -3.154 31.184 1.00 55.29 C ANISOU 567 C VAL C 69 10517 4430 6059 -277 -166 -59 C ATOM 568 O VAL C 69 13.722 -2.904 31.148 1.00 58.16 O ANISOU 568 O VAL C 69 10776 4946 6376 -286 83 -14 O ATOM 569 CB VAL C 69 16.214 -2.744 33.354 1.00 54.43 C ANISOU 569 CB VAL C 69 11056 4062 5563 0 -526 -93 C ATOM 570 CG1 VAL C 69 15.507 -1.380 33.261 1.00 54.26 C ANISOU 570 CG1 VAL C 69 11009 4121 5485 77 -422 -174 C ATOM 571 CG2 VAL C 69 16.230 -3.255 34.783 1.00 57.47 C ANISOU 571 CG2 VAL C 69 11905 4330 5600 123 -539 -9 C ATOM 572 N PRO C 70 15.754 -2.894 30.147 1.00 54.37 N ANISOU 572 N PRO C 70 10176 4327 6154 -341 -345 -140 N ATOM 573 CA PRO C 70 15.163 -2.319 28.907 1.00 52.12 C ANISOU 573 CA PRO C 70 9599 4199 6005 -440 -258 -159 C ATOM 574 C PRO C 70 14.116 -3.209 28.248 1.00 52.10 C ANISOU 574 C PRO C 70 9417 4314 6064 -588 -55 -109 C ATOM 575 O PRO C 70 13.068 -2.710 27.798 1.00 52.18 O ANISOU 575 O PRO C 70 9243 4490 6091 -606 57 -82 O ATOM 576 CB PRO C 70 16.384 -2.145 27.991 1.00 52.16 C ANISOU 576 CB PRO C 70 9441 4207 6169 -516 -443 -225 C ATOM 577 CG PRO C 70 17.509 -1.860 28.924 1.00 53.33 C ANISOU 577 CG PRO C 70 9752 4233 6279 -429 -677 -258 C ATOM 578 CD PRO C 70 17.220 -2.684 30.196 1.00 55.32 C ANISOU 578 CD PRO C 70 10299 4366 6351 -304 -644 -210 C ATOM 579 N CYS C 71 14.384 -4.517 28.203 1.00 49.91 N ANISOU 579 N CYS C 71 9206 3932 5824 -686 -47 -98 N ATOM 580 CA CYS C 71 13.443 -5.456 27.634 1.00 51.12 C ANISOU 580 CA CYS C 71 9256 4131 6036 -899 89 -61 C ATOM 581 C CYS C 71 12.125 -5.433 28.390 1.00 53.74 C ANISOU 581 C CYS C 71 9556 4588 6275 -967 320 69 C ATOM 582 O CYS C 71 11.056 -5.640 27.795 1.00 55.61 O ANISOU 582 O CYS C 71 9534 5002 6592 -1159 426 105 O ATOM 583 CB CYS C 71 14.024 -6.891 27.617 1.00 53.70 C ANISOU 583 CB CYS C 71 9793 4211 6398 -966 28 -79 C ATOM 584 SG CYS C 71 15.140 -7.238 26.205 1.00 48.79 S ANISOU 584 SG CYS C 71 9066 3559 5911 -917 -123 -273 S ATOM 585 N LEU C 72 12.192 -5.197 29.699 1.00 54.73 N ANISOU 585 N LEU C 72 9925 4657 6213 -814 398 139 N ATOM 586 CA LEU C 72 10.990 -5.185 30.531 1.00 57.01 C ANISOU 586 CA LEU C 72 10185 5114 6360 -847 699 270 C ATOM 587 C LEU C 72 10.190 -3.894 30.428 1.00 57.99 C ANISOU 587 C LEU C 72 10046 5511 6474 -650 811 226 C ATOM 588 O LEU C 72 9.049 -3.861 30.878 1.00 63.27 O ANISOU 588 O LEU C 72 10538 6424 7076 -655 1102 317 O ATOM 589 CB LEU C 72 11.341 -5.480 31.987 1.00 56.91 C ANISOU 589 CB LEU C 72 10611 4944 6067 -736 768 365 C ATOM 590 CG LEU C 72 11.845 -6.911 32.181 1.00 58.24 C ANISOU 590 CG LEU C 72 11071 4824 6230 -921 686 468 C ATOM 591 CD1 LEU C 72 12.504 -7.085 33.543 1.00 60.14 C ANISOU 591 CD1 LEU C 72 11815 4865 6167 -739 621 553 C ATOM 592 CD2 LEU C 72 10.727 -7.939 31.987 1.00 59.92 C ANISOU 592 CD2 LEU C 72 11169 5088 6508 -1307 933 632 C ATOM 593 N ARG C 73 10.767 -2.839 29.831 1.00 57.90 N ANISOU 593 N ARG C 73 10005 5461 6532 -472 591 98 N ATOM 594 CA ARG C 73 10.046 -1.558 29.680 1.00 59.91 C ANISOU 594 CA ARG C 73 10094 5888 6779 -226 640 54 C ATOM 595 C ARG C 73 8.807 -1.724 28.830 1.00 62.19 C ANISOU 595 C ARG C 73 9914 6484 7231 -338 756 113 C ATOM 596 O ARG C 73 8.887 -2.242 27.728 1.00 62.47 O ANISOU 596 O ARG C 73 9772 6533 7428 -580 611 110 O ATOM 597 CB ARG C 73 10.927 -0.498 29.055 1.00 59.03 C ANISOU 597 CB ARG C 73 10088 5611 6727 -111 349 -48 C ATOM 598 CG ARG C 73 11.827 0.219 30.039 1.00 60.93 C ANISOU 598 CG ARG C 73 10743 5609 6796 73 212 -129 C ATOM 599 CD ARG C 73 12.468 1.456 29.417 1.00 61.63 C ANISOU 599 CD ARG C 73 10918 5538 6958 131 -56 -200 C ATOM 600 NE ARG C 73 11.480 2.397 28.839 1.00 62.49 N ANISOU 600 NE ARG C 73 10891 5742 7107 326 -12 -194 N ATOM 601 CZ ARG C 73 11.125 3.588 29.355 1.00 65.30 C ANISOU 601 CZ ARG C 73 11493 5973 7343 655 -36 -269 C ATOM 602 NH1 ARG C 73 11.660 4.069 30.485 1.00 67.57 N ANISOU 602 NH1 ARG C 73 12217 6025 7429 799 -110 -378 N ATOM 603 NH2 ARG C 73 10.220 4.313 28.724 1.00 69.88 N ANISOU 603 NH2 ARG C 73 11917 6644 7989 874 -22 -249 N ATOM 604 N LYS C 74 7.665 -1.275 29.357 1.00 66.60 N ANISOU 604 N LYS C 74 10262 7312 7731 -140 1009 152 N ATOM 605 CA LYS C 74 6.363 -1.385 28.660 1.00 70.77 C ANISOU 605 CA LYS C 74 10234 8217 8434 -220 1106 219 C ATOM 606 C LYS C 74 6.222 -0.377 27.492 1.00 71.48 C ANISOU 606 C LYS C 74 10147 8354 8658 -24 829 154 C ATOM 607 O LYS C 74 5.742 -0.736 26.441 1.00 74.65 O ANISOU 607 O LYS C 74 10215 8926 9222 -235 690 188 O ATOM 608 CB LYS C 74 5.184 -1.208 29.656 1.00 74.89 C ANISOU 608 CB LYS C 74 10506 9093 8855 -18 1515 288 C ATOM 609 CG LYS C 74 5.008 -2.369 30.655 1.00 75.92 C ANISOU 609 CG LYS C 74 10728 9267 8849 -327 1843 433 C ATOM 610 N GLU C 75 6.658 0.869 27.696 1.00 70.64 N ANISOU 610 N GLU C 75 10328 8056 8453 358 720 69 N ATOM 611 CA GLU C 75 6.411 1.959 26.725 1.00 71.09 C ANISOU 611 CA GLU C 75 10299 8115 8596 601 472 49 C ATOM 612 C GLU C 75 7.708 2.578 26.204 1.00 65.75 C ANISOU 612 C GLU C 75 10051 7046 7882 549 172 7 C ATOM 613 O GLU C 75 8.722 2.554 26.886 1.00 61.20 O ANISOU 613 O GLU C 75 9840 6207 7205 488 162 -47 O ATOM 614 CB GLU C 75 5.585 3.067 27.387 1.00 77.44 C ANISOU 614 CB GLU C 75 11078 9019 9326 1155 608 0 C ATOM 615 CG GLU C 75 4.212 2.628 27.925 1.00 84.75 C ANISOU 615 CG GLU C 75 11471 10438 10292 1271 971 52 C ATOM 616 CD GLU C 75 3.143 2.462 26.831 1.00 89.22 C ANISOU 616 CD GLU C 75 11394 11405 11100 1209 847 140 C ATOM 617 OE1 GLU C 75 1.977 2.170 27.187 1.00 94.07 O ANISOU 617 OE1 GLU C 75 11454 12488 11797 1283 1123 196 O ATOM 618 OE2 GLU C 75 3.463 2.626 25.623 1.00 89.34 O ANISOU 618 OE2 GLU C 75 11441 11295 11206 1076 473 161 O ATOM 619 N PRO C 76 7.680 3.148 24.987 1.00 65.31 N ANISOU 619 N PRO C 76 9943 6974 7897 552 -81 51 N ATOM 620 CA PRO C 76 8.858 3.970 24.567 1.00 64.21 C ANISOU 620 CA PRO C 76 10222 6471 7703 505 -321 49 C ATOM 621 C PRO C 76 9.083 5.192 25.500 1.00 63.29 C ANISOU 621 C PRO C 76 10522 6042 7480 855 -358 -22 C ATOM 622 O PRO C 76 8.161 5.632 26.172 1.00 63.69 O ANISOU 622 O PRO C 76 10531 6180 7488 1256 -225 -74 O ATOM 623 CB PRO C 76 8.500 4.408 23.130 1.00 65.43 C ANISOU 623 CB PRO C 76 10261 6702 7895 489 -552 151 C ATOM 624 CG PRO C 76 7.017 4.134 22.981 1.00 68.20 C ANISOU 624 CG PRO C 76 10140 7438 8333 676 -492 177 C ATOM 625 CD PRO C 76 6.703 2.983 23.896 1.00 67.42 C ANISOU 625 CD PRO C 76 9793 7546 8275 521 -192 126 C ATOM 626 N CYS C 77 10.309 5.698 25.550 1.00 61.51 N ANISOU 626 N CYS C 77 10686 5472 7212 693 -533 -39 N ATOM 627 CA CYS C 77 10.650 6.752 26.517 1.00 60.93 C ANISOU 627 CA CYS C 77 11088 5039 7022 938 -622 -141 C ATOM 628 C CYS C 77 10.188 8.101 26.031 1.00 61.14 C ANISOU 628 C CYS C 77 11365 4826 7038 1249 -818 -106 C ATOM 629 O CYS C 77 9.980 8.988 26.821 1.00 63.41 O ANISOU 629 O CYS C 77 12025 4847 7218 1611 -856 -222 O ATOM 630 CB CYS C 77 12.151 6.778 26.784 1.00 61.20 C ANISOU 630 CB CYS C 77 11404 4804 7042 586 -790 -168 C ATOM 631 SG CYS C 77 13.095 7.769 25.621 1.00 59.40 S ANISOU 631 SG CYS C 77 11397 4283 6887 277 -1098 -30 S ATOM 632 N GLY C 78 10.061 8.259 24.721 1.00 59.86 N ANISOU 632 N GLY C 78 11065 4723 6955 1123 -964 52 N ATOM 633 CA GLY C 78 9.472 9.485 24.135 1.00 63.79 C ANISOU 633 CA GLY C 78 11803 4997 7436 1466 -1184 133 C ATOM 634 C GLY C 78 10.412 10.675 23.984 1.00 65.69 C ANISOU 634 C GLY C 78 12664 4673 7621 1330 -1470 192 C ATOM 635 O GLY C 78 10.022 11.689 23.451 1.00 69.46 O ANISOU 635 O GLY C 78 13439 4880 8072 1579 -1687 292 O ATOM 636 N ALA C 79 11.659 10.540 24.437 1.00 64.54 N ANISOU 636 N ALA C 79 12708 4344 7468 913 -1497 149 N ATOM 637 CA ALA C 79 12.613 11.674 24.454 1.00 66.14 C ANISOU 637 CA ALA C 79 13490 3999 7641 686 -1782 198 C ATOM 638 C ALA C 79 14.024 11.363 23.893 1.00 64.56 C ANISOU 638 C ALA C 79 13200 3822 7508 1 -1833 332 C ATOM 639 O ALA C 79 14.785 12.264 23.670 1.00 68.35 O ANISOU 639 O ALA C 79 14066 3912 7988 -296 -2057 440 O ATOM 640 CB ALA C 79 12.729 12.234 25.878 1.00 67.67 C ANISOU 640 CB ALA C 79 14130 3839 7740 938 -1852 -42 C ATOM 641 N CYS C 80 14.377 10.104 23.670 1.00 61.45 N ANISOU 641 N CYS C 80 12298 3875 7173 -242 -1621 327 N ATOM 642 CA CYS C 80 15.676 9.825 23.064 1.00 61.84 C ANISOU 642 CA CYS C 80 12200 4010 7286 -802 -1627 444 C ATOM 643 C CYS C 80 15.646 10.205 21.593 1.00 63.74 C ANISOU 643 C CYS C 80 12463 4284 7470 -1000 -1649 697 C ATOM 644 O CYS C 80 14.586 10.562 21.047 1.00 65.72 O ANISOU 644 O CYS C 80 12817 4511 7641 -685 -1702 776 O ATOM 645 CB CYS C 80 16.073 8.366 23.244 1.00 59.30 C ANISOU 645 CB CYS C 80 11387 4113 7029 -917 -1403 342 C ATOM 646 SG CYS C 80 15.067 7.196 22.368 1.00 56.43 S ANISOU 646 SG CYS C 80 10600 4201 6638 -762 -1166 356 S ATOM 647 N TYR C 81 16.802 10.156 20.947 1.00 65.26 N ANISOU 647 N TYR C 81 12556 4556 7683 -1507 -1613 837 N ATOM 648 CA TYR C 81 16.901 10.574 19.536 1.00 68.79 C ANISOU 648 CA TYR C 81 13098 5035 8002 -1756 -1604 1112 C ATOM 649 C TYR C 81 15.995 9.725 18.636 1.00 66.80 C ANISOU 649 C TYR C 81 12570 5179 7632 -1530 -1457 1117 C ATOM 650 O TYR C 81 15.392 10.223 17.692 1.00 73.18 O ANISOU 650 O TYR C 81 13586 5937 8280 -1452 -1557 1303 O ATOM 651 CB TYR C 81 18.344 10.463 19.065 1.00 71.58 C ANISOU 651 CB TYR C 81 13263 5543 8391 -2343 -1483 1239 C ATOM 652 CG TYR C 81 18.542 10.845 17.628 1.00 75.02 C ANISOU 652 CG TYR C 81 13813 6058 8631 -2647 -1401 1542 C ATOM 653 CD1 TYR C 81 18.818 12.149 17.276 1.00 79.49 C ANISOU 653 CD1 TYR C 81 14875 6198 9128 -2943 -1589 1822 C ATOM 654 CD2 TYR C 81 18.447 9.888 16.612 1.00 75.44 C ANISOU 654 CD2 TYR C 81 13547 6589 8528 -2646 -1142 1553 C ATOM 655 CE1 TYR C 81 18.999 12.510 15.955 1.00 84.41 C ANISOU 655 CE1 TYR C 81 15665 6891 9513 -3244 -1498 2146 C ATOM 656 CE2 TYR C 81 18.621 10.236 15.284 1.00 79.30 C ANISOU 656 CE2 TYR C 81 14201 7172 8755 -2912 -1052 1833 C ATOM 657 CZ TYR C 81 18.903 11.551 14.962 1.00 82.91 C ANISOU 657 CZ TYR C 81 15143 7227 9129 -3218 -1216 2150 C ATOM 658 OH TYR C 81 19.085 11.913 13.647 1.00 88.13 O ANISOU 658 OH TYR C 81 16028 7977 9478 -3509 -1110 2474 O ATOM 659 N ASN C 82 15.906 8.450 18.941 1.00 62.58 N ANISOU 659 N ASN C 82 11609 5003 7163 -1438 -1264 916 N ATOM 660 CA ASN C 82 15.116 7.524 18.128 1.00 61.40 C ANISOU 660 CA ASN C 82 11200 5215 6915 -1304 -1156 884 C ATOM 661 C ASN C 82 13.586 7.665 18.339 1.00 62.00 C ANISOU 661 C ASN C 82 11282 5280 6994 -848 -1288 841 C ATOM 662 O ASN C 82 12.811 7.485 17.395 1.00 63.49 O ANISOU 662 O ASN C 82 11399 5661 7063 -759 -1354 914 O ATOM 663 CB ASN C 82 15.595 6.093 18.365 1.00 57.63 C ANISOU 663 CB ASN C 82 10329 5053 6514 -1394 -928 688 C ATOM 664 CG ASN C 82 17.076 5.902 17.997 1.00 58.35 C ANISOU 664 CG ASN C 82 10307 5257 6606 -1772 -776 727 C ATOM 665 OD1 ASN C 82 17.648 6.693 17.240 1.00 65.35 O ANISOU 665 OD1 ASN C 82 11357 6089 7384 -2045 -782 934 O ATOM 666 ND2 ASN C 82 17.691 4.874 18.531 1.00 54.60 N ANISOU 666 ND2 ASN C 82 9545 4946 6251 -1779 -636 548 N ATOM 667 N CYS C 83 13.163 7.993 19.565 1.00 61.32 N ANISOU 667 N CYS C 83 11265 5005 7028 -552 -1327 718 N ATOM 668 CA CYS C 83 11.751 8.308 19.839 1.00 62.58 C ANISOU 668 CA CYS C 83 11395 5177 7204 -68 -1416 684 C ATOM 669 C CYS C 83 11.331 9.604 19.156 1.00 65.81 C ANISOU 669 C CYS C 83 12189 5301 7515 125 -1685 881 C ATOM 670 O CYS C 83 10.267 9.666 18.547 1.00 68.87 O ANISOU 670 O CYS C 83 12451 5854 7862 411 -1807 946 O ATOM 671 CB CYS C 83 11.493 8.418 21.347 1.00 65.53 C ANISOU 671 CB CYS C 83 11812 5419 7667 228 -1337 497 C ATOM 672 SG CYS C 83 11.397 6.819 22.196 1.00 59.61 S ANISOU 672 SG CYS C 83 10611 5039 6999 158 -1040 309 S ATOM 673 N VAL C 84 12.169 10.637 19.256 1.00 66.13 N ANISOU 673 N VAL C 84 12709 4894 7520 -44 -1816 987 N ATOM 674 CA VAL C 84 11.852 11.952 18.637 1.00 70.79 C ANISOU 674 CA VAL C 84 13806 5086 8002 120 -2106 1208 C ATOM 675 C VAL C 84 11.754 11.829 17.108 1.00 71.68 C ANISOU 675 C VAL C 84 13898 5406 7928 -77 -2179 1459 C ATOM 676 O VAL C 84 10.960 12.526 16.481 1.00 74.33 O ANISOU 676 O VAL C 84 14476 5607 8157 235 -2434 1625 O ATOM 677 CB VAL C 84 12.895 13.030 19.028 1.00 73.28 C ANISOU 677 CB VAL C 84 14690 4831 8320 -168 -2244 1291 C ATOM 678 CG1 VAL C 84 12.667 14.334 18.273 1.00 78.80 C ANISOU 678 CG1 VAL C 84 16003 5050 8886 -83 -2554 1571 C ATOM 679 CG2 VAL C 84 12.853 13.289 20.534 1.00 73.64 C ANISOU 679 CG2 VAL C 84 14883 4618 8479 108 -2252 1019 C ATOM 680 N ASN C 85 12.560 10.925 16.528 1.00 69.68 N ANISOU 680 N ASN C 85 13378 5486 7608 -550 -1962 1473 N ATOM 681 CA ASN C 85 12.541 10.647 15.080 1.00 71.93 C ANISOU 681 CA ASN C 85 13659 6029 7641 -757 -1976 1666 C ATOM 682 C ASN C 85 11.798 9.353 14.725 1.00 69.38 C ANISOU 682 C ASN C 85 12838 6222 7302 -641 -1892 1492 C ATOM 683 O ASN C 85 12.171 8.673 13.773 1.00 68.86 O ANISOU 683 O ASN C 85 12684 6440 7038 -927 -1781 1521 O ATOM 684 CB ASN C 85 13.967 10.572 14.539 1.00 73.13 C ANISOU 684 CB ASN C 85 13896 6216 7674 -1351 -1763 1799 C ATOM 685 CG ASN C 85 14.748 11.844 14.775 1.00 80.32 C ANISOU 685 CG ASN C 85 15294 6619 8604 -1609 -1872 2012 C ATOM 686 OD1 ASN C 85 14.290 12.759 15.457 1.00 84.34 O ANISOU 686 OD1 ASN C 85 16144 6681 9218 -1319 -2116 2013 O ATOM 687 ND2 ASN C 85 15.926 11.914 14.207 1.00 84.58 N ANISOU 687 ND2 ASN C 85 15876 7224 9037 -2162 -1687 2189 N ATOM 688 N ARG C 86 10.733 9.039 15.481 1.00 69.22 N ANISOU 688 N ARG C 86 12514 6314 7470 -233 -1941 1310 N ATOM 689 CA ARG C 86 9.927 7.801 15.275 1.00 68.31 C ANISOU 689 CA ARG C 86 11904 6660 7391 -179 -1892 1146 C ATOM 690 C ARG C 86 9.578 7.558 13.796 1.00 72.23 C ANISOU 690 C ARG C 86 12437 7395 7610 -292 -2078 1272 C ATOM 691 O ARG C 86 9.820 6.485 13.270 1.00 72.08 O ANISOU 691 O ARG C 86 12238 7657 7491 -564 -1955 1158 O ATOM 692 CB ARG C 86 8.633 7.850 16.117 1.00 68.47 C ANISOU 692 CB ARG C 86 11615 6774 7624 297 -1966 1032 C ATOM 693 N SER C 87 9.032 8.566 13.129 1.00 77.95 N ANISOU 693 N SER C 87 13461 7974 8181 -60 -2399 1502 N ATOM 694 CA SER C 87 8.601 8.421 11.703 1.00 83.75 C ANISOU 694 CA SER C 87 14296 8934 8588 -122 -2656 1644 C ATOM 695 C SER C 87 9.707 7.922 10.774 1.00 83.30 C ANISOU 695 C SER C 87 14459 8983 8207 -618 -2442 1688 C ATOM 696 O SER C 87 9.452 7.180 9.834 1.00 86.37 O ANISOU 696 O SER C 87 14791 9681 8345 -744 -2520 1634 O ATOM 697 CB SER C 87 8.098 9.749 11.181 1.00 88.55 C ANISOU 697 CB SER C 87 15339 9260 9045 200 -3040 1943 C ATOM 698 OG SER C 87 7.203 10.318 12.102 1.00 91.20 O ANISOU 698 OG SER C 87 15507 9465 9679 732 -3185 1883 O ATOM 699 N THR C 88 10.928 8.344 11.070 1.00 82.61 N ANISOU 699 N THR C 88 14610 8651 8124 -891 -2175 1770 N ATOM 700 CA THR C 88 12.101 8.094 10.242 1.00 81.22 C ANISOU 700 CA THR C 88 14627 8582 7649 -1339 -1905 1855 C ATOM 701 C THR C 88 12.911 6.880 10.679 1.00 75.87 C ANISOU 701 C THR C 88 13573 8143 7111 -1560 -1518 1562 C ATOM 702 O THR C 88 13.419 6.150 9.855 1.00 77.28 O ANISOU 702 O THR C 88 13749 8590 7023 -1776 -1324 1494 O ATOM 703 CB THR C 88 13.022 9.315 10.323 1.00 83.99 C ANISOU 703 CB THR C 88 15399 8548 7963 -1563 -1841 2148 C ATOM 704 OG1 THR C 88 12.410 10.390 9.621 1.00 88.52 O ANISOU 704 OG1 THR C 88 16462 8873 8296 -1403 -2199 2471 O ATOM 705 CG2 THR C 88 14.435 9.021 9.736 1.00 85.10 C ANISOU 705 CG2 THR C 88 15575 8868 7888 -2077 -1435 2220 C ATOM 706 N SER C 89 13.046 6.698 11.983 1.00 70.21 N ANISOU 706 N SER C 89 12589 7306 6781 -1467 -1415 1389 N ATOM 707 CA SER C 89 14.014 5.761 12.538 1.00 66.31 C ANISOU 707 CA SER C 89 11811 6941 6442 -1654 -1080 1167 C ATOM 708 C SER C 89 13.626 4.298 12.333 1.00 63.50 C ANISOU 708 C SER C 89 11175 6883 6067 -1614 -1005 888 C ATOM 709 O SER C 89 12.457 3.933 12.408 1.00 63.61 O ANISOU 709 O SER C 89 11054 6970 6142 -1423 -1215 800 O ATOM 710 CB SER C 89 14.183 6.034 14.039 1.00 65.10 C ANISOU 710 CB SER C 89 11532 6542 6659 -1538 -1063 1079 C ATOM 711 OG SER C 89 15.249 5.296 14.572 1.00 63.98 O ANISOU 711 OG SER C 89 11162 6491 6655 -1712 -798 919 O ATOM 712 N HIS C 90 14.624 3.471 12.056 1.00 61.30 N ANISOU 712 N HIS C 90 10807 6773 5708 -1802 -711 748 N ATOM 713 CA HIS C 90 14.464 2.034 12.083 1.00 57.32 C ANISOU 713 CA HIS C 90 10105 6435 5239 -1762 -622 448 C ATOM 714 C HIS C 90 15.153 1.498 13.299 1.00 54.92 C ANISOU 714 C HIS C 90 9561 6039 5266 -1729 -437 294 C ATOM 715 O HIS C 90 15.542 0.303 13.338 1.00 52.42 O ANISOU 715 O HIS C 90 9133 5811 4974 -1720 -279 59 O ATOM 716 CB HIS C 90 15.078 1.392 10.829 1.00 58.69 C ANISOU 716 CB HIS C 90 10417 6849 5031 -1900 -431 356 C ATOM 717 CG HIS C 90 14.415 1.777 9.540 1.00 61.38 C ANISOU 717 CG HIS C 90 11064 7307 4950 -1939 -638 491 C ATOM 718 ND1 HIS C 90 14.591 1.063 8.404 1.00 63.68 N ANISOU 718 ND1 HIS C 90 11546 7818 4831 -2009 -547 350 N ATOM 719 CD2 HIS C 90 13.551 2.837 9.207 1.00 63.40 C ANISOU 719 CD2 HIS C 90 11513 7474 5100 -1875 -973 758 C ATOM 720 CE1 HIS C 90 13.892 1.637 7.384 1.00 67.05 C ANISOU 720 CE1 HIS C 90 12283 8313 4878 -2030 -824 532 C ATOM 721 NE2 HIS C 90 13.257 2.717 7.869 1.00 66.50 N ANISOU 721 NE2 HIS C 90 12202 8053 5011 -1936 -1096 793 N ATOM 722 N GLN C 91 15.323 2.358 14.330 1.00 57.00 N ANISOU 722 N GLN C 91 9797 6091 5770 -1684 -485 412 N ATOM 723 CA GLN C 91 16.035 1.975 15.553 1.00 54.98 C ANISOU 723 CA GLN C 91 9359 5738 5792 -1651 -366 291 C ATOM 724 C GLN C 91 15.115 2.049 16.784 1.00 53.50 C ANISOU 724 C GLN C 91 9123 5377 5827 -1445 -511 252 C ATOM 725 O GLN C 91 14.293 2.998 16.916 1.00 52.06 O ANISOU 725 O GLN C 91 9056 5077 5645 -1320 -687 381 O ATOM 726 CB GLN C 91 17.266 2.876 15.752 1.00 57.79 C ANISOU 726 CB GLN C 91 9735 6020 6200 -1834 -285 438 C ATOM 727 CG AGLN C 91 18.407 2.649 14.744 0.50 61.02 C ANISOU 727 CG AGLN C 91 10066 6688 6430 -2049 -24 463 C ATOM 728 CG BGLN C 91 18.364 2.660 14.717 0.50 63.16 C ANISOU 728 CG BGLN C 91 10345 6957 6692 -2047 -29 466 C ATOM 729 CD AGLN C 91 19.632 1.900 15.343 0.50 60.84 C ANISOU 729 CD AGLN C 91 9719 6789 6606 -2047 171 300 C ATOM 730 CD BGLN C 91 19.693 3.290 15.125 0.50 66.66 C ANISOU 730 CD BGLN C 91 10643 7398 7284 -2277 74 578 C ATOM 731 OE1AGLN C 91 19.502 0.838 15.949 0.50 56.13 O ANISOU 731 OE1AGLN C 91 9005 6177 6142 -1837 172 80 O ATOM 732 OE1BGLN C 91 20.734 2.613 15.176 0.50 69.52 O ANISOU 732 OE1BGLN C 91 10704 7982 7726 -2305 290 458 O ATOM 733 NE2AGLN C 91 20.830 2.464 15.139 0.50 64.10 N ANISOU 733 NE2AGLN C 91 9980 7334 7038 -2293 323 432 N ATOM 734 NE2BGLN C 91 19.671 4.586 15.402 0.50 69.10 N ANISOU 734 NE2BGLN C 91 11161 7452 7639 -2440 -101 803 N ATOM 735 N ILE C 92 15.272 1.064 17.689 1.00 47.82 N ANISOU 735 N ILE C 92 8258 4639 5271 -1377 -422 81 N ATOM 736 CA ILE C 92 14.466 0.989 18.873 1.00 47.70 C ANISOU 736 CA ILE C 92 8202 4510 5409 -1208 -479 48 C ATOM 737 C ILE C 92 14.794 2.100 19.895 1.00 46.98 C ANISOU 737 C ILE C 92 8240 4201 5407 -1118 -549 126 C ATOM 738 O ILE C 92 15.924 2.602 19.981 1.00 48.61 O ANISOU 738 O ILE C 92 8510 4323 5636 -1247 -553 168 O ATOM 739 CB ILE C 92 14.585 -0.411 19.550 1.00 47.99 C ANISOU 739 CB ILE C 92 8140 4546 5547 -1194 -369 -116 C ATOM 740 CG1 ILE C 92 13.444 -0.636 20.532 1.00 45.88 C ANISOU 740 CG1 ILE C 92 7819 4242 5369 -1078 -377 -115 C ATOM 741 CG2 ILE C 92 15.946 -0.582 20.246 1.00 47.30 C ANISOU 741 CG2 ILE C 92 8054 4368 5550 -1191 -305 -166 C ATOM 742 CD1 ILE C 92 13.448 -2.035 21.112 1.00 47.28 C ANISOU 742 CD1 ILE C 92 7977 4374 5613 -1124 -281 -223 C ATOM 743 N CYS C 93 13.795 2.502 20.641 1.00 47.24 N ANISOU 743 N CYS C 93 8308 4157 5482 -904 -608 138 N ATOM 744 CA CYS C 93 14.013 3.435 21.749 1.00 48.49 C ANISOU 744 CA CYS C 93 8666 4072 5683 -766 -677 148 C ATOM 745 C CYS C 93 15.288 3.046 22.510 1.00 47.75 C ANISOU 745 C CYS C 93 8592 3895 5655 -892 -651 71 C ATOM 746 O CYS C 93 15.503 1.854 22.825 1.00 49.04 O ANISOU 746 O CYS C 93 8613 4160 5859 -910 -544 -22 O ATOM 747 CB CYS C 93 12.821 3.407 22.684 1.00 50.57 C ANISOU 747 CB CYS C 93 8898 4351 5965 -474 -626 98 C ATOM 748 SG CYS C 93 13.087 4.268 24.229 1.00 50.07 S ANISOU 748 SG CYS C 93 9154 3996 5874 -255 -669 31 S ATOM 749 N LYS C 94 16.134 4.035 22.800 1.00 51.30 N ANISOU 749 N LYS C 94 9230 4141 6122 -988 -789 116 N ATOM 750 CA LYS C 94 17.434 3.760 23.443 1.00 52.65 C ANISOU 750 CA LYS C 94 9350 4277 6376 -1135 -837 55 C ATOM 751 C LYS C 94 17.266 3.114 24.845 1.00 51.51 C ANISOU 751 C LYS C 94 9270 4073 6228 -929 -839 -70 C ATOM 752 O LYS C 94 18.122 2.346 25.276 1.00 54.75 O ANISOU 752 O LYS C 94 9564 4538 6698 -973 -857 -131 O ATOM 753 CB LYS C 94 18.321 5.025 23.492 1.00 54.77 C ANISOU 753 CB LYS C 94 9801 4329 6677 -1360 -1036 140 C ATOM 754 CG LYS C 94 18.986 5.377 22.146 1.00 56.88 C ANISOU 754 CG LYS C 94 9943 4723 6944 -1687 -977 299 C ATOM 755 CD LYS C 94 20.195 6.296 22.332 1.00 62.30 C ANISOU 755 CD LYS C 94 10685 5262 7723 -2043 -1147 388 C ATOM 756 CE LYS C 94 20.890 6.608 20.997 1.00 66.23 C ANISOU 756 CE LYS C 94 11029 5943 8192 -2419 -1011 587 C ATOM 757 N MET C 95 16.156 3.408 25.508 1.00 49.07 N ANISOU 757 N MET C 95 9139 3674 5828 -680 -808 -95 N ATOM 758 CA MET C 95 15.865 2.839 26.824 1.00 49.37 C ANISOU 758 CA MET C 95 9291 3680 5787 -491 -752 -181 C ATOM 759 C MET C 95 15.232 1.436 26.722 1.00 48.39 C ANISOU 759 C MET C 95 8950 3761 5674 -475 -533 -178 C ATOM 760 O MET C 95 15.127 0.737 27.718 1.00 48.61 O ANISOU 760 O MET C 95 9074 3768 5626 -389 -464 -204 O ATOM 761 CB MET C 95 14.954 3.775 27.630 1.00 50.99 C ANISOU 761 CB MET C 95 9785 3737 5852 -206 -749 -221 C ATOM 762 CG MET C 95 15.520 5.168 27.862 1.00 53.19 C ANISOU 762 CG MET C 95 10413 3700 6097 -216 -1010 -252 C ATOM 763 SD MET C 95 14.700 6.092 29.216 1.00 58.32 S ANISOU 763 SD MET C 95 11545 4106 6506 214 -1018 -396 S ATOM 764 CE MET C 95 15.277 5.115 30.599 1.00 57.33 C ANISOU 764 CE MET C 95 11531 4025 6227 209 -1007 -486 C ATOM 765 N ARG C 96 14.820 1.016 25.522 1.00 47.37 N ANISOU 765 N ARG C 96 8584 3801 5611 -586 -448 -138 N ATOM 766 CA ARG C 96 14.285 -0.348 25.347 1.00 46.85 C ANISOU 766 CA ARG C 96 8361 3869 5569 -647 -296 -150 C ATOM 767 C ARG C 96 15.295 -1.298 24.731 1.00 46.21 C ANISOU 767 C ARG C 96 8199 3802 5555 -789 -315 -205 C ATOM 768 O ARG C 96 15.076 -2.497 24.712 1.00 47.03 O ANISOU 768 O ARG C 96 8283 3911 5676 -833 -234 -239 O ATOM 769 CB ARG C 96 12.989 -0.315 24.517 1.00 48.20 C ANISOU 769 CB ARG C 96 8339 4224 5750 -663 -226 -105 C ATOM 770 CG ARG C 96 11.881 0.484 25.212 1.00 51.00 C ANISOU 770 CG ARG C 96 8698 4621 6056 -429 -161 -66 C ATOM 771 CD ARG C 96 10.515 0.402 24.530 1.00 54.05 C ANISOU 771 CD ARG C 96 8783 5261 6489 -415 -112 -15 C ATOM 772 NE ARG C 96 10.184 -0.965 24.146 1.00 56.59 N ANISOU 772 NE ARG C 96 8920 5711 6871 -681 -43 -21 N ATOM 773 CZ ARG C 96 10.195 -1.442 22.885 1.00 60.33 C ANISOU 773 CZ ARG C 96 9288 6262 7370 -886 -159 -45 C ATOM 774 NH1 ARG C 96 10.498 -0.649 21.823 1.00 62.17 N ANISOU 774 NH1 ARG C 96 9557 6509 7554 -857 -323 -30 N ATOM 775 NH2 ARG C 96 9.898 -2.728 22.670 1.00 62.04 N ANISOU 775 NH2 ARG C 96 9424 6516 7629 -1137 -120 -81 N ATOM 776 N LYS C 97 16.399 -0.752 24.211 1.00 46.15 N ANISOU 776 N LYS C 97 8150 3798 5587 -859 -410 -213 N ATOM 777 CA LYS C 97 17.472 -1.551 23.566 1.00 45.21 C ANISOU 777 CA LYS C 97 7892 3757 5528 -925 -385 -285 C ATOM 778 C LYS C 97 17.964 -2.624 24.539 1.00 46.02 C ANISOU 778 C LYS C 97 8064 3748 5673 -796 -413 -349 C ATOM 779 O LYS C 97 18.310 -2.326 25.654 1.00 44.46 O ANISOU 779 O LYS C 97 7983 3439 5468 -713 -535 -328 O ATOM 780 CB LYS C 97 18.620 -0.614 23.120 1.00 47.44 C ANISOU 780 CB LYS C 97 8064 4106 5854 -1046 -456 -245 C ATOM 781 CG LYS C 97 19.771 -1.258 22.360 1.00 48.71 C ANISOU 781 CG LYS C 97 7989 4447 6070 -1083 -366 -315 C ATOM 782 CD LYS C 97 19.348 -1.806 20.992 1.00 48.29 C ANISOU 782 CD LYS C 97 7901 4545 5901 -1125 -190 -363 C ATOM 783 CE LYS C 97 20.519 -2.477 20.304 1.00 49.82 C ANISOU 783 CE LYS C 97 7882 4934 6112 -1078 -47 -472 C ATOM 784 NZ LYS C 97 20.282 -2.726 18.854 1.00 51.39 N ANISOU 784 NZ LYS C 97 8100 5308 6116 -1143 131 -523 N ATOM 785 N CYS C 98 17.936 -3.875 24.098 1.00 46.64 N ANISOU 785 N CYS C 98 8135 3820 5765 -771 -330 -428 N ATOM 786 CA CYS C 98 18.312 -5.006 24.920 1.00 48.48 C ANISOU 786 CA CYS C 98 8513 3882 6026 -625 -375 -467 C ATOM 787 C CYS C 98 19.772 -5.002 25.262 1.00 50.96 C ANISOU 787 C CYS C 98 8710 4220 6433 -470 -514 -513 C ATOM 788 O CYS C 98 20.623 -4.854 24.377 1.00 54.87 O ANISOU 788 O CYS C 98 8947 4900 7000 -472 -473 -581 O ATOM 789 CB CYS C 98 18.015 -6.304 24.176 1.00 50.33 C ANISOU 789 CB CYS C 98 8822 4042 6258 -637 -284 -566 C ATOM 790 SG CYS C 98 18.436 -7.787 25.085 1.00 52.25 S ANISOU 790 SG CYS C 98 9355 3968 6526 -439 -367 -593 S ATOM 791 N GLU C 99 20.073 -5.231 26.542 1.00 52.20 N ANISOU 791 N GLU C 99 9041 4219 6572 -330 -676 -470 N ATOM 792 CA GLU C 99 21.468 -5.252 27.033 1.00 54.46 C ANISOU 792 CA GLU C 99 9184 4545 6962 -160 -898 -506 C ATOM 793 C GLU C 99 22.295 -6.274 26.320 1.00 54.48 C ANISOU 793 C GLU C 99 9003 4609 7085 40 -856 -627 C ATOM 794 O GLU C 99 23.486 -6.065 26.092 1.00 57.53 O ANISOU 794 O GLU C 99 9038 5207 7613 134 -938 -681 O ATOM 795 CB GLU C 99 21.523 -5.520 28.556 1.00 55.69 C ANISOU 795 CB GLU C 99 9659 4489 7010 -9 -1120 -435 C ATOM 796 CG GLU C 99 20.991 -4.379 29.405 1.00 56.28 C ANISOU 796 CG GLU C 99 9925 4526 6932 -128 -1191 -364 C ATOM 797 CD GLU C 99 21.811 -3.088 29.268 1.00 58.26 C ANISOU 797 CD GLU C 99 9940 4917 7280 -261 -1375 -395 C ATOM 798 OE1 GLU C 99 23.032 -3.137 28.991 1.00 63.92 O ANISOU 798 OE1 GLU C 99 10326 5783 8176 -241 -1534 -440 O ATOM 799 OE2 GLU C 99 21.237 -2.028 29.450 1.00 58.32 O ANISOU 799 OE2 GLU C 99 10089 4880 7190 -387 -1365 -372 O ATOM 800 N GLN C 100 21.675 -7.390 25.980 1.00 53.70 N ANISOU 800 N GLN C 100 9139 4327 6936 108 -731 -677 N ATOM 801 CA GLN C 100 22.373 -8.447 25.274 1.00 55.91 C ANISOU 801 CA GLN C 100 9352 4595 7296 366 -681 -838 C ATOM 802 C GLN C 100 22.705 -8.044 23.828 1.00 55.93 C ANISOU 802 C GLN C 100 9015 4919 7316 286 -458 -957 C ATOM 803 O GLN C 100 23.700 -8.491 23.286 1.00 59.02 O ANISOU 803 O GLN C 100 9173 5463 7786 544 -397 -1098 O ATOM 804 CB GLN C 100 21.548 -9.729 25.282 1.00 56.09 C ANISOU 804 CB GLN C 100 9822 4252 7238 401 -639 -868 C ATOM 805 CG GLN C 100 21.222 -10.249 26.675 1.00 57.69 C ANISOU 805 CG GLN C 100 10423 4124 7373 457 -813 -708 C ATOM 806 CD GLN C 100 22.466 -10.420 27.573 1.00 60.57 C ANISOU 806 CD GLN C 100 10744 4459 7809 829 -1095 -691 C ATOM 807 OE1 GLN C 100 23.518 -10.836 27.124 1.00 61.22 O ANISOU 807 OE1 GLN C 100 10599 4630 8030 1155 -1156 -834 O ATOM 808 NE2 GLN C 100 22.319 -10.089 28.849 1.00 62.06 N ANISOU 808 NE2 GLN C 100 11145 4552 7883 799 -1271 -520 N ATOM 809 N LEU C 101 21.869 -7.208 23.215 1.00 54.52 N ANISOU 809 N LEU C 101 8820 4856 7039 -36 -329 -893 N ATOM 810 CA LEU C 101 22.072 -6.818 21.783 1.00 55.87 C ANISOU 810 CA LEU C 101 8766 5317 7143 -145 -111 -970 C ATOM 811 C LEU C 101 23.046 -5.671 21.599 1.00 56.83 C ANISOU 811 C LEU C 101 8485 5764 7343 -256 -87 -886 C ATOM 812 O LEU C 101 23.498 -5.417 20.485 1.00 58.14 O ANISOU 812 O LEU C 101 8434 6211 7444 -320 125 -927 O ATOM 813 CB LEU C 101 20.736 -6.506 21.104 1.00 53.69 C ANISOU 813 CB LEU C 101 8681 5012 6706 -421 -33 -926 C ATOM 814 CG LEU C 101 19.739 -7.692 21.148 1.00 53.51 C ANISOU 814 CG LEU C 101 9010 4696 6624 -417 -59 -1008 C ATOM 815 CD1 LEU C 101 18.426 -7.337 20.465 1.00 52.30 C ANISOU 815 CD1 LEU C 101 8937 4590 6343 -705 -34 -960 C ATOM 816 CD2 LEU C 101 20.341 -8.938 20.518 1.00 57.75 C ANISOU 816 CD2 LEU C 101 9669 5138 7134 -165 8 -1242 C ATOM 817 N LYS C 102 23.393 -4.993 22.694 1.00 58.54 N ANISOU 817 N LYS C 102 8627 5937 7675 -306 -309 -767 N ATOM 818 CA LYS C 102 24.437 -3.953 22.660 1.00 60.83 C ANISOU 818 CA LYS C 102 8528 6497 8085 -473 -356 -683 C ATOM 819 C LYS C 102 25.833 -4.538 22.514 1.00 68.67 C ANISOU 819 C LYS C 102 9079 7764 9245 -225 -323 -790 C ATOM 820 O LYS C 102 26.788 -3.802 22.282 1.00 74.12 O ANISOU 820 O LYS C 102 9333 8769 10058 -401 -304 -724 O ATOM 821 CB LYS C 102 24.366 -3.090 23.908 1.00 58.57 C ANISOU 821 CB LYS C 102 8364 6039 7849 -605 -662 -564 C ATOM 822 CG LYS C 102 23.093 -2.305 23.948 1.00 54.94 C ANISOU 822 CG LYS C 102 8252 5384 7235 -806 -648 -467 C ATOM 823 CD LYS C 102 23.077 -1.216 24.992 1.00 54.63 C ANISOU 823 CD LYS C 102 8370 5183 7201 -940 -913 -380 C ATOM 824 CE LYS C 102 22.021 -1.480 26.044 1.00 53.97 C ANISOU 824 CE LYS C 102 8697 4827 6980 -781 -987 -383 C ATOM 825 NZ LYS C 102 21.557 -0.231 26.694 1.00 52.82 N ANISOU 825 NZ LYS C 102 8811 4512 6745 -895 -1132 -325 N ATOM 826 N LYS C 103 25.962 -5.856 22.669 1.00 72.77 N ANISOU 826 N LYS C 103 9702 8161 9785 183 -328 -945 N ATOM 827 CA LYS C 103 27.220 -6.527 22.397 1.00 80.35 C ANISOU 827 CA LYS C 103 10237 9393 10897 543 -261 -1084 C ATOM 828 C LYS C 103 27.267 -6.908 20.928 1.00 82.14 C ANISOU 828 C LYS C 103 10378 9848 10981 616 151 -1233 C ATOM 829 O LYS C 103 26.332 -7.513 20.408 1.00 81.91 O ANISOU 829 O LYS C 103 10792 9574 10755 647 264 -1331 O ATOM 830 CB LYS C 103 27.366 -7.775 23.264 1.00 84.20 C ANISOU 830 CB LYS C 103 10962 9576 11453 1021 -495 -1184 C ATOM 831 CG LYS C 103 27.299 -7.492 24.757 1.00 85.79 C ANISOU 831 CG LYS C 103 11341 9544 11709 982 -910 -1036 C ATOM 832 CD LYS C 103 27.236 -8.781 25.573 1.00 87.64 C ANISOU 832 CD LYS C 103 11973 9394 11930 1422 -1131 -1084 C ATOM 833 CE LYS C 103 26.928 -8.501 27.039 1.00 86.44 C ANISOU 833 CE LYS C 103 12151 8981 11709 1340 -1498 -915 C ATOM 834 NZ LYS C 103 26.251 -9.670 27.661 1.00 87.80 N ANISOU 834 NZ LYS C 103 12948 8670 11740 1566 -1585 -886 N ATOM 835 N LYS C 104 28.356 -6.548 20.261 1.00 85.16 N ANISOU 835 N LYS C 104 10190 10722 11444 618 377 -1249 N ATOM 836 CA LYS C 104 28.567 -6.917 18.874 1.00 86.76 C ANISOU 836 CA LYS C 104 10293 11214 11458 742 818 -1406 C ATOM 837 C LYS C 104 28.406 -8.457 18.717 1.00 88.16 C ANISOU 837 C LYS C 104 10825 11112 11558 1313 852 -1702 C ATOM 838 O LYS C 104 28.727 -9.231 19.641 1.00 87.23 O ANISOU 838 O LYS C 104 10757 10757 11628 1706 581 -1770 O ATOM 839 CB LYS C 104 29.970 -6.453 18.415 1.00 92.53 C ANISOU 839 CB LYS C 104 10246 12576 12333 740 1072 -1377 C ATOM 840 CG LYS C 104 30.136 -6.297 16.909 1.00 95.93 C ANISOU 840 CG LYS C 104 10555 13412 12481 647 1606 -1430 C ATOM 841 N ARG C 105 27.881 -8.884 17.566 1.00 88.44 N ANISOU 841 N ARG C 105 11183 11126 11294 1343 1140 -1870 N ATOM 842 CA ARG C 105 27.753 -10.322 17.254 1.00 91.20 C ANISOU 842 CA ARG C 105 11943 11173 11534 1853 1182 -2190 C ATOM 843 C ARG C 105 29.122 -11.004 17.307 1.00 96.61 C ANISOU 843 C ARG C 105 12179 12125 12402 2490 1298 -2386 C ATOM 844 O ARG C 105 30.100 -10.460 16.796 1.00 99.54 O ANISOU 844 O ARG C 105 11907 13096 12817 2514 1601 -2368 O ATOM 845 CB ARG C 105 27.138 -10.530 15.852 1.00 92.32 C ANISOU 845 CB ARG C 105 12453 11347 11275 1757 1484 -2369 C ATOM 846 CG ARG C 105 25.619 -10.329 15.761 1.00 86.95 C ANISOU 846 CG ARG C 105 12328 10294 10412 1290 1290 -2268 C ATOM 847 CD ARG C 105 25.087 -10.643 14.351 1.00 89.11 C ANISOU 847 CD ARG C 105 12983 10607 10266 1239 1513 -2481 C ATOM 848 NE ARG C 105 25.302 -12.061 13.949 1.00 93.34 N ANISOU 848 NE ARG C 105 13904 10879 10681 1753 1573 -2878 N ATOM 849 CZ ARG C 105 24.335 -12.961 13.678 1.00 94.09 C ANISOU 849 CZ ARG C 105 14666 10481 10603 1718 1385 -3077 C ATOM 850 NH1 ARG C 105 24.667 -14.209 13.324 1.00 99.20 N ANISOU 850 NH1 ARG C 105 15700 10847 11144 2217 1433 -3455 N ATOM 851 NH2 ARG C 105 23.046 -12.634 13.734 1.00 90.86 N ANISOU 851 NH2 ARG C 105 14536 9855 10130 1197 1140 -2915 N ATOM 852 N VAL C 106 29.182 -12.190 17.926 1.00 98.20 N ANISOU 852 N VAL C 106 12711 11884 12714 3007 1057 -2555 N ATOM 853 CA VAL C 106 30.429 -12.985 17.976 1.00106.36 C ANISOU 853 CA VAL C 106 13375 13111 13925 3756 1123 -2777 C ATOM 854 C VAL C 106 30.938 -13.319 16.552 1.00112.74 C ANISOU 854 C VAL C 106 14038 14315 14484 4094 1661 -3090 C ATOM 855 O VAL C 106 32.138 -13.316 16.300 1.00118.24 O ANISOU 855 O VAL C 106 14047 15565 15313 4511 1918 -3187 O ATOM 856 CB VAL C 106 30.240 -14.294 18.774 1.00107.32 C ANISOU 856 CB VAL C 106 14089 12548 14137 4272 751 -2907 C ATOM 857 N VAL C 107 30.002 -13.604 15.640 1.00112.93 N ANISOU 857 N VAL C 107 14703 14075 14127 3908 1822 -3247 N ATOM 858 CA VAL C 107 30.301 -13.777 14.208 1.00119.01 C ANISOU 858 CA VAL C 107 15467 15217 14532 4116 2344 -3532 C ATOM 859 C VAL C 107 29.203 -13.087 13.370 1.00116.48 C ANISOU 859 C VAL C 107 15542 14888 13828 3428 2449 -3423 C ATOM 860 O VAL C 107 28.019 -13.214 13.684 1.00111.44 O ANISOU 860 O VAL C 107 15490 13709 13140 3069 2104 -3347 O ATOM 861 CB VAL C 107 30.373 -15.265 13.817 1.00122.10 C ANISOU 861 CB VAL C 107 16449 15175 14767 4855 2376 -3995 C ATOM 862 N PRO C 108 29.594 -12.342 12.303 1.00121.42 N ANISOU 862 N PRO C 108 15824 16137 14172 3238 2923 -3391 N ATOM 863 CA PRO C 108 28.578 -11.637 11.477 1.00118.58 C ANISOU 863 CA PRO C 108 15858 15779 13417 2617 2976 -3257 C ATOM 864 C PRO C 108 27.720 -12.569 10.580 1.00119.90 C ANISOU 864 C PRO C 108 16877 15544 13135 2753 2960 -3617 C ATOM 865 O PRO C 108 27.967 -13.781 10.523 1.00123.47 O ANISOU 865 O PRO C 108 17663 15693 13556 3344 2958 -4000 O ATOM 866 CB PRO C 108 29.429 -10.686 10.590 1.00122.69 C ANISOU 866 CB PRO C 108 15790 17092 13735 2444 3521 -3114 C ATOM 867 CG PRO C 108 30.842 -10.796 11.082 1.00126.87 C ANISOU 867 CG PRO C 108 15502 18066 14634 2882 3723 -3136 C ATOM 868 CD PRO C 108 30.966 -12.091 11.815 1.00128.14 C ANISOU 868 CD PRO C 108 15898 17743 15044 3561 3429 -3441 C ATOM 869 N MET C 109 26.726 -11.983 9.893 1.00115.90 N ANISOU 869 N MET C 109 16737 15016 12284 2210 2905 -3493 N ATOM 870 CA MET C 109 25.910 -12.699 8.879 1.00115.73 C ANISOU 870 CA MET C 109 17495 14710 11768 2233 2866 -3820 C ATOM 871 C MET C 109 26.428 -12.381 7.476 1.00120.37 C ANISOU 871 C MET C 109 18068 15873 11792 2316 3403 -3947 C ATOM 872 O MET C 109 26.287 -13.183 6.552 1.00126.49 O ANISOU 872 O MET C 109 19415 16537 12106 2607 3525 -4353 O ATOM 873 CB MET C 109 24.432 -12.286 8.986 1.00108.46 C ANISOU 873 CB MET C 109 16969 13436 10802 1602 2412 -3605 C ATOM 874 CG MET C 109 23.862 -12.363 10.401 1.00101.90 C ANISOU 874 CG MET C 109 16081 12147 10488 1419 1959 -3391 C ATOM 875 SD MET C 109 22.056 -12.217 10.508 1.00 95.44 S ANISOU 875 SD MET C 109 15727 10908 9626 796 1454 -3236 S ATOM 876 CE MET C 109 21.762 -10.635 9.736 1.00 93.83 C ANISOU 876 CE MET C 109 15267 11233 9150 333 1579 -2893 C TER 877 MET C 109 HETATM 878 ZN ZN C 201 17.227 -7.765 27.024 1.00 46.03 ZN HETATM 879 ZN ZN C 202 13.236 6.546 23.644 1.00 47.67 ZN HETATM 880 O HOH A 101 15.312 -5.971 12.933 1.00 52.11 O HETATM 881 O HOH A 102 22.997 -5.743 16.351 1.00 56.41 O HETATM 882 O HOH B 101 10.071 -9.949 13.718 1.00 51.58 O HETATM 883 O HOH C 301 18.845 0.133 26.861 1.00 44.53 O HETATM 884 O HOH C 302 19.241 9.845 22.361 1.00 45.18 O HETATM 885 O HOH C 303 11.151 1.955 20.402 1.00 48.61 O HETATM 886 O HOH C 304 14.026 -9.288 19.179 1.00 43.78 O HETATM 887 O HOH C 305 12.195 4.592 16.713 1.00 49.92 O HETATM 888 O HOH C 306 18.401 -14.650 20.373 1.00 64.46 O HETATM 889 O HOH C 307 14.391 -4.963 23.914 1.00 41.42 O CONECT 86 114 CONECT 97 98 103 106 CONECT 98 97 99 104 CONECT 99 98 100 CONECT 100 99 101 105 CONECT 101 100 102 103 CONECT 102 101 CONECT 103 97 101 CONECT 104 98 CONECT 105 100 CONECT 106 97 107 110 CONECT 107 106 108 CONECT 108 107 109 111 CONECT 109 108 110 112 CONECT 110 106 109 CONECT 111 108 117 CONECT 112 109 113 CONECT 113 112 114 CONECT 114 86 113 115 116 CONECT 115 114 CONECT 116 114 CONECT 117 111 CONECT 331 359 CONECT 342 343 348 351 CONECT 343 342 344 349 CONECT 344 343 345 CONECT 345 344 346 350 CONECT 346 345 347 348 CONECT 347 346 CONECT 348 342 346 CONECT 349 343 CONECT 350 345 CONECT 351 342 352 355 CONECT 352 351 353 CONECT 353 352 354 356 CONECT 354 353 355 357 CONECT 355 351 354 CONECT 356 353 362 CONECT 357 354 358 CONECT 358 357 359 CONECT 359 331 358 360 361 CONECT 360 359 CONECT 361 359 CONECT 362 356 CONECT 547 878 CONECT 564 878 CONECT 584 878 CONECT 631 879 CONECT 646 879 CONECT 672 879 CONECT 748 879 CONECT 790 878 CONECT 878 547 564 584 790 CONECT 879 631 646 672 748 MASTER 370 0 4 2 0 0 2 6 882 3 54 8 END
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Related entries of code: 4hp1
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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RCSB PDB
PDBbind
12aa, >3QMB_2|Chains... *
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PDBbind
12aa, >6ASD_1|Chains... at 100%
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RCSB PDB
PDBbind
12aa, >6CNP_2|Chains... at 100%
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
4hp1
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
xtTet3 CXXC domain
Ligand Name
a non-CpG dsDNA (GCCACmCGGTGGC)
EC.Number
E.C.-.-.-.-
Resolution
2.25(Å)
Affinity (Kd/Ki/IC50)
Kd=7uM
Release Year
2012
Protein/NA Sequence
Check fasta file
Primary Reference
(2012) Cell(Cambridge,Mass.) Vol. 151: pp. 1200-1213
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):
A0JP82
Entrez Gene ID
NCBI Entrez Gene ID:
100036628
ASD
Information of known allosteric effects of PDB entries
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