Browse entries in the PDBbind-CN Database
HEADER DNA BINDING PROTEIN/DNA 02-OCT-12 4HDV TITLE CRYSTAL STRUCTURE OF S. POMBE ATL1 IN COMPLEX WITH DAMAGED DNA TITLE 2 CONTAINING 2,6-DIAMINOPURINE COMPND MOL_ID: 1; COMPND 2 MOLECULE: ALKYLTRANSFERASE-LIKE PROTEIN 1; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: ATL1; COMPND 5 ENGINEERED: YES; COMPND 6 MOL_ID: 2; COMPND 7 MOLECULE: 5'-D(*GP*CP*CP*AP*TP*GP*(1AP)P*CP*TP*AP*GP*TP*A)-3'; COMPND 8 CHAIN: B; COMPND 9 ENGINEERED: YES; COMPND 10 MOL_ID: 3; COMPND 11 MOLECULE: 5'-D(*CP*TP*AP*CP*TP*AP*GP*CP*CP*AP*TP*GP*G)-3'; COMPND 12 CHAIN: C; COMPND 13 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: SCHIZOSACCHAROMYCES POMBE; SOURCE 3 ORGANISM_COMMON: FISSION YEAST; SOURCE 4 ORGANISM_TAXID: 4896; SOURCE 5 GENE: ATL1, SPAC1250.04C; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 MOL_ID: 2; SOURCE 9 SYNTHETIC: YES; SOURCE 10 MOL_ID: 3; SOURCE 11 SYNTHETIC: YES KEYWDS ALKYLTRANSFERASE, DNA REPAIR, NUCLEOTIDE EXCISION REPAIR, NER, BASE KEYWDS 2 REPAIR, DNA DAMAGE, GUANINE, ALKYLATION, DNA BINDING PROTEIN-DNA KEYWDS 3 COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR J.L.TUBBS,J.A.TAINER REVDAT 1 26-DEC-12 4HDV 0 JRNL AUTH O.J.WILKINSON,V.LATYPOV,J.L.TUBBS,C.L.MILLINGTON,R.MORITA, JRNL AUTH 2 H.BLACKBURN,A.MARRIOTT,G.MCGOWN,M.THORNCROFT,A.J.WATSON, JRNL AUTH 3 B.A.CONNOLLY,J.A.GRASBY,R.MASUI,C.A.HUNTER,J.A.TAINER, JRNL AUTH 4 G.P.MARGISON,D.M.WILLIAMS JRNL TITL ALKYLTRANSFERASE-LIKE PROTEIN (ATL1) DISTINGUISHES ALKYLATED JRNL TITL 2 GUANINES FOR DNA REPAIR USING CATION-{PI} INTERACTIONS. JRNL REF PROC.NATL.ACAD.SCI.USA V. 109 18755 2012 JRNL REFN ISSN 0027-8424 JRNL PMID 23112169 JRNL DOI 10.1073/PNAS.1209451109 REMARK 2 REMARK 2 RESOLUTION. 2.70 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX (PHENIX.REFINE: 1.6.1_357) REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VICENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE- REMARK 3 : KUNSTLEVE,LI-WEI HUNG,ROBERT IMMORMINO, REMARK 3 : TOM IOERGER,AIRLIE MCCOY,ERIK MCKEE,NIGEL REMARK 3 : MORIARTY,REETAL PAI,RANDY READ,JANE REMARK 3 : RICHARDSON,DAVID RICHARDSON,TOD ROMO,JIM REMARK 3 : SACCHETTINI,NICHOLAS SAUTER,JACOB SMITH, REMARK 3 : LAURENT STORONI,TOM TERWILLIGER,PETER REMARK 3 : ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : ML REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.70 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 43.18 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 0.150 REMARK 3 COMPLETENESS FOR RANGE (%) : 98.3 REMARK 3 NUMBER OF REFLECTIONS : 7353 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.218 REMARK 3 R VALUE (WORKING SET) : 0.216 REMARK 3 FREE R VALUE : 0.252 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.020 REMARK 3 FREE R VALUE TEST SET COUNT : 369 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT (IN BINS). REMARK 3 BIN RESOLUTION RANGE COMPL. NWORK NFREE RWORK RFREE REMARK 3 1 43.1862 - 3.8963 0.99 2501 131 0.2076 0.2275 REMARK 3 2 3.8963 - 3.0929 0.99 2300 123 0.1937 0.2355 REMARK 3 3 3.0929 - 2.7020 0.96 2183 115 0.2754 0.3605 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : FLAT BULK SOLVENT MODEL REMARK 3 SOLVENT RADIUS : 1.11 REMARK 3 SHRINKAGE RADIUS : 0.90 REMARK 3 K_SOL : 0.39 REMARK 3 B_SOL : 42.85 REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.300 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 25.560 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 6.75220 REMARK 3 B22 (A**2) : 6.75220 REMARK 3 B33 (A**2) : -13.50440 REMARK 3 B12 (A**2) : -0.00000 REMARK 3 B13 (A**2) : -0.00000 REMARK 3 B23 (A**2) : -0.00000 REMARK 3 REMARK 3 TWINNING INFORMATION. REMARK 3 FRACTION: NULL REMARK 3 OPERATOR: NULL REMARK 3 REMARK 3 DEVIATIONS FROM IDEAL VALUES. REMARK 3 RMSD COUNT REMARK 3 BOND : 0.004 1539 REMARK 3 ANGLE : 0.632 2151 REMARK 3 CHIRALITY : 0.033 227 REMARK 3 PLANARITY : 0.002 187 REMARK 3 DIHEDRAL : 22.836 616 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 NCS DETAILS REMARK 3 NUMBER OF NCS GROUPS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 4HDV COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 04-OCT-12. REMARK 100 THE RCSB ID CODE IS RCSB075342. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 21-MAY-11 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 5.4 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : SSRL REMARK 200 BEAMLINE : BL11-1 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.97945 REMARK 200 MONOCHROMATOR : SIDE SCATTERING BENT CUBE-ROOT I REMARK 200 -BEAM SINGLE CRYSTAL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARMOSAIC 325 MM CCD REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 7480 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.700 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : -3.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.9 REMARK 200 DATA REDUNDANCY : 26.200 REMARK 200 R MERGE (I) : 0.05600 REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 74.4000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.70 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.80 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : 27.60 REMARK 200 R MERGE FOR SHELL (I) : 0.40500 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : 9.600 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: PDB ENTRY 3GVA REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 56.19 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.81 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 20% MPEG2000, 0.5 M SODIUM FORMATE, REMARK 280 200 MM IMIDAZOLE-MALATE, 30% XYLOSE, PH 5.4, VAPOR DIFFUSION, REMARK 280 HANGING DROP, TEMPERATURE 288K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 61 2 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+1/3 REMARK 290 3555 -X+Y,-X,Z+2/3 REMARK 290 4555 -X,-Y,Z+1/2 REMARK 290 5555 Y,-X+Y,Z+5/6 REMARK 290 6555 X-Y,X,Z+1/6 REMARK 290 7555 Y,X,-Z+1/3 REMARK 290 8555 X-Y,-Y,-Z REMARK 290 9555 -X,-X+Y,-Z+2/3 REMARK 290 10555 -Y,-X,-Z+5/6 REMARK 290 11555 -X+Y,Y,-Z+1/2 REMARK 290 12555 X,X-Y,-Z+1/6 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 79.11667 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 158.23333 REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 118.67500 REMARK 290 SMTRY1 5 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 5 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 197.79167 REMARK 290 SMTRY1 6 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 39.55833 REMARK 290 SMTRY1 7 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 7 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 79.11667 REMARK 290 SMTRY1 8 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 9 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 9 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 9 0.000000 0.000000 -1.000000 158.23333 REMARK 290 SMTRY1 10 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 10 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 10 0.000000 0.000000 -1.000000 197.79167 REMARK 290 SMTRY1 11 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 11 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 11 0.000000 0.000000 -1.000000 118.67500 REMARK 290 SMTRY1 12 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 12 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 12 0.000000 0.000000 -1.000000 39.55833 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TRIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TRIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 3540 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 9460 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -10.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B, C REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLY A 109 REMARK 465 SER A 110 REMARK 465 HIS A 111 REMARK 465 HIS A 112 REMARK 465 HIS A 113 REMARK 465 HIS A 114 REMARK 465 HIS A 115 REMARK 465 HIS A 116 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 DG B 6 O4' - C1' - N9 ANGL. DEV. = 2.3 DEGREES REMARK 500 DC C 17 O4' - C1' - N1 ANGL. DEV. = 2.2 DEGREES REMARK 500 DG C 20 O4' - C1' - N9 ANGL. DEV. = 2.1 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 TYR A 37 41.63 -104.78 REMARK 500 ILE A 71 -166.76 -77.83 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 4HDU RELATED DB: PDB DBREF 4HDV A 1 108 UNP Q9UTN9 ATL1_SCHPO 1 108 DBREF 4HDV B 1 13 PDB 4HDV 4HDV 1 13 DBREF 4HDV C 14 26 PDB 4HDV 4HDV 14 26 SEQADV 4HDV GLY A 109 UNP Q9UTN9 EXPRESSION TAG SEQADV 4HDV SER A 110 UNP Q9UTN9 EXPRESSION TAG SEQADV 4HDV HIS A 111 UNP Q9UTN9 EXPRESSION TAG SEQADV 4HDV HIS A 112 UNP Q9UTN9 EXPRESSION TAG SEQADV 4HDV HIS A 113 UNP Q9UTN9 EXPRESSION TAG SEQADV 4HDV HIS A 114 UNP Q9UTN9 EXPRESSION TAG SEQADV 4HDV HIS A 115 UNP Q9UTN9 EXPRESSION TAG SEQADV 4HDV HIS A 116 UNP Q9UTN9 EXPRESSION TAG SEQRES 1 A 116 MET ARG MET ASP GLU PHE TYR THR LYS VAL TYR ASP ALA SEQRES 2 A 116 VAL CYS GLU ILE PRO TYR GLY LYS VAL SER THR TYR GLY SEQRES 3 A 116 GLU ILE ALA ARG TYR VAL GLY MET PRO SER TYR ALA ARG SEQRES 4 A 116 GLN VAL GLY GLN ALA MET LYS HIS LEU HIS PRO GLU THR SEQRES 5 A 116 HIS VAL PRO TRP HIS ARG VAL ILE ASN SER ARG GLY THR SEQRES 6 A 116 ILE SER LYS ARG ASP ILE SER ALA GLY GLU GLN ARG GLN SEQRES 7 A 116 LYS ASP ARG LEU GLU GLU GLU GLY VAL GLU ILE TYR GLN SEQRES 8 A 116 THR SER LEU GLY GLU TYR LYS LEU ASN LEU PRO GLU TYR SEQRES 9 A 116 MET TRP LYS PRO GLY SER HIS HIS HIS HIS HIS HIS SEQRES 1 B 13 DG DC DC DA DT DG 1AP DC DT DA DG DT DA SEQRES 1 C 13 DC DT DA DC DT DA DG DC DC DA DT DG DG MODRES 4HDV 1AP B 7 DA 2,6-DIAMINOPURINE NUCLEOTIDE HET 1AP B 7 22 HETNAM 1AP 2,6-DIAMINOPURINE NUCLEOTIDE FORMUL 2 1AP C10 H15 N6 O6 P FORMUL 4 HOH *(H2 O) HELIX 1 1 ARG A 2 ILE A 17 1 16 HELIX 2 2 TYR A 25 VAL A 32 1 8 HELIX 3 3 TYR A 37 HIS A 47 1 11 HELIX 4 4 PRO A 55 HIS A 57 5 3 HELIX 5 5 SER A 72 GLU A 84 1 13 HELIX 6 6 ASN A 100 MET A 105 1 6 SHEET 1 A 2 SER A 23 THR A 24 0 SHEET 2 A 2 VAL A 59 ILE A 60 1 O ILE A 60 N SER A 23 LINK O3' DG B 6 P 1AP B 7 1555 1555 1.61 CRYST1 59.505 59.505 237.350 90.00 90.00 120.00 P 61 2 2 12 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.016805 0.009703 0.000000 0.00000 SCALE2 0.000000 0.019405 0.000000 0.00000 SCALE3 0.000000 0.000000 0.004213 0.00000 ATOM 1 N MET A 1 38.581 -25.298 22.459 1.00 70.29 N ATOM 2 CA MET A 1 37.778 -24.277 21.795 1.00 62.79 C ATOM 3 C MET A 1 36.291 -24.587 21.896 1.00 59.70 C ATOM 4 O MET A 1 35.811 -25.559 21.311 1.00 59.63 O ATOM 5 CB MET A 1 38.172 -24.153 20.323 1.00 44.96 C ATOM 6 CG MET A 1 37.469 -23.017 19.590 1.00 45.43 C ATOM 7 SD MET A 1 37.511 -23.224 17.801 1.00 68.58 S ATOM 8 CE MET A 1 38.022 -21.593 17.278 1.00 48.36 C ATOM 9 N ARG A 2 35.567 -23.755 22.638 1.00 57.15 N ATOM 10 CA ARG A 2 34.122 -23.902 22.763 1.00 44.73 C ATOM 11 C ARG A 2 33.444 -23.765 21.403 1.00 49.45 C ATOM 12 O ARG A 2 33.946 -23.072 20.517 1.00 45.57 O ATOM 13 CB ARG A 2 33.555 -22.872 23.746 1.00 53.34 C ATOM 14 CG ARG A 2 33.857 -23.173 25.208 1.00 49.57 C ATOM 15 CD ARG A 2 33.173 -22.186 26.145 1.00 47.54 C ATOM 16 NE ARG A 2 34.024 -21.043 26.468 1.00 59.29 N ATOM 17 CZ ARG A 2 33.986 -19.875 25.835 1.00 51.49 C ATOM 18 NH1 ARG A 2 33.137 -19.684 24.837 1.00 45.33 N ATOM 19 NH2 ARG A 2 34.798 -18.895 26.203 1.00 50.21 N ATOM 20 N MET A 3 32.306 -24.430 21.238 1.00 41.19 N ATOM 21 CA MET A 3 31.576 -24.372 19.975 1.00 42.92 C ATOM 22 C MET A 3 31.007 -22.981 19.716 1.00 41.80 C ATOM 23 O MET A 3 30.891 -22.555 18.568 1.00 48.65 O ATOM 24 CB MET A 3 30.464 -25.423 19.932 1.00 49.15 C ATOM 25 CG MET A 3 30.965 -26.839 19.699 1.00 52.67 C ATOM 26 SD MET A 3 31.959 -26.980 18.199 1.00 53.85 S ATOM 27 CE MET A 3 30.810 -26.374 16.966 1.00 36.69 C ATOM 28 N ASP A 4 30.657 -22.276 20.787 1.00 33.16 N ATOM 29 CA ASP A 4 30.142 -20.919 20.659 1.00 43.89 C ATOM 30 C ASP A 4 31.229 -19.995 20.122 1.00 44.71 C ATOM 31 O ASP A 4 30.936 -18.975 19.500 1.00 39.60 O ATOM 32 CB ASP A 4 29.619 -20.401 22.000 1.00 38.61 C ATOM 33 CG ASP A 4 30.729 -20.122 22.990 1.00 45.41 C ATOM 34 OD1 ASP A 4 31.281 -19.001 22.961 1.00 45.39 O ATOM 35 OD2 ASP A 4 31.046 -21.021 23.797 1.00 46.83 O ATOM 36 N GLU A 5 32.484 -20.357 20.370 1.00 36.72 N ATOM 37 CA GLU A 5 33.613 -19.616 19.827 1.00 39.59 C ATOM 38 C GLU A 5 33.781 -19.961 18.353 1.00 49.56 C ATOM 39 O GLU A 5 34.040 -19.088 17.524 1.00 52.67 O ATOM 40 CB GLU A 5 34.897 -19.953 20.588 1.00 33.29 C ATOM 41 CG GLU A 5 34.764 -19.891 22.099 1.00 53.61 C ATOM 42 CD GLU A 5 36.106 -19.928 22.806 1.00 61.69 C ATOM 43 OE1 GLU A 5 36.968 -19.078 22.495 1.00 62.90 O ATOM 44 OE2 GLU A 5 36.300 -20.810 23.669 1.00 55.68 O ATOM 45 N PHE A 6 33.628 -21.244 18.035 1.00 38.72 N ATOM 46 CA PHE A 6 33.740 -21.716 16.659 1.00 38.55 C ATOM 47 C PHE A 6 32.726 -21.021 15.756 1.00 45.18 C ATOM 48 O PHE A 6 33.081 -20.489 14.704 1.00 47.22 O ATOM 49 CB PHE A 6 33.557 -23.235 16.594 1.00 44.63 C ATOM 50 CG PHE A 6 33.530 -23.785 15.196 1.00 44.30 C ATOM 51 CD1 PHE A 6 34.707 -24.013 14.505 1.00 48.67 C ATOM 52 CD2 PHE A 6 32.327 -24.081 14.578 1.00 47.65 C ATOM 53 CE1 PHE A 6 34.685 -24.519 13.224 1.00 41.56 C ATOM 54 CE2 PHE A 6 32.300 -24.589 13.296 1.00 49.28 C ATOM 55 CZ PHE A 6 33.480 -24.808 12.619 1.00 41.36 C ATOM 56 N TYR A 7 31.466 -21.030 16.178 1.00 40.26 N ATOM 57 CA TYR A 7 30.401 -20.367 15.436 1.00 47.20 C ATOM 58 C TYR A 7 30.728 -18.897 15.192 1.00 49.72 C ATOM 59 O TYR A 7 30.515 -18.378 14.097 1.00 42.47 O ATOM 60 CB TYR A 7 29.071 -20.501 16.181 1.00 38.30 C ATOM 61 CG TYR A 7 28.390 -21.839 15.983 1.00 58.33 C ATOM 62 CD1 TYR A 7 28.971 -23.013 16.443 1.00 58.29 C ATOM 63 CD2 TYR A 7 27.161 -21.926 15.343 1.00 59.67 C ATOM 64 CE1 TYR A 7 28.353 -24.237 16.265 1.00 52.87 C ATOM 65 CE2 TYR A 7 26.533 -23.146 15.162 1.00 60.68 C ATOM 66 CZ TYR A 7 27.134 -24.298 15.625 1.00 62.98 C ATOM 67 OH TYR A 7 26.517 -25.516 15.449 1.00 59.29 O ATOM 68 N THR A 8 31.254 -18.231 16.215 1.00 43.48 N ATOM 69 CA THR A 8 31.584 -16.813 16.117 1.00 44.10 C ATOM 70 C THR A 8 32.707 -16.558 15.117 1.00 47.22 C ATOM 71 O THR A 8 32.665 -15.587 14.362 1.00 51.44 O ATOM 72 CB THR A 8 31.982 -16.227 17.485 1.00 44.95 C ATOM 73 OG1 THR A 8 30.879 -16.338 18.392 1.00 48.32 O ATOM 74 CG2 THR A 8 32.364 -14.762 17.346 1.00 40.81 C ATOM 75 N LYS A 9 33.710 -17.430 15.115 1.00 44.37 N ATOM 76 CA LYS A 9 34.831 -17.286 14.191 1.00 40.98 C ATOM 77 C LYS A 9 34.429 -17.614 12.754 1.00 48.80 C ATOM 78 O LYS A 9 34.883 -16.965 11.813 1.00 50.87 O ATOM 79 CB LYS A 9 36.021 -18.141 14.631 1.00 36.85 C ATOM 80 CG LYS A 9 36.742 -17.600 15.857 1.00 50.75 C ATOM 81 CD LYS A 9 37.999 -18.395 16.163 1.00 54.95 C ATOM 82 CE LYS A 9 38.732 -17.825 17.369 1.00 71.82 C ATOM 83 NZ LYS A 9 39.934 -18.628 17.732 1.00 76.89 N ATOM 84 N VAL A 10 33.575 -18.619 12.590 1.00 43.45 N ATOM 85 CA VAL A 10 33.063 -18.969 11.271 1.00 32.42 C ATOM 86 C VAL A 10 32.249 -17.812 10.702 1.00 40.23 C ATOM 87 O VAL A 10 32.408 -17.443 9.538 1.00 46.08 O ATOM 88 CB VAL A 10 32.195 -20.240 11.316 1.00 34.90 C ATOM 89 CG1 VAL A 10 31.502 -20.454 9.979 1.00 28.51 C ATOM 90 CG2 VAL A 10 33.045 -21.446 11.684 1.00 34.49 C ATOM 91 N TYR A 11 31.384 -17.242 11.535 1.00 44.62 N ATOM 92 CA TYR A 11 30.568 -16.099 11.141 1.00 41.96 C ATOM 93 C TYR A 11 31.443 -14.897 10.798 1.00 47.00 C ATOM 94 O TYR A 11 31.172 -14.176 9.838 1.00 55.88 O ATOM 95 CB TYR A 11 29.574 -15.740 12.249 1.00 44.72 C ATOM 96 CG TYR A 11 28.542 -16.814 12.518 1.00 41.12 C ATOM 97 CD1 TYR A 11 27.910 -16.906 13.751 1.00 45.42 C ATOM 98 CD2 TYR A 11 28.198 -17.735 11.537 1.00 32.31 C ATOM 99 CE1 TYR A 11 26.966 -17.886 14.001 1.00 39.54 C ATOM 100 CE2 TYR A 11 27.255 -18.719 11.777 1.00 40.10 C ATOM 101 CZ TYR A 11 26.643 -18.789 13.012 1.00 45.02 C ATOM 102 OH TYR A 11 25.704 -19.763 13.261 1.00 51.73 O ATOM 103 N ASP A 12 32.492 -14.687 11.587 1.00 40.91 N ATOM 104 CA ASP A 12 33.458 -13.632 11.305 1.00 41.82 C ATOM 105 C ASP A 12 34.049 -13.819 9.913 1.00 50.20 C ATOM 106 O ASP A 12 34.074 -12.889 9.107 1.00 50.12 O ATOM 107 CB ASP A 12 34.581 -13.627 12.347 1.00 54.27 C ATOM 108 CG ASP A 12 34.195 -12.903 13.623 1.00 63.12 C ATOM 109 OD1 ASP A 12 34.666 -13.312 14.706 1.00 59.63 O ATOM 110 OD2 ASP A 12 33.429 -11.920 13.543 1.00 60.32 O ATOM 111 N ALA A 13 34.517 -15.033 9.638 1.00 50.13 N ATOM 112 CA ALA A 13 35.144 -15.353 8.360 1.00 41.51 C ATOM 113 C ALA A 13 34.188 -15.183 7.182 1.00 47.58 C ATOM 114 O ALA A 13 34.553 -14.610 6.156 1.00 52.14 O ATOM 115 CB ALA A 13 35.707 -16.766 8.389 1.00 37.53 C ATOM 116 N VAL A 14 32.968 -15.689 7.330 1.00 43.75 N ATOM 117 CA VAL A 14 31.973 -15.610 6.265 1.00 42.99 C ATOM 118 C VAL A 14 31.627 -14.163 5.923 1.00 46.26 C ATOM 119 O VAL A 14 31.431 -13.823 4.755 1.00 60.36 O ATOM 120 CB VAL A 14 30.686 -16.375 6.629 1.00 46.23 C ATOM 121 CG1 VAL A 14 29.622 -16.167 5.560 1.00 35.77 C ATOM 122 CG2 VAL A 14 30.983 -17.856 6.811 1.00 50.84 C ATOM 123 N CYS A 15 31.556 -13.314 6.943 1.00 50.20 N ATOM 124 CA CYS A 15 31.261 -11.899 6.740 1.00 48.59 C ATOM 125 C CYS A 15 32.364 -11.197 5.952 1.00 50.84 C ATOM 126 O CYS A 15 32.160 -10.102 5.429 1.00 55.52 O ATOM 127 CB CYS A 15 31.046 -11.190 8.079 1.00 43.86 C ATOM 128 SG CYS A 15 29.495 -11.602 8.907 1.00 60.70 S ATOM 129 N GLU A 16 33.531 -11.830 5.873 1.00 52.44 N ATOM 130 CA GLU A 16 34.662 -11.263 5.145 1.00 53.69 C ATOM 131 C GLU A 16 34.574 -11.550 3.649 1.00 58.28 C ATOM 132 O GLU A 16 35.119 -10.804 2.835 1.00 51.79 O ATOM 133 CB GLU A 16 35.988 -11.787 5.703 1.00 56.91 C ATOM 134 CG GLU A 16 36.257 -11.408 7.151 1.00 58.68 C ATOM 135 CD GLU A 16 37.695 -11.668 7.562 1.00 76.22 C ATOM 136 OE1 GLU A 16 37.911 -12.440 8.519 1.00 74.07 O ATOM 137 OE2 GLU A 16 38.609 -11.097 6.929 1.00 82.71 O ATOM 138 N ILE A 17 33.893 -12.635 3.291 1.00 56.38 N ATOM 139 CA ILE A 17 33.706 -12.988 1.887 1.00 53.39 C ATOM 140 C ILE A 17 33.085 -11.817 1.134 1.00 51.29 C ATOM 141 O ILE A 17 31.947 -11.433 1.403 1.00 51.18 O ATOM 142 CB ILE A 17 32.812 -14.231 1.721 1.00 50.22 C ATOM 143 CG1 ILE A 17 33.324 -15.380 2.591 1.00 45.34 C ATOM 144 CG2 ILE A 17 32.751 -14.652 0.259 1.00 40.85 C ATOM 145 CD1 ILE A 17 32.471 -16.628 2.517 1.00 40.74 C ATOM 146 N PRO A 18 33.838 -11.244 0.186 1.00 51.53 N ATOM 147 CA PRO A 18 33.422 -10.050 -0.557 1.00 50.47 C ATOM 148 C PRO A 18 32.218 -10.299 -1.458 1.00 52.34 C ATOM 149 O PRO A 18 32.122 -11.348 -2.094 1.00 52.23 O ATOM 150 CB PRO A 18 34.654 -9.723 -1.406 1.00 42.63 C ATOM 151 CG PRO A 18 35.360 -11.026 -1.558 1.00 63.10 C ATOM 152 CD PRO A 18 35.155 -11.734 -0.253 1.00 52.93 C ATOM 153 N TYR A 19 31.313 -9.328 -1.497 1.00 64.13 N ATOM 154 CA TYR A 19 30.157 -9.365 -2.382 1.00 61.82 C ATOM 155 C TYR A 19 30.576 -9.795 -3.785 1.00 57.64 C ATOM 156 O TYR A 19 31.522 -9.251 -4.354 1.00 54.65 O ATOM 157 CB TYR A 19 29.503 -7.981 -2.424 1.00 57.65 C ATOM 158 CG TYR A 19 28.321 -7.859 -3.358 1.00 63.55 C ATOM 159 CD1 TYR A 19 28.501 -7.781 -4.733 1.00 62.34 C ATOM 160 CD2 TYR A 19 27.024 -7.795 -2.863 1.00 68.72 C ATOM 161 CE1 TYR A 19 27.424 -7.661 -5.589 1.00 68.44 C ATOM 162 CE2 TYR A 19 25.940 -7.673 -3.713 1.00 61.33 C ATOM 163 CZ TYR A 19 26.147 -7.606 -5.075 1.00 72.25 C ATOM 164 OH TYR A 19 25.072 -7.484 -5.926 1.00 77.25 O ATOM 165 N GLY A 20 29.877 -10.782 -4.335 1.00 63.45 N ATOM 166 CA GLY A 20 30.170 -11.261 -5.673 1.00 56.21 C ATOM 167 C GLY A 20 31.108 -12.452 -5.706 1.00 50.93 C ATOM 168 O GLY A 20 31.312 -13.060 -6.756 1.00 57.34 O ATOM 169 N LYS A 21 31.681 -12.788 -4.555 1.00 60.96 N ATOM 170 CA LYS A 21 32.565 -13.943 -4.454 1.00 59.12 C ATOM 171 C LYS A 21 32.003 -15.011 -3.520 1.00 52.30 C ATOM 172 O LYS A 21 31.079 -14.753 -2.750 1.00 60.24 O ATOM 173 CB LYS A 21 33.957 -13.521 -3.980 1.00 57.17 C ATOM 174 CG LYS A 21 35.003 -13.501 -5.077 1.00 63.92 C ATOM 175 CD LYS A 21 34.948 -12.216 -5.878 1.00 56.69 C ATOM 176 CE LYS A 21 35.649 -12.381 -7.217 1.00 78.93 C ATOM 177 NZ LYS A 21 36.943 -13.113 -7.092 1.00 80.54 N ATOM 178 N VAL A 22 32.570 -16.211 -3.593 1.00 42.22 N ATOM 179 CA VAL A 22 32.138 -17.315 -2.745 1.00 47.90 C ATOM 180 C VAL A 22 33.332 -18.003 -2.095 1.00 51.98 C ATOM 181 O VAL A 22 34.475 -17.810 -2.509 1.00 51.04 O ATOM 182 CB VAL A 22 31.339 -18.364 -3.542 1.00 42.39 C ATOM 183 CG1 VAL A 22 30.196 -17.702 -4.298 1.00 48.34 C ATOM 184 CG2 VAL A 22 32.254 -19.112 -4.499 1.00 43.31 C ATOM 185 N SER A 23 33.059 -18.803 -1.070 1.00 45.03 N ATOM 186 CA SER A 23 34.093 -19.603 -0.425 1.00 38.23 C ATOM 187 C SER A 23 33.596 -21.030 -0.237 1.00 36.19 C ATOM 188 O SER A 23 32.535 -21.396 -0.740 1.00 39.89 O ATOM 189 CB SER A 23 34.500 -18.997 0.917 1.00 45.56 C ATOM 190 OG SER A 23 35.637 -19.657 1.444 1.00 49.20 O ATOM 191 N THR A 24 34.363 -21.831 0.493 1.00 39.49 N ATOM 192 CA THR A 24 34.047 -23.244 0.663 1.00 36.25 C ATOM 193 C THR A 24 33.999 -23.640 2.136 1.00 38.53 C ATOM 194 O THR A 24 34.773 -23.131 2.946 1.00 50.55 O ATOM 195 CB THR A 24 35.075 -24.128 -0.076 1.00 34.12 C ATOM 196 OG1 THR A 24 34.714 -24.233 -1.459 1.00 42.90 O ATOM 197 CG2 THR A 24 35.131 -25.517 0.531 1.00 46.19 C ATOM 198 N TYR A 25 33.083 -24.543 2.478 1.00 36.21 N ATOM 199 CA TYR A 25 32.984 -25.053 3.842 1.00 31.57 C ATOM 200 C TYR A 25 34.364 -25.448 4.357 1.00 39.40 C ATOM 201 O TYR A 25 34.766 -25.060 5.454 1.00 41.46 O ATOM 202 CB TYR A 25 32.046 -26.262 3.906 1.00 31.39 C ATOM 203 CG TYR A 25 30.642 -26.000 3.402 1.00 36.99 C ATOM 204 CD1 TYR A 25 30.246 -26.423 2.139 1.00 43.21 C ATOM 205 CD2 TYR A 25 29.712 -25.336 4.191 1.00 40.22 C ATOM 206 CE1 TYR A 25 28.965 -26.189 1.675 1.00 44.12 C ATOM 207 CE2 TYR A 25 28.427 -25.096 3.735 1.00 38.01 C ATOM 208 CZ TYR A 25 28.060 -25.525 2.477 1.00 44.20 C ATOM 209 OH TYR A 25 26.784 -25.290 2.019 1.00 45.70 O ATOM 210 N GLY A 26 35.087 -26.220 3.551 1.00 34.85 N ATOM 211 CA GLY A 26 36.421 -26.669 3.906 1.00 36.14 C ATOM 212 C GLY A 26 37.397 -25.524 4.088 1.00 36.86 C ATOM 213 O GLY A 26 38.222 -25.541 5.000 1.00 39.75 O ATOM 214 N GLU A 27 37.306 -24.526 3.216 1.00 37.72 N ATOM 215 CA GLU A 27 38.171 -23.356 3.305 1.00 38.05 C ATOM 216 C GLU A 27 37.947 -22.585 4.599 1.00 40.39 C ATOM 217 O GLU A 27 38.891 -22.319 5.341 1.00 46.90 O ATOM 218 CB GLU A 27 37.965 -22.436 2.103 1.00 40.52 C ATOM 219 CG GLU A 27 39.019 -22.602 1.029 1.00 61.21 C ATOM 220 CD GLU A 27 40.414 -22.295 1.539 1.00 67.96 C ATOM 221 OE1 GLU A 27 40.664 -21.133 1.928 1.00 57.67 O ATOM 222 OE2 GLU A 27 41.255 -23.218 1.558 1.00 57.06 O ATOM 223 N ILE A 28 36.695 -22.225 4.861 1.00 39.82 N ATOM 224 CA ILE A 28 36.341 -21.516 6.085 1.00 39.94 C ATOM 225 C ILE A 28 36.781 -22.306 7.313 1.00 33.46 C ATOM 226 O ILE A 28 37.220 -21.732 8.309 1.00 34.47 O ATOM 227 CB ILE A 28 34.826 -21.245 6.162 1.00 38.48 C ATOM 228 CG1 ILE A 28 34.385 -20.358 4.996 1.00 31.31 C ATOM 229 CG2 ILE A 28 34.464 -20.598 7.490 1.00 32.86 C ATOM 230 CD1 ILE A 28 35.015 -18.982 5.001 1.00 38.25 C ATOM 231 N ALA A 29 36.666 -23.627 7.234 1.00 32.47 N ATOM 232 CA ALA A 29 37.083 -24.494 8.329 1.00 30.57 C ATOM 233 C ALA A 29 38.590 -24.408 8.550 1.00 39.11 C ATOM 234 O ALA A 29 39.058 -24.375 9.686 1.00 41.38 O ATOM 235 CB ALA A 29 36.662 -25.930 8.061 1.00 31.90 C ATOM 236 N ARG A 30 39.342 -24.376 7.454 1.00 40.17 N ATOM 237 CA ARG A 30 40.794 -24.250 7.518 1.00 34.23 C ATOM 238 C ARG A 30 41.198 -22.832 7.911 1.00 36.16 C ATOM 239 O ARG A 30 42.161 -22.630 8.649 1.00 37.17 O ATOM 240 CB ARG A 30 41.423 -24.621 6.173 1.00 30.47 C ATOM 241 CG ARG A 30 41.317 -26.099 5.821 1.00 41.28 C ATOM 242 CD ARG A 30 42.020 -26.418 4.508 1.00 32.77 C ATOM 243 NE ARG A 30 41.293 -25.914 3.346 1.00 50.17 N ATOM 244 CZ ARG A 30 40.443 -26.639 2.625 1.00 54.50 C ATOM 245 NH1 ARG A 30 40.211 -27.905 2.945 1.00 36.73 N ATOM 246 NH2 ARG A 30 39.825 -26.101 1.582 1.00 45.09 N ATOM 247 N TYR A 31 40.449 -21.855 7.414 1.00 37.82 N ATOM 248 CA TYR A 31 40.717 -20.447 7.684 1.00 40.13 C ATOM 249 C TYR A 31 40.653 -20.133 9.177 1.00 44.12 C ATOM 250 O TYR A 31 41.405 -19.295 9.674 1.00 49.77 O ATOM 251 CB TYR A 31 39.720 -19.572 6.919 1.00 46.91 C ATOM 252 CG TYR A 31 39.926 -18.081 7.082 1.00 50.30 C ATOM 253 CD1 TYR A 31 40.632 -17.351 6.135 1.00 63.06 C ATOM 254 CD2 TYR A 31 39.400 -17.402 8.173 1.00 51.94 C ATOM 255 CE1 TYR A 31 40.817 -15.987 6.274 1.00 53.85 C ATOM 256 CE2 TYR A 31 39.580 -16.040 8.322 1.00 61.76 C ATOM 257 CZ TYR A 31 40.288 -15.337 7.370 1.00 67.35 C ATOM 258 OH TYR A 31 40.467 -13.981 7.516 1.00 70.24 O ATOM 259 N VAL A 32 39.754 -20.807 9.887 1.00 35.62 N ATOM 260 CA VAL A 32 39.570 -20.558 11.314 1.00 36.88 C ATOM 261 C VAL A 32 40.369 -21.529 12.183 1.00 46.04 C ATOM 262 O VAL A 32 40.233 -21.533 13.405 1.00 46.54 O ATOM 263 CB VAL A 32 38.081 -20.610 11.716 1.00 34.16 C ATOM 264 CG1 VAL A 32 37.270 -19.637 10.871 1.00 42.35 C ATOM 265 CG2 VAL A 32 37.541 -22.023 11.575 1.00 34.04 C ATOM 266 N GLY A 33 41.196 -22.352 11.546 1.00 43.89 N ATOM 267 CA GLY A 33 42.106 -23.228 12.264 1.00 32.40 C ATOM 268 C GLY A 33 41.545 -24.587 12.645 1.00 42.63 C ATOM 269 O GLY A 33 42.076 -25.254 13.531 1.00 44.89 O ATOM 270 N MET A 34 40.474 -25.001 11.975 1.00 44.90 N ATOM 271 CA MET A 34 39.852 -26.293 12.251 1.00 41.32 C ATOM 272 C MET A 34 39.603 -27.062 10.956 1.00 44.08 C ATOM 273 O MET A 34 38.465 -27.163 10.498 1.00 44.88 O ATOM 274 CB MET A 34 38.541 -26.097 13.015 1.00 38.29 C ATOM 275 CG MET A 34 38.672 -25.221 14.255 1.00 43.09 C ATOM 276 SD MET A 34 38.763 -26.146 15.803 1.00 51.54 S ATOM 277 CE MET A 34 40.139 -27.245 15.484 1.00 61.14 C ATOM 278 N PRO A 35 40.677 -27.612 10.367 1.00 48.65 N ATOM 279 CA PRO A 35 40.672 -28.285 9.061 1.00 46.63 C ATOM 280 C PRO A 35 39.634 -29.400 8.935 1.00 41.89 C ATOM 281 O PRO A 35 39.146 -29.658 7.834 1.00 43.44 O ATOM 282 CB PRO A 35 42.081 -28.882 8.974 1.00 42.95 C ATOM 283 CG PRO A 35 42.913 -28.000 9.834 1.00 43.08 C ATOM 284 CD PRO A 35 42.021 -27.601 10.972 1.00 35.72 C ATOM 285 N SER A 36 39.304 -30.051 10.044 1.00 36.30 N ATOM 286 CA SER A 36 38.413 -31.207 10.012 1.00 42.72 C ATOM 287 C SER A 36 36.950 -30.840 10.249 1.00 38.53 C ATOM 288 O SER A 36 36.089 -31.717 10.318 1.00 37.10 O ATOM 289 CB SER A 36 38.858 -32.242 11.046 1.00 41.64 C ATOM 290 OG SER A 36 38.902 -31.672 12.344 1.00 48.74 O ATOM 291 N TYR A 37 36.668 -29.547 10.364 1.00 33.53 N ATOM 292 CA TYR A 37 35.327 -29.094 10.725 1.00 36.66 C ATOM 293 C TYR A 37 34.521 -28.519 9.563 1.00 37.25 C ATOM 294 O TYR A 37 33.827 -27.515 9.720 1.00 41.03 O ATOM 295 CB TYR A 37 35.398 -28.082 11.871 1.00 39.15 C ATOM 296 CG TYR A 37 35.619 -28.719 13.223 1.00 42.58 C ATOM 297 CD1 TYR A 37 34.671 -28.601 14.230 1.00 46.59 C ATOM 298 CD2 TYR A 37 36.769 -29.451 13.488 1.00 45.38 C ATOM 299 CE1 TYR A 37 34.866 -29.183 15.467 1.00 50.52 C ATOM 300 CE2 TYR A 37 36.973 -30.038 14.720 1.00 46.58 C ATOM 301 CZ TYR A 37 36.019 -29.902 15.706 1.00 51.87 C ATOM 302 OH TYR A 37 36.217 -30.484 16.935 1.00 54.23 O ATOM 303 N ALA A 38 34.603 -29.163 8.404 1.00 38.43 N ATOM 304 CA ALA A 38 33.833 -28.733 7.242 1.00 30.88 C ATOM 305 C ALA A 38 32.333 -28.877 7.488 1.00 38.93 C ATOM 306 O ALA A 38 31.556 -27.971 7.188 1.00 36.03 O ATOM 307 CB ALA A 38 34.247 -29.517 6.007 1.00 40.20 C ATOM 308 N ARG A 39 31.932 -30.020 8.036 1.00 37.11 N ATOM 309 CA ARG A 39 30.521 -30.291 8.293 1.00 29.61 C ATOM 310 C ARG A 39 29.961 -29.318 9.326 1.00 37.12 C ATOM 311 O ARG A 39 28.838 -28.832 9.192 1.00 43.62 O ATOM 312 CB ARG A 39 30.325 -31.735 8.764 1.00 32.36 C ATOM 313 CG ARG A 39 31.107 -32.764 7.959 1.00 40.64 C ATOM 314 CD ARG A 39 30.678 -34.191 8.281 1.00 38.61 C ATOM 315 NE ARG A 39 29.367 -34.510 7.721 1.00 39.22 N ATOM 316 CZ ARG A 39 28.882 -35.742 7.601 1.00 46.62 C ATOM 317 NH1 ARG A 39 27.679 -35.935 7.078 1.00 39.34 N ATOM 318 NH2 ARG A 39 29.601 -36.783 8.000 1.00 40.01 N ATOM 319 N GLN A 40 30.754 -29.039 10.355 1.00 35.08 N ATOM 320 CA GLN A 40 30.354 -28.121 11.415 1.00 36.04 C ATOM 321 C GLN A 40 30.153 -26.706 10.881 1.00 37.57 C ATOM 322 O GLN A 40 29.305 -25.962 11.376 1.00 30.21 O ATOM 323 CB GLN A 40 31.382 -28.128 12.550 1.00 34.36 C ATOM 324 CG GLN A 40 31.370 -29.399 13.396 1.00 30.97 C ATOM 325 CD GLN A 40 31.787 -30.637 12.619 1.00 34.24 C ATOM 326 OE1 GLN A 40 31.328 -31.745 12.899 1.00 42.34 O ATOM 327 NE2 GLN A 40 32.671 -30.456 11.647 1.00 43.06 N ATOM 328 N VAL A 41 30.937 -26.338 9.872 1.00 35.37 N ATOM 329 CA VAL A 41 30.756 -25.056 9.205 1.00 38.57 C ATOM 330 C VAL A 41 29.391 -25.032 8.532 1.00 31.23 C ATOM 331 O VAL A 41 28.718 -24.001 8.499 1.00 36.02 O ATOM 332 CB VAL A 41 31.854 -24.796 8.159 1.00 33.34 C ATOM 333 CG1 VAL A 41 31.541 -23.538 7.361 1.00 24.30 C ATOM 334 CG2 VAL A 41 33.209 -24.678 8.835 1.00 23.03 C ATOM 335 N GLY A 42 28.986 -26.181 8.000 1.00 35.03 N ATOM 336 CA GLY A 42 27.664 -26.327 7.424 1.00 30.72 C ATOM 337 C GLY A 42 26.598 -26.125 8.482 1.00 35.28 C ATOM 338 O GLY A 42 25.610 -25.430 8.255 1.00 39.82 O ATOM 339 N GLN A 43 26.806 -26.734 9.646 1.00 39.22 N ATOM 340 CA GLN A 43 25.895 -26.570 10.773 1.00 35.98 C ATOM 341 C GLN A 43 25.741 -25.097 11.126 1.00 43.50 C ATOM 342 O GLN A 43 24.628 -24.599 11.290 1.00 53.31 O ATOM 343 CB GLN A 43 26.405 -27.336 11.995 1.00 44.14 C ATOM 344 CG GLN A 43 26.468 -28.842 11.820 1.00 47.93 C ATOM 345 CD GLN A 43 27.037 -29.544 13.040 1.00 63.65 C ATOM 346 OE1 GLN A 43 27.607 -28.907 13.927 1.00 63.67 O ATOM 347 NE2 GLN A 43 26.882 -30.862 13.091 1.00 51.59 N ATOM 348 N ALA A 44 26.872 -24.407 11.235 1.00 38.02 N ATOM 349 CA ALA A 44 26.888 -22.993 11.592 1.00 36.85 C ATOM 350 C ALA A 44 25.964 -22.168 10.701 1.00 43.06 C ATOM 351 O ALA A 44 25.260 -21.280 11.177 1.00 43.61 O ATOM 352 CB ALA A 44 28.308 -22.449 11.528 1.00 34.09 C ATOM 353 N MET A 45 25.975 -22.464 9.407 1.00 35.55 N ATOM 354 CA MET A 45 25.130 -21.756 8.456 1.00 42.95 C ATOM 355 C MET A 45 23.665 -22.060 8.734 1.00 45.17 C ATOM 356 O MET A 45 22.820 -21.164 8.757 1.00 47.08 O ATOM 357 CB MET A 45 25.483 -22.164 7.026 1.00 36.80 C ATOM 358 CG MET A 45 26.932 -21.913 6.635 1.00 35.91 C ATOM 359 SD MET A 45 27.397 -20.171 6.689 1.00 40.28 S ATOM 360 CE MET A 45 28.063 -20.035 8.347 1.00 31.31 C ATOM 361 N LYS A 46 23.378 -23.339 8.948 1.00 40.01 N ATOM 362 CA LYS A 46 22.025 -23.805 9.214 1.00 40.30 C ATOM 363 C LYS A 46 21.453 -23.155 10.468 1.00 45.54 C ATOM 364 O LYS A 46 20.310 -22.699 10.484 1.00 50.13 O ATOM 365 CB LYS A 46 22.039 -25.323 9.392 1.00 34.86 C ATOM 366 CG LYS A 46 20.744 -26.013 9.030 1.00 36.13 C ATOM 367 CD LYS A 46 20.831 -27.504 9.310 1.00 47.72 C ATOM 368 CE LYS A 46 19.830 -28.276 8.470 1.00 57.25 C ATOM 369 NZ LYS A 46 20.132 -28.140 7.015 1.00 64.47 N ATOM 370 N HIS A 47 22.270 -23.111 11.515 1.00 48.09 N ATOM 371 CA AHIS A 47 21.809 -22.613 12.807 0.50 46.77 C ATOM 372 CA BHIS A 47 21.874 -22.605 12.825 0.50 46.81 C ATOM 373 C HIS A 47 21.610 -21.098 12.817 1.00 46.22 C ATOM 374 O HIS A 47 21.159 -20.533 13.812 1.00 63.55 O ATOM 375 CB AHIS A 47 22.754 -23.056 13.927 0.50 46.78 C ATOM 376 CB BHIS A 47 22.966 -22.943 13.849 0.50 46.58 C ATOM 377 CG AHIS A 47 22.820 -24.541 14.104 0.50 49.33 C ATOM 378 CG BHIS A 47 22.582 -22.670 15.268 0.50 52.82 C ATOM 379 ND1AHIS A 47 22.295 -25.425 13.181 0.50 45.85 N ATOM 380 ND1BHIS A 47 22.640 -21.410 15.827 0.50 53.51 N ATOM 381 CD2AHIS A 47 23.343 -25.300 15.092 0.50 50.91 C ATOM 382 CD2BHIS A 47 22.153 -23.496 16.251 0.50 48.29 C ATOM 383 CE1AHIS A 47 22.496 -26.658 13.594 0.50 41.04 C ATOM 384 CE1BHIS A 47 22.253 -21.473 17.088 0.50 45.63 C ATOM 385 NE2AHIS A 47 23.130 -26.617 14.754 0.50 53.31 N ATOM 386 NE2BHIS A 47 21.953 -22.728 17.370 0.50 44.62 N ATOM 387 N LEU A 48 21.924 -20.448 11.701 1.00 48.70 N ATOM 388 CA LEU A 48 21.737 -19.006 11.577 1.00 54.55 C ATOM 389 C LEU A 48 20.263 -18.621 11.515 1.00 72.32 C ATOM 390 O LEU A 48 19.448 -19.341 10.940 1.00 67.25 O ATOM 391 CB LEU A 48 22.456 -18.478 10.335 1.00 51.61 C ATOM 392 CG LEU A 48 23.952 -18.193 10.456 1.00 61.65 C ATOM 393 CD1 LEU A 48 24.556 -17.891 9.093 1.00 43.97 C ATOM 394 CD2 LEU A 48 24.192 -17.041 11.420 1.00 43.19 C ATOM 395 N HIS A 49 19.930 -17.478 12.109 1.00 69.55 N ATOM 396 CA HIS A 49 18.584 -16.926 12.007 1.00 75.25 C ATOM 397 C HIS A 49 18.371 -16.325 10.621 1.00 68.25 C ATOM 398 O HIS A 49 19.278 -15.713 10.062 1.00 75.27 O ATOM 399 CB HIS A 49 18.347 -15.866 13.085 1.00 77.89 C ATOM 400 CG HIS A 49 18.093 -16.432 14.448 1.00 99.22 C ATOM 401 ND1 HIS A 49 18.397 -15.749 15.606 1.00 95.91 N ATOM 402 CD2 HIS A 49 17.556 -17.612 14.838 1.00 87.45 C ATOM 403 CE1 HIS A 49 18.063 -16.485 16.650 1.00 86.27 C ATOM 404 NE2 HIS A 49 17.550 -17.621 16.212 1.00 98.17 N ATOM 405 N PRO A 50 17.166 -16.503 10.062 1.00 70.85 N ATOM 406 CA PRO A 50 16.840 -16.059 8.700 1.00 70.42 C ATOM 407 C PRO A 50 17.076 -14.566 8.471 1.00 60.40 C ATOM 408 O PRO A 50 17.320 -14.158 7.334 1.00 81.93 O ATOM 409 CB PRO A 50 15.347 -16.380 8.579 1.00 67.42 C ATOM 410 CG PRO A 50 15.123 -17.486 9.544 1.00 82.17 C ATOM 411 CD PRO A 50 16.035 -17.199 10.699 1.00 77.60 C ATOM 412 N GLU A 51 17.006 -13.767 9.530 1.00 59.67 N ATOM 413 CA GLU A 51 17.165 -12.321 9.400 1.00 61.11 C ATOM 414 C GLU A 51 18.622 -11.895 9.544 1.00 67.30 C ATOM 415 O GLU A 51 18.915 -10.711 9.706 1.00 65.95 O ATOM 416 CB GLU A 51 16.310 -11.587 10.435 1.00 69.09 C ATOM 417 CG GLU A 51 15.098 -12.367 10.910 1.00 73.70 C ATOM 418 CD GLU A 51 15.410 -13.272 12.088 1.00 89.93 C ATOM 419 OE1 GLU A 51 15.046 -14.466 12.035 1.00 79.08 O ATOM 420 OE2 GLU A 51 16.013 -12.788 13.069 1.00 94.67 O ATOM 421 N THR A 52 19.530 -12.864 9.479 1.00 64.85 N ATOM 422 CA THR A 52 20.952 -12.598 9.669 1.00 57.93 C ATOM 423 C THR A 52 21.544 -11.779 8.527 1.00 55.65 C ATOM 424 O THR A 52 21.056 -11.823 7.397 1.00 59.91 O ATOM 425 CB THR A 52 21.759 -13.905 9.805 1.00 56.45 C ATOM 426 OG1 THR A 52 23.130 -13.600 10.092 1.00 55.97 O ATOM 427 CG2 THR A 52 21.681 -14.713 8.520 1.00 54.49 C ATOM 428 N HIS A 53 22.600 -11.033 8.836 1.00 64.11 N ATOM 429 CA HIS A 53 23.328 -10.278 7.826 1.00 57.57 C ATOM 430 C HIS A 53 24.617 -11.002 7.459 1.00 59.47 C ATOM 431 O HIS A 53 25.461 -10.468 6.737 1.00 64.28 O ATOM 432 CB HIS A 53 23.625 -8.861 8.318 1.00 63.94 C ATOM 433 CG HIS A 53 22.406 -8.005 8.461 1.00 89.28 C ATOM 434 ND1 HIS A 53 21.998 -7.121 7.485 1.00 93.57 N ATOM 435 CD2 HIS A 53 21.502 -7.901 9.464 1.00 86.32 C ATOM 436 CE1 HIS A 53 20.898 -6.507 7.882 1.00102.09 C ATOM 437 NE2 HIS A 53 20.575 -6.963 9.079 1.00 99.41 N ATOM 438 N VAL A 54 24.759 -12.221 7.972 1.00 57.50 N ATOM 439 CA VAL A 54 25.866 -13.090 7.600 1.00 54.52 C ATOM 440 C VAL A 54 25.566 -13.718 6.245 1.00 52.52 C ATOM 441 O VAL A 54 24.555 -14.405 6.087 1.00 49.82 O ATOM 442 CB VAL A 54 26.085 -14.206 8.638 1.00 55.57 C ATOM 443 CG1 VAL A 54 27.255 -15.088 8.227 1.00 43.44 C ATOM 444 CG2 VAL A 54 26.320 -13.610 10.017 1.00 40.15 C ATOM 445 N PRO A 55 26.446 -13.477 5.261 1.00 47.04 N ATOM 446 CA PRO A 55 26.253 -13.934 3.879 1.00 45.77 C ATOM 447 C PRO A 55 26.473 -15.435 3.718 1.00 46.74 C ATOM 448 O PRO A 55 27.397 -15.854 3.022 1.00 46.40 O ATOM 449 CB PRO A 55 27.325 -13.161 3.111 1.00 50.58 C ATOM 450 CG PRO A 55 28.413 -12.952 4.110 1.00 51.09 C ATOM 451 CD PRO A 55 27.715 -12.746 5.430 1.00 50.83 C ATOM 452 N TRP A 56 25.618 -16.231 4.352 1.00 39.79 N ATOM 453 CA TRP A 56 25.719 -17.684 4.285 1.00 44.22 C ATOM 454 C TRP A 56 25.632 -18.194 2.850 1.00 49.06 C ATOM 455 O TRP A 56 26.168 -19.253 2.525 1.00 41.31 O ATOM 456 CB TRP A 56 24.621 -18.331 5.133 1.00 42.89 C ATOM 457 CG TRP A 56 23.240 -17.863 4.779 1.00 46.66 C ATOM 458 CD1 TRP A 56 22.553 -16.830 5.348 1.00 42.07 C ATOM 459 CD2 TRP A 56 22.379 -18.412 3.774 1.00 45.95 C ATOM 460 NE1 TRP A 56 21.318 -16.702 4.760 1.00 58.29 N ATOM 461 CE2 TRP A 56 21.186 -17.661 3.791 1.00 54.34 C ATOM 462 CE3 TRP A 56 22.499 -19.465 2.861 1.00 48.75 C ATOM 463 CZ2 TRP A 56 20.123 -17.929 2.932 1.00 52.56 C ATOM 464 CZ3 TRP A 56 21.441 -19.729 2.009 1.00 49.54 C ATOM 465 CH2 TRP A 56 20.269 -18.964 2.051 1.00 53.21 C ATOM 466 N HIS A 57 24.956 -17.433 1.996 1.00 45.41 N ATOM 467 CA HIS A 57 24.736 -17.835 0.611 1.00 48.33 C ATOM 468 C HIS A 57 26.029 -17.874 -0.197 1.00 48.11 C ATOM 469 O HIS A 57 26.055 -18.380 -1.319 1.00 41.84 O ATOM 470 CB HIS A 57 23.727 -16.899 -0.060 1.00 41.02 C ATOM 471 CG HIS A 57 24.091 -15.450 0.037 1.00 41.23 C ATOM 472 ND1 HIS A 57 23.887 -14.707 1.179 1.00 47.43 N ATOM 473 CD2 HIS A 57 24.643 -14.606 -0.867 1.00 46.18 C ATOM 474 CE1 HIS A 57 24.298 -13.467 0.976 1.00 50.08 C ATOM 475 NE2 HIS A 57 24.761 -13.381 -0.259 1.00 52.61 N ATOM 476 N ARG A 58 27.102 -17.345 0.380 1.00 45.09 N ATOM 477 CA ARG A 58 28.382 -17.269 -0.313 1.00 42.02 C ATOM 478 C ARG A 58 29.300 -18.440 0.035 1.00 40.65 C ATOM 479 O ARG A 58 30.463 -18.470 -0.363 1.00 47.66 O ATOM 480 CB ARG A 58 29.068 -15.936 -0.006 1.00 37.02 C ATOM 481 CG ARG A 58 28.209 -14.719 -0.331 1.00 40.75 C ATOM 482 CD ARG A 58 29.043 -13.564 -0.870 1.00 48.08 C ATOM 483 NE ARG A 58 29.417 -12.599 0.160 1.00 48.50 N ATOM 484 CZ ARG A 58 28.761 -11.465 0.391 1.00 53.42 C ATOM 485 NH1 ARG A 58 27.697 -11.155 -0.336 1.00 45.73 N ATOM 486 NH2 ARG A 58 29.167 -10.640 1.347 1.00 45.11 N ATOM 487 N VAL A 59 28.768 -19.406 0.777 1.00 34.16 N ATOM 488 CA VAL A 59 29.528 -20.595 1.146 1.00 33.63 C ATOM 489 C VAL A 59 28.973 -21.842 0.459 1.00 39.50 C ATOM 490 O VAL A 59 27.903 -22.332 0.818 1.00 44.87 O ATOM 491 CB VAL A 59 29.521 -20.816 2.670 1.00 33.45 C ATOM 492 CG1 VAL A 59 30.395 -22.006 3.034 1.00 34.61 C ATOM 493 CG2 VAL A 59 29.992 -19.562 3.389 1.00 36.30 C ATOM 494 N ILE A 60 29.704 -22.349 -0.530 1.00 41.36 N ATOM 495 CA ILE A 60 29.298 -23.553 -1.249 1.00 31.87 C ATOM 496 C ILE A 60 30.271 -24.694 -0.969 1.00 45.04 C ATOM 497 O ILE A 60 31.161 -24.562 -0.130 1.00 41.67 O ATOM 498 CB ILE A 60 29.208 -23.305 -2.765 1.00 40.62 C ATOM 499 CG1 ILE A 60 30.599 -23.075 -3.357 1.00 47.74 C ATOM 500 CG2 ILE A 60 28.303 -22.118 -3.054 1.00 33.33 C ATOM 501 CD1 ILE A 60 30.593 -22.851 -4.854 1.00 41.20 C ATOM 502 N ASN A 61 30.102 -25.813 -1.667 1.00 36.83 N ATOM 503 CA ASN A 61 30.951 -26.984 -1.447 1.00 37.52 C ATOM 504 C ASN A 61 32.232 -26.966 -2.281 1.00 41.30 C ATOM 505 O ASN A 61 32.369 -26.163 -3.203 1.00 36.54 O ATOM 506 CB ASN A 61 30.168 -28.282 -1.683 1.00 39.03 C ATOM 507 CG ASN A 61 29.733 -28.458 -3.130 1.00 54.70 C ATOM 508 OD1 ASN A 61 30.420 -28.030 -4.059 1.00 47.29 O ATOM 509 ND2 ASN A 61 28.582 -29.093 -3.325 1.00 49.74 N ATOM 510 N SER A 62 33.161 -27.861 -1.954 1.00 44.35 N ATOM 511 CA SER A 62 34.460 -27.906 -2.620 1.00 39.37 C ATOM 512 C SER A 62 34.354 -28.237 -4.105 1.00 40.40 C ATOM 513 O SER A 62 35.293 -28.007 -4.866 1.00 57.44 O ATOM 514 CB SER A 62 35.378 -28.921 -1.935 1.00 44.10 C ATOM 515 OG SER A 62 35.662 -28.539 -0.601 1.00 50.52 O ATOM 516 N ARG A 63 33.213 -28.783 -4.509 1.00 43.74 N ATOM 517 CA ARG A 63 32.992 -29.163 -5.900 1.00 40.09 C ATOM 518 C ARG A 63 32.447 -28.001 -6.723 1.00 38.19 C ATOM 519 O ARG A 63 32.185 -28.144 -7.917 1.00 48.37 O ATOM 520 CB ARG A 63 32.045 -30.361 -5.980 1.00 39.88 C ATOM 521 CG ARG A 63 32.657 -31.664 -5.499 1.00 41.10 C ATOM 522 CD ARG A 63 31.610 -32.757 -5.386 1.00 60.61 C ATOM 523 NE ARG A 63 30.575 -32.628 -6.407 1.00 60.81 N ATOM 524 CZ ARG A 63 29.353 -32.161 -6.173 1.00 74.12 C ATOM 525 NH1 ARG A 63 29.007 -31.789 -4.948 1.00 63.52 N ATOM 526 NH2 ARG A 63 28.476 -32.072 -7.163 1.00 71.09 N ATOM 527 N GLY A 64 32.276 -26.851 -6.079 1.00 45.83 N ATOM 528 CA GLY A 64 31.814 -25.657 -6.761 1.00 44.31 C ATOM 529 C GLY A 64 30.325 -25.656 -7.056 1.00 47.13 C ATOM 530 O GLY A 64 29.848 -24.873 -7.877 1.00 46.20 O ATOM 531 N THR A 65 29.588 -26.536 -6.386 1.00 47.09 N ATOM 532 CA THR A 65 28.142 -26.612 -6.564 1.00 45.01 C ATOM 533 C THR A 65 27.418 -26.288 -5.262 1.00 46.07 C ATOM 534 O THR A 65 28.020 -26.288 -4.189 1.00 41.31 O ATOM 535 CB THR A 65 27.700 -28.006 -7.042 1.00 48.43 C ATOM 536 OG1 THR A 65 27.675 -28.913 -5.934 1.00 47.84 O ATOM 537 CG2 THR A 65 28.651 -28.530 -8.108 1.00 53.80 C ATOM 538 N ILE A 66 26.123 -26.011 -5.361 1.00 50.68 N ATOM 539 CA ILE A 66 25.310 -25.738 -4.182 1.00 41.93 C ATOM 540 C ILE A 66 24.844 -27.039 -3.535 1.00 39.68 C ATOM 541 O ILE A 66 24.239 -27.887 -4.191 1.00 47.32 O ATOM 542 CB ILE A 66 24.091 -24.862 -4.528 1.00 35.78 C ATOM 543 CG1 ILE A 66 24.550 -23.517 -5.097 1.00 33.93 C ATOM 544 CG2 ILE A 66 23.222 -24.649 -3.301 1.00 40.90 C ATOM 545 CD1 ILE A 66 23.418 -22.554 -5.386 1.00 43.41 C ATOM 546 N SER A 67 25.134 -27.190 -2.247 1.00 42.34 N ATOM 547 CA SER A 67 24.811 -28.414 -1.522 1.00 41.97 C ATOM 548 C SER A 67 23.303 -28.604 -1.398 1.00 45.04 C ATOM 549 O SER A 67 22.554 -27.633 -1.307 1.00 47.69 O ATOM 550 CB SER A 67 25.453 -28.392 -0.135 1.00 51.15 C ATOM 551 OG SER A 67 26.841 -28.122 -0.223 1.00 49.32 O ATOM 552 N LYS A 68 22.862 -29.857 -1.393 1.00 52.59 N ATOM 553 CA LYS A 68 21.438 -30.159 -1.289 1.00 50.14 C ATOM 554 C LYS A 68 21.001 -30.393 0.153 1.00 47.60 C ATOM 555 O LYS A 68 21.583 -31.210 0.867 1.00 56.79 O ATOM 556 CB LYS A 68 21.073 -31.367 -2.155 1.00 48.16 C ATOM 557 CG LYS A 68 20.808 -31.025 -3.613 1.00 72.23 C ATOM 558 CD LYS A 68 20.454 -32.263 -4.422 1.00 70.46 C ATOM 559 CE LYS A 68 19.830 -31.884 -5.757 1.00 70.61 C ATOM 560 NZ LYS A 68 20.650 -30.881 -6.494 1.00 65.10 N ATOM 561 N ARG A 69 19.972 -29.667 0.575 1.00 54.56 N ATOM 562 CA ARG A 69 19.409 -29.839 1.907 1.00 50.37 C ATOM 563 C ARG A 69 18.403 -30.985 1.901 1.00 57.14 C ATOM 564 O ARG A 69 18.167 -31.606 0.866 1.00 68.24 O ATOM 565 CB ARG A 69 18.729 -28.551 2.378 1.00 45.77 C ATOM 566 CG ARG A 69 19.677 -27.421 2.769 1.00 42.13 C ATOM 567 CD ARG A 69 20.401 -26.818 1.572 1.00 35.55 C ATOM 568 NE ARG A 69 20.989 -25.521 1.899 1.00 38.54 N ATOM 569 CZ ARG A 69 21.824 -24.852 1.108 1.00 41.10 C ATOM 570 NH1 ARG A 69 22.187 -25.359 -0.060 1.00 40.07 N ATOM 571 NH2 ARG A 69 22.305 -23.677 1.490 1.00 39.98 N ATOM 572 N ASP A 70 17.823 -31.269 3.062 1.00 70.99 N ATOM 573 CA ASP A 70 16.755 -32.258 3.158 1.00 74.16 C ATOM 574 C ASP A 70 15.576 -31.816 2.295 1.00 74.99 C ATOM 575 O ASP A 70 15.067 -32.582 1.476 1.00 58.51 O ATOM 576 CB ASP A 70 16.324 -32.445 4.615 1.00 75.04 C ATOM 577 CG ASP A 70 15.903 -31.141 5.275 1.00 86.37 C ATOM 578 OD1 ASP A 70 16.344 -30.065 4.815 1.00 77.41 O ATOM 579 OD2 ASP A 70 15.135 -31.191 6.259 1.00 75.58 O ATOM 580 N ILE A 71 15.150 -30.572 2.493 1.00 76.79 N ATOM 581 CA ILE A 71 14.160 -29.937 1.635 1.00 69.17 C ATOM 582 C ILE A 71 14.871 -29.500 0.352 1.00 79.26 C ATOM 583 O ILE A 71 15.998 -29.922 0.091 1.00 80.25 O ATOM 584 CB ILE A 71 13.515 -28.721 2.352 1.00 76.15 C ATOM 585 CG1 ILE A 71 12.401 -28.086 1.510 1.00 69.04 C ATOM 586 CG2 ILE A 71 14.576 -27.701 2.735 1.00 83.01 C ATOM 587 CD1 ILE A 71 11.017 -28.605 1.832 1.00 76.36 C ATOM 588 N SER A 72 14.221 -28.665 -0.451 1.00 69.01 N ATOM 589 CA SER A 72 14.841 -28.149 -1.665 1.00 58.20 C ATOM 590 C SER A 72 14.774 -26.626 -1.712 1.00 54.83 C ATOM 591 O SER A 72 15.248 -26.003 -2.661 1.00 55.62 O ATOM 592 CB SER A 72 14.178 -28.750 -2.908 1.00 61.50 C ATOM 593 OG SER A 72 14.841 -28.333 -4.089 1.00 62.44 O ATOM 594 N ALA A 73 14.192 -26.032 -0.674 1.00 49.64 N ATOM 595 CA ALA A 73 14.000 -24.586 -0.617 1.00 54.92 C ATOM 596 C ALA A 73 15.300 -23.826 -0.368 1.00 57.57 C ATOM 597 O ALA A 73 15.597 -22.851 -1.059 1.00 49.38 O ATOM 598 CB ALA A 73 12.966 -24.232 0.441 1.00 49.23 C ATOM 599 N GLY A 74 16.065 -24.265 0.628 1.00 60.90 N ATOM 600 CA GLY A 74 17.327 -23.627 0.956 1.00 55.33 C ATOM 601 C GLY A 74 18.250 -23.558 -0.245 1.00 50.98 C ATOM 602 O GLY A 74 18.788 -22.500 -0.570 1.00 44.84 O ATOM 603 N GLU A 75 18.431 -24.699 -0.903 1.00 48.28 N ATOM 604 CA GLU A 75 19.227 -24.776 -2.123 1.00 42.49 C ATOM 605 C GLU A 75 18.820 -23.687 -3.110 1.00 53.20 C ATOM 606 O GLU A 75 19.652 -22.908 -3.574 1.00 56.82 O ATOM 607 CB GLU A 75 19.061 -26.154 -2.768 1.00 55.06 C ATOM 608 CG GLU A 75 19.666 -26.284 -4.156 1.00 53.53 C ATOM 609 CD GLU A 75 19.386 -27.636 -4.786 1.00 56.23 C ATOM 610 OE1 GLU A 75 19.929 -27.910 -5.877 1.00 65.20 O ATOM 611 OE2 GLU A 75 18.622 -28.424 -4.190 1.00 66.05 O ATOM 612 N GLN A 76 17.530 -23.638 -3.421 1.00 52.84 N ATOM 613 CA GLN A 76 17.000 -22.659 -4.360 1.00 51.15 C ATOM 614 C GLN A 76 17.201 -21.237 -3.845 1.00 40.74 C ATOM 615 O GLN A 76 17.459 -20.316 -4.620 1.00 53.24 O ATOM 616 CB GLN A 76 15.514 -22.926 -4.613 1.00 46.05 C ATOM 617 CG GLN A 76 14.916 -22.110 -5.745 1.00 39.48 C ATOM 618 CD GLN A 76 15.446 -22.526 -7.102 1.00 55.30 C ATOM 619 OE1 GLN A 76 15.698 -21.686 -7.966 1.00 54.52 O ATOM 620 NE2 GLN A 76 15.614 -23.829 -7.300 1.00 45.71 N ATOM 621 N ARG A 77 17.088 -21.065 -2.532 1.00 40.63 N ATOM 622 CA ARG A 77 17.239 -19.747 -1.925 1.00 56.62 C ATOM 623 C ARG A 77 18.665 -19.226 -2.081 1.00 52.89 C ATOM 624 O ARG A 77 18.889 -18.017 -2.158 1.00 50.44 O ATOM 625 CB ARG A 77 16.838 -19.781 -0.447 1.00 60.27 C ATOM 626 CG ARG A 77 16.729 -18.407 0.195 1.00 65.87 C ATOM 627 CD ARG A 77 15.762 -18.417 1.370 1.00 82.02 C ATOM 628 NE ARG A 77 16.354 -18.967 2.585 1.00 85.09 N ATOM 629 CZ ARG A 77 16.738 -18.234 3.625 1.00 86.14 C ATOM 630 NH1 ARG A 77 16.588 -16.916 3.601 1.00 75.37 N ATOM 631 NH2 ARG A 77 17.266 -18.817 4.692 1.00 74.48 N ATOM 632 N GLN A 78 19.626 -20.142 -2.139 1.00 46.26 N ATOM 633 CA GLN A 78 21.027 -19.766 -2.279 1.00 45.21 C ATOM 634 C GLN A 78 21.340 -19.326 -3.707 1.00 56.13 C ATOM 635 O GLN A 78 21.991 -18.303 -3.923 1.00 43.66 O ATOM 636 CB GLN A 78 21.939 -20.921 -1.859 1.00 45.51 C ATOM 637 CG GLN A 78 23.405 -20.542 -1.768 1.00 52.77 C ATOM 638 CD GLN A 78 24.233 -21.571 -1.023 1.00 48.14 C ATOM 639 OE1 GLN A 78 23.755 -22.661 -0.707 1.00 41.79 O ATOM 640 NE2 GLN A 78 25.481 -21.226 -0.733 1.00 34.80 N ATOM 641 N LYS A 79 20.870 -20.100 -4.680 1.00 46.06 N ATOM 642 CA LYS A 79 21.067 -19.760 -6.083 1.00 39.30 C ATOM 643 C LYS A 79 20.549 -18.360 -6.382 1.00 49.90 C ATOM 644 O LYS A 79 21.271 -17.523 -6.921 1.00 58.27 O ATOM 645 CB LYS A 79 20.356 -20.766 -6.988 1.00 56.67 C ATOM 646 CG LYS A 79 20.267 -20.316 -8.438 1.00 58.68 C ATOM 647 CD LYS A 79 18.974 -20.784 -9.084 1.00 68.68 C ATOM 648 CE LYS A 79 18.754 -20.103 -10.425 1.00 71.09 C ATOM 649 NZ LYS A 79 17.419 -20.427 -10.999 1.00 75.56 N ATOM 650 N ASP A 80 19.289 -18.119 -6.033 1.00 53.48 N ATOM 651 CA ASP A 80 18.657 -16.826 -6.270 1.00 63.73 C ATOM 652 C ASP A 80 19.481 -15.684 -5.685 1.00 61.56 C ATOM 653 O ASP A 80 19.687 -14.658 -6.334 1.00 63.71 O ATOM 654 CB ASP A 80 17.241 -16.807 -5.691 1.00 71.57 C ATOM 655 CG ASP A 80 16.332 -17.832 -6.342 1.00 75.86 C ATOM 656 OD1 ASP A 80 16.603 -18.220 -7.499 1.00 74.84 O ATOM 657 OD2 ASP A 80 15.345 -18.248 -5.698 1.00 80.17 O ATOM 658 N ARG A 81 19.952 -15.869 -4.456 1.00 66.24 N ATOM 659 CA ARG A 81 20.779 -14.867 -3.798 1.00 53.99 C ATOM 660 C ARG A 81 22.061 -14.607 -4.580 1.00 56.81 C ATOM 661 O ARG A 81 22.409 -13.459 -4.852 1.00 68.46 O ATOM 662 CB ARG A 81 21.119 -15.304 -2.373 1.00 52.46 C ATOM 663 CG ARG A 81 19.981 -15.164 -1.378 1.00 53.05 C ATOM 664 CD ARG A 81 20.448 -14.391 -0.158 1.00 50.02 C ATOM 665 NE ARG A 81 19.526 -14.504 0.967 1.00 67.18 N ATOM 666 CZ ARG A 81 19.839 -14.186 2.218 1.00 72.94 C ATOM 667 NH1 ARG A 81 21.055 -13.740 2.504 1.00 59.11 N ATOM 668 NH2 ARG A 81 18.942 -14.319 3.185 1.00 79.39 N ATOM 669 N LEU A 82 22.761 -15.680 -4.938 1.00 57.54 N ATOM 670 CA LEU A 82 24.018 -15.565 -5.669 1.00 55.57 C ATOM 671 C LEU A 82 23.839 -14.848 -7.004 1.00 59.39 C ATOM 672 O LEU A 82 24.602 -13.940 -7.336 1.00 63.87 O ATOM 673 CB LEU A 82 24.646 -16.945 -5.881 1.00 54.25 C ATOM 674 CG LEU A 82 25.249 -17.596 -4.634 1.00 44.96 C ATOM 675 CD1 LEU A 82 25.618 -19.047 -4.898 1.00 33.97 C ATOM 676 CD2 LEU A 82 26.461 -16.808 -4.158 1.00 39.22 C ATOM 677 N GLU A 83 22.828 -15.258 -7.765 1.00 57.40 N ATOM 678 CA GLU A 83 22.520 -14.609 -9.035 1.00 50.95 C ATOM 679 C GLU A 83 22.270 -13.119 -8.838 1.00 56.02 C ATOM 680 O GLU A 83 22.594 -12.306 -9.704 1.00 59.70 O ATOM 681 CB GLU A 83 21.304 -15.260 -9.701 1.00 46.05 C ATOM 682 CG GLU A 83 21.582 -16.615 -10.333 1.00 63.96 C ATOM 683 CD GLU A 83 20.426 -17.107 -11.184 1.00 79.56 C ATOM 684 OE1 GLU A 83 20.650 -17.993 -12.037 1.00 65.26 O ATOM 685 OE2 GLU A 83 19.295 -16.608 -11.001 1.00 86.89 O ATOM 686 N GLU A 84 21.697 -12.765 -7.693 1.00 48.65 N ATOM 687 CA GLU A 84 21.403 -11.370 -7.388 1.00 59.55 C ATOM 688 C GLU A 84 22.682 -10.570 -7.169 1.00 60.95 C ATOM 689 O GLU A 84 22.661 -9.340 -7.165 1.00 65.99 O ATOM 690 CB GLU A 84 20.488 -11.267 -6.166 1.00 72.23 C ATOM 691 CG GLU A 84 19.179 -10.545 -6.442 1.00 82.45 C ATOM 692 CD GLU A 84 18.051 -11.018 -5.546 1.00101.46 C ATOM 693 OE1 GLU A 84 16.887 -11.004 -6.000 1.00101.23 O ATOM 694 OE2 GLU A 84 18.327 -11.404 -4.391 1.00 98.49 O ATOM 695 N GLU A 85 23.793 -11.277 -6.991 1.00 66.67 N ATOM 696 CA GLU A 85 25.086 -10.630 -6.802 1.00 67.64 C ATOM 697 C GLU A 85 25.955 -10.747 -8.051 1.00 62.90 C ATOM 698 O GLU A 85 27.133 -10.392 -8.034 1.00 61.16 O ATOM 699 CB GLU A 85 25.814 -11.212 -5.589 1.00 67.34 C ATOM 700 CG GLU A 85 25.103 -10.963 -4.269 1.00 62.21 C ATOM 701 CD GLU A 85 25.922 -11.400 -3.071 1.00 70.44 C ATOM 702 OE1 GLU A 85 27.085 -11.817 -3.260 1.00 59.16 O ATOM 703 OE2 GLU A 85 25.400 -11.326 -1.939 1.00 64.67 O ATOM 704 N GLY A 86 25.365 -11.248 -9.131 1.00 60.24 N ATOM 705 CA GLY A 86 26.054 -11.325 -10.406 1.00 65.65 C ATOM 706 C GLY A 86 26.746 -12.648 -10.671 1.00 67.79 C ATOM 707 O GLY A 86 27.461 -12.791 -11.662 1.00 62.75 O ATOM 708 N VAL A 87 26.534 -13.621 -9.790 1.00 63.56 N ATOM 709 CA VAL A 87 27.143 -14.938 -9.956 1.00 61.25 C ATOM 710 C VAL A 87 26.417 -15.767 -11.011 1.00 59.41 C ATOM 711 O VAL A 87 25.226 -16.047 -10.882 1.00 64.12 O ATOM 712 CB VAL A 87 27.171 -15.727 -8.633 1.00 53.16 C ATOM 713 CG1 VAL A 87 27.666 -17.143 -8.876 1.00 43.01 C ATOM 714 CG2 VAL A 87 28.047 -15.020 -7.612 1.00 56.08 C ATOM 715 N GLU A 88 27.142 -16.160 -12.054 1.00 48.11 N ATOM 716 CA GLU A 88 26.558 -16.956 -13.126 1.00 60.07 C ATOM 717 C GLU A 88 26.433 -18.422 -12.726 1.00 60.15 C ATOM 718 O GLU A 88 27.422 -19.153 -12.693 1.00 65.94 O ATOM 719 CB GLU A 88 27.378 -16.827 -14.412 1.00 64.73 C ATOM 720 CG GLU A 88 27.410 -15.421 -14.989 1.00 87.51 C ATOM 721 CD GLU A 88 27.994 -15.373 -16.389 1.00102.35 C ATOM 722 OE1 GLU A 88 27.265 -15.701 -17.350 1.00103.53 O ATOM 723 OE2 GLU A 88 29.180 -15.008 -16.527 1.00 85.75 O ATOM 724 N ILE A 89 25.210 -18.842 -12.421 1.00 61.68 N ATOM 725 CA ILE A 89 24.936 -20.228 -12.064 1.00 47.74 C ATOM 726 C ILE A 89 24.377 -20.980 -13.266 1.00 48.07 C ATOM 727 O ILE A 89 23.535 -20.456 -13.995 1.00 61.66 O ATOM 728 CB ILE A 89 23.913 -20.314 -10.915 1.00 55.04 C ATOM 729 CG1 ILE A 89 24.329 -19.407 -9.756 1.00 55.26 C ATOM 730 CG2 ILE A 89 23.749 -21.755 -10.444 1.00 48.97 C ATOM 731 CD1 ILE A 89 25.530 -19.907 -8.992 1.00 55.47 C ATOM 732 N TYR A 90 24.851 -22.204 -13.479 1.00 44.51 N ATOM 733 CA TYR A 90 24.298 -23.058 -14.524 1.00 53.15 C ATOM 734 C TYR A 90 23.906 -24.417 -13.952 1.00 53.40 C ATOM 735 O TYR A 90 24.546 -24.918 -13.027 1.00 54.67 O ATOM 736 CB TYR A 90 25.275 -23.212 -15.696 1.00 52.36 C ATOM 737 CG TYR A 90 26.568 -23.920 -15.359 1.00 61.79 C ATOM 738 CD1 TYR A 90 27.674 -23.212 -14.903 1.00 57.27 C ATOM 739 CD2 TYR A 90 26.689 -25.296 -15.512 1.00 55.73 C ATOM 740 CE1 TYR A 90 28.859 -23.856 -14.599 1.00 60.99 C ATOM 741 CE2 TYR A 90 27.872 -25.948 -15.210 1.00 63.31 C ATOM 742 CZ TYR A 90 28.953 -25.222 -14.755 1.00 65.23 C ATOM 743 OH TYR A 90 30.133 -25.863 -14.453 1.00 64.83 O ATOM 744 N GLN A 91 22.847 -25.004 -14.499 1.00 56.31 N ATOM 745 CA GLN A 91 22.324 -26.264 -13.984 1.00 59.27 C ATOM 746 C GLN A 91 23.057 -27.463 -14.585 1.00 58.18 C ATOM 747 O GLN A 91 23.907 -27.309 -15.461 1.00 59.65 O ATOM 748 CB GLN A 91 20.815 -26.358 -14.227 1.00 65.00 C ATOM 749 CG GLN A 91 20.115 -27.431 -13.407 1.00 80.41 C ATOM 750 CD GLN A 91 18.609 -27.262 -13.386 1.00 92.33 C ATOM 751 OE1 GLN A 91 18.099 -26.143 -13.306 1.00 88.20 O ATOM 752 NE2 GLN A 91 17.887 -28.374 -13.460 1.00 92.00 N ATOM 753 N THR A 92 22.723 -28.654 -14.098 1.00 65.14 N ATOM 754 CA THR A 92 23.412 -29.877 -14.483 1.00 62.66 C ATOM 755 C THR A 92 22.423 -30.906 -15.021 1.00 78.22 C ATOM 756 O THR A 92 21.221 -30.809 -14.777 1.00 89.13 O ATOM 757 CB THR A 92 24.173 -30.474 -13.273 1.00 57.60 C ATOM 758 OG1 THR A 92 25.237 -29.593 -12.892 1.00 65.43 O ATOM 759 CG2 THR A 92 24.751 -31.844 -13.604 1.00 81.03 C ATOM 760 N SER A 93 22.935 -31.879 -15.769 1.00 78.62 N ATOM 761 CA SER A 93 22.128 -33.003 -16.226 1.00 82.54 C ATOM 762 C SER A 93 21.466 -33.695 -15.039 1.00 78.62 C ATOM 763 O SER A 93 20.402 -34.298 -15.170 1.00 75.83 O ATOM 764 CB SER A 93 22.996 -33.994 -17.006 1.00 85.12 C ATOM 765 OG SER A 93 24.239 -34.202 -16.356 1.00 83.49 O ATOM 766 N LEU A 94 22.106 -33.595 -13.878 1.00 70.00 N ATOM 767 CA LEU A 94 21.586 -34.188 -12.652 1.00 75.89 C ATOM 768 C LEU A 94 20.807 -33.161 -11.836 1.00 74.83 C ATOM 769 O LEU A 94 20.346 -33.450 -10.732 1.00 77.91 O ATOM 770 CB LEU A 94 22.723 -34.772 -11.809 1.00 75.02 C ATOM 771 CG LEU A 94 23.442 -36.017 -12.338 1.00 86.00 C ATOM 772 CD1 LEU A 94 22.452 -37.146 -12.588 1.00 81.88 C ATOM 773 CD2 LEU A 94 24.238 -35.710 -13.599 1.00 85.24 C ATOM 774 N GLY A 95 20.667 -31.959 -12.385 1.00 64.84 N ATOM 775 CA GLY A 95 19.930 -30.899 -11.724 1.00 66.00 C ATOM 776 C GLY A 95 20.666 -30.318 -10.532 1.00 70.78 C ATOM 777 O GLY A 95 20.082 -30.125 -9.465 1.00 69.83 O ATOM 778 N GLU A 96 21.953 -30.043 -10.711 1.00 73.82 N ATOM 779 CA GLU A 96 22.755 -29.425 -9.661 1.00 64.91 C ATOM 780 C GLU A 96 23.173 -28.015 -10.052 1.00 51.16 C ATOM 781 O GLU A 96 23.725 -27.799 -11.130 1.00 60.21 O ATOM 782 CB GLU A 96 24.000 -30.263 -9.360 1.00 56.77 C ATOM 783 CG GLU A 96 23.871 -31.178 -8.155 1.00 74.49 C ATOM 784 CD GLU A 96 25.137 -31.972 -7.890 1.00 80.63 C ATOM 785 OE1 GLU A 96 25.138 -32.801 -6.956 1.00 81.25 O ATOM 786 OE2 GLU A 96 26.132 -31.767 -8.618 1.00 69.70 O ATOM 787 N TYR A 97 22.904 -27.057 -9.172 1.00 40.16 N ATOM 788 CA TYR A 97 23.347 -25.687 -9.388 1.00 47.76 C ATOM 789 C TYR A 97 24.863 -25.599 -9.246 1.00 50.69 C ATOM 790 O TYR A 97 25.427 -25.991 -8.224 1.00 50.98 O ATOM 791 CB TYR A 97 22.644 -24.739 -8.418 1.00 54.56 C ATOM 792 CG TYR A 97 21.178 -24.552 -8.732 1.00 67.17 C ATOM 793 CD1 TYR A 97 20.751 -24.356 -10.039 1.00 64.74 C ATOM 794 CD2 TYR A 97 20.221 -24.586 -7.728 1.00 60.58 C ATOM 795 CE1 TYR A 97 19.413 -24.187 -10.336 1.00 62.09 C ATOM 796 CE2 TYR A 97 18.879 -24.420 -8.015 1.00 62.08 C ATOM 797 CZ TYR A 97 18.481 -24.221 -9.322 1.00 67.11 C ATOM 798 OH TYR A 97 17.147 -24.054 -9.616 1.00 55.98 O ATOM 799 N LYS A 98 25.516 -25.082 -10.281 1.00 49.72 N ATOM 800 CA LYS A 98 26.969 -25.128 -10.365 1.00 42.50 C ATOM 801 C LYS A 98 27.534 -23.814 -10.889 1.00 49.25 C ATOM 802 O LYS A 98 26.883 -23.116 -11.666 1.00 53.72 O ATOM 803 CB LYS A 98 27.385 -26.282 -11.279 1.00 47.44 C ATOM 804 CG LYS A 98 28.859 -26.632 -11.250 1.00 59.68 C ATOM 805 CD LYS A 98 29.107 -27.937 -11.991 1.00 55.74 C ATOM 806 CE LYS A 98 30.537 -28.419 -11.818 1.00 68.26 C ATOM 807 NZ LYS A 98 30.727 -29.782 -12.387 1.00 70.67 N ATOM 808 N LEU A 99 28.746 -23.480 -10.458 1.00 50.07 N ATOM 809 CA LEU A 99 29.425 -22.278 -10.933 1.00 59.79 C ATOM 810 C LEU A 99 30.904 -22.539 -11.211 1.00 55.83 C ATOM 811 O LEU A 99 31.424 -23.612 -10.903 1.00 42.47 O ATOM 812 CB LEU A 99 29.262 -21.124 -9.936 1.00 44.70 C ATOM 813 CG LEU A 99 29.628 -21.325 -8.461 1.00 49.70 C ATOM 814 CD1 LEU A 99 31.064 -21.799 -8.284 1.00 45.72 C ATOM 815 CD2 LEU A 99 29.400 -20.034 -7.689 1.00 55.80 C ATOM 816 N ASN A 100 31.576 -21.554 -11.798 1.00 52.75 N ATOM 817 CA ASN A 100 33.009 -21.650 -12.047 1.00 44.61 C ATOM 818 C ASN A 100 33.799 -21.248 -10.805 1.00 49.59 C ATOM 819 O ASN A 100 34.008 -20.063 -10.545 1.00 48.66 O ATOM 820 CB ASN A 100 33.407 -20.788 -13.247 1.00 60.24 C ATOM 821 CG ASN A 100 34.827 -21.053 -13.710 1.00 71.21 C ATOM 822 OD1 ASN A 100 35.743 -20.287 -13.413 1.00 75.95 O ATOM 823 ND2 ASN A 100 35.016 -22.146 -14.441 1.00 61.30 N ATOM 824 N LEU A 101 34.233 -22.247 -10.042 1.00 46.57 N ATOM 825 CA LEU A 101 34.876 -22.009 -8.753 1.00 49.27 C ATOM 826 C LEU A 101 36.101 -21.092 -8.838 1.00 61.13 C ATOM 827 O LEU A 101 36.179 -20.102 -8.115 1.00 54.72 O ATOM 828 CB LEU A 101 35.225 -23.335 -8.066 1.00 41.54 C ATOM 829 CG LEU A 101 35.551 -23.261 -6.574 1.00 44.70 C ATOM 830 CD1 LEU A 101 34.520 -22.415 -5.846 1.00 41.51 C ATOM 831 CD2 LEU A 101 35.630 -24.655 -5.970 1.00 48.99 C ATOM 832 N PRO A 102 37.059 -21.414 -9.724 1.00 64.80 N ATOM 833 CA PRO A 102 38.247 -20.562 -9.853 1.00 53.34 C ATOM 834 C PRO A 102 37.898 -19.098 -10.127 1.00 57.91 C ATOM 835 O PRO A 102 38.636 -18.204 -9.712 1.00 56.99 O ATOM 836 CB PRO A 102 38.972 -21.162 -11.060 1.00 52.32 C ATOM 837 CG PRO A 102 38.551 -22.590 -11.073 1.00 57.03 C ATOM 838 CD PRO A 102 37.123 -22.588 -10.612 1.00 61.55 C ATOM 839 N GLU A 103 36.785 -18.863 -10.813 1.00 54.02 N ATOM 840 CA GLU A 103 36.372 -17.509 -11.170 1.00 52.03 C ATOM 841 C GLU A 103 35.790 -16.749 -9.982 1.00 57.04 C ATOM 842 O GLU A 103 35.991 -15.541 -9.850 1.00 61.76 O ATOM 843 CB GLU A 103 35.357 -17.547 -12.316 1.00 56.94 C ATOM 844 CG GLU A 103 34.805 -16.186 -12.713 1.00 62.25 C ATOM 845 CD GLU A 103 33.809 -16.268 -13.857 1.00 94.20 C ATOM 846 OE1 GLU A 103 33.134 -15.253 -14.131 1.00102.13 O ATOM 847 OE2 GLU A 103 33.701 -17.344 -14.483 1.00 75.75 O ATOM 848 N TYR A 104 35.072 -17.458 -9.118 1.00 54.69 N ATOM 849 CA TYR A 104 34.358 -16.813 -8.020 1.00 51.44 C ATOM 850 C TYR A 104 34.939 -17.130 -6.643 1.00 47.78 C ATOM 851 O TYR A 104 34.449 -16.631 -5.630 1.00 55.26 O ATOM 852 CB TYR A 104 32.875 -17.186 -8.060 1.00 48.83 C ATOM 853 CG TYR A 104 32.143 -16.650 -9.269 1.00 50.18 C ATOM 854 CD1 TYR A 104 31.884 -17.462 -10.365 1.00 53.18 C ATOM 855 CD2 TYR A 104 31.715 -15.330 -9.316 1.00 42.61 C ATOM 856 CE1 TYR A 104 31.215 -16.976 -11.473 1.00 52.35 C ATOM 857 CE2 TYR A 104 31.047 -14.835 -10.418 1.00 57.94 C ATOM 858 CZ TYR A 104 30.800 -15.661 -11.494 1.00 61.26 C ATOM 859 OH TYR A 104 30.134 -15.168 -12.594 1.00 67.72 O ATOM 860 N MET A 105 35.982 -17.951 -6.606 1.00 48.09 N ATOM 861 CA MET A 105 36.596 -18.329 -5.338 1.00 42.55 C ATOM 862 C MET A 105 37.283 -17.139 -4.675 1.00 47.70 C ATOM 863 O MET A 105 38.044 -16.412 -5.314 1.00 64.69 O ATOM 864 CB MET A 105 37.598 -19.470 -5.535 1.00 56.45 C ATOM 865 CG MET A 105 38.217 -19.978 -4.243 1.00 53.03 C ATOM 866 SD MET A 105 36.993 -20.655 -3.107 1.00 75.66 S ATOM 867 CE MET A 105 37.951 -20.757 -1.601 1.00 62.81 C ATOM 868 N TRP A 106 37.004 -16.944 -3.390 1.00 54.91 N ATOM 869 CA TRP A 106 37.653 -15.890 -2.622 1.00 60.41 C ATOM 870 C TRP A 106 39.011 -16.371 -2.136 1.00 72.46 C ATOM 871 O TRP A 106 39.096 -17.231 -1.261 1.00 76.02 O ATOM 872 CB TRP A 106 36.784 -15.471 -1.437 1.00 55.47 C ATOM 873 CG TRP A 106 37.452 -14.489 -0.524 1.00 63.59 C ATOM 874 CD1 TRP A 106 37.937 -13.258 -0.859 1.00 66.68 C ATOM 875 CD2 TRP A 106 37.698 -14.646 0.877 1.00 70.73 C ATOM 876 NE1 TRP A 106 38.475 -12.642 0.244 1.00 71.25 N ATOM 877 CE2 TRP A 106 38.339 -13.478 1.329 1.00 71.33 C ATOM 878 CE3 TRP A 106 37.440 -15.668 1.801 1.00 86.40 C ATOM 879 CZ2 TRP A 106 38.728 -13.294 2.651 1.00 75.30 C ATOM 880 CZ3 TRP A 106 37.826 -15.486 3.117 1.00 69.67 C ATOM 881 CH2 TRP A 106 38.462 -14.309 3.529 1.00 72.62 C ATOM 882 N LYS A 107 40.071 -15.813 -2.713 1.00 78.18 N ATOM 883 CA LYS A 107 41.432 -16.232 -2.398 1.00 79.93 C ATOM 884 C LYS A 107 42.158 -15.224 -1.513 1.00 81.04 C ATOM 885 O LYS A 107 42.689 -14.227 -2.002 1.00 74.57 O ATOM 886 CB LYS A 107 42.226 -16.467 -3.685 1.00 69.61 C ATOM 887 CG LYS A 107 41.763 -17.677 -4.482 1.00 70.91 C ATOM 888 CD LYS A 107 42.444 -17.750 -5.840 1.00 76.18 C ATOM 889 CE LYS A 107 41.893 -16.703 -6.797 1.00 86.60 C ATOM 890 NZ LYS A 107 42.464 -16.849 -8.166 1.00 68.21 N ATOM 891 N PRO A 108 42.178 -15.486 -0.198 1.00 83.64 N ATOM 892 CA PRO A 108 42.867 -14.642 0.784 1.00 87.03 C ATOM 893 C PRO A 108 44.383 -14.788 0.679 1.00 74.60 C ATOM 894 O PRO A 108 45.041 -13.887 0.160 1.00 65.27 O ATOM 895 CB PRO A 108 42.382 -15.201 2.130 1.00 79.89 C ATOM 896 CG PRO A 108 41.179 -16.043 1.806 1.00 76.13 C ATOM 897 CD PRO A 108 41.446 -16.586 0.446 1.00 68.18 C TER 898 PRO A 108 ATOM 899 O5' DG B 1 30.764 -43.400 25.877 1.00 80.81 O ATOM 900 C5' DG B 1 30.998 -44.796 26.025 1.00 73.86 C ATOM 901 C4' DG B 1 29.686 -45.559 26.072 1.00 78.47 C ATOM 902 O4' DG B 1 28.786 -44.888 26.988 1.00 81.41 O ATOM 903 C3' DG B 1 28.935 -45.642 24.750 1.00 73.25 C ATOM 904 O3' DG B 1 29.347 -46.806 24.042 1.00 84.22 O ATOM 905 C2' DG B 1 27.482 -45.756 25.202 1.00 67.95 C ATOM 906 C1' DG B 1 27.456 -44.971 26.512 1.00 64.01 C ATOM 907 N9 DG B 1 26.910 -43.622 26.377 1.00 62.97 N ATOM 908 C8 DG B 1 27.574 -42.432 26.552 1.00 60.53 C ATOM 909 N7 DG B 1 26.823 -41.381 26.365 1.00 60.26 N ATOM 910 C5 DG B 1 25.579 -41.909 26.043 1.00 55.94 C ATOM 911 C6 DG B 1 24.362 -41.256 25.734 1.00 60.33 C ATOM 912 O6 DG B 1 24.133 -40.040 25.681 1.00 55.90 O ATOM 913 N1 DG B 1 23.342 -42.166 25.468 1.00 55.72 N ATOM 914 C2 DG B 1 23.479 -43.534 25.497 1.00 55.56 C ATOM 915 N2 DG B 1 22.385 -44.254 25.213 1.00 53.80 N ATOM 916 N3 DG B 1 24.613 -44.158 25.785 1.00 49.66 N ATOM 917 C4 DG B 1 25.616 -43.286 26.047 1.00 52.72 C ATOM 918 P DC B 2 29.496 -46.771 22.442 1.00 93.90 P ATOM 919 OP1 DC B 2 30.255 -47.973 22.028 1.00 68.52 O ATOM 920 OP2 DC B 2 29.982 -45.426 22.059 1.00 73.40 O ATOM 921 O5' DC B 2 27.991 -46.913 21.923 1.00 78.86 O ATOM 922 C5' DC B 2 27.189 -48.003 22.363 1.00 64.35 C ATOM 923 C4' DC B 2 25.733 -47.749 22.022 1.00 74.29 C ATOM 924 O4' DC B 2 25.246 -46.634 22.806 1.00 69.47 O ATOM 925 C3' DC B 2 25.492 -47.368 20.569 1.00 65.15 C ATOM 926 O3' DC B 2 25.180 -48.539 19.823 1.00 75.99 O ATOM 927 C2' DC B 2 24.303 -46.411 20.628 1.00 64.02 C ATOM 928 C1' DC B 2 24.280 -45.909 22.071 1.00 70.84 C ATOM 929 N1 DC B 2 24.576 -44.452 22.217 1.00 65.42 N ATOM 930 C2 DC B 2 23.618 -43.506 21.833 1.00 59.89 C ATOM 931 O2 DC B 2 22.538 -43.891 21.369 1.00 57.07 O ATOM 932 N3 DC B 2 23.904 -42.189 21.977 1.00 54.84 N ATOM 933 C4 DC B 2 25.079 -41.810 22.481 1.00 51.02 C ATOM 934 N4 DC B 2 25.313 -40.499 22.604 1.00 57.48 N ATOM 935 C5 DC B 2 26.067 -42.758 22.879 1.00 59.76 C ATOM 936 C6 DC B 2 25.775 -44.054 22.732 1.00 67.23 C ATOM 937 P DC B 3 25.532 -48.620 18.257 1.00 92.04 P ATOM 938 OP1 DC B 3 25.352 -50.023 17.820 1.00 80.13 O ATOM 939 OP2 DC B 3 26.831 -47.943 18.046 1.00 65.51 O ATOM 940 O5' DC B 3 24.407 -47.714 17.574 1.00 76.43 O ATOM 941 C5' DC B 3 23.037 -47.856 17.927 1.00 73.46 C ATOM 942 C4' DC B 3 22.268 -46.695 17.331 1.00 73.17 C ATOM 943 O4' DC B 3 22.494 -45.498 18.121 1.00 78.60 O ATOM 944 C3' DC B 3 22.713 -46.365 15.910 1.00 71.99 C ATOM 945 O3' DC B 3 21.601 -46.215 15.039 1.00 74.00 O ATOM 946 C2' DC B 3 23.467 -45.049 16.062 1.00 76.70 C ATOM 947 C1' DC B 3 22.736 -44.424 17.239 1.00 73.71 C ATOM 948 N1 DC B 3 23.561 -43.392 17.912 1.00 65.87 N ATOM 949 C2 DC B 3 23.072 -42.089 18.027 1.00 64.45 C ATOM 950 O2 DC B 3 21.951 -41.825 17.575 1.00 58.72 O ATOM 951 N3 DC B 3 23.839 -41.154 18.638 1.00 53.70 N ATOM 952 C4 DC B 3 25.042 -41.485 19.111 1.00 60.01 C ATOM 953 N4 DC B 3 25.764 -40.530 19.705 1.00 52.33 N ATOM 954 C5 DC B 3 25.560 -42.807 18.998 1.00 55.92 C ATOM 955 C6 DC B 3 24.793 -43.719 18.395 1.00 59.29 C ATOM 956 P DA B 4 21.824 -46.199 13.448 1.00 88.53 P ATOM 957 OP1 DA B 4 21.887 -47.602 12.982 1.00 77.54 O ATOM 958 OP2 DA B 4 22.944 -45.277 13.153 1.00 82.81 O ATOM 959 O5' DA B 4 20.489 -45.522 12.889 1.00 74.18 O ATOM 960 C5' DA B 4 19.550 -44.955 13.791 1.00 76.14 C ATOM 961 C4' DA B 4 19.347 -43.478 13.503 1.00 82.60 C ATOM 962 O4' DA B 4 20.234 -42.687 14.335 1.00 78.21 O ATOM 963 C3' DA B 4 19.623 -43.048 12.066 1.00 71.37 C ATOM 964 O3' DA B 4 18.637 -42.104 11.681 1.00 78.41 O ATOM 965 C2' DA B 4 21.002 -42.403 12.155 1.00 72.20 C ATOM 966 C1' DA B 4 20.906 -41.746 13.525 1.00 71.21 C ATOM 967 N9 DA B 4 22.190 -41.448 14.150 1.00 62.01 N ATOM 968 C8 DA B 4 23.249 -42.298 14.313 1.00 58.92 C ATOM 969 N7 DA B 4 24.277 -41.752 14.920 1.00 57.93 N ATOM 970 C5 DA B 4 23.860 -40.454 15.175 1.00 55.69 C ATOM 971 C6 DA B 4 24.489 -39.357 15.797 1.00 49.50 C ATOM 972 N6 DA B 4 25.728 -39.403 16.298 1.00 49.09 N ATOM 973 N1 DA B 4 23.790 -38.206 15.887 1.00 44.74 N ATOM 974 C2 DA B 4 22.550 -38.161 15.386 1.00 54.25 C ATOM 975 N3 DA B 4 21.856 -39.123 14.780 1.00 49.76 N ATOM 976 C4 DA B 4 22.575 -40.253 14.707 1.00 52.47 C ATOM 977 P DT B 5 18.539 -41.614 10.154 1.00 97.76 P ATOM 978 OP1 DT B 5 17.107 -41.557 9.787 1.00 88.95 O ATOM 979 OP2 DT B 5 19.469 -42.438 9.351 1.00 84.65 O ATOM 980 O5' DT B 5 19.111 -40.121 10.205 1.00 80.98 O ATOM 981 C5' DT B 5 18.451 -39.146 11.004 1.00 75.97 C ATOM 982 C4' DT B 5 19.179 -37.815 10.948 1.00 69.68 C ATOM 983 O4' DT B 5 20.376 -37.865 11.768 1.00 75.92 O ATOM 984 C3' DT B 5 19.632 -37.387 9.555 1.00 63.91 C ATOM 985 O3' DT B 5 19.300 -36.020 9.367 1.00 70.48 O ATOM 986 C2' DT B 5 21.144 -37.588 9.600 1.00 59.48 C ATOM 987 C1' DT B 5 21.417 -37.234 11.055 1.00 58.80 C ATOM 988 N1 DT B 5 22.719 -37.725 11.583 1.00 52.54 N ATOM 989 C2 DT B 5 23.468 -36.882 12.372 1.00 50.98 C ATOM 990 O2 DT B 5 23.116 -35.751 12.659 1.00 54.83 O ATOM 991 N3 DT B 5 24.650 -37.416 12.816 1.00 40.61 N ATOM 992 C4 DT B 5 25.144 -38.680 12.553 1.00 52.32 C ATOM 993 O4 DT B 5 26.220 -39.070 12.998 1.00 45.90 O ATOM 994 C5 DT B 5 24.308 -39.510 11.721 1.00 53.06 C ATOM 995 C7 DT B 5 24.744 -40.902 11.371 1.00 37.21 C ATOM 996 C6 DT B 5 23.150 -39.000 11.281 1.00 51.37 C ATOM 997 P DG B 6 18.748 -35.511 7.947 1.00 89.42 P ATOM 998 OP1 DG B 6 17.377 -34.992 8.149 1.00 68.21 O ATOM 999 OP2 DG B 6 18.998 -36.577 6.950 1.00 51.02 O ATOM 1000 O5' DG B 6 19.710 -34.286 7.593 1.00 80.46 O ATOM 1001 C5' DG B 6 20.187 -33.440 8.629 1.00 54.28 C ATOM 1002 C4' DG B 6 21.623 -33.046 8.337 1.00 54.54 C ATOM 1003 O4' DG B 6 22.546 -33.925 9.031 1.00 62.04 O ATOM 1004 C3' DG B 6 22.010 -33.116 6.859 1.00 60.11 C ATOM 1005 O3' DG B 6 22.710 -31.941 6.485 1.00 43.63 O ATOM 1006 C2' DG B 6 22.927 -34.332 6.798 1.00 40.17 C ATOM 1007 C1' DG B 6 23.614 -34.164 8.143 1.00 42.49 C ATOM 1008 N9 DG B 6 24.390 -35.321 8.573 1.00 41.85 N ATOM 1009 C8 DG B 6 24.189 -36.638 8.238 1.00 43.89 C ATOM 1010 N7 DG B 6 25.058 -37.450 8.778 1.00 47.47 N ATOM 1011 C5 DG B 6 25.888 -36.614 9.515 1.00 37.84 C ATOM 1012 C6 DG B 6 27.013 -36.915 10.317 1.00 46.12 C ATOM 1013 O6 DG B 6 27.524 -38.020 10.547 1.00 45.90 O ATOM 1014 N1 DG B 6 27.563 -35.767 10.886 1.00 45.45 N ATOM 1015 C2 DG B 6 27.086 -34.490 10.704 1.00 47.41 C ATOM 1016 N2 DG B 6 27.745 -33.506 11.333 1.00 46.85 N ATOM 1017 N3 DG B 6 26.034 -34.195 9.956 1.00 40.70 N ATOM 1018 C4 DG B 6 25.490 -35.302 9.397 1.00 45.81 C HETATM 1019 N1 1AP B 7 23.891 -21.937 4.216 1.00 40.68 N HETATM 1020 C2 1AP B 7 24.826 -22.639 3.496 1.00 33.10 C HETATM 1021 C4 1AP B 7 23.797 -24.731 4.100 1.00 34.88 C HETATM 1022 C5 1AP B 7 22.839 -24.054 4.837 1.00 31.75 C HETATM 1023 C6 1AP B 7 22.906 -22.595 4.883 1.00 30.73 C HETATM 1024 C8 1AP B 7 22.453 -26.262 4.972 1.00 41.83 C HETATM 1025 N2 1AP B 7 25.859 -21.927 2.802 1.00 35.59 N HETATM 1026 N3 1AP B 7 24.801 -23.980 3.427 1.00 25.10 N HETATM 1027 N9 1AP B 7 23.527 -26.102 4.207 1.00 39.06 N HETATM 1028 N7 1AP B 7 22.010 -25.017 5.372 1.00 45.56 N HETATM 1029 N6 1AP B 7 21.903 -21.829 5.655 1.00 40.23 N HETATM 1030 P 1AP B 7 21.902 -30.626 6.041 1.00 58.95 P HETATM 1031 OP1 1AP B 7 22.044 -30.196 7.540 1.00 49.72 O HETATM 1032 OP2 1AP B 7 20.423 -30.446 5.391 1.00 44.17 O HETATM 1033 O5' 1AP B 7 22.929 -29.838 5.203 1.00 53.59 O HETATM 1034 C5' 1AP B 7 23.293 -30.291 3.922 1.00 46.24 C HETATM 1035 C4' 1AP B 7 24.156 -29.392 3.137 1.00 46.79 C HETATM 1036 O4' 1AP B 7 23.495 -28.145 2.981 1.00 44.08 O HETATM 1037 C1' 1AP B 7 24.313 -27.149 3.566 1.00 42.72 C HETATM 1038 C2' 1AP B 7 25.194 -27.862 4.505 1.00 35.60 C HETATM 1039 C3' 1AP B 7 25.383 -29.148 3.868 1.00 38.82 C HETATM 1040 O3' 1AP B 7 26.446 -29.050 2.963 1.00 37.14 O ATOM 1041 P DC B 8 27.235 -30.368 2.492 1.00 40.71 P ATOM 1042 OP1 DC B 8 28.002 -30.029 1.274 1.00 37.80 O ATOM 1043 OP2 DC B 8 26.271 -31.490 2.460 1.00 45.56 O ATOM 1044 O5' DC B 8 28.260 -30.634 3.689 1.00 40.96 O ATOM 1045 C5' DC B 8 28.983 -29.539 4.238 1.00 31.23 C ATOM 1046 C4' DC B 8 30.477 -29.799 4.203 1.00 37.84 C ATOM 1047 O4' DC B 8 30.749 -31.077 4.832 1.00 37.14 O ATOM 1048 C3' DC B 8 31.088 -29.869 2.808 1.00 35.19 C ATOM 1049 O3' DC B 8 32.370 -29.256 2.814 1.00 42.25 O ATOM 1050 C2' DC B 8 31.186 -31.367 2.536 1.00 29.21 C ATOM 1051 C1' DC B 8 31.424 -31.929 3.932 1.00 33.86 C ATOM 1052 N1 DC B 8 30.893 -33.308 4.104 1.00 38.07 N ATOM 1053 C2 DC B 8 31.762 -34.339 4.470 1.00 39.38 C ATOM 1054 O2 DC B 8 32.959 -34.080 4.648 1.00 44.13 O ATOM 1055 N3 DC B 8 31.265 -35.591 4.623 1.00 48.67 N ATOM 1056 C4 DC B 8 29.967 -35.823 4.422 1.00 38.60 C ATOM 1057 N4 DC B 8 29.528 -37.076 4.585 1.00 41.36 N ATOM 1058 C5 DC B 8 29.066 -34.784 4.046 1.00 34.49 C ATOM 1059 C6 DC B 8 29.567 -33.553 3.899 1.00 45.54 C ATOM 1060 P DT B 9 33.259 -29.231 1.477 1.00 32.10 P ATOM 1061 OP1 DT B 9 34.160 -28.064 1.553 1.00 30.64 O ATOM 1062 OP2 DT B 9 32.349 -29.386 0.321 1.00 34.46 O ATOM 1063 O5' DT B 9 34.137 -30.562 1.588 1.00 35.54 O ATOM 1064 C5' DT B 9 35.156 -30.650 2.572 1.00 36.92 C ATOM 1065 C4' DT B 9 36.139 -31.750 2.215 1.00 49.34 C ATOM 1066 O4' DT B 9 35.550 -33.045 2.506 1.00 49.21 O ATOM 1067 C3' DT B 9 36.537 -31.792 0.745 1.00 40.10 C ATOM 1068 O3' DT B 9 37.894 -32.188 0.640 1.00 47.39 O ATOM 1069 C2' DT B 9 35.615 -32.866 0.184 1.00 38.98 C ATOM 1070 C1' DT B 9 35.619 -33.849 1.347 1.00 37.40 C ATOM 1071 N1 DT B 9 34.467 -34.791 1.356 1.00 35.86 N ATOM 1072 C2 DT B 9 34.672 -36.080 1.791 1.00 46.93 C ATOM 1073 O2 DT B 9 35.753 -36.493 2.173 1.00 46.03 O ATOM 1074 N3 DT B 9 33.557 -36.874 1.765 1.00 48.17 N ATOM 1075 C4 DT B 9 32.287 -36.518 1.356 1.00 45.64 C ATOM 1076 O4 DT B 9 31.352 -37.313 1.373 1.00 51.14 O ATOM 1077 C5 DT B 9 32.143 -35.153 0.912 1.00 38.59 C ATOM 1078 C7 DT B 9 30.810 -34.649 0.444 1.00 30.39 C ATOM 1079 C6 DT B 9 33.226 -34.364 0.933 1.00 37.25 C ATOM 1080 P DA B 10 38.852 -31.511 -0.458 1.00 68.51 P ATOM 1081 OP1 DA B 10 39.373 -30.246 0.109 1.00 58.32 O ATOM 1082 OP2 DA B 10 38.128 -31.494 -1.749 1.00 42.57 O ATOM 1083 O5' DA B 10 40.053 -32.554 -0.594 1.00 63.02 O ATOM 1084 C5' DA B 10 40.666 -33.070 0.580 1.00 55.80 C ATOM 1085 C4' DA B 10 40.982 -34.544 0.410 1.00 59.23 C ATOM 1086 O4' DA B 10 39.751 -35.313 0.445 1.00 64.78 O ATOM 1087 C3' DA B 10 41.671 -34.900 -0.902 1.00 72.57 C ATOM 1088 O3' DA B 10 42.692 -35.862 -0.667 1.00 85.12 O ATOM 1089 C2' DA B 10 40.538 -35.476 -1.747 1.00 62.54 C ATOM 1090 C1' DA B 10 39.691 -36.160 -0.682 1.00 66.33 C ATOM 1091 N9 DA B 10 38.289 -36.319 -1.052 1.00 53.57 N ATOM 1092 C8 DA B 10 37.498 -35.424 -1.718 1.00 48.90 C ATOM 1093 N7 DA B 10 36.269 -35.845 -1.907 1.00 41.39 N ATOM 1094 C5 DA B 10 36.253 -37.101 -1.321 1.00 44.73 C ATOM 1095 C6 DA B 10 35.244 -38.074 -1.180 1.00 46.10 C ATOM 1096 N6 DA B 10 33.998 -37.924 -1.642 1.00 41.89 N ATOM 1097 N1 DA B 10 35.566 -39.217 -0.541 1.00 49.17 N ATOM 1098 C2 DA B 10 36.811 -39.372 -0.078 1.00 50.18 C ATOM 1099 N3 DA B 10 37.842 -38.532 -0.149 1.00 55.02 N ATOM 1100 C4 DA B 10 37.491 -37.406 -0.788 1.00 44.49 C ATOM 1101 P DG B 11 43.541 -36.454 -1.895 1.00 83.36 P ATOM 1102 OP1 DG B 11 44.917 -36.711 -1.417 1.00 80.54 O ATOM 1103 OP2 DG B 11 43.321 -35.576 -3.066 1.00 67.76 O ATOM 1104 O5' DG B 11 42.830 -37.853 -2.196 1.00 60.91 O ATOM 1105 C5' DG B 11 42.700 -38.803 -1.148 1.00 66.51 C ATOM 1106 C4' DG B 11 41.895 -40.003 -1.608 1.00 73.01 C ATOM 1107 O4' DG B 11 40.509 -39.625 -1.796 1.00 70.70 O ATOM 1108 C3' DG B 11 42.366 -40.611 -2.926 1.00 74.26 C ATOM 1109 O3' DG B 11 42.737 -41.970 -2.722 1.00 86.04 O ATOM 1110 C2' DG B 11 41.165 -40.481 -3.863 1.00 64.88 C ATOM 1111 C1' DG B 11 40.001 -40.360 -2.887 1.00 56.51 C ATOM 1112 N9 DG B 11 38.840 -39.662 -3.431 1.00 52.38 N ATOM 1113 C8 DG B 11 38.795 -38.386 -3.937 1.00 50.62 C ATOM 1114 N7 DG B 11 37.612 -38.030 -4.355 1.00 44.97 N ATOM 1115 C5 DG B 11 36.820 -39.143 -4.108 1.00 50.66 C ATOM 1116 C6 DG B 11 35.442 -39.356 -4.350 1.00 53.12 C ATOM 1117 O6 DG B 11 34.616 -38.578 -4.847 1.00 51.86 O ATOM 1118 N1 DG B 11 35.042 -40.628 -3.949 1.00 47.89 N ATOM 1119 C2 DG B 11 35.864 -41.575 -3.386 1.00 58.30 C ATOM 1120 N2 DG B 11 35.299 -42.747 -3.063 1.00 47.08 N ATOM 1121 N3 DG B 11 37.155 -41.389 -3.154 1.00 57.23 N ATOM 1122 C4 DG B 11 37.561 -40.155 -3.539 1.00 53.38 C ATOM 1123 P DT B 12 43.445 -42.798 -3.902 1.00101.98 P ATOM 1124 OP1 DT B 12 44.504 -43.639 -3.299 1.00 76.50 O ATOM 1125 OP2 DT B 12 43.786 -41.848 -4.984 1.00 69.81 O ATOM 1126 O5' DT B 12 42.276 -43.739 -4.449 1.00 86.02 O ATOM 1127 C5' DT B 12 41.475 -44.475 -3.535 1.00 75.48 C ATOM 1128 C4' DT B 12 40.252 -45.018 -4.247 1.00 81.83 C ATOM 1129 O4' DT B 12 39.305 -43.946 -4.493 1.00 84.07 O ATOM 1130 C3' DT B 12 40.544 -45.649 -5.605 1.00 84.24 C ATOM 1131 O3' DT B 12 39.818 -46.862 -5.729 1.00 91.42 O ATOM 1132 C2' DT B 12 40.041 -44.599 -6.589 1.00 74.97 C ATOM 1133 C1' DT B 12 38.836 -44.082 -5.817 1.00 72.07 C ATOM 1134 N1 DT B 12 38.308 -42.775 -6.296 1.00 61.42 N ATOM 1135 C2 DT B 12 36.954 -42.659 -6.507 1.00 61.18 C ATOM 1136 O2 DT B 12 36.166 -43.569 -6.318 1.00 59.83 O ATOM 1137 N3 DT B 12 36.550 -41.429 -6.949 1.00 52.35 N ATOM 1138 C4 DT B 12 37.341 -40.327 -7.198 1.00 54.94 C ATOM 1139 O4 DT B 12 36.865 -39.266 -7.595 1.00 54.95 O ATOM 1140 C5 DT B 12 38.751 -40.517 -6.958 1.00 56.83 C ATOM 1141 C7 DT B 12 39.716 -39.393 -7.192 1.00 55.27 C ATOM 1142 C6 DT B 12 39.162 -41.717 -6.525 1.00 57.80 C ATOM 1143 P DA B 13 40.339 -48.016 -6.716 1.00111.84 P ATOM 1144 OP1 DA B 13 40.657 -49.208 -5.897 1.00 82.08 O ATOM 1145 OP2 DA B 13 41.375 -47.429 -7.595 1.00 84.80 O ATOM 1146 O5' DA B 13 39.063 -48.332 -7.626 1.00 86.40 O ATOM 1147 C5' DA B 13 37.827 -48.674 -7.014 1.00 80.78 C ATOM 1148 C4' DA B 13 36.672 -48.410 -7.962 1.00 76.87 C ATOM 1149 O4' DA B 13 36.451 -46.980 -8.076 1.00 77.90 O ATOM 1150 C3' DA B 13 36.884 -48.922 -9.385 1.00 79.27 C ATOM 1151 O3' DA B 13 35.669 -49.467 -9.885 1.00 84.80 O ATOM 1152 C2' DA B 13 37.270 -47.653 -10.138 1.00 79.15 C ATOM 1153 C1' DA B 13 36.340 -46.666 -9.447 1.00 72.29 C ATOM 1154 N9 DA B 13 36.671 -45.260 -9.660 1.00 67.70 N ATOM 1155 C8 DA B 13 37.900 -44.662 -9.608 1.00 67.70 C ATOM 1156 N7 DA B 13 37.868 -43.370 -9.849 1.00 60.75 N ATOM 1157 C5 DA B 13 36.524 -43.107 -10.071 1.00 60.18 C ATOM 1158 C6 DA B 13 35.816 -41.927 -10.378 1.00 56.04 C ATOM 1159 N6 DA B 13 36.388 -40.728 -10.523 1.00 56.77 N ATOM 1160 N1 DA B 13 34.480 -42.026 -10.534 1.00 53.42 N ATOM 1161 C2 DA B 13 33.893 -43.219 -10.392 1.00 62.85 C ATOM 1162 N3 DA B 13 34.451 -44.392 -10.106 1.00 58.63 N ATOM 1163 C4 DA B 13 35.777 -44.263 -9.957 1.00 58.90 C TER 1164 DA B 13 ATOM 1165 O5' DC C 14 32.166 -32.948 -14.280 1.00 74.30 O ATOM 1166 C5' DC C 14 31.428 -32.885 -15.494 1.00 62.45 C ATOM 1167 C4' DC C 14 30.871 -34.252 -15.842 1.00 59.93 C ATOM 1168 O4' DC C 14 31.915 -35.077 -16.415 1.00 65.32 O ATOM 1169 C3' DC C 14 30.331 -35.029 -14.653 1.00 71.01 C ATOM 1170 O3' DC C 14 28.954 -34.723 -14.490 1.00 79.14 O ATOM 1171 C2' DC C 14 30.540 -36.480 -15.072 1.00 63.61 C ATOM 1172 C1' DC C 14 31.778 -36.411 -15.965 1.00 51.02 C ATOM 1173 N1 DC C 14 33.046 -36.800 -15.282 1.00 50.82 N ATOM 1174 C2 DC C 14 33.272 -38.137 -14.943 1.00 57.10 C ATOM 1175 O2 DC C 14 32.407 -38.978 -15.215 1.00 54.79 O ATOM 1176 N3 DC C 14 34.432 -38.472 -14.325 1.00 55.39 N ATOM 1177 C4 DC C 14 35.339 -37.531 -14.052 1.00 58.58 C ATOM 1178 N4 DC C 14 36.467 -37.908 -13.442 1.00 45.89 N ATOM 1179 C5 DC C 14 35.127 -36.163 -14.391 1.00 48.64 C ATOM 1180 C6 DC C 14 33.979 -35.847 -14.999 1.00 44.29 C ATOM 1181 P DT C 15 28.291 -34.740 -13.028 1.00 87.62 P ATOM 1182 OP1 DT C 15 26.962 -34.096 -13.121 1.00 78.18 O ATOM 1183 OP2 DT C 15 29.295 -34.229 -12.067 1.00 63.78 O ATOM 1184 O5' DT C 15 28.090 -36.297 -12.729 1.00 58.01 O ATOM 1185 C5' DT C 15 27.428 -37.122 -13.679 1.00 55.36 C ATOM 1186 C4' DT C 15 27.430 -38.562 -13.205 1.00 64.83 C ATOM 1187 O4' DT C 15 28.790 -39.066 -13.196 1.00 71.16 O ATOM 1188 C3' DT C 15 26.882 -38.758 -11.796 1.00 72.73 C ATOM 1189 O3' DT C 15 26.005 -39.876 -11.769 1.00 76.75 O ATOM 1190 C2' DT C 15 28.126 -38.987 -10.941 1.00 74.31 C ATOM 1191 C1' DT C 15 29.091 -39.623 -11.934 1.00 63.76 C ATOM 1192 N1 DT C 15 30.521 -39.340 -11.625 1.00 57.28 N ATOM 1193 C2 DT C 15 31.352 -40.384 -11.284 1.00 61.77 C ATOM 1194 O2 DT C 15 30.981 -41.542 -11.223 1.00 66.12 O ATOM 1195 N3 DT C 15 32.646 -40.016 -11.018 1.00 54.96 N ATOM 1196 C4 DT C 15 33.182 -38.743 -11.056 1.00 58.82 C ATOM 1197 O4 DT C 15 34.363 -38.523 -10.798 1.00 59.13 O ATOM 1198 C5 DT C 15 32.257 -37.698 -11.418 1.00 58.96 C ATOM 1199 C7 DT C 15 32.720 -36.273 -11.493 1.00 54.27 C ATOM 1200 C6 DT C 15 30.989 -38.043 -11.681 1.00 58.52 C ATOM 1201 P DA C 16 25.131 -40.184 -10.457 1.00 99.04 P ATOM 1202 OP1 DA C 16 23.882 -40.852 -10.887 1.00 95.81 O ATOM 1203 OP2 DA C 16 25.062 -38.943 -9.654 1.00 69.27 O ATOM 1204 O5' DA C 16 26.027 -41.231 -9.649 1.00 71.93 O ATOM 1205 C5' DA C 16 26.382 -42.476 -10.239 1.00 79.05 C ATOM 1206 C4' DA C 16 27.127 -43.324 -9.227 1.00 73.77 C ATOM 1207 O4' DA C 16 28.520 -42.918 -9.183 1.00 75.55 O ATOM 1208 C3' DA C 16 26.603 -43.184 -7.804 1.00 75.87 C ATOM 1209 O3' DA C 16 26.690 -44.421 -7.112 1.00 89.06 O ATOM 1210 C2' DA C 16 27.551 -42.152 -7.204 1.00 71.76 C ATOM 1211 C1' DA C 16 28.859 -42.580 -7.855 1.00 68.56 C ATOM 1212 N9 DA C 16 29.873 -41.534 -7.893 1.00 60.29 N ATOM 1213 C8 DA C 16 29.693 -40.209 -8.175 1.00 59.65 C ATOM 1214 N7 DA C 16 30.801 -39.505 -8.134 1.00 53.40 N ATOM 1215 C5 DA C 16 31.775 -40.437 -7.805 1.00 55.48 C ATOM 1216 C6 DA C 16 33.168 -40.339 -7.606 1.00 54.71 C ATOM 1217 N6 DA C 16 33.863 -39.201 -7.714 1.00 42.29 N ATOM 1218 N1 DA C 16 33.829 -41.469 -7.288 1.00 57.26 N ATOM 1219 C2 DA C 16 33.150 -42.615 -7.177 1.00 61.20 C ATOM 1220 N3 DA C 16 31.848 -42.831 -7.340 1.00 55.49 N ATOM 1221 C4 DA C 16 31.215 -41.692 -7.655 1.00 52.86 C ATOM 1222 P DC C 17 25.840 -44.652 -5.769 1.00102.64 P ATOM 1223 OP1 DC C 17 24.425 -44.854 -6.155 1.00 76.04 O ATOM 1224 OP2 DC C 17 26.192 -43.576 -4.816 1.00 86.19 O ATOM 1225 O5' DC C 17 26.415 -46.027 -5.190 1.00 85.86 O ATOM 1226 C5' DC C 17 27.656 -46.541 -5.657 1.00 90.96 C ATOM 1227 C4' DC C 17 28.821 -46.141 -4.764 1.00 89.85 C ATOM 1228 O4' DC C 17 29.342 -44.841 -5.136 1.00 82.11 O ATOM 1229 C3' DC C 17 28.529 -46.046 -3.265 1.00 74.91 C ATOM 1230 O3' DC C 17 29.121 -47.164 -2.611 1.00 73.48 O ATOM 1231 C2' DC C 17 29.174 -44.724 -2.837 1.00 74.60 C ATOM 1232 C1' DC C 17 30.090 -44.426 -4.017 1.00 62.75 C ATOM 1233 N1 DC C 17 30.499 -42.996 -4.162 1.00 59.38 N ATOM 1234 C2 DC C 17 31.852 -42.670 -4.028 1.00 63.59 C ATOM 1235 O2 DC C 17 32.662 -43.575 -3.797 1.00 70.69 O ATOM 1236 N3 DC C 17 32.234 -41.376 -4.157 1.00 51.24 N ATOM 1237 C4 DC C 17 31.325 -40.433 -4.408 1.00 56.41 C ATOM 1238 N4 DC C 17 31.757 -39.172 -4.526 1.00 55.72 N ATOM 1239 C5 DC C 17 29.940 -40.746 -4.546 1.00 62.80 C ATOM 1240 C6 DC C 17 29.574 -42.027 -4.417 1.00 61.42 C ATOM 1241 P DT C 18 29.093 -47.276 -1.007 1.00106.85 P ATOM 1242 OP1 DT C 18 28.977 -48.708 -0.653 1.00 91.52 O ATOM 1243 OP2 DT C 18 28.091 -46.312 -0.498 1.00 69.33 O ATOM 1244 O5' DT C 18 30.542 -46.761 -0.570 1.00 92.57 O ATOM 1245 C5' DT C 18 31.702 -47.453 -1.019 1.00 85.10 C ATOM 1246 C4' DT C 18 32.950 -46.893 -0.362 1.00 81.86 C ATOM 1247 O4' DT C 18 33.200 -45.556 -0.856 1.00 76.42 O ATOM 1248 C3' DT C 18 32.877 -46.803 1.158 1.00 83.44 C ATOM 1249 O3' DT C 18 33.848 -47.677 1.724 1.00 83.15 O ATOM 1250 C2' DT C 18 33.157 -45.337 1.494 1.00 81.12 C ATOM 1251 C1' DT C 18 33.668 -44.734 0.189 1.00 74.77 C ATOM 1252 N1 DT C 18 33.166 -43.352 -0.075 1.00 64.90 N ATOM 1253 C2 DT C 18 34.060 -42.307 -0.148 1.00 62.99 C ATOM 1254 O2 DT C 18 35.263 -42.437 -0.004 1.00 63.38 O ATOM 1255 N3 DT C 18 33.491 -41.085 -0.399 1.00 56.89 N ATOM 1256 C4 DT C 18 32.150 -40.809 -0.581 1.00 66.38 C ATOM 1257 O4 DT C 18 31.740 -39.673 -0.802 1.00 63.94 O ATOM 1258 C5 DT C 18 31.270 -41.948 -0.493 1.00 70.41 C ATOM 1259 C7 DT C 18 29.790 -41.776 -0.673 1.00 61.69 C ATOM 1260 C6 DT C 18 31.813 -43.147 -0.249 1.00 58.25 C ATOM 1261 P DA C 19 33.772 -48.071 3.280 1.00 98.25 P ATOM 1262 OP1 DA C 19 34.166 -49.490 3.412 1.00 82.50 O ATOM 1263 OP2 DA C 19 32.463 -47.618 3.801 1.00 77.13 O ATOM 1264 O5' DA C 19 34.903 -47.163 3.948 1.00 93.08 O ATOM 1265 C5' DA C 19 36.184 -47.098 3.343 1.00 82.19 C ATOM 1266 C4' DA C 19 36.947 -45.893 3.857 1.00 73.26 C ATOM 1267 O4' DA C 19 36.344 -44.673 3.354 1.00 76.80 O ATOM 1268 C3' DA C 19 36.981 -45.758 5.373 1.00 76.78 C ATOM 1269 O3' DA C 19 38.263 -45.296 5.754 1.00 60.49 O ATOM 1270 C2' DA C 19 35.895 -44.723 5.656 1.00 67.08 C ATOM 1271 C1' DA C 19 36.006 -43.824 4.431 1.00 74.86 C ATOM 1272 N9 DA C 19 34.770 -43.131 4.082 1.00 73.48 N ATOM 1273 C8 DA C 19 33.489 -43.594 4.196 1.00 67.85 C ATOM 1274 N7 DA C 19 32.579 -42.736 3.793 1.00 56.02 N ATOM 1275 C5 DA C 19 33.316 -41.636 3.385 1.00 53.60 C ATOM 1276 C6 DA C 19 32.951 -40.383 2.852 1.00 52.04 C ATOM 1277 N6 DA C 19 31.687 -40.007 2.626 1.00 51.39 N ATOM 1278 N1 DA C 19 33.944 -39.519 2.555 1.00 52.77 N ATOM 1279 C2 DA C 19 35.210 -39.884 2.777 1.00 56.24 C ATOM 1280 N3 DA C 19 35.675 -41.029 3.271 1.00 61.28 N ATOM 1281 C4 DA C 19 34.667 -41.866 3.556 1.00 60.91 C ATOM 1282 P DG C 20 38.751 -45.437 7.277 1.00 87.57 P ATOM 1283 OP1 DG C 20 40.137 -45.955 7.265 1.00 69.26 O ATOM 1284 OP2 DG C 20 37.701 -46.165 8.024 1.00 60.07 O ATOM 1285 O5' DG C 20 38.769 -43.927 7.798 1.00 72.12 O ATOM 1286 C5' DG C 20 39.403 -42.936 6.999 1.00 61.61 C ATOM 1287 C4' DG C 20 38.857 -41.556 7.314 1.00 52.55 C ATOM 1288 O4' DG C 20 37.561 -41.368 6.695 1.00 61.73 O ATOM 1289 C3' DG C 20 38.653 -41.275 8.802 1.00 48.64 C ATOM 1290 O3' DG C 20 39.558 -40.264 9.224 1.00 44.35 O ATOM 1291 C2' DG C 20 37.198 -40.818 8.913 1.00 56.54 C ATOM 1292 C1' DG C 20 36.889 -40.409 7.479 1.00 55.01 C ATOM 1293 N9 DG C 20 35.466 -40.384 7.145 1.00 51.40 N ATOM 1294 C8 DG C 20 34.526 -41.362 7.370 1.00 55.50 C ATOM 1295 N7 DG C 20 33.330 -41.039 6.958 1.00 57.36 N ATOM 1296 C5 DG C 20 33.490 -39.766 6.425 1.00 52.58 C ATOM 1297 C6 DG C 20 32.545 -38.899 5.827 1.00 45.45 C ATOM 1298 O6 DG C 20 31.336 -39.089 5.639 1.00 47.99 O ATOM 1299 N1 DG C 20 33.130 -37.701 5.423 1.00 42.67 N ATOM 1300 C2 DG C 20 34.456 -37.379 5.578 1.00 47.55 C ATOM 1301 N2 DG C 20 34.835 -36.175 5.127 1.00 38.98 N ATOM 1302 N3 DG C 20 35.351 -38.180 6.137 1.00 46.59 N ATOM 1303 C4 DG C 20 34.797 -39.350 6.535 1.00 50.01 C ATOM 1304 P DC C 21 39.523 -39.730 10.738 1.00 61.16 P ATOM 1305 OP1 DC C 21 40.813 -39.059 11.014 1.00 54.88 O ATOM 1306 OP2 DC C 21 39.075 -40.843 11.603 1.00 53.15 O ATOM 1307 O5' DC C 21 38.364 -38.630 10.717 1.00 60.01 O ATOM 1308 C5' DC C 21 38.469 -37.529 9.823 1.00 49.00 C ATOM 1309 C4' DC C 21 37.220 -36.671 9.884 1.00 46.02 C ATOM 1310 O4' DC C 21 36.143 -37.321 9.170 1.00 55.27 O ATOM 1311 C3' DC C 21 36.680 -36.444 11.286 1.00 53.01 C ATOM 1312 O3' DC C 21 37.331 -35.318 11.861 1.00 44.25 O ATOM 1313 C2' DC C 21 35.198 -36.180 11.032 1.00 48.80 C ATOM 1314 C1' DC C 21 34.904 -36.949 9.742 1.00 48.04 C ATOM 1315 N1 DC C 21 34.095 -38.187 9.951 1.00 48.55 N ATOM 1316 C2 DC C 21 32.837 -38.311 9.350 1.00 46.96 C ATOM 1317 O2 DC C 21 32.406 -37.388 8.648 1.00 53.29 O ATOM 1318 N3 DC C 21 32.120 -39.444 9.554 1.00 51.46 N ATOM 1319 C4 DC C 21 32.616 -40.420 10.317 1.00 58.61 C ATOM 1320 N4 DC C 21 31.874 -41.518 10.491 1.00 46.60 N ATOM 1321 C5 DC C 21 33.894 -40.313 10.938 1.00 47.89 C ATOM 1322 C6 DC C 21 34.590 -39.191 10.728 1.00 50.79 C ATOM 1323 P DC C 22 37.498 -35.207 13.455 1.00 48.04 P ATOM 1324 OP1 DC C 22 38.507 -34.162 13.736 1.00 42.20 O ATOM 1325 OP2 DC C 22 37.680 -36.574 13.992 1.00 45.61 O ATOM 1326 O5' DC C 22 36.071 -34.682 13.942 1.00 45.05 O ATOM 1327 C5' DC C 22 35.586 -33.434 13.471 1.00 38.67 C ATOM 1328 C4' DC C 22 34.172 -33.212 13.966 1.00 42.55 C ATOM 1329 O4' DC C 22 33.247 -34.009 13.181 1.00 37.65 O ATOM 1330 C3' DC C 22 33.948 -33.613 15.422 1.00 41.39 C ATOM 1331 O3' DC C 22 33.162 -32.628 16.068 1.00 42.30 O ATOM 1332 C2' DC C 22 33.183 -34.927 15.304 1.00 40.37 C ATOM 1333 C1' DC C 22 32.342 -34.621 14.073 1.00 47.79 C ATOM 1334 N1 DC C 22 31.749 -35.823 13.430 1.00 41.38 N ATOM 1335 C2 DC C 22 30.570 -35.685 12.695 1.00 44.66 C ATOM 1336 O2 DC C 22 30.052 -34.567 12.594 1.00 45.38 O ATOM 1337 N3 DC C 22 30.027 -36.781 12.112 1.00 41.24 N ATOM 1338 C4 DC C 22 30.617 -37.969 12.245 1.00 43.00 C ATOM 1339 N4 DC C 22 30.044 -39.020 11.652 1.00 41.26 N ATOM 1340 C5 DC C 22 31.820 -38.132 12.993 1.00 37.43 C ATOM 1341 C6 DC C 22 32.347 -37.043 13.564 1.00 38.58 C ATOM 1342 P DA C 23 33.155 -32.520 17.671 1.00 46.25 P ATOM 1343 OP1 DA C 23 34.417 -31.876 18.091 1.00 46.76 O ATOM 1344 OP2 DA C 23 32.790 -33.846 18.216 1.00 48.91 O ATOM 1345 O5' DA C 23 31.946 -31.521 17.966 1.00 48.08 O ATOM 1346 C5' DA C 23 31.814 -30.353 17.171 1.00 44.59 C ATOM 1347 C4' DA C 23 30.368 -30.153 16.762 1.00 40.28 C ATOM 1348 O4' DA C 23 29.953 -31.251 15.911 1.00 48.61 O ATOM 1349 C3' DA C 23 29.384 -30.116 17.924 1.00 36.22 C ATOM 1350 O3' DA C 23 28.437 -29.086 17.704 1.00 47.76 O ATOM 1351 C2' DA C 23 28.735 -31.498 17.904 1.00 42.85 C ATOM 1352 C1' DA C 23 28.782 -31.852 16.424 1.00 47.44 C ATOM 1353 N9 DA C 23 28.870 -33.286 16.168 1.00 43.50 N ATOM 1354 C8 DA C 23 29.853 -34.139 16.589 1.00 48.57 C ATOM 1355 N7 DA C 23 29.676 -35.382 16.203 1.00 38.03 N ATOM 1356 C5 DA C 23 28.496 -35.337 15.478 1.00 35.91 C ATOM 1357 C6 DA C 23 27.762 -36.330 14.801 1.00 43.83 C ATOM 1358 N6 DA C 23 28.131 -37.614 14.746 1.00 42.54 N ATOM 1359 N1 DA C 23 26.627 -35.951 14.178 1.00 42.12 N ATOM 1360 C2 DA C 23 26.257 -34.666 14.233 1.00 41.41 C ATOM 1361 N3 DA C 23 26.864 -33.645 14.837 1.00 37.22 N ATOM 1362 C4 DA C 23 27.987 -34.053 15.446 1.00 36.06 C ATOM 1363 P DT C 24 27.432 -28.650 18.878 1.00 50.72 P ATOM 1364 OP1 DT C 24 27.180 -27.200 18.747 1.00 54.69 O ATOM 1365 OP2 DT C 24 27.951 -29.201 20.149 1.00 43.30 O ATOM 1366 O5' DT C 24 26.083 -29.426 18.519 1.00 43.50 O ATOM 1367 C5' DT C 24 25.547 -29.324 17.208 1.00 47.82 C ATOM 1368 C4' DT C 24 24.300 -30.179 17.101 1.00 58.40 C ATOM 1369 O4' DT C 24 24.655 -31.542 16.760 1.00 59.94 O ATOM 1370 C3' DT C 24 23.496 -30.251 18.394 1.00 63.56 C ATOM 1371 O3' DT C 24 22.140 -29.911 18.134 1.00 84.61 O ATOM 1372 C2' DT C 24 23.647 -31.700 18.854 1.00 63.63 C ATOM 1373 C1' DT C 24 23.873 -32.423 17.534 1.00 54.78 C ATOM 1374 N1 DT C 24 24.612 -33.708 17.660 1.00 44.49 N ATOM 1375 C2 DT C 24 24.135 -34.815 16.995 1.00 44.98 C ATOM 1376 O2 DT C 24 23.132 -34.793 16.308 1.00 54.92 O ATOM 1377 N3 DT C 24 24.883 -35.953 17.168 1.00 40.26 N ATOM 1378 C4 DT C 24 26.036 -36.086 17.923 1.00 38.44 C ATOM 1379 O4 DT C 24 26.640 -37.150 18.019 1.00 39.94 O ATOM 1380 C5 DT C 24 26.477 -34.887 18.591 1.00 41.06 C ATOM 1381 C7 DT C 24 27.713 -34.914 19.437 1.00 26.98 C ATOM 1382 C6 DT C 24 25.756 -33.769 18.431 1.00 46.21 C ATOM 1383 P DG C 25 21.159 -29.524 19.346 1.00 97.87 P ATOM 1384 OP1 DG C 25 20.406 -28.313 18.955 1.00 72.30 O ATOM 1385 OP2 DG C 25 21.954 -29.522 20.594 1.00 64.81 O ATOM 1386 O5' DG C 25 20.149 -30.758 19.415 1.00 76.73 O ATOM 1387 C5' DG C 25 19.523 -31.229 18.232 1.00 68.10 C ATOM 1388 C4' DG C 25 18.870 -32.569 18.509 1.00 71.89 C ATOM 1389 O4' DG C 25 19.866 -33.626 18.467 1.00 70.97 O ATOM 1390 C3' DG C 25 18.209 -32.670 19.878 1.00 82.13 C ATOM 1391 O3' DG C 25 17.050 -33.478 19.793 1.00 87.82 O ATOM 1392 C2' DG C 25 19.289 -33.370 20.692 1.00 51.52 C ATOM 1393 C1' DG C 25 19.748 -34.381 19.652 1.00 63.95 C ATOM 1394 N9 DG C 25 21.028 -35.011 19.950 1.00 54.03 N ATOM 1395 C8 DG C 25 22.068 -34.482 20.673 1.00 54.09 C ATOM 1396 N7 DG C 25 23.087 -35.289 20.774 1.00 47.90 N ATOM 1397 C5 DG C 25 22.695 -36.423 20.073 1.00 44.61 C ATOM 1398 C6 DG C 25 23.385 -37.634 19.836 1.00 42.45 C ATOM 1399 O6 DG C 25 24.521 -37.952 20.216 1.00 44.80 O ATOM 1400 N1 DG C 25 22.625 -38.522 19.078 1.00 41.61 N ATOM 1401 C2 DG C 25 21.358 -38.271 18.607 1.00 53.46 C ATOM 1402 N2 DG C 25 20.783 -39.248 17.893 1.00 52.25 N ATOM 1403 N3 DG C 25 20.700 -37.140 18.821 1.00 48.17 N ATOM 1404 C4 DG C 25 21.428 -36.267 19.559 1.00 51.58 C ATOM 1405 P DG C 26 16.046 -33.572 21.041 1.00 88.07 P ATOM 1406 OP1 DG C 26 15.301 -32.297 21.121 1.00 67.38 O ATOM 1407 OP2 DG C 26 16.818 -34.045 22.211 1.00 64.49 O ATOM 1408 O5' DG C 26 15.035 -34.739 20.624 1.00 79.34 O ATOM 1409 C5' DG C 26 15.331 -35.580 19.516 1.00 70.49 C ATOM 1410 C4' DG C 26 15.476 -37.024 19.958 1.00 78.12 C ATOM 1411 O4' DG C 26 16.880 -37.363 20.084 1.00 67.32 O ATOM 1412 C3' DG C 26 14.836 -37.349 21.306 1.00 78.37 C ATOM 1413 O3' DG C 26 14.052 -38.530 21.201 1.00 92.50 O ATOM 1414 C2' DG C 26 16.032 -37.562 22.230 1.00 70.96 C ATOM 1415 C1' DG C 26 17.035 -38.148 21.246 1.00 60.04 C ATOM 1416 N9 DG C 26 18.422 -38.078 21.693 1.00 47.82 N ATOM 1417 C8 DG C 26 19.061 -37.002 22.261 1.00 55.48 C ATOM 1418 N7 DG C 26 20.309 -37.237 22.559 1.00 53.21 N ATOM 1419 C5 DG C 26 20.509 -38.554 22.163 1.00 51.19 C ATOM 1420 C6 DG C 26 21.668 -39.361 22.235 1.00 51.27 C ATOM 1421 O6 DG C 26 22.788 -39.066 22.678 1.00 47.79 O ATOM 1422 N1 DG C 26 21.440 -40.635 21.723 1.00 50.30 N ATOM 1423 C2 DG C 26 20.245 -41.075 21.206 1.00 57.02 C ATOM 1424 N2 DG C 26 20.220 -42.339 20.760 1.00 55.73 N ATOM 1425 N3 DG C 26 19.150 -40.329 21.132 1.00 54.29 N ATOM 1426 C4 DG C 26 19.357 -39.085 21.627 1.00 46.82 C TER 1427 DG C 26 HETATM 1428 O HOH A 201 27.052 -32.948 6.501 1.00 35.07 O CONECT 1005 1030 CONECT 1019 1020 1023 CONECT 1020 1019 1025 1026 CONECT 1021 1022 1026 1027 CONECT 1022 1021 1023 1028 CONECT 1023 1019 1022 1029 CONECT 1024 1027 1028 CONECT 1025 1020 CONECT 1026 1020 1021 CONECT 1027 1021 1024 1037 CONECT 1028 1022 1024 CONECT 1029 1023 CONECT 1030 1005 1031 1032 1033 CONECT 1031 1030 CONECT 1032 1030 CONECT 1033 1030 1034 CONECT 1034 1033 1035 CONECT 1035 1034 1036 1039 CONECT 1036 1035 1037 CONECT 1037 1027 1036 1038 CONECT 1038 1037 1039 CONECT 1039 1035 1038 1040 CONECT 1040 1039 MASTER 287 0 1 6 2 0 0 6 1418 3 23 11 END
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Related entries of code: 4hdv
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB Code
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Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4hdv
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
S. pombe Alkyltransferase-like protein 1, ATL1
Ligand Name
damaged DNA containing 2,6-diaminopurine (DAP)
EC.Number
E.C.-.-.-.-
Resolution
2.7(Å)
Affinity (Kd/Ki/IC50)
Kd=4.9nM
Release Year
2012
Protein/NA Sequence
Check fasta file
Primary Reference
(2012) Proc.Natl.Acad.Sci.USA Vol. 109: pp. 18755-18760
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):
Q9UTN9
Entrez Gene ID
NCBI Entrez Gene ID:
2541704
ASD
Information of known allosteric effects of PDB entries
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