Browse entries in the PDBbind-CN Database
HEADER DNA BINDING PROTEIN/DNA 02-OCT-12 4HDU TITLE CRYSTAL STRUCTURE OF S. POMBE ATL1 IN COMPLEX WITH DAMAGED DNA TITLE 2 CONTAINING 2-AMINOPURINE 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*(2PR)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 4HDU 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. 2.85 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) : 2.85 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 34.89 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 0.210 REMARK 3 COMPLETENESS FOR RANGE (%) : 97.9 REMARK 3 NUMBER OF REFLECTIONS : 6352 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.219 REMARK 3 R VALUE (WORKING SET) : 0.213 REMARK 3 FREE R VALUE : 0.267 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 10.080 REMARK 3 FREE R VALUE TEST SET COUNT : 640 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 34.8930 - 4.8667 0.99 1277 143 0.2012 0.2335 REMARK 3 2 4.8667 - 3.8645 1.00 1164 130 0.1936 0.2661 REMARK 3 3 3.8645 - 3.3764 0.99 1124 127 0.2280 0.2680 REMARK 3 4 3.3764 - 3.0679 0.98 1106 124 0.2178 0.3185 REMARK 3 5 3.0679 - 2.8480 0.93 1041 116 0.2809 0.3331 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 : 0.33 REMARK 3 B_SOL : 54.58 REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.400 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 25.650 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) : 8.40430 REMARK 3 B22 (A**2) : 8.40430 REMARK 3 B33 (A**2) : -16.80870 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 : 0.006 1541 REMARK 3 ANGLE : 0.780 2153 REMARK 3 CHIRALITY : 0.039 227 REMARK 3 PLANARITY : 0.002 188 REMARK 3 DIHEDRAL : 22.584 616 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 4HDU 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 RCSB075341. 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 : 6482 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.848 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 (%) : 99.8 REMARK 200 DATA REDUNDANCY : 19.900 REMARK 200 R MERGE (I) : 0.04800 REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 83.6000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.85 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.95 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : 20.90 REMARK 200 R MERGE FOR SHELL (I) : 0.36900 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : 12.200 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 (%): 56.56 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.83 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 78.49600 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 156.99200 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 117.74400 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 196.24000 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 39.24800 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 78.49600 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 156.99200 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 196.24000 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 117.74400 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 39.24800 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: 3550 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 9490 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 11 O4' - C1' - N9 ANGL. DEV. = 3.4 DEGREES REMARK 500 DT B 12 O4' - C1' - N1 ANGL. DEV. = 1.9 DEGREES REMARK 500 DA B 13 O4' - C1' - N9 ANGL. DEV. = 1.9 DEGREES REMARK 500 DG C 25 O4' - C1' - N9 ANGL. DEV. = 3.3 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 30.35 -94.07 REMARK 500 LEU A 94 50.47 70.61 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 4HDV RELATED DB: PDB DBREF 4HDU A 1 108 UNP Q9UTN9 ATL1_SCHPO 1 108 DBREF 4HDU B 1 13 PDB 4HDU 4HDU 1 13 DBREF 4HDU C 14 26 PDB 4HDU 4HDU 14 26 SEQADV 4HDU GLY A 109 UNP Q9UTN9 EXPRESSION TAG SEQADV 4HDU SER A 110 UNP Q9UTN9 EXPRESSION TAG SEQADV 4HDU HIS A 111 UNP Q9UTN9 EXPRESSION TAG SEQADV 4HDU HIS A 112 UNP Q9UTN9 EXPRESSION TAG SEQADV 4HDU HIS A 113 UNP Q9UTN9 EXPRESSION TAG SEQADV 4HDU HIS A 114 UNP Q9UTN9 EXPRESSION TAG SEQADV 4HDU HIS A 115 UNP Q9UTN9 EXPRESSION TAG SEQADV 4HDU 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 2PR DC DT DA DG DT DA SEQRES 1 C 13 DC DT DA DC DT DA DG DC DC DA DT DG DG MODRES 4HDU 2PR B 7 DG HET 2PR B 7 21 HETNAM 2PR 2-AMINO-9-[2-DEOXYRIBOFURANOSYL]-9H-PURINE-5'- HETNAM 2 2PR MONOPHOSPHATE HETSYN 2PR 2-AMINOPURINE-2'-DEOXYRIBO-5'-MONOPHOSPHATE FORMUL 2 2PR C10 H14 N5 O6 P 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 LEU A 48 1 12 HELIX 4 4 PRO A 55 HIS A 57 5 3 HELIX 5 5 ILE A 71 GLU A 85 1 15 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 SHEET 1 B 2 TYR A 90 GLN A 91 0 SHEET 2 B 2 TYR A 97 LYS A 98 -1 O LYS A 98 N TYR A 90 LINK O3' DG B 6 P 2PR B 7 1555 1555 1.61 LINK O3' 2PR B 7 P DC B 8 1555 1555 1.61 CRYST1 59.978 59.978 235.488 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 0.016673 0.009626 0.000000 0.00000 SCALE2 0.000000 0.019252 0.000000 0.00000 SCALE3 0.000000 0.000000 0.004247 0.00000 ATOM 1 N MET A 1 37.603 -26.181 21.632 1.00 51.55 N ATOM 2 CA MET A 1 36.716 -25.166 21.076 1.00 63.30 C ATOM 3 C MET A 1 35.252 -25.535 21.279 1.00 69.11 C ATOM 4 O MET A 1 34.775 -26.542 20.753 1.00 66.09 O ATOM 5 CB MET A 1 36.991 -24.958 19.586 1.00 52.29 C ATOM 6 CG MET A 1 36.090 -23.913 18.945 1.00 57.38 C ATOM 7 SD MET A 1 36.302 -23.744 17.157 1.00 66.37 S ATOM 8 CE MET A 1 37.932 -23.016 17.050 1.00 52.72 C ATOM 9 N ARG A 2 34.544 -24.712 22.043 1.00 65.97 N ATOM 10 CA ARG A 2 33.119 -24.914 22.260 1.00 57.23 C ATOM 11 C ARG A 2 32.346 -24.734 20.963 1.00 55.08 C ATOM 12 O ARG A 2 32.741 -23.951 20.095 1.00 50.50 O ATOM 13 CB ARG A 2 32.594 -23.936 23.310 1.00 63.78 C ATOM 14 CG ARG A 2 32.977 -24.290 24.729 1.00 62.36 C ATOM 15 CD ARG A 2 32.376 -23.307 25.717 1.00 64.14 C ATOM 16 NE ARG A 2 33.357 -22.335 26.187 1.00 69.44 N ATOM 17 CZ ARG A 2 33.416 -21.070 25.785 1.00 61.70 C ATOM 18 NH1 ARG A 2 32.542 -20.608 24.902 1.00 50.00 N ATOM 19 NH2 ARG A 2 34.349 -20.264 26.272 1.00 64.45 N ATOM 20 N MET A 3 31.242 -25.462 20.834 1.00 48.66 N ATOM 21 CA MET A 3 30.410 -25.351 19.645 1.00 52.97 C ATOM 22 C MET A 3 29.977 -23.909 19.405 1.00 51.55 C ATOM 23 O MET A 3 29.959 -23.440 18.269 1.00 56.35 O ATOM 24 CB MET A 3 29.194 -26.271 19.741 1.00 48.63 C ATOM 25 CG MET A 3 29.449 -27.688 19.243 1.00 63.15 C ATOM 26 SD MET A 3 29.973 -27.738 17.505 1.00 85.01 S ATOM 27 CE MET A 3 31.755 -27.788 17.695 1.00 50.41 C ATOM 28 N ASP A 4 29.648 -23.204 20.480 1.00 53.00 N ATOM 29 CA ASP A 4 29.237 -21.810 20.377 1.00 49.72 C ATOM 30 C ASP A 4 30.360 -20.959 19.804 1.00 52.41 C ATOM 31 O ASP A 4 30.119 -20.040 19.023 1.00 55.61 O ATOM 32 CB ASP A 4 28.809 -21.272 21.743 1.00 53.98 C ATOM 33 CG ASP A 4 29.920 -21.341 22.773 1.00 58.25 C ATOM 34 OD1 ASP A 4 30.685 -20.359 22.888 1.00 62.77 O ATOM 35 OD2 ASP A 4 30.023 -22.372 23.470 1.00 48.87 O ATOM 36 N GLU A 5 31.589 -21.267 20.199 1.00 51.11 N ATOM 37 CA GLU A 5 32.745 -20.562 19.668 1.00 59.63 C ATOM 38 C GLU A 5 32.837 -20.797 18.170 1.00 58.23 C ATOM 39 O GLU A 5 33.026 -19.862 17.393 1.00 57.17 O ATOM 40 CB GLU A 5 34.025 -21.030 20.357 1.00 56.55 C ATOM 41 CG GLU A 5 34.012 -20.828 21.859 1.00 54.11 C ATOM 42 CD GLU A 5 35.348 -21.140 22.499 1.00 63.90 C ATOM 43 OE1 GLU A 5 36.267 -20.306 22.367 1.00 68.54 O ATOM 44 OE2 GLU A 5 35.482 -22.214 23.129 1.00 57.02 O ATOM 45 N PHE A 6 32.694 -22.058 17.775 1.00 56.89 N ATOM 46 CA PHE A 6 32.721 -22.436 16.370 1.00 44.66 C ATOM 47 C PHE A 6 31.684 -21.662 15.564 1.00 55.25 C ATOM 48 O PHE A 6 32.027 -20.950 14.619 1.00 55.75 O ATOM 49 CB PHE A 6 32.485 -23.939 16.221 1.00 52.00 C ATOM 50 CG PHE A 6 32.462 -24.410 14.794 1.00 57.48 C ATOM 51 CD1 PHE A 6 33.636 -24.534 14.071 1.00 57.42 C ATOM 52 CD2 PHE A 6 31.265 -24.729 14.174 1.00 59.12 C ATOM 53 CE1 PHE A 6 33.616 -24.966 12.754 1.00 61.49 C ATOM 54 CE2 PHE A 6 31.239 -25.164 12.859 1.00 55.83 C ATOM 55 CZ PHE A 6 32.416 -25.282 12.149 1.00 48.98 C ATOM 56 N TYR A 7 30.416 -21.806 15.943 1.00 56.08 N ATOM 57 CA TYR A 7 29.321 -21.134 15.246 1.00 53.51 C ATOM 58 C TYR A 7 29.606 -19.648 15.058 1.00 51.86 C ATOM 59 O TYR A 7 29.307 -19.076 14.014 1.00 50.70 O ATOM 60 CB TYR A 7 28.002 -21.311 16.005 1.00 56.98 C ATOM 61 CG TYR A 7 27.322 -22.647 15.790 1.00 60.97 C ATOM 62 CD1 TYR A 7 27.924 -23.827 16.201 1.00 60.93 C ATOM 63 CD2 TYR A 7 26.067 -22.725 15.195 1.00 60.85 C ATOM 64 CE1 TYR A 7 27.306 -25.051 16.013 1.00 59.46 C ATOM 65 CE2 TYR A 7 25.440 -23.944 15.003 1.00 66.32 C ATOM 66 CZ TYR A 7 26.067 -25.104 15.415 1.00 76.71 C ATOM 67 OH TYR A 7 25.455 -26.325 15.232 1.00 81.95 O ATOM 68 N THR A 8 30.184 -19.020 16.074 1.00 52.42 N ATOM 69 CA THR A 8 30.461 -17.594 15.999 1.00 55.82 C ATOM 70 C THR A 8 31.552 -17.309 14.973 1.00 55.42 C ATOM 71 O THR A 8 31.413 -16.405 14.151 1.00 59.70 O ATOM 72 CB THR A 8 30.821 -17.000 17.380 1.00 56.62 C ATOM 73 OG1 THR A 8 29.676 -17.073 18.240 1.00 58.53 O ATOM 74 CG2 THR A 8 31.236 -15.545 17.245 1.00 52.80 C ATOM 75 N LYS A 9 32.626 -18.092 15.009 1.00 51.99 N ATOM 76 CA LYS A 9 33.709 -17.931 14.041 1.00 59.74 C ATOM 77 C LYS A 9 33.221 -18.122 12.608 1.00 55.05 C ATOM 78 O LYS A 9 33.486 -17.288 11.738 1.00 52.91 O ATOM 79 CB LYS A 9 34.866 -18.881 14.348 1.00 55.64 C ATOM 80 CG LYS A 9 35.675 -18.469 15.568 1.00 70.00 C ATOM 81 CD LYS A 9 36.887 -19.359 15.778 1.00 69.93 C ATOM 82 CE LYS A 9 37.702 -18.888 16.972 1.00 79.22 C ATOM 83 NZ LYS A 9 38.870 -19.775 17.230 1.00 96.78 N ATOM 84 N VAL A 10 32.508 -19.220 12.372 1.00 49.46 N ATOM 85 CA VAL A 10 31.904 -19.480 11.069 1.00 45.63 C ATOM 86 C VAL A 10 31.102 -18.274 10.597 1.00 49.97 C ATOM 87 O VAL A 10 31.256 -17.821 9.465 1.00 54.31 O ATOM 88 CB VAL A 10 30.984 -20.709 11.116 1.00 48.35 C ATOM 89 CG1 VAL A 10 30.240 -20.875 9.803 1.00 38.40 C ATOM 90 CG2 VAL A 10 31.790 -21.955 11.440 1.00 57.95 C ATOM 91 N TYR A 11 30.255 -17.748 11.474 1.00 51.01 N ATOM 92 CA TYR A 11 29.462 -16.566 11.146 1.00 55.69 C ATOM 93 C TYR A 11 30.329 -15.345 10.855 1.00 53.66 C ATOM 94 O TYR A 11 30.062 -14.603 9.913 1.00 52.57 O ATOM 95 CB TYR A 11 28.462 -16.256 12.259 1.00 54.82 C ATOM 96 CG TYR A 11 27.404 -17.319 12.404 1.00 57.92 C ATOM 97 CD1 TYR A 11 26.789 -17.554 13.624 1.00 52.98 C ATOM 98 CD2 TYR A 11 27.023 -18.094 11.317 1.00 61.52 C ATOM 99 CE1 TYR A 11 25.825 -18.531 13.759 1.00 55.80 C ATOM 100 CE2 TYR A 11 26.058 -19.075 11.442 1.00 58.99 C ATOM 101 CZ TYR A 11 25.462 -19.288 12.664 1.00 50.32 C ATOM 102 OH TYR A 11 24.501 -20.262 12.790 1.00 54.00 O ATOM 103 N ASP A 12 31.365 -15.134 11.661 1.00 50.65 N ATOM 104 CA ASP A 12 32.263 -14.014 11.425 1.00 50.71 C ATOM 105 C ASP A 12 32.864 -14.163 10.044 1.00 55.12 C ATOM 106 O ASP A 12 32.917 -13.210 9.267 1.00 57.71 O ATOM 107 CB ASP A 12 33.380 -13.966 12.469 1.00 54.95 C ATOM 108 CG ASP A 12 32.883 -13.570 13.842 1.00 60.31 C ATOM 109 OD1 ASP A 12 33.420 -14.095 14.840 1.00 71.90 O ATOM 110 OD2 ASP A 12 31.961 -12.734 13.929 1.00 61.17 O ATOM 111 N ALA A 13 33.312 -15.380 9.752 1.00 60.09 N ATOM 112 CA ALA A 13 33.950 -15.698 8.481 1.00 58.87 C ATOM 113 C ALA A 13 33.036 -15.383 7.303 1.00 55.79 C ATOM 114 O ALA A 13 33.397 -14.606 6.418 1.00 48.59 O ATOM 115 CB ALA A 13 34.364 -17.157 8.457 1.00 40.30 C ATOM 116 N VAL A 14 31.854 -15.991 7.300 1.00 58.92 N ATOM 117 CA VAL A 14 30.896 -15.802 6.219 1.00 54.86 C ATOM 118 C VAL A 14 30.620 -14.326 5.949 1.00 59.13 C ATOM 119 O VAL A 14 30.533 -13.908 4.796 1.00 71.96 O ATOM 120 CB VAL A 14 29.567 -16.523 6.502 1.00 52.93 C ATOM 121 CG1 VAL A 14 28.586 -16.277 5.373 1.00 51.82 C ATOM 122 CG2 VAL A 14 29.801 -18.014 6.683 1.00 53.25 C ATOM 123 N CYS A 15 30.489 -13.535 7.008 1.00 53.56 N ATOM 124 CA CYS A 15 30.243 -12.106 6.846 1.00 62.43 C ATOM 125 C CYS A 15 31.369 -11.429 6.064 1.00 70.36 C ATOM 126 O CYS A 15 31.170 -10.369 5.468 1.00 64.67 O ATOM 127 CB CYS A 15 30.035 -11.423 8.203 1.00 64.75 C ATOM 128 SG CYS A 15 28.407 -11.713 8.951 1.00 64.90 S ATOM 129 N GLU A 16 32.545 -12.052 6.055 1.00 65.86 N ATOM 130 CA GLU A 16 33.695 -11.501 5.340 1.00 73.91 C ATOM 131 C GLU A 16 33.600 -11.711 3.827 1.00 70.57 C ATOM 132 O GLU A 16 34.261 -11.015 3.052 1.00 63.16 O ATOM 133 CB GLU A 16 35.001 -12.100 5.868 1.00 71.68 C ATOM 134 CG GLU A 16 35.289 -11.795 7.326 1.00 64.58 C ATOM 135 CD GLU A 16 36.600 -12.398 7.791 1.00 75.06 C ATOM 136 OE1 GLU A 16 36.785 -12.558 9.018 1.00 79.15 O ATOM 137 OE2 GLU A 16 37.447 -12.713 6.927 1.00 67.92 O ATOM 138 N ILE A 17 32.785 -12.676 3.411 1.00 65.97 N ATOM 139 CA ILE A 17 32.592 -12.949 1.991 1.00 68.42 C ATOM 140 C ILE A 17 32.010 -11.734 1.275 1.00 65.60 C ATOM 141 O ILE A 17 30.872 -11.341 1.530 1.00 69.28 O ATOM 142 CB ILE A 17 31.667 -14.157 1.766 1.00 65.13 C ATOM 143 CG1 ILE A 17 32.197 -15.381 2.516 1.00 61.92 C ATOM 144 CG2 ILE A 17 31.524 -14.450 0.281 1.00 57.84 C ATOM 145 CD1 ILE A 17 31.320 -16.610 2.368 1.00 55.84 C ATOM 146 N PRO A 18 32.799 -11.136 0.372 1.00 66.62 N ATOM 147 CA PRO A 18 32.433 -9.932 -0.379 1.00 71.51 C ATOM 148 C PRO A 18 31.112 -10.082 -1.121 1.00 73.91 C ATOM 149 O PRO A 18 30.702 -11.198 -1.439 1.00 71.90 O ATOM 150 CB PRO A 18 33.576 -9.795 -1.388 1.00 74.10 C ATOM 151 CG PRO A 18 34.727 -10.462 -0.737 1.00 76.12 C ATOM 152 CD PRO A 18 34.143 -11.617 0.017 1.00 78.21 C ATOM 153 N TYR A 19 30.453 -8.960 -1.387 1.00 77.38 N ATOM 154 CA TYR A 19 29.233 -8.963 -2.178 1.00 69.14 C ATOM 155 C TYR A 19 29.498 -9.640 -3.516 1.00 73.15 C ATOM 156 O TYR A 19 30.548 -9.440 -4.126 1.00 75.46 O ATOM 157 CB TYR A 19 28.743 -7.531 -2.398 1.00 69.52 C ATOM 158 CG TYR A 19 27.494 -7.430 -3.243 1.00 84.68 C ATOM 159 CD1 TYR A 19 27.568 -7.422 -4.631 1.00 87.47 C ATOM 160 CD2 TYR A 19 26.241 -7.335 -2.654 1.00 83.37 C ATOM 161 CE1 TYR A 19 26.428 -7.330 -5.408 1.00 85.43 C ATOM 162 CE2 TYR A 19 25.095 -7.241 -3.423 1.00 86.97 C ATOM 163 CZ TYR A 19 25.194 -7.239 -4.799 1.00 95.79 C ATOM 164 OH TYR A 19 24.055 -7.145 -5.567 1.00 97.14 O ATOM 165 N GLY A 20 28.550 -10.454 -3.964 1.00 76.79 N ATOM 166 CA GLY A 20 28.658 -11.107 -5.257 1.00 86.32 C ATOM 167 C GLY A 20 29.769 -12.136 -5.342 1.00 79.22 C ATOM 168 O GLY A 20 30.102 -12.607 -6.430 1.00 80.86 O ATOM 169 N LYS A 21 30.345 -12.483 -4.196 1.00 76.08 N ATOM 170 CA LYS A 21 31.360 -13.529 -4.136 1.00 74.21 C ATOM 171 C LYS A 21 30.797 -14.785 -3.477 1.00 71.64 C ATOM 172 O LYS A 21 29.683 -14.777 -2.955 1.00 63.15 O ATOM 173 CB LYS A 21 32.596 -13.042 -3.380 1.00 77.78 C ATOM 174 CG LYS A 21 33.864 -13.034 -4.215 1.00 78.66 C ATOM 175 CD LYS A 21 33.672 -12.215 -5.484 1.00 85.81 C ATOM 176 CE LYS A 21 34.970 -12.075 -6.266 1.00 98.22 C ATOM 177 NZ LYS A 21 35.500 -13.386 -6.733 1.00 91.30 N ATOM 178 N VAL A 22 31.573 -15.862 -3.499 1.00 62.67 N ATOM 179 CA VAL A 22 31.113 -17.140 -2.977 1.00 53.00 C ATOM 180 C VAL A 22 32.247 -17.892 -2.286 1.00 60.26 C ATOM 181 O VAL A 22 33.411 -17.757 -2.663 1.00 64.52 O ATOM 182 CB VAL A 22 30.537 -18.012 -4.115 1.00 57.00 C ATOM 183 CG1 VAL A 22 30.436 -19.467 -3.694 1.00 64.39 C ATOM 184 CG2 VAL A 22 29.183 -17.482 -4.562 1.00 65.08 C ATOM 185 N SER A 23 31.909 -18.668 -1.261 1.00 51.72 N ATOM 186 CA SER A 23 32.871 -19.581 -0.660 1.00 47.75 C ATOM 187 C SER A 23 32.233 -20.942 -0.396 1.00 49.63 C ATOM 188 O SER A 23 31.082 -21.182 -0.767 1.00 49.13 O ATOM 189 CB SER A 23 33.485 -19.001 0.613 1.00 46.90 C ATOM 190 OG SER A 23 34.546 -19.821 1.075 1.00 45.14 O ATOM 191 N THR A 24 32.985 -21.820 0.257 1.00 47.00 N ATOM 192 CA THR A 24 32.622 -23.229 0.364 1.00 46.72 C ATOM 193 C THR A 24 32.572 -23.709 1.809 1.00 52.83 C ATOM 194 O THR A 24 33.341 -23.245 2.649 1.00 58.11 O ATOM 195 CB THR A 24 33.631 -24.079 -0.421 1.00 50.27 C ATOM 196 OG1 THR A 24 33.378 -23.928 -1.822 1.00 60.60 O ATOM 197 CG2 THR A 24 33.514 -25.540 -0.058 1.00 67.24 C ATOM 198 N TYR A 25 31.664 -24.636 2.103 1.00 55.98 N ATOM 199 CA TYR A 25 31.575 -25.195 3.450 1.00 51.62 C ATOM 200 C TYR A 25 32.960 -25.610 3.929 1.00 52.20 C ATOM 201 O TYR A 25 33.412 -25.194 4.996 1.00 49.20 O ATOM 202 CB TYR A 25 30.626 -26.401 3.492 1.00 47.58 C ATOM 203 CG TYR A 25 29.233 -26.106 2.988 1.00 48.50 C ATOM 204 CD1 TYR A 25 28.760 -26.691 1.824 1.00 46.45 C ATOM 205 CD2 TYR A 25 28.394 -25.231 3.671 1.00 53.95 C ATOM 206 CE1 TYR A 25 27.493 -26.422 1.355 1.00 56.51 C ATOM 207 CE2 TYR A 25 27.123 -24.956 3.209 1.00 47.25 C ATOM 208 CZ TYR A 25 26.678 -25.554 2.049 1.00 58.21 C ATOM 209 OH TYR A 25 25.414 -25.289 1.576 1.00 53.37 O ATOM 210 N GLY A 26 33.634 -26.421 3.119 1.00 54.75 N ATOM 211 CA GLY A 26 34.953 -26.921 3.458 1.00 47.37 C ATOM 212 C GLY A 26 35.990 -25.825 3.609 1.00 39.45 C ATOM 213 O GLY A 26 36.874 -25.908 4.459 1.00 43.85 O ATOM 214 N GLU A 27 35.886 -24.796 2.777 1.00 37.61 N ATOM 215 CA GLU A 27 36.834 -23.698 2.816 1.00 47.45 C ATOM 216 C GLU A 27 36.682 -22.923 4.112 1.00 53.88 C ATOM 217 O GLU A 27 37.664 -22.592 4.776 1.00 56.80 O ATOM 218 CB GLU A 27 36.628 -22.765 1.624 1.00 56.81 C ATOM 219 CG GLU A 27 37.647 -21.642 1.555 1.00 68.74 C ATOM 220 CD GLU A 27 39.072 -22.158 1.458 1.00 69.83 C ATOM 221 OE1 GLU A 27 39.965 -21.572 2.106 1.00 75.45 O ATOM 222 OE2 GLU A 27 39.299 -23.149 0.733 1.00 63.23 O ATOM 223 N ILE A 28 35.438 -22.637 4.471 1.00 53.76 N ATOM 224 CA ILE A 28 35.156 -21.925 5.706 1.00 51.89 C ATOM 225 C ILE A 28 35.631 -22.749 6.892 1.00 45.54 C ATOM 226 O ILE A 28 36.291 -22.230 7.794 1.00 45.59 O ATOM 227 CB ILE A 28 33.656 -21.614 5.842 1.00 44.47 C ATOM 228 CG1 ILE A 28 33.187 -20.770 4.661 1.00 52.39 C ATOM 229 CG2 ILE A 28 33.380 -20.872 7.130 1.00 47.47 C ATOM 230 CD1 ILE A 28 33.906 -19.445 4.543 1.00 45.05 C ATOM 231 N ALA A 29 35.298 -24.036 6.885 1.00 41.78 N ATOM 232 CA ALA A 29 35.723 -24.935 7.953 1.00 45.66 C ATOM 233 C ALA A 29 37.230 -24.844 8.153 1.00 50.02 C ATOM 234 O ALA A 29 37.708 -24.587 9.258 1.00 41.45 O ATOM 235 CB ALA A 29 35.311 -26.362 7.643 1.00 44.63 C ATOM 236 N ARG A 30 37.978 -25.052 7.075 1.00 51.71 N ATOM 237 CA ARG A 30 39.426 -24.927 7.133 1.00 55.03 C ATOM 238 C ARG A 30 39.800 -23.544 7.650 1.00 54.68 C ATOM 239 O ARG A 30 40.594 -23.407 8.580 1.00 58.22 O ATOM 240 CB ARG A 30 40.044 -25.178 5.755 1.00 45.88 C ATOM 241 CG ARG A 30 39.931 -26.624 5.287 1.00 58.25 C ATOM 242 CD ARG A 30 40.640 -26.853 3.957 1.00 42.56 C ATOM 243 NE ARG A 30 40.031 -26.093 2.867 1.00 57.39 N ATOM 244 CZ ARG A 30 39.134 -26.587 2.017 1.00 58.62 C ATOM 245 NH1 ARG A 30 38.735 -27.848 2.124 1.00 52.48 N ATOM 246 NH2 ARG A 30 38.635 -25.820 1.057 1.00 43.11 N ATOM 247 N TYR A 31 39.193 -22.526 7.052 1.00 45.77 N ATOM 248 CA TYR A 31 39.462 -21.137 7.398 1.00 46.27 C ATOM 249 C TYR A 31 39.405 -20.845 8.898 1.00 47.29 C ATOM 250 O TYR A 31 40.161 -20.013 9.396 1.00 59.98 O ATOM 251 CB TYR A 31 38.492 -20.224 6.651 1.00 49.33 C ATOM 252 CG TYR A 31 38.716 -18.754 6.893 1.00 52.94 C ATOM 253 CD1 TYR A 31 39.608 -18.029 6.113 1.00 64.16 C ATOM 254 CD2 TYR A 31 38.025 -18.084 7.891 1.00 51.75 C ATOM 255 CE1 TYR A 31 39.810 -16.679 6.326 1.00 57.71 C ATOM 256 CE2 TYR A 31 38.220 -16.735 8.112 1.00 60.94 C ATOM 257 CZ TYR A 31 39.113 -16.038 7.328 1.00 67.16 C ATOM 258 OH TYR A 31 39.309 -14.695 7.548 1.00 78.23 O ATOM 259 N VAL A 32 38.512 -21.517 9.619 1.00 52.13 N ATOM 260 CA VAL A 32 38.381 -21.278 11.060 1.00 52.86 C ATOM 261 C VAL A 32 39.138 -22.312 11.888 1.00 46.68 C ATOM 262 O VAL A 32 38.900 -22.450 13.087 1.00 51.67 O ATOM 263 CB VAL A 32 36.905 -21.241 11.520 1.00 44.42 C ATOM 264 CG1 VAL A 32 36.126 -20.205 10.730 1.00 50.32 C ATOM 265 CG2 VAL A 32 36.266 -22.611 11.386 1.00 52.32 C ATOM 266 N GLY A 33 40.043 -23.038 11.242 1.00 45.88 N ATOM 267 CA GLY A 33 40.880 -24.001 11.933 1.00 52.49 C ATOM 268 C GLY A 33 40.182 -25.305 12.259 1.00 55.12 C ATOM 269 O GLY A 33 40.594 -26.028 13.158 1.00 64.37 O ATOM 270 N MET A 34 39.128 -25.613 11.515 1.00 58.48 N ATOM 271 CA MET A 34 38.349 -26.817 11.757 1.00 52.86 C ATOM 272 C MET A 34 38.077 -27.528 10.437 1.00 53.76 C ATOM 273 O MET A 34 36.938 -27.587 9.977 1.00 57.34 O ATOM 274 CB MET A 34 37.037 -26.450 12.446 1.00 51.15 C ATOM 275 CG MET A 34 37.217 -25.808 13.816 1.00 52.23 C ATOM 276 SD MET A 34 37.466 -27.021 15.130 1.00 62.77 S ATOM 277 CE MET A 34 39.232 -26.918 15.393 1.00 80.70 C ATOM 278 N PRO A 35 39.131 -28.083 9.828 1.00 60.43 N ATOM 279 CA PRO A 35 39.069 -28.639 8.472 1.00 56.59 C ATOM 280 C PRO A 35 38.029 -29.746 8.329 1.00 59.04 C ATOM 281 O PRO A 35 37.427 -29.875 7.263 1.00 61.06 O ATOM 282 CB PRO A 35 40.474 -29.214 8.263 1.00 60.18 C ATOM 283 CG PRO A 35 41.332 -28.525 9.278 1.00 62.67 C ATOM 284 CD PRO A 35 40.450 -28.283 10.451 1.00 48.60 C ATOM 285 N SER A 36 37.819 -30.531 9.381 1.00 47.08 N ATOM 286 CA SER A 36 36.905 -31.664 9.297 1.00 50.56 C ATOM 287 C SER A 36 35.465 -31.270 9.610 1.00 57.88 C ATOM 288 O SER A 36 34.549 -32.085 9.498 1.00 65.05 O ATOM 289 CB SER A 36 37.362 -32.794 10.224 1.00 50.91 C ATOM 290 OG SER A 36 37.418 -32.361 11.570 1.00 55.81 O ATOM 291 N TYR A 37 35.268 -30.012 9.985 1.00 47.89 N ATOM 292 CA TYR A 37 33.956 -29.541 10.410 1.00 52.09 C ATOM 293 C TYR A 37 33.136 -28.906 9.288 1.00 54.46 C ATOM 294 O TYR A 37 32.315 -28.023 9.529 1.00 51.58 O ATOM 295 CB TYR A 37 34.104 -28.577 11.584 1.00 53.53 C ATOM 296 CG TYR A 37 34.282 -29.291 12.899 1.00 52.95 C ATOM 297 CD1 TYR A 37 35.377 -30.115 13.120 1.00 55.69 C ATOM 298 CD2 TYR A 37 33.350 -29.150 13.916 1.00 55.54 C ATOM 299 CE1 TYR A 37 35.538 -30.776 14.321 1.00 64.46 C ATOM 300 CE2 TYR A 37 33.501 -29.807 15.118 1.00 63.69 C ATOM 301 CZ TYR A 37 34.596 -30.617 15.316 1.00 71.92 C ATOM 302 OH TYR A 37 34.747 -31.269 16.516 1.00 70.91 O ATOM 303 N ALA A 38 33.352 -29.373 8.065 1.00 57.41 N ATOM 304 CA ALA A 38 32.623 -28.859 6.914 1.00 56.56 C ATOM 305 C ALA A 38 31.120 -29.064 7.070 1.00 53.14 C ATOM 306 O ALA A 38 30.328 -28.164 6.795 1.00 52.89 O ATOM 307 CB ALA A 38 33.119 -29.520 5.638 1.00 61.23 C ATOM 308 N ARG A 39 30.731 -30.253 7.516 1.00 56.12 N ATOM 309 CA ARG A 39 29.321 -30.562 7.695 1.00 54.27 C ATOM 310 C ARG A 39 28.691 -29.616 8.708 1.00 52.25 C ATOM 311 O ARG A 39 27.554 -29.179 8.543 1.00 59.11 O ATOM 312 CB ARG A 39 29.131 -32.018 8.129 1.00 50.67 C ATOM 313 CG ARG A 39 29.738 -33.027 7.163 1.00 62.43 C ATOM 314 CD ARG A 39 29.134 -34.417 7.324 1.00 60.50 C ATOM 315 NE ARG A 39 27.804 -34.516 6.725 1.00 59.61 N ATOM 316 CZ ARG A 39 27.179 -35.663 6.471 1.00 58.42 C ATOM 317 NH1 ARG A 39 25.970 -35.654 5.923 1.00 50.68 N ATOM 318 NH2 ARG A 39 27.764 -36.819 6.757 1.00 46.76 N ATOM 319 N GLN A 40 29.447 -29.291 9.750 1.00 54.16 N ATOM 320 CA GLN A 40 28.950 -28.434 10.815 1.00 53.89 C ATOM 321 C GLN A 40 28.813 -26.993 10.331 1.00 48.93 C ATOM 322 O GLN A 40 28.002 -26.229 10.846 1.00 54.84 O ATOM 323 CB GLN A 40 29.870 -28.515 12.033 1.00 50.60 C ATOM 324 CG GLN A 40 30.928 -29.601 11.925 1.00 55.20 C ATOM 325 CD GLN A 40 30.351 -30.998 11.846 1.00 58.08 C ATOM 326 OE1 GLN A 40 29.399 -31.335 12.550 1.00 56.36 O ATOM 327 NE2 GLN A 40 30.929 -31.822 10.981 1.00 62.03 N ATOM 328 N VAL A 41 29.608 -26.620 9.336 1.00 47.19 N ATOM 329 CA VAL A 41 29.439 -25.318 8.709 1.00 51.01 C ATOM 330 C VAL A 41 28.067 -25.270 8.035 1.00 52.90 C ATOM 331 O VAL A 41 27.400 -24.233 8.013 1.00 48.56 O ATOM 332 CB VAL A 41 30.542 -25.029 7.676 1.00 40.66 C ATOM 333 CG1 VAL A 41 30.347 -23.656 7.064 1.00 44.03 C ATOM 334 CG2 VAL A 41 31.909 -25.118 8.323 1.00 40.94 C ATOM 335 N GLY A 42 27.645 -26.406 7.493 1.00 47.69 N ATOM 336 CA GLY A 42 26.301 -26.524 6.962 1.00 48.40 C ATOM 337 C GLY A 42 25.285 -26.250 8.052 1.00 51.15 C ATOM 338 O GLY A 42 24.433 -25.365 7.925 1.00 53.10 O ATOM 339 N GLN A 43 25.391 -27.014 9.134 1.00 56.25 N ATOM 340 CA GLN A 43 24.519 -26.859 10.290 1.00 49.16 C ATOM 341 C GLN A 43 24.398 -25.399 10.711 1.00 52.94 C ATOM 342 O GLN A 43 23.296 -24.882 10.874 1.00 56.90 O ATOM 343 CB GLN A 43 25.048 -27.681 11.460 1.00 54.31 C ATOM 344 CG GLN A 43 25.224 -29.166 11.173 1.00 56.15 C ATOM 345 CD GLN A 43 25.727 -29.931 12.391 1.00 79.40 C ATOM 346 OE1 GLN A 43 26.123 -29.335 13.397 1.00 62.83 O ATOM 347 NE2 GLN A 43 25.710 -31.257 12.306 1.00 69.11 N ATOM 348 N ALA A 44 25.538 -24.744 10.902 1.00 45.37 N ATOM 349 CA ALA A 44 25.551 -23.340 11.289 1.00 50.63 C ATOM 350 C ALA A 44 24.659 -22.510 10.370 1.00 51.20 C ATOM 351 O ALA A 44 23.850 -21.711 10.832 1.00 56.46 O ATOM 352 CB ALA A 44 26.969 -22.801 11.281 1.00 48.60 C ATOM 353 N MET A 45 24.807 -22.713 9.066 1.00 52.72 N ATOM 354 CA MET A 45 24.009 -21.990 8.083 1.00 58.73 C ATOM 355 C MET A 45 22.522 -22.267 8.258 1.00 57.22 C ATOM 356 O MET A 45 21.697 -21.354 8.250 1.00 57.05 O ATOM 357 CB MET A 45 24.430 -22.383 6.665 1.00 56.97 C ATOM 358 CG MET A 45 25.857 -22.013 6.298 1.00 52.85 C ATOM 359 SD MET A 45 26.230 -20.260 6.513 1.00 53.89 S ATOM 360 CE MET A 45 26.878 -20.248 8.183 1.00 48.01 C ATOM 361 N LYS A 46 22.194 -23.544 8.404 1.00 50.26 N ATOM 362 CA LYS A 46 20.813 -23.976 8.526 1.00 47.90 C ATOM 363 C LYS A 46 20.163 -23.427 9.792 1.00 61.22 C ATOM 364 O LYS A 46 18.982 -23.087 9.795 1.00 69.94 O ATOM 365 CB LYS A 46 20.759 -25.502 8.533 1.00 52.42 C ATOM 366 CG LYS A 46 19.381 -26.093 8.749 1.00 61.56 C ATOM 367 CD LYS A 46 19.473 -27.606 8.851 1.00 74.94 C ATOM 368 CE LYS A 46 18.102 -28.253 8.860 1.00 82.41 C ATOM 369 NZ LYS A 46 18.215 -29.738 8.851 1.00 81.82 N ATOM 370 N AHIS A 47 20.943 -23.333 10.862 0.48 60.13 N ATOM 371 N BHIS A 47 20.945 -23.348 10.865 0.52 60.40 N ATOM 372 CA AHIS A 47 20.421 -22.902 12.153 0.48 56.69 C ATOM 373 CA BHIS A 47 20.450 -22.898 12.161 0.52 56.69 C ATOM 374 C AHIS A 47 20.058 -21.419 12.186 0.48 56.76 C ATOM 375 C BHIS A 47 20.004 -21.438 12.134 0.52 56.84 C ATOM 376 O AHIS A 47 19.285 -20.982 13.037 0.48 65.03 O ATOM 377 O BHIS A 47 19.118 -21.038 12.888 0.52 64.97 O ATOM 378 CB AHIS A 47 21.413 -23.237 13.267 0.48 59.48 C ATOM 379 CB BHIS A 47 21.523 -23.101 13.237 0.52 59.46 C ATOM 380 CG AHIS A 47 21.626 -24.707 13.465 0.48 61.30 C ATOM 381 CG BHIS A 47 21.122 -22.619 14.599 0.52 61.42 C ATOM 382 ND1AHIS A 47 22.590 -25.212 14.303 0.48 60.46 N ATOM 383 ND1BHIS A 47 20.330 -23.362 15.449 0.52 56.20 N ATOM 384 CD2AHIS A 47 20.989 -25.775 12.927 0.48 55.81 C ATOM 385 CD2BHIS A 47 21.408 -21.472 15.259 0.52 53.67 C ATOM 386 CE1AHIS A 47 22.544 -26.536 14.276 0.48 61.70 C ATOM 387 CE1BHIS A 47 20.145 -22.692 16.573 0.52 56.32 C ATOM 388 NE2AHIS A 47 21.583 -26.899 13.451 0.48 57.08 N ATOM 389 NE2BHIS A 47 20.789 -21.542 16.483 0.52 55.73 N ATOM 390 N LEU A 48 20.617 -20.647 11.260 1.00 48.11 N ATOM 391 CA LEU A 48 20.326 -19.217 11.192 1.00 64.33 C ATOM 392 C LEU A 48 18.834 -18.915 11.032 1.00 69.62 C ATOM 393 O LEU A 48 18.085 -19.702 10.452 1.00 73.71 O ATOM 394 CB LEU A 48 21.112 -18.566 10.053 1.00 65.28 C ATOM 395 CG LEU A 48 22.618 -18.426 10.271 1.00 58.90 C ATOM 396 CD1 LEU A 48 23.349 -18.332 8.945 1.00 58.39 C ATOM 397 CD2 LEU A 48 22.928 -17.226 11.148 1.00 56.25 C ATOM 398 N HIS A 49 18.411 -17.772 11.561 1.00 69.06 N ATOM 399 CA HIS A 49 17.040 -17.309 11.393 1.00 68.53 C ATOM 400 C HIS A 49 16.948 -16.491 10.113 1.00 70.20 C ATOM 401 O HIS A 49 17.926 -15.871 9.700 1.00 71.51 O ATOM 402 CB HIS A 49 16.604 -16.465 12.594 1.00 80.17 C ATOM 403 CG HIS A 49 16.638 -17.202 13.897 1.00 91.26 C ATOM 404 ND1 HIS A 49 16.890 -16.577 15.099 1.00 97.32 N ATOM 405 CD2 HIS A 49 16.450 -18.512 14.187 1.00 83.45 C ATOM 406 CE1 HIS A 49 16.859 -17.469 16.073 1.00100.49 C ATOM 407 NE2 HIS A 49 16.594 -18.651 15.546 1.00 95.50 N ATOM 408 N PRO A 50 15.770 -16.491 9.478 1.00 70.49 N ATOM 409 CA PRO A 50 15.567 -15.834 8.180 1.00 69.24 C ATOM 410 C PRO A 50 15.963 -14.354 8.151 1.00 67.28 C ATOM 411 O PRO A 50 16.304 -13.849 7.081 1.00 78.51 O ATOM 412 CB PRO A 50 14.061 -15.985 7.947 1.00 77.23 C ATOM 413 CG PRO A 50 13.687 -17.213 8.718 1.00 65.19 C ATOM 414 CD PRO A 50 14.563 -17.203 9.937 1.00 64.05 C ATOM 415 N GLU A 51 15.925 -13.676 9.296 1.00 67.35 N ATOM 416 CA GLU A 51 16.202 -12.241 9.343 1.00 65.94 C ATOM 417 C GLU A 51 17.689 -11.927 9.248 1.00 67.38 C ATOM 418 O GLU A 51 18.070 -10.827 8.851 1.00 73.13 O ATOM 419 CB GLU A 51 15.657 -11.617 10.633 1.00 63.41 C ATOM 420 CG GLU A 51 14.284 -12.094 11.047 1.00 65.33 C ATOM 421 CD GLU A 51 14.336 -13.357 11.880 1.00 84.07 C ATOM 422 OE1 GLU A 51 14.307 -13.252 13.128 1.00 90.15 O ATOM 423 OE2 GLU A 51 14.399 -14.455 11.288 1.00 80.89 O ATOM 424 N THR A 52 18.522 -12.893 9.624 1.00 61.92 N ATOM 425 CA THR A 52 19.959 -12.667 9.761 1.00 58.78 C ATOM 426 C THR A 52 20.575 -11.889 8.603 1.00 57.70 C ATOM 427 O THR A 52 20.211 -12.079 7.442 1.00 72.29 O ATOM 428 CB THR A 52 20.728 -13.986 9.933 1.00 57.02 C ATOM 429 OG1 THR A 52 22.117 -13.700 10.133 1.00 58.71 O ATOM 430 CG2 THR A 52 20.568 -14.858 8.702 1.00 68.95 C ATOM 431 N HIS A 53 21.517 -11.014 8.935 1.00 54.70 N ATOM 432 CA HIS A 53 22.241 -10.247 7.931 1.00 62.98 C ATOM 433 C HIS A 53 23.454 -11.030 7.444 1.00 66.42 C ATOM 434 O HIS A 53 24.204 -10.562 6.586 1.00 67.09 O ATOM 435 CB HIS A 53 22.682 -8.900 8.501 1.00 74.31 C ATOM 436 CG HIS A 53 21.543 -8.004 8.879 1.00 92.56 C ATOM 437 ND1 HIS A 53 21.244 -6.850 8.189 1.00 92.87 N ATOM 438 CD2 HIS A 53 20.627 -8.099 9.872 1.00 86.41 C ATOM 439 CE1 HIS A 53 20.194 -6.269 8.743 1.00 96.24 C ATOM 440 NE2 HIS A 53 19.801 -7.006 9.765 1.00 88.37 N ATOM 441 N VAL A 54 23.643 -12.223 7.999 1.00 50.69 N ATOM 442 CA VAL A 54 24.727 -13.095 7.572 1.00 61.26 C ATOM 443 C VAL A 54 24.457 -13.623 6.167 1.00 67.19 C ATOM 444 O VAL A 54 23.392 -14.188 5.909 1.00 64.83 O ATOM 445 CB VAL A 54 24.902 -14.284 8.526 1.00 57.56 C ATOM 446 CG1 VAL A 54 25.909 -15.272 7.958 1.00 53.63 C ATOM 447 CG2 VAL A 54 25.333 -13.798 9.897 1.00 53.94 C ATOM 448 N PRO A 55 25.422 -13.437 5.252 1.00 51.32 N ATOM 449 CA PRO A 55 25.259 -13.841 3.848 1.00 62.10 C ATOM 450 C PRO A 55 25.324 -15.356 3.650 1.00 60.31 C ATOM 451 O PRO A 55 26.129 -15.838 2.859 1.00 55.30 O ATOM 452 CB PRO A 55 26.436 -13.156 3.148 1.00 62.28 C ATOM 453 CG PRO A 55 27.464 -12.986 4.215 1.00 61.89 C ATOM 454 CD PRO A 55 26.704 -12.752 5.489 1.00 50.33 C ATOM 455 N TRP A 56 24.470 -16.089 4.357 1.00 61.34 N ATOM 456 CA TRP A 56 24.424 -17.547 4.270 1.00 60.88 C ATOM 457 C TRP A 56 24.279 -18.041 2.834 1.00 62.74 C ATOM 458 O TRP A 56 24.563 -19.203 2.539 1.00 54.28 O ATOM 459 CB TRP A 56 23.256 -18.082 5.099 1.00 62.89 C ATOM 460 CG TRP A 56 21.937 -17.539 4.649 1.00 64.42 C ATOM 461 CD1 TRP A 56 21.351 -16.378 5.055 1.00 71.09 C ATOM 462 CD2 TRP A 56 21.051 -18.122 3.688 1.00 69.29 C ATOM 463 NE1 TRP A 56 20.149 -16.205 4.413 1.00 72.24 N ATOM 464 CE2 TRP A 56 19.941 -17.262 3.568 1.00 71.78 C ATOM 465 CE3 TRP A 56 21.084 -19.290 2.920 1.00 68.15 C ATOM 466 CZ2 TRP A 56 18.875 -17.532 2.713 1.00 88.77 C ATOM 467 CZ3 TRP A 56 20.024 -19.557 2.070 1.00 79.00 C ATOM 468 CH2 TRP A 56 18.935 -18.681 1.974 1.00 82.47 C ATOM 469 N HIS A 57 23.824 -17.161 1.948 1.00 58.42 N ATOM 470 CA HIS A 57 23.578 -17.537 0.560 1.00 64.27 C ATOM 471 C HIS A 57 24.873 -17.575 -0.248 1.00 64.40 C ATOM 472 O HIS A 57 24.910 -18.112 -1.353 1.00 54.15 O ATOM 473 CB HIS A 57 22.577 -16.576 -0.085 1.00 63.47 C ATOM 474 CG HIS A 57 23.038 -15.152 -0.111 1.00 61.89 C ATOM 475 ND1 HIS A 57 22.988 -14.333 0.995 1.00 65.78 N ATOM 476 CD2 HIS A 57 23.556 -14.402 -1.113 1.00 66.66 C ATOM 477 CE1 HIS A 57 23.457 -13.139 0.677 1.00 73.85 C ATOM 478 NE2 HIS A 57 23.808 -13.155 -0.595 1.00 62.98 N ATOM 479 N ARG A 58 25.932 -17.004 0.319 1.00 66.01 N ATOM 480 CA ARG A 58 27.230 -16.949 -0.341 1.00 53.75 C ATOM 481 C ARG A 58 28.110 -18.151 0.012 1.00 52.30 C ATOM 482 O ARG A 58 29.328 -18.104 -0.146 1.00 56.48 O ATOM 483 CB ARG A 58 27.955 -15.638 -0.005 1.00 56.45 C ATOM 484 CG ARG A 58 27.259 -14.384 -0.530 1.00 66.25 C ATOM 485 CD ARG A 58 28.235 -13.225 -0.732 1.00 68.15 C ATOM 486 NE ARG A 58 28.237 -12.271 0.374 1.00 74.80 N ATOM 487 CZ ARG A 58 27.463 -11.190 0.432 1.00 75.00 C ATOM 488 NH1 ARG A 58 26.614 -10.925 -0.551 1.00 68.42 N ATOM 489 NH2 ARG A 58 27.534 -10.374 1.477 1.00 65.41 N ATOM 490 N VAL A 59 27.490 -19.228 0.485 1.00 49.22 N ATOM 491 CA VAL A 59 28.223 -20.457 0.778 1.00 50.00 C ATOM 492 C VAL A 59 27.609 -21.657 0.062 1.00 54.36 C ATOM 493 O VAL A 59 26.495 -22.070 0.378 1.00 55.08 O ATOM 494 CB VAL A 59 28.272 -20.757 2.293 1.00 47.86 C ATOM 495 CG1 VAL A 59 29.002 -22.063 2.551 1.00 49.57 C ATOM 496 CG2 VAL A 59 28.940 -19.621 3.049 1.00 47.89 C ATOM 497 N ILE A 60 28.340 -22.216 -0.899 1.00 55.43 N ATOM 498 CA ILE A 60 27.884 -23.412 -1.604 1.00 53.16 C ATOM 499 C ILE A 60 28.812 -24.595 -1.349 1.00 58.63 C ATOM 500 O ILE A 60 29.704 -24.522 -0.494 1.00 58.26 O ATOM 501 CB ILE A 60 27.760 -23.172 -3.119 1.00 55.53 C ATOM 502 CG1 ILE A 60 29.109 -22.771 -3.717 1.00 54.92 C ATOM 503 CG2 ILE A 60 26.713 -22.107 -3.405 1.00 56.35 C ATOM 504 CD1 ILE A 60 29.053 -22.503 -5.205 1.00 55.76 C ATOM 505 N ASN A 61 28.596 -25.684 -2.087 1.00 52.49 N ATOM 506 CA ASN A 61 29.437 -26.871 -1.948 1.00 52.18 C ATOM 507 C ASN A 61 30.686 -26.812 -2.817 1.00 58.77 C ATOM 508 O ASN A 61 30.837 -25.921 -3.655 1.00 51.39 O ATOM 509 CB ASN A 61 28.656 -28.153 -2.236 1.00 58.73 C ATOM 510 CG ASN A 61 28.080 -28.184 -3.635 1.00 66.50 C ATOM 511 OD1 ASN A 61 26.863 -28.191 -3.816 1.00 64.73 O ATOM 512 ND2 ASN A 61 28.953 -28.201 -4.635 1.00 57.45 N ATOM 513 N SER A 62 31.576 -27.775 -2.606 1.00 64.52 N ATOM 514 CA SER A 62 32.870 -27.807 -3.280 1.00 64.63 C ATOM 515 C SER A 62 32.754 -27.972 -4.797 1.00 60.85 C ATOM 516 O SER A 62 33.649 -27.570 -5.537 1.00 62.50 O ATOM 517 CB SER A 62 33.738 -28.923 -2.699 1.00 68.55 C ATOM 518 OG SER A 62 33.111 -30.186 -2.850 1.00 73.80 O ATOM 519 N ARG A 63 31.654 -28.561 -5.254 1.00 63.85 N ATOM 520 CA ARG A 63 31.436 -28.774 -6.682 1.00 56.68 C ATOM 521 C ARG A 63 30.892 -27.522 -7.366 1.00 58.78 C ATOM 522 O ARG A 63 30.476 -27.568 -8.522 1.00 59.50 O ATOM 523 CB ARG A 63 30.474 -29.939 -6.912 1.00 53.11 C ATOM 524 CG ARG A 63 30.866 -31.225 -6.210 1.00 55.35 C ATOM 525 CD ARG A 63 30.053 -32.404 -6.730 1.00 70.50 C ATOM 526 NE ARG A 63 28.626 -32.101 -6.834 1.00 80.38 N ATOM 527 CZ ARG A 63 27.768 -32.172 -5.820 1.00 90.49 C ATOM 528 NH1 ARG A 63 28.189 -32.529 -4.612 1.00 76.57 N ATOM 529 NH2 ARG A 63 26.489 -31.882 -6.013 1.00 79.68 N ATOM 530 N GLY A 64 30.891 -26.408 -6.645 1.00 58.58 N ATOM 531 CA GLY A 64 30.415 -25.152 -7.192 1.00 53.58 C ATOM 532 C GLY A 64 28.917 -25.137 -7.425 1.00 59.01 C ATOM 533 O GLY A 64 28.402 -24.268 -8.125 1.00 72.81 O ATOM 534 N THR A 65 28.212 -26.098 -6.839 1.00 54.57 N ATOM 535 CA THR A 65 26.760 -26.165 -6.981 1.00 65.84 C ATOM 536 C THR A 65 26.044 -25.792 -5.687 1.00 59.91 C ATOM 537 O THR A 65 26.658 -25.722 -4.626 1.00 58.94 O ATOM 538 CB THR A 65 26.287 -27.563 -7.439 1.00 72.15 C ATOM 539 OG1 THR A 65 26.617 -28.541 -6.445 1.00 67.94 O ATOM 540 CG2 THR A 65 26.942 -27.942 -8.758 1.00 79.73 C ATOM 541 N ILE A 66 24.743 -25.540 -5.788 1.00 62.12 N ATOM 542 CA ILE A 66 23.925 -25.252 -4.617 1.00 57.92 C ATOM 543 C ILE A 66 23.413 -26.550 -4.020 1.00 56.66 C ATOM 544 O ILE A 66 22.779 -27.352 -4.703 1.00 61.28 O ATOM 545 CB ILE A 66 22.726 -24.365 -4.965 1.00 57.04 C ATOM 546 CG1 ILE A 66 23.202 -23.019 -5.508 1.00 50.13 C ATOM 547 CG2 ILE A 66 21.844 -24.166 -3.742 1.00 54.75 C ATOM 548 CD1 ILE A 66 22.077 -22.071 -5.831 1.00 66.65 C ATOM 549 N SER A 67 23.686 -26.754 -2.739 1.00 54.25 N ATOM 550 CA SER A 67 23.351 -28.014 -2.107 1.00 54.99 C ATOM 551 C SER A 67 21.845 -28.185 -1.930 1.00 59.72 C ATOM 552 O SER A 67 21.126 -27.239 -1.608 1.00 56.45 O ATOM 553 CB SER A 67 24.075 -28.142 -0.770 1.00 55.61 C ATOM 554 OG SER A 67 25.475 -28.052 -0.960 1.00 62.68 O ATOM 555 N LYS A 68 21.374 -29.402 -2.162 1.00 61.67 N ATOM 556 CA LYS A 68 19.979 -29.726 -1.926 1.00 67.54 C ATOM 557 C LYS A 68 19.783 -29.994 -0.442 1.00 66.98 C ATOM 558 O LYS A 68 20.626 -30.627 0.197 1.00 63.69 O ATOM 559 CB LYS A 68 19.567 -30.950 -2.747 1.00 76.89 C ATOM 560 CG LYS A 68 19.628 -30.731 -4.250 1.00 87.76 C ATOM 561 CD LYS A 68 19.137 -31.951 -5.012 1.00 89.95 C ATOM 562 CE LYS A 68 19.096 -31.678 -6.508 1.00 98.86 C ATOM 563 NZ LYS A 68 18.186 -30.545 -6.841 1.00 94.69 N ATOM 564 N ARG A 69 18.675 -29.503 0.104 1.00 69.54 N ATOM 565 CA ARG A 69 18.375 -29.694 1.517 1.00 67.99 C ATOM 566 C ARG A 69 16.928 -30.096 1.756 1.00 79.78 C ATOM 567 O ARG A 69 16.115 -30.120 0.829 1.00 84.09 O ATOM 568 CB ARG A 69 18.702 -28.433 2.322 1.00 65.98 C ATOM 569 CG ARG A 69 18.163 -27.142 1.741 1.00 55.85 C ATOM 570 CD ARG A 69 19.215 -26.475 0.874 1.00 67.89 C ATOM 571 NE ARG A 69 19.375 -25.062 1.194 1.00 65.73 N ATOM 572 CZ ARG A 69 20.361 -24.303 0.729 1.00 61.44 C ATOM 573 NH1 ARG A 69 21.279 -24.824 -0.071 1.00 55.65 N ATOM 574 NH2 ARG A 69 20.433 -23.023 1.068 1.00 69.75 N ATOM 575 N ASP A 70 16.616 -30.408 3.011 1.00 79.25 N ATOM 576 CA ASP A 70 15.257 -30.756 3.401 1.00 83.55 C ATOM 577 C ASP A 70 14.293 -29.626 3.051 1.00 94.88 C ATOM 578 O ASP A 70 13.243 -29.856 2.449 1.00 99.37 O ATOM 579 CB ASP A 70 15.191 -31.064 4.895 1.00 81.09 C ATOM 580 CG ASP A 70 14.548 -32.406 5.185 1.00102.56 C ATOM 581 OD1 ASP A 70 13.964 -32.562 6.278 1.00112.86 O ATOM 582 OD2 ASP A 70 14.626 -33.306 4.320 1.00 98.95 O ATOM 583 N ILE A 71 14.659 -28.404 3.425 1.00 84.60 N ATOM 584 CA ILE A 71 13.855 -27.229 3.097 1.00 75.65 C ATOM 585 C ILE A 71 14.218 -26.708 1.706 1.00 73.87 C ATOM 586 O ILE A 71 15.096 -25.859 1.554 1.00 63.66 O ATOM 587 CB ILE A 71 14.016 -26.111 4.152 1.00 69.79 C ATOM 588 CG1 ILE A 71 13.258 -26.471 5.434 1.00 66.88 C ATOM 589 CG2 ILE A 71 13.496 -24.782 3.620 1.00 68.29 C ATOM 590 CD1 ILE A 71 13.694 -27.770 6.086 1.00 80.62 C ATOM 591 N SER A 72 13.533 -27.229 0.692 1.00 84.63 N ATOM 592 CA SER A 72 13.830 -26.893 -0.698 1.00 74.14 C ATOM 593 C SER A 72 13.753 -25.394 -0.970 1.00 68.91 C ATOM 594 O SER A 72 14.409 -24.887 -1.878 1.00 76.20 O ATOM 595 CB SER A 72 12.886 -27.639 -1.641 1.00 69.72 C ATOM 596 OG SER A 72 13.082 -29.039 -1.556 1.00 92.57 O ATOM 597 N ALA A 73 12.948 -24.689 -0.186 1.00 62.87 N ATOM 598 CA ALA A 73 12.795 -23.251 -0.365 1.00 71.14 C ATOM 599 C ALA A 73 14.148 -22.542 -0.355 1.00 75.83 C ATOM 600 O ALA A 73 14.391 -21.636 -1.155 1.00 69.98 O ATOM 601 CB ALA A 73 11.881 -22.678 0.708 1.00 92.37 C ATOM 602 N GLY A 74 15.025 -22.958 0.555 1.00 72.59 N ATOM 603 CA GLY A 74 16.328 -22.332 0.694 1.00 80.60 C ATOM 604 C GLY A 74 17.150 -22.470 -0.570 1.00 77.41 C ATOM 605 O GLY A 74 17.685 -21.490 -1.099 1.00 61.72 O ATOM 606 N GLU A 75 17.251 -23.704 -1.047 1.00 73.34 N ATOM 607 CA GLU A 75 17.903 -23.987 -2.312 1.00 68.38 C ATOM 608 C GLU A 75 17.490 -22.957 -3.354 1.00 70.27 C ATOM 609 O GLU A 75 18.323 -22.429 -4.088 1.00 76.75 O ATOM 610 CB GLU A 75 17.516 -25.381 -2.785 1.00 65.79 C ATOM 611 CG GLU A 75 17.967 -25.701 -4.189 1.00 76.78 C ATOM 612 CD GLU A 75 17.595 -27.106 -4.596 1.00 85.94 C ATOM 613 OE1 GLU A 75 17.927 -27.505 -5.732 1.00 87.70 O ATOM 614 OE2 GLU A 75 16.971 -27.812 -3.773 1.00 84.09 O ATOM 615 N GLN A 76 16.195 -22.669 -3.406 1.00 73.79 N ATOM 616 CA GLN A 76 15.666 -21.724 -4.378 1.00 74.87 C ATOM 617 C GLN A 76 16.054 -20.297 -4.026 1.00 69.34 C ATOM 618 O GLN A 76 16.438 -19.512 -4.892 1.00 64.71 O ATOM 619 CB GLN A 76 14.145 -21.836 -4.461 1.00 77.51 C ATOM 620 CG GLN A 76 13.591 -21.385 -5.794 1.00 76.87 C ATOM 621 CD GLN A 76 14.047 -22.283 -6.922 1.00 78.34 C ATOM 622 OE1 GLN A 76 14.424 -21.813 -7.995 1.00 83.65 O ATOM 623 NE2 GLN A 76 14.019 -23.589 -6.681 1.00 75.93 N ATOM 624 N ARG A 77 15.946 -19.962 -2.748 1.00 76.68 N ATOM 625 CA ARG A 77 16.230 -18.608 -2.300 1.00 78.06 C ATOM 626 C ARG A 77 17.704 -18.282 -2.492 1.00 81.06 C ATOM 627 O ARG A 77 18.057 -17.163 -2.870 1.00 69.91 O ATOM 628 CB ARG A 77 15.841 -18.446 -0.836 1.00 70.37 C ATOM 629 CG ARG A 77 15.591 -17.009 -0.425 1.00 89.60 C ATOM 630 CD ARG A 77 15.251 -16.917 1.053 1.00 98.37 C ATOM 631 NE ARG A 77 14.721 -18.175 1.575 1.00100.62 N ATOM 632 CZ ARG A 77 13.517 -18.663 1.289 1.00 97.51 C ATOM 633 NH1 ARG A 77 12.707 -18.005 0.470 1.00 88.93 N ATOM 634 NH2 ARG A 77 13.127 -19.815 1.816 1.00 88.44 N ATOM 635 N GLN A 78 18.559 -19.265 -2.225 1.00 71.58 N ATOM 636 CA GLN A 78 19.994 -19.089 -2.390 1.00 60.75 C ATOM 637 C GLN A 78 20.301 -18.713 -3.833 1.00 70.72 C ATOM 638 O GLN A 78 21.011 -17.743 -4.092 1.00 72.05 O ATOM 639 CB GLN A 78 20.753 -20.354 -1.985 1.00 64.12 C ATOM 640 CG GLN A 78 22.264 -20.163 -1.921 1.00 64.28 C ATOM 641 CD GLN A 78 22.988 -21.323 -1.259 1.00 58.73 C ATOM 642 OE1 GLN A 78 22.383 -22.334 -0.908 1.00 56.52 O ATOM 643 NE2 GLN A 78 24.294 -21.175 -1.084 1.00 55.85 N ATOM 644 N LYS A 79 19.752 -19.481 -4.769 1.00 75.89 N ATOM 645 CA LYS A 79 19.897 -19.177 -6.187 1.00 74.37 C ATOM 646 C LYS A 79 19.459 -17.749 -6.488 1.00 82.11 C ATOM 647 O LYS A 79 20.166 -16.997 -7.157 1.00 87.25 O ATOM 648 CB LYS A 79 19.079 -20.149 -7.034 1.00 81.10 C ATOM 649 CG LYS A 79 18.584 -19.543 -8.342 1.00 93.33 C ATOM 650 CD LYS A 79 17.791 -20.541 -9.166 1.00 87.93 C ATOM 651 CE LYS A 79 16.827 -19.832 -10.105 1.00 91.56 C ATOM 652 NZ LYS A 79 17.503 -18.768 -10.896 1.00 96.26 N ATOM 653 N ASP A 80 18.285 -17.381 -5.988 1.00 84.13 N ATOM 654 CA ASP A 80 17.733 -16.059 -6.250 1.00 88.14 C ATOM 655 C ASP A 80 18.621 -14.955 -5.681 1.00 83.41 C ATOM 656 O ASP A 80 18.988 -14.019 -6.389 1.00 88.29 O ATOM 657 CB ASP A 80 16.309 -15.957 -5.698 1.00 96.51 C ATOM 658 CG ASP A 80 15.360 -16.954 -6.345 1.00106.08 C ATOM 659 OD1 ASP A 80 15.577 -17.298 -7.526 1.00101.38 O ATOM 660 OD2 ASP A 80 14.401 -17.396 -5.676 1.00106.32 O ATOM 661 N ARG A 81 18.973 -15.075 -4.406 1.00 79.67 N ATOM 662 CA ARG A 81 19.825 -14.084 -3.754 1.00 83.58 C ATOM 663 C ARG A 81 21.160 -13.906 -4.471 1.00 80.91 C ATOM 664 O ARG A 81 21.649 -12.787 -4.619 1.00 72.61 O ATOM 665 CB ARG A 81 20.071 -14.457 -2.292 1.00 74.52 C ATOM 666 CG ARG A 81 18.890 -14.199 -1.382 1.00 74.48 C ATOM 667 CD ARG A 81 19.316 -14.250 0.070 1.00 82.60 C ATOM 668 NE ARG A 81 18.269 -13.776 0.967 1.00 85.49 N ATOM 669 CZ ARG A 81 18.436 -13.597 2.273 1.00 81.62 C ATOM 670 NH1 ARG A 81 19.612 -13.851 2.831 1.00 81.55 N ATOM 671 NH2 ARG A 81 17.431 -13.162 3.020 1.00 92.55 N ATOM 672 N LEU A 82 21.746 -15.015 -4.908 1.00 80.74 N ATOM 673 CA LEU A 82 23.018 -14.979 -5.616 1.00 83.71 C ATOM 674 C LEU A 82 22.880 -14.264 -6.949 1.00 87.28 C ATOM 675 O LEU A 82 23.770 -13.519 -7.364 1.00 89.31 O ATOM 676 CB LEU A 82 23.542 -16.394 -5.852 1.00 77.69 C ATOM 677 CG LEU A 82 24.111 -17.133 -4.643 1.00 72.13 C ATOM 678 CD1 LEU A 82 24.442 -18.566 -5.014 1.00 54.29 C ATOM 679 CD2 LEU A 82 25.339 -16.411 -4.116 1.00 78.59 C ATOM 680 N GLU A 83 21.762 -14.500 -7.624 1.00 84.05 N ATOM 681 CA GLU A 83 21.546 -13.899 -8.930 1.00 86.63 C ATOM 682 C GLU A 83 21.383 -12.393 -8.779 1.00 86.95 C ATOM 683 O GLU A 83 21.854 -11.624 -9.616 1.00 85.86 O ATOM 684 CB GLU A 83 20.335 -14.521 -9.624 1.00 86.01 C ATOM 685 CG GLU A 83 20.394 -14.433 -11.140 1.00101.56 C ATOM 686 CD GLU A 83 19.958 -15.719 -11.818 1.00115.63 C ATOM 687 OE1 GLU A 83 20.346 -15.937 -12.987 1.00110.05 O ATOM 688 OE2 GLU A 83 19.230 -16.512 -11.184 1.00101.87 O ATOM 689 N GLU A 84 20.728 -11.978 -7.699 1.00 84.44 N ATOM 690 CA GLU A 84 20.578 -10.559 -7.395 1.00 84.99 C ATOM 691 C GLU A 84 21.948 -9.940 -7.174 1.00 84.66 C ATOM 692 O GLU A 84 22.147 -8.744 -7.387 1.00 83.73 O ATOM 693 CB GLU A 84 19.709 -10.364 -6.153 1.00 83.80 C ATOM 694 CG GLU A 84 18.332 -11.001 -6.260 1.00 99.09 C ATOM 695 CD GLU A 84 17.477 -10.764 -5.030 1.00 99.94 C ATOM 696 OE1 GLU A 84 16.514 -11.531 -4.815 1.00 85.86 O ATOM 697 OE2 GLU A 84 17.765 -9.806 -4.281 1.00106.69 O ATOM 698 N GLU A 85 22.889 -10.773 -6.743 1.00 90.12 N ATOM 699 CA GLU A 85 24.256 -10.343 -6.491 1.00 88.11 C ATOM 700 C GLU A 85 25.035 -10.293 -7.795 1.00 90.23 C ATOM 701 O GLU A 85 26.242 -10.053 -7.799 1.00 93.19 O ATOM 702 CB GLU A 85 24.935 -11.308 -5.521 1.00 94.04 C ATOM 703 CG GLU A 85 24.166 -11.530 -4.232 1.00 80.78 C ATOM 704 CD GLU A 85 24.800 -10.830 -3.053 1.00 88.91 C ATOM 705 OE1 GLU A 85 25.903 -10.273 -3.223 1.00 90.42 O ATOM 706 OE2 GLU A 85 24.201 -10.841 -1.957 1.00 90.42 O ATOM 707 N GLY A 86 24.335 -10.527 -8.902 1.00 89.15 N ATOM 708 CA GLY A 86 24.951 -10.506 -10.217 1.00 94.71 C ATOM 709 C GLY A 86 25.854 -11.701 -10.447 1.00 90.64 C ATOM 710 O GLY A 86 26.941 -11.576 -11.011 1.00 85.86 O ATOM 711 N VAL A 87 25.400 -12.868 -10.004 1.00 90.52 N ATOM 712 CA VAL A 87 26.181 -14.090 -10.136 1.00 91.49 C ATOM 713 C VAL A 87 25.570 -15.026 -11.173 1.00 85.70 C ATOM 714 O VAL A 87 24.486 -15.573 -10.967 1.00 80.41 O ATOM 715 CB VAL A 87 26.298 -14.830 -8.790 1.00 85.39 C ATOM 716 CG1 VAL A 87 27.043 -16.143 -8.967 1.00 80.56 C ATOM 717 CG2 VAL A 87 26.990 -13.950 -7.761 1.00 83.07 C ATOM 718 N GLU A 88 26.275 -15.206 -12.286 1.00 82.52 N ATOM 719 CA GLU A 88 25.803 -16.073 -13.359 1.00 87.38 C ATOM 720 C GLU A 88 25.660 -17.514 -12.890 1.00 79.45 C ATOM 721 O GLU A 88 26.644 -18.168 -12.547 1.00 81.53 O ATOM 722 CB GLU A 88 26.741 -16.004 -14.564 1.00104.24 C ATOM 723 CG GLU A 88 26.611 -14.729 -15.384 1.00118.55 C ATOM 724 CD GLU A 88 27.564 -14.695 -16.564 1.00123.93 C ATOM 725 OE1 GLU A 88 27.114 -14.380 -17.686 1.00127.75 O ATOM 726 OE2 GLU A 88 28.765 -14.978 -16.370 1.00118.08 O ATOM 727 N ILE A 89 24.425 -18.001 -12.880 1.00 80.05 N ATOM 728 CA ILE A 89 24.147 -19.362 -12.443 1.00 79.31 C ATOM 729 C ILE A 89 23.366 -20.126 -13.502 1.00 86.75 C ATOM 730 O ILE A 89 22.231 -19.772 -13.822 1.00 91.66 O ATOM 731 CB ILE A 89 23.344 -19.377 -11.130 1.00 85.68 C ATOM 732 CG1 ILE A 89 24.115 -18.651 -10.029 1.00 85.73 C ATOM 733 CG2 ILE A 89 23.030 -20.809 -10.710 1.00 80.62 C ATOM 734 CD1 ILE A 89 23.421 -18.673 -8.694 1.00 80.66 C ATOM 735 N TYR A 90 23.977 -21.171 -14.048 1.00 81.64 N ATOM 736 CA TYR A 90 23.298 -22.005 -15.028 1.00 81.07 C ATOM 737 C TYR A 90 22.727 -23.254 -14.374 1.00 81.33 C ATOM 738 O TYR A 90 23.093 -23.602 -13.252 1.00 79.35 O ATOM 739 CB TYR A 90 24.228 -22.371 -16.186 1.00 84.15 C ATOM 740 CG TYR A 90 25.457 -23.156 -15.792 1.00 80.50 C ATOM 741 CD1 TYR A 90 26.609 -22.509 -15.359 1.00 77.47 C ATOM 742 CD2 TYR A 90 25.474 -24.542 -15.872 1.00 70.41 C ATOM 743 CE1 TYR A 90 27.740 -23.222 -15.006 1.00 81.94 C ATOM 744 CE2 TYR A 90 26.601 -25.264 -15.523 1.00 83.68 C ATOM 745 CZ TYR A 90 27.731 -24.599 -15.090 1.00 92.18 C ATOM 746 OH TYR A 90 28.856 -25.313 -14.740 1.00 86.54 O ATOM 747 N GLN A 91 21.825 -23.923 -15.082 1.00 85.17 N ATOM 748 CA GLN A 91 21.093 -25.039 -14.503 1.00 78.45 C ATOM 749 C GLN A 91 21.374 -26.354 -15.215 1.00 81.28 C ATOM 750 O GLN A 91 20.939 -26.576 -16.343 1.00 97.75 O ATOM 751 CB GLN A 91 19.595 -24.748 -14.509 1.00 79.33 C ATOM 752 CG GLN A 91 18.771 -25.805 -13.816 1.00 91.48 C ATOM 753 CD GLN A 91 17.306 -25.445 -13.776 1.00101.11 C ATOM 754 OE1 GLN A 91 16.896 -24.410 -14.304 1.00 96.53 O ATOM 755 NE2 GLN A 91 16.505 -26.297 -13.147 1.00 99.15 N ATOM 756 N THR A 92 22.109 -27.222 -14.535 1.00 91.13 N ATOM 757 CA THR A 92 22.419 -28.548 -15.034 1.00 91.87 C ATOM 758 C THR A 92 21.147 -29.300 -15.395 1.00 96.49 C ATOM 759 O THR A 92 20.109 -29.107 -14.764 1.00105.77 O ATOM 760 CB THR A 92 23.171 -29.358 -13.958 1.00 85.04 C ATOM 761 OG1 THR A 92 24.352 -28.651 -13.559 1.00 85.17 O ATOM 762 CG2 THR A 92 23.556 -30.728 -14.478 1.00102.38 C ATOM 763 N SER A 93 21.220 -30.147 -16.419 1.00 97.82 N ATOM 764 CA SER A 93 20.141 -31.097 -16.685 1.00100.55 C ATOM 765 C SER A 93 20.114 -32.075 -15.516 1.00104.66 C ATOM 766 O SER A 93 21.166 -32.425 -14.975 1.00104.34 O ATOM 767 CB SER A 93 20.371 -31.829 -18.005 1.00 90.32 C ATOM 768 OG SER A 93 21.573 -32.573 -17.980 1.00 91.90 O ATOM 769 N LEU A 94 18.922 -32.519 -15.131 1.00108.54 N ATOM 770 CA LEU A 94 18.737 -33.103 -13.811 1.00121.76 C ATOM 771 C LEU A 94 18.856 -31.939 -12.826 1.00 98.59 C ATOM 772 O LEU A 94 19.603 -31.984 -11.851 1.00103.99 O ATOM 773 CB LEU A 94 19.763 -34.199 -13.534 1.00112.73 C ATOM 774 CG LEU A 94 19.700 -35.401 -14.476 1.00122.01 C ATOM 775 CD1 LEU A 94 20.889 -36.309 -14.248 1.00109.00 C ATOM 776 CD2 LEU A 94 18.396 -36.173 -14.302 1.00132.72 C ATOM 777 N GLY A 95 18.094 -30.892 -13.130 1.00102.98 N ATOM 778 CA GLY A 95 18.171 -29.586 -12.495 1.00 97.52 C ATOM 779 C GLY A 95 18.933 -29.385 -11.200 1.00100.76 C ATOM 780 O GLY A 95 18.331 -29.292 -10.131 1.00108.49 O ATOM 781 N GLU A 96 20.257 -29.304 -11.293 1.00102.98 N ATOM 782 CA GLU A 96 21.068 -28.811 -10.182 1.00 90.46 C ATOM 783 C GLU A 96 21.634 -27.447 -10.564 1.00 82.09 C ATOM 784 O GLU A 96 22.036 -27.234 -11.707 1.00 85.54 O ATOM 785 CB GLU A 96 22.200 -29.783 -9.833 1.00 87.51 C ATOM 786 CG GLU A 96 22.979 -29.395 -8.584 1.00 96.13 C ATOM 787 CD GLU A 96 24.100 -30.366 -8.263 1.00100.28 C ATOM 788 OE1 GLU A 96 24.647 -30.295 -7.141 1.00 95.23 O ATOM 789 OE2 GLU A 96 24.435 -31.198 -9.134 1.00 78.99 O ATOM 790 N TYR A 97 21.649 -26.516 -9.617 1.00 78.79 N ATOM 791 CA TYR A 97 22.160 -25.178 -9.895 1.00 77.05 C ATOM 792 C TYR A 97 23.671 -25.162 -9.765 1.00 76.65 C ATOM 793 O TYR A 97 24.222 -25.684 -8.798 1.00 69.35 O ATOM 794 CB TYR A 97 21.535 -24.151 -8.955 1.00 76.55 C ATOM 795 CG TYR A 97 20.041 -24.032 -9.112 1.00 86.29 C ATOM 796 CD1 TYR A 97 19.437 -24.265 -10.338 1.00 80.62 C ATOM 797 CD2 TYR A 97 19.232 -23.701 -8.034 1.00 96.81 C ATOM 798 CE1 TYR A 97 18.073 -24.164 -10.489 1.00 84.60 C ATOM 799 CE2 TYR A 97 17.864 -23.600 -8.175 1.00 91.14 C ATOM 800 CZ TYR A 97 17.290 -23.831 -9.406 1.00 86.20 C ATOM 801 OH TYR A 97 15.928 -23.728 -9.550 1.00 81.88 O ATOM 802 N LYS A 98 24.336 -24.554 -10.741 1.00 79.18 N ATOM 803 CA LYS A 98 25.786 -24.614 -10.831 1.00 71.67 C ATOM 804 C LYS A 98 26.350 -23.248 -11.193 1.00 75.15 C ATOM 805 O LYS A 98 25.623 -22.378 -11.669 1.00 75.73 O ATOM 806 CB LYS A 98 26.188 -25.645 -11.887 1.00 72.43 C ATOM 807 CG LYS A 98 27.619 -26.132 -11.796 1.00 75.24 C ATOM 808 CD LYS A 98 27.785 -27.425 -12.580 1.00 79.27 C ATOM 809 CE LYS A 98 29.223 -27.914 -12.562 1.00 89.90 C ATOM 810 NZ LYS A 98 29.704 -28.171 -11.179 1.00 90.27 N ATOM 811 N LEU A 99 27.645 -23.062 -10.961 1.00 75.16 N ATOM 812 CA LEU A 99 28.310 -21.814 -11.316 1.00 74.90 C ATOM 813 C LEU A 99 29.813 -22.024 -11.446 1.00 76.16 C ATOM 814 O LEU A 99 30.354 -23.011 -10.942 1.00 58.18 O ATOM 815 CB LEU A 99 28.005 -20.730 -10.279 1.00 66.51 C ATOM 816 CG LEU A 99 28.567 -20.934 -8.868 1.00 71.60 C ATOM 817 CD1 LEU A 99 30.022 -20.499 -8.800 1.00 70.11 C ATOM 818 CD2 LEU A 99 27.744 -20.166 -7.845 1.00 69.13 C ATOM 819 N ASN A 100 30.483 -21.095 -12.123 1.00 80.80 N ATOM 820 CA ASN A 100 31.932 -21.159 -12.277 1.00 72.86 C ATOM 821 C ASN A 100 32.636 -20.859 -10.960 1.00 69.03 C ATOM 822 O ASN A 100 32.838 -19.699 -10.599 1.00 74.44 O ATOM 823 CB ASN A 100 32.402 -20.195 -13.373 1.00 76.36 C ATOM 824 CG ASN A 100 33.908 -20.228 -13.577 1.00 82.85 C ATOM 825 OD1 ASN A 100 34.684 -20.139 -12.621 1.00 82.71 O ATOM 826 ND2 ASN A 100 34.328 -20.362 -14.830 1.00 66.61 N ATOM 827 N LEU A 101 33.012 -21.915 -10.249 1.00 66.80 N ATOM 828 CA LEU A 101 33.593 -21.768 -8.919 1.00 73.23 C ATOM 829 C LEU A 101 34.895 -20.959 -8.901 1.00 80.52 C ATOM 830 O LEU A 101 35.043 -20.047 -8.088 1.00 69.87 O ATOM 831 CB LEU A 101 33.797 -23.136 -8.264 1.00 68.26 C ATOM 832 CG LEU A 101 34.144 -23.114 -6.774 1.00 78.51 C ATOM 833 CD1 LEU A 101 33.064 -22.389 -5.988 1.00 72.55 C ATOM 834 CD2 LEU A 101 34.343 -24.526 -6.241 1.00 68.28 C ATOM 835 N PRO A 102 35.844 -21.289 -9.793 1.00 80.78 N ATOM 836 CA PRO A 102 37.122 -20.570 -9.802 1.00 75.97 C ATOM 837 C PRO A 102 36.942 -19.055 -9.850 1.00 80.09 C ATOM 838 O PRO A 102 37.674 -18.329 -9.176 1.00 70.93 O ATOM 839 CB PRO A 102 37.782 -21.060 -11.089 1.00 68.63 C ATOM 840 CG PRO A 102 37.234 -22.424 -11.279 1.00 78.64 C ATOM 841 CD PRO A 102 35.810 -22.356 -10.809 1.00 75.57 C ATOM 842 N GLU A 103 35.976 -18.587 -10.633 1.00 70.42 N ATOM 843 CA GLU A 103 35.756 -17.154 -10.782 1.00 73.73 C ATOM 844 C GLU A 103 35.205 -16.508 -9.518 1.00 80.76 C ATOM 845 O GLU A 103 35.803 -15.582 -8.971 1.00 82.47 O ATOM 846 CB GLU A 103 34.802 -16.871 -11.939 1.00 80.83 C ATOM 847 CG GLU A 103 34.441 -15.404 -12.066 1.00 86.69 C ATOM 848 CD GLU A 103 33.339 -15.156 -13.073 1.00 95.95 C ATOM 849 OE1 GLU A 103 32.975 -13.977 -13.271 1.00 89.23 O ATOM 850 OE2 GLU A 103 32.836 -16.136 -13.663 1.00 91.37 O ATOM 851 N TYR A 104 34.058 -17.001 -9.064 1.00 83.92 N ATOM 852 CA TYR A 104 33.341 -16.393 -7.945 1.00 77.90 C ATOM 853 C TYR A 104 33.934 -16.717 -6.569 1.00 68.63 C ATOM 854 O TYR A 104 33.617 -16.056 -5.578 1.00 71.36 O ATOM 855 CB TYR A 104 31.863 -16.790 -7.990 1.00 67.31 C ATOM 856 CG TYR A 104 31.118 -16.261 -9.196 1.00 80.91 C ATOM 857 CD1 TYR A 104 30.923 -17.053 -10.321 1.00 83.83 C ATOM 858 CD2 TYR A 104 30.607 -14.969 -9.209 1.00 84.21 C ATOM 859 CE1 TYR A 104 30.239 -16.571 -11.426 1.00 89.11 C ATOM 860 CE2 TYR A 104 29.923 -14.478 -10.308 1.00 90.41 C ATOM 861 CZ TYR A 104 29.742 -15.282 -11.413 1.00 92.22 C ATOM 862 OH TYR A 104 29.060 -14.792 -12.504 1.00 89.46 O ATOM 863 N MET A 105 34.794 -17.729 -6.514 1.00 67.70 N ATOM 864 CA MET A 105 35.405 -18.151 -5.256 1.00 71.30 C ATOM 865 C MET A 105 36.085 -16.995 -4.531 1.00 64.09 C ATOM 866 O MET A 105 36.723 -16.152 -5.155 1.00 75.40 O ATOM 867 CB MET A 105 36.416 -19.270 -5.503 1.00 72.54 C ATOM 868 CG MET A 105 36.996 -19.855 -4.232 1.00 73.20 C ATOM 869 SD MET A 105 35.742 -20.682 -3.236 1.00 77.11 S ATOM 870 CE MET A 105 36.719 -21.222 -1.834 1.00 57.96 C ATOM 871 N TRP A 106 35.952 -16.964 -3.209 1.00 63.03 N ATOM 872 CA TRP A 106 36.558 -15.907 -2.406 1.00 63.51 C ATOM 873 C TRP A 106 37.872 -16.342 -1.767 1.00 72.16 C ATOM 874 O TRP A 106 37.927 -17.342 -1.049 1.00 68.13 O ATOM 875 CB TRP A 106 35.592 -15.418 -1.327 1.00 64.80 C ATOM 876 CG TRP A 106 36.225 -14.455 -0.376 1.00 70.94 C ATOM 877 CD1 TRP A 106 36.725 -13.221 -0.672 1.00 81.66 C ATOM 878 CD2 TRP A 106 36.426 -14.644 1.028 1.00 68.15 C ATOM 879 NE1 TRP A 106 37.225 -12.629 0.461 1.00 75.63 N ATOM 880 CE2 TRP A 106 37.054 -13.482 1.521 1.00 79.73 C ATOM 881 CE3 TRP A 106 36.138 -15.681 1.919 1.00 80.28 C ATOM 882 CZ2 TRP A 106 37.400 -13.329 2.863 1.00 78.89 C ATOM 883 CZ3 TRP A 106 36.482 -15.528 3.255 1.00 75.06 C ATOM 884 CH2 TRP A 106 37.105 -14.360 3.712 1.00 71.08 C ATOM 885 N LYS A 107 38.925 -15.574 -2.027 1.00 85.02 N ATOM 886 CA LYS A 107 40.258 -15.884 -1.520 1.00 86.95 C ATOM 887 C LYS A 107 40.806 -14.707 -0.720 1.00 84.55 C ATOM 888 O LYS A 107 41.203 -13.694 -1.295 1.00 84.34 O ATOM 889 CB LYS A 107 41.199 -16.209 -2.684 1.00 87.34 C ATOM 890 CG LYS A 107 40.477 -16.601 -3.969 1.00 90.23 C ATOM 891 CD LYS A 107 41.446 -17.055 -5.053 1.00113.18 C ATOM 892 CE LYS A 107 40.712 -17.372 -6.353 1.00107.51 C ATOM 893 NZ LYS A 107 41.614 -17.943 -7.394 1.00 93.45 N ATOM 894 N PRO A 108 40.830 -14.839 0.616 1.00 90.54 N ATOM 895 CA PRO A 108 41.288 -13.772 1.517 1.00100.70 C ATOM 896 C PRO A 108 42.653 -13.202 1.131 1.00 97.87 C ATOM 897 O PRO A 108 43.412 -13.866 0.426 1.00 96.34 O ATOM 898 CB PRO A 108 41.378 -14.479 2.871 1.00 98.33 C ATOM 899 CG PRO A 108 40.362 -15.567 2.785 1.00 90.72 C ATOM 900 CD PRO A 108 40.397 -16.039 1.355 1.00 76.50 C TER 901 PRO A 108 ATOM 902 O5' DG B 1 29.118 -45.484 24.294 1.00 85.27 O ATOM 903 C5' DG B 1 28.970 -46.838 24.701 1.00 87.94 C ATOM 904 C4' DG B 1 27.558 -47.331 24.437 1.00 95.39 C ATOM 905 O4' DG B 1 26.602 -46.643 25.282 1.00 88.36 O ATOM 906 C3' DG B 1 27.055 -47.089 23.023 1.00 84.70 C ATOM 907 O3' DG B 1 27.511 -48.145 22.199 1.00 91.13 O ATOM 908 C2' DG B 1 25.543 -47.134 23.212 1.00 77.65 C ATOM 909 C1' DG B 1 25.366 -46.527 24.603 1.00 81.39 C ATOM 910 N9 DG B 1 24.973 -45.121 24.573 1.00 66.16 N ATOM 911 C8 DG B 1 25.766 -44.022 24.798 1.00 62.01 C ATOM 912 N7 DG B 1 25.120 -42.892 24.697 1.00 63.07 N ATOM 913 C5 DG B 1 23.819 -43.265 24.384 1.00 54.93 C ATOM 914 C6 DG B 1 22.669 -42.470 24.156 1.00 61.92 C ATOM 915 O6 DG B 1 22.570 -41.232 24.183 1.00 62.96 O ATOM 916 N1 DG B 1 21.553 -43.255 23.871 1.00 57.95 N ATOM 917 C2 DG B 1 21.551 -44.630 23.813 1.00 66.20 C ATOM 918 N2 DG B 1 20.378 -45.214 23.522 1.00 63.18 N ATOM 919 N3 DG B 1 22.621 -45.385 24.026 1.00 64.76 N ATOM 920 C4 DG B 1 23.714 -44.635 24.305 1.00 59.68 C ATOM 921 P DC B 2 27.727 -47.908 20.626 1.00 97.00 P ATOM 922 OP1 DC B 2 28.632 -48.964 20.128 1.00103.33 O ATOM 923 OP2 DC B 2 28.075 -46.486 20.422 1.00 90.56 O ATOM 924 O5' DC B 2 26.273 -48.150 20.012 1.00 84.80 O ATOM 925 C5' DC B 2 25.495 -49.240 20.483 1.00 86.90 C ATOM 926 C4' DC B 2 24.085 -49.090 19.959 1.00 89.55 C ATOM 927 O4' DC B 2 23.445 -47.967 20.617 1.00 95.48 O ATOM 928 C3' DC B 2 24.060 -48.801 18.467 1.00 94.65 C ATOM 929 O3' DC B 2 23.150 -49.645 17.795 1.00102.07 O ATOM 930 C2' DC B 2 23.630 -47.344 18.362 1.00 96.41 C ATOM 931 C1' DC B 2 22.864 -47.111 19.656 1.00 88.19 C ATOM 932 N1 DC B 2 22.998 -45.702 20.106 1.00 79.47 N ATOM 933 C2 DC B 2 21.909 -44.827 20.002 1.00 71.80 C ATOM 934 O2 DC B 2 20.833 -45.240 19.549 1.00 73.38 O ATOM 935 N3 DC B 2 22.062 -43.543 20.409 1.00 62.39 N ATOM 936 C4 DC B 2 23.238 -43.133 20.892 1.00 71.77 C ATOM 937 N4 DC B 2 23.343 -41.857 21.281 1.00 70.52 N ATOM 938 C5 DC B 2 24.358 -44.010 20.999 1.00 68.77 C ATOM 939 C6 DC B 2 24.197 -45.274 20.595 1.00 71.07 C ATOM 940 P DC B 3 23.230 -49.792 16.201 1.00114.63 P ATOM 941 OP1 DC B 3 22.578 -51.067 15.828 1.00111.07 O ATOM 942 OP2 DC B 3 24.626 -49.514 15.791 1.00 96.22 O ATOM 943 O5' DC B 3 22.320 -48.594 15.670 1.00 87.90 O ATOM 944 C5' DC B 3 20.915 -48.696 15.808 1.00 94.30 C ATOM 945 C4' DC B 3 20.281 -47.360 15.496 1.00 95.27 C ATOM 946 O4' DC B 3 20.771 -46.381 16.435 1.00 90.05 O ATOM 947 C3' DC B 3 20.660 -46.797 14.135 1.00 86.70 C ATOM 948 O3' DC B 3 19.699 -47.195 13.173 1.00 92.41 O ATOM 949 C2' DC B 3 20.643 -45.283 14.335 1.00 84.72 C ATOM 950 C1' DC B 3 20.606 -45.106 15.851 1.00 87.05 C ATOM 951 N1 DC B 3 21.661 -44.206 16.380 1.00 77.01 N ATOM 952 C2 DC B 3 21.390 -42.841 16.484 1.00 71.76 C ATOM 953 O2 DC B 3 20.279 -42.433 16.125 1.00 66.42 O ATOM 954 N3 DC B 3 22.351 -42.017 16.973 1.00 67.14 N ATOM 955 C4 DC B 3 23.533 -42.517 17.347 1.00 72.54 C ATOM 956 N4 DC B 3 24.449 -41.665 17.822 1.00 70.95 N ATOM 957 C5 DC B 3 23.826 -43.910 17.248 1.00 72.67 C ATOM 958 C6 DC B 3 22.869 -44.709 16.764 1.00 81.55 C ATOM 959 P DA B 4 19.902 -46.815 11.626 1.00112.09 P ATOM 960 OP1 DA B 4 19.070 -47.736 10.820 1.00 95.28 O ATOM 961 OP2 DA B 4 21.357 -46.716 11.367 1.00 91.39 O ATOM 962 O5' DA B 4 19.281 -45.346 11.517 1.00 76.52 O ATOM 963 C5' DA B 4 17.915 -45.145 11.844 1.00 70.67 C ATOM 964 C4' DA B 4 17.563 -43.671 11.793 1.00 78.18 C ATOM 965 O4' DA B 4 18.379 -42.947 12.751 1.00 86.67 O ATOM 966 C3' DA B 4 17.803 -42.999 10.446 1.00 74.90 C ATOM 967 O3' DA B 4 16.768 -42.056 10.191 1.00 86.35 O ATOM 968 C2' DA B 4 19.151 -42.316 10.651 1.00 76.99 C ATOM 969 C1' DA B 4 19.027 -41.871 12.102 1.00 76.58 C ATOM 970 N9 DA B 4 20.307 -41.627 12.766 1.00 69.38 N ATOM 971 C8 DA B 4 21.339 -42.513 12.911 1.00 67.35 C ATOM 972 N7 DA B 4 22.372 -42.024 13.557 1.00 63.99 N ATOM 973 C5 DA B 4 21.993 -40.727 13.862 1.00 56.51 C ATOM 974 C6 DA B 4 22.649 -39.680 14.543 1.00 56.51 C ATOM 975 N6 DA B 4 23.878 -39.790 15.058 1.00 52.07 N ATOM 976 N1 DA B 4 21.991 -38.508 14.672 1.00 57.20 N ATOM 977 C2 DA B 4 20.759 -38.400 14.157 1.00 60.18 C ATOM 978 N3 DA B 4 20.041 -39.312 13.498 1.00 65.71 N ATOM 979 C4 DA B 4 20.722 -40.465 13.382 1.00 63.12 C ATOM 980 P DT B 5 16.454 -41.584 8.686 1.00110.93 P ATOM 981 OP1 DT B 5 15.017 -41.822 8.418 1.00 85.97 O ATOM 982 OP2 DT B 5 17.488 -42.165 7.799 1.00 96.85 O ATOM 983 O5' DT B 5 16.693 -40.012 8.738 1.00 88.74 O ATOM 984 C5' DT B 5 17.811 -39.549 9.456 1.00 78.03 C ATOM 985 C4' DT B 5 17.680 -38.065 9.688 1.00 80.95 C ATOM 986 O4' DT B 5 18.653 -37.670 10.680 1.00 85.18 O ATOM 987 C3' DT B 5 17.986 -37.223 8.465 1.00 77.26 C ATOM 988 O3' DT B 5 17.378 -35.953 8.614 1.00 83.31 O ATOM 989 C2' DT B 5 19.507 -37.151 8.532 1.00 70.22 C ATOM 990 C1' DT B 5 19.762 -37.076 10.036 1.00 65.47 C ATOM 991 N1 DT B 5 21.006 -37.773 10.481 1.00 60.74 N ATOM 992 C2 DT B 5 21.890 -37.074 11.272 1.00 55.52 C ATOM 993 O2 DT B 5 21.695 -35.924 11.624 1.00 58.82 O ATOM 994 N3 DT B 5 23.009 -37.776 11.637 1.00 49.60 N ATOM 995 C4 DT B 5 23.327 -39.078 11.297 1.00 52.86 C ATOM 996 O4 DT B 5 24.362 -39.623 11.676 1.00 54.90 O ATOM 997 C5 DT B 5 22.361 -39.751 10.469 1.00 56.91 C ATOM 998 C7 DT B 5 22.614 -41.169 10.044 1.00 61.73 C ATOM 999 C6 DT B 5 21.258 -39.078 10.103 1.00 57.04 C ATOM 1000 P DG B 6 16.996 -35.087 7.317 1.00101.98 P ATOM 1001 OP1 DG B 6 15.831 -34.239 7.659 1.00 87.65 O ATOM 1002 OP2 DG B 6 16.950 -36.003 6.152 1.00 73.62 O ATOM 1003 O5' DG B 6 18.256 -34.132 7.130 1.00 85.95 O ATOM 1004 C5' DG B 6 18.548 -33.160 8.119 1.00 76.64 C ATOM 1005 C4' DG B 6 19.945 -32.639 7.873 1.00 74.21 C ATOM 1006 O4' DG B 6 20.910 -33.553 8.454 1.00 75.74 O ATOM 1007 C3' DG B 6 20.290 -32.543 6.390 1.00 64.27 C ATOM 1008 O3' DG B 6 20.917 -31.308 6.123 1.00 58.82 O ATOM 1009 C2' DG B 6 21.252 -33.703 6.173 1.00 59.38 C ATOM 1010 C1' DG B 6 21.954 -33.707 7.521 1.00 65.15 C ATOM 1011 N9 DG B 6 22.681 -34.937 7.792 1.00 57.42 N ATOM 1012 C8 DG B 6 22.398 -36.194 7.323 1.00 50.33 C ATOM 1013 N7 DG B 6 23.243 -37.097 7.740 1.00 58.44 N ATOM 1014 C5 DG B 6 24.142 -36.389 8.532 1.00 45.35 C ATOM 1015 C6 DG B 6 25.276 -36.833 9.247 1.00 44.94 C ATOM 1016 O6 DG B 6 25.731 -37.982 9.332 1.00 50.90 O ATOM 1017 N1 DG B 6 25.902 -35.784 9.913 1.00 49.60 N ATOM 1018 C2 DG B 6 25.489 -34.474 9.891 1.00 48.54 C ATOM 1019 N2 DG B 6 26.224 -33.605 10.595 1.00 47.74 N ATOM 1020 N3 DG B 6 24.427 -34.042 9.225 1.00 49.79 N ATOM 1021 C4 DG B 6 23.808 -35.055 8.571 1.00 55.08 C HETATM 1022 P 2PR B 7 20.111 -30.143 5.368 1.00 70.15 P HETATM 1023 OP1 2PR B 7 18.718 -29.764 4.900 1.00 70.90 O HETATM 1024 OP2 2PR B 7 20.367 -29.747 6.872 1.00 72.42 O HETATM 1025 O5' 2PR B 7 21.211 -29.417 4.538 1.00 71.53 O HETATM 1026 C5' 2PR B 7 21.955 -30.104 3.555 1.00 37.18 C HETATM 1027 C4' 2PR B 7 22.843 -29.283 2.734 1.00 52.56 C HETATM 1028 O4' 2PR B 7 22.248 -28.011 2.572 1.00 51.67 O HETATM 1029 C3' 2PR B 7 24.106 -29.072 3.414 1.00 50.91 C HETATM 1030 O3' 2PR B 7 25.107 -28.911 2.486 1.00 47.73 O HETATM 1031 C2' 2PR B 7 23.926 -27.818 4.093 1.00 49.75 C HETATM 1032 C1' 2PR B 7 23.100 -27.068 3.156 1.00 48.64 C HETATM 1033 N9 2PR B 7 22.281 -26.034 3.799 1.00 52.77 N HETATM 1034 C8 2PR B 7 21.179 -26.233 4.577 1.00 52.80 C HETATM 1035 N7 2PR B 7 20.708 -25.007 4.973 1.00 51.03 N HETATM 1036 C5 2PR B 7 21.534 -24.021 4.431 1.00 45.53 C HETATM 1037 C6 2PR B 7 21.573 -22.555 4.475 1.00 55.61 C HETATM 1038 N1 2PR B 7 22.525 -21.892 3.826 1.00 60.24 N HETATM 1039 C2 2PR B 7 23.462 -22.573 3.123 1.00 47.95 C HETATM 1040 N2 2PR B 7 24.465 -21.866 2.449 1.00 50.04 N HETATM 1041 N3 2PR B 7 23.466 -23.934 3.053 1.00 46.91 N HETATM 1042 C4 2PR B 7 22.506 -24.660 3.703 1.00 52.13 C ATOM 1043 P DC B 8 25.875 -30.190 1.887 1.00 55.71 P ATOM 1044 OP1 DC B 8 26.613 -29.753 0.681 1.00 52.24 O ATOM 1045 OP2 DC B 8 24.910 -31.305 1.801 1.00 55.20 O ATOM 1046 O5' DC B 8 26.913 -30.578 3.039 1.00 50.73 O ATOM 1047 C5' DC B 8 27.668 -29.564 3.691 1.00 48.65 C ATOM 1048 C4' DC B 8 29.139 -29.906 3.610 1.00 51.70 C ATOM 1049 O4' DC B 8 29.334 -31.246 4.124 1.00 49.72 O ATOM 1050 C3' DC B 8 29.704 -29.912 2.196 1.00 51.95 C ATOM 1051 O3' DC B 8 30.958 -29.254 2.205 1.00 62.68 O ATOM 1052 C2' DC B 8 29.847 -31.390 1.852 1.00 43.44 C ATOM 1053 C1' DC B 8 30.095 -32.008 3.215 1.00 44.40 C ATOM 1054 N1 DC B 8 29.601 -33.396 3.302 1.00 53.26 N ATOM 1055 C2 DC B 8 30.494 -34.431 3.599 1.00 57.40 C ATOM 1056 O2 DC B 8 31.691 -34.166 3.787 1.00 62.18 O ATOM 1057 N3 DC B 8 30.014 -35.698 3.675 1.00 54.63 N ATOM 1058 C4 DC B 8 28.717 -35.937 3.467 1.00 46.24 C ATOM 1059 N4 DC B 8 28.287 -37.199 3.552 1.00 48.47 N ATOM 1060 C5 DC B 8 27.800 -34.894 3.163 1.00 35.91 C ATOM 1061 C6 DC B 8 28.279 -33.649 3.091 1.00 46.92 C ATOM 1062 P DT B 9 31.828 -29.145 0.858 1.00 48.67 P ATOM 1063 OP1 DT B 9 32.765 -28.017 1.019 1.00 39.41 O ATOM 1064 OP2 DT B 9 30.898 -29.170 -0.294 1.00 49.67 O ATOM 1065 O5' DT B 9 32.667 -30.506 0.843 1.00 46.93 O ATOM 1066 C5' DT B 9 33.600 -30.744 1.882 1.00 52.79 C ATOM 1067 C4' DT B 9 34.633 -31.764 1.452 1.00 52.35 C ATOM 1068 O4' DT B 9 34.125 -33.107 1.648 1.00 57.10 O ATOM 1069 C3' DT B 9 35.023 -31.690 -0.015 1.00 62.65 C ATOM 1070 O3' DT B 9 36.392 -32.032 -0.123 1.00 73.65 O ATOM 1071 C2' DT B 9 34.127 -32.752 -0.645 1.00 56.61 C ATOM 1072 C1' DT B 9 34.192 -33.822 0.434 1.00 49.92 C ATOM 1073 N1 DT B 9 33.058 -34.774 0.421 1.00 49.42 N ATOM 1074 C2 DT B 9 33.275 -36.087 0.785 1.00 58.30 C ATOM 1075 O2 DT B 9 34.365 -36.522 1.113 1.00 59.07 O ATOM 1076 N3 DT B 9 32.158 -36.883 0.750 1.00 54.38 N ATOM 1077 C4 DT B 9 30.876 -36.502 0.398 1.00 54.55 C ATOM 1078 O4 DT B 9 29.938 -37.296 0.396 1.00 51.04 O ATOM 1079 C5 DT B 9 30.723 -35.113 0.033 1.00 58.29 C ATOM 1080 C7 DT B 9 29.380 -34.579 -0.369 1.00 44.27 C ATOM 1081 C6 DT B 9 31.806 -34.325 0.061 1.00 49.22 C ATOM 1082 P DA B 10 37.234 -31.606 -1.422 1.00 68.30 P ATOM 1083 OP1 DA B 10 37.948 -30.349 -1.110 1.00 71.33 O ATOM 1084 OP2 DA B 10 36.331 -31.669 -2.593 1.00 54.61 O ATOM 1085 O5' DA B 10 38.298 -32.785 -1.572 1.00 63.95 O ATOM 1086 C5' DA B 10 38.899 -33.322 -0.404 1.00 76.18 C ATOM 1087 C4' DA B 10 39.208 -34.791 -0.626 1.00 81.31 C ATOM 1088 O4' DA B 10 37.981 -35.566 -0.589 1.00 71.55 O ATOM 1089 C3' DA B 10 39.875 -35.086 -1.964 1.00 78.86 C ATOM 1090 O3' DA B 10 40.977 -35.957 -1.728 1.00 86.46 O ATOM 1091 C2' DA B 10 38.768 -35.717 -2.810 1.00 67.76 C ATOM 1092 C1' DA B 10 37.817 -36.319 -1.778 1.00 71.93 C ATOM 1093 N9 DA B 10 36.408 -36.259 -2.173 1.00 59.81 N ATOM 1094 C8 DA B 10 35.783 -35.212 -2.793 1.00 55.83 C ATOM 1095 N7 DA B 10 34.509 -35.416 -3.027 1.00 50.55 N ATOM 1096 C5 DA B 10 34.277 -36.686 -2.526 1.00 58.84 C ATOM 1097 C6 DA B 10 33.112 -37.482 -2.470 1.00 62.81 C ATOM 1098 N6 DA B 10 31.929 -37.077 -2.952 1.00 55.46 N ATOM 1099 N1 DA B 10 33.214 -38.705 -1.901 1.00 56.64 N ATOM 1100 C2 DA B 10 34.405 -39.094 -1.426 1.00 58.63 C ATOM 1101 N3 DA B 10 35.565 -38.432 -1.424 1.00 58.55 N ATOM 1102 C4 DA B 10 35.436 -37.222 -1.994 1.00 52.56 C ATOM 1103 P DG B 11 41.856 -36.508 -2.955 1.00 76.27 P ATOM 1104 OP1 DG B 11 43.249 -36.653 -2.485 1.00 77.78 O ATOM 1105 OP2 DG B 11 41.563 -35.675 -4.142 1.00 62.00 O ATOM 1106 O5' DG B 11 41.268 -37.970 -3.200 1.00 68.90 O ATOM 1107 C5' DG B 11 41.201 -38.854 -2.090 1.00 63.47 C ATOM 1108 C4' DG B 11 40.466 -40.119 -2.478 1.00 73.13 C ATOM 1109 O4' DG B 11 39.052 -39.828 -2.656 1.00 79.20 O ATOM 1110 C3' DG B 11 40.940 -40.728 -3.792 1.00 73.01 C ATOM 1111 O3' DG B 11 40.912 -42.142 -3.686 1.00 79.39 O ATOM 1112 C2' DG B 11 39.894 -40.215 -4.775 1.00 65.50 C ATOM 1113 C1' DG B 11 38.652 -40.342 -3.908 1.00 62.15 C ATOM 1114 N9 DG B 11 37.504 -39.619 -4.445 1.00 62.42 N ATOM 1115 C8 DG B 11 37.473 -38.349 -4.969 1.00 58.47 C ATOM 1116 N7 DG B 11 36.289 -37.992 -5.385 1.00 51.64 N ATOM 1117 C5 DG B 11 35.485 -39.097 -5.124 1.00 55.83 C ATOM 1118 C6 DG B 11 34.105 -39.305 -5.356 1.00 54.50 C ATOM 1119 O6 DG B 11 33.279 -38.527 -5.855 1.00 57.00 O ATOM 1120 N1 DG B 11 33.700 -40.571 -4.943 1.00 51.58 N ATOM 1121 C2 DG B 11 34.519 -41.517 -4.375 1.00 60.48 C ATOM 1122 N2 DG B 11 33.944 -42.680 -4.040 1.00 63.43 N ATOM 1123 N3 DG B 11 35.812 -41.336 -4.150 1.00 61.85 N ATOM 1124 C4 DG B 11 36.222 -40.107 -4.549 1.00 63.09 C ATOM 1125 P DT B 12 41.512 -43.055 -4.864 1.00 91.37 P ATOM 1126 OP1 DT B 12 42.979 -43.101 -4.700 1.00 68.04 O ATOM 1127 OP2 DT B 12 40.931 -42.592 -6.148 1.00 82.23 O ATOM 1128 O5' DT B 12 40.908 -44.504 -4.551 1.00 84.15 O ATOM 1129 C5' DT B 12 39.577 -44.629 -4.051 1.00 79.88 C ATOM 1130 C4' DT B 12 38.535 -44.849 -5.143 1.00 89.07 C ATOM 1131 O4' DT B 12 37.836 -43.623 -5.476 1.00 83.38 O ATOM 1132 C3' DT B 12 39.024 -45.399 -6.484 1.00 87.82 C ATOM 1133 O3' DT B 12 38.693 -46.789 -6.554 1.00107.26 O ATOM 1134 C2' DT B 12 38.279 -44.562 -7.530 1.00 76.28 C ATOM 1135 C1' DT B 12 37.190 -43.889 -6.700 1.00 72.46 C ATOM 1136 N1 DT B 12 36.636 -42.625 -7.278 1.00 65.77 N ATOM 1137 C2 DT B 12 35.292 -42.558 -7.581 1.00 63.49 C ATOM 1138 O2 DT B 12 34.513 -43.477 -7.404 1.00 63.66 O ATOM 1139 N3 DT B 12 34.883 -41.361 -8.106 1.00 60.62 N ATOM 1140 C4 DT B 12 35.657 -40.243 -8.358 1.00 65.17 C ATOM 1141 O4 DT B 12 35.183 -39.212 -8.836 1.00 56.87 O ATOM 1142 C5 DT B 12 37.054 -40.384 -8.019 1.00 57.14 C ATOM 1143 C7 DT B 12 38.009 -39.248 -8.240 1.00 52.61 C ATOM 1144 C6 DT B 12 37.470 -41.549 -7.504 1.00 57.56 C ATOM 1145 P DA B 13 38.732 -47.568 -7.961 1.00111.70 P ATOM 1146 OP1 DA B 13 38.728 -49.020 -7.679 1.00 92.30 O ATOM 1147 OP2 DA B 13 39.809 -46.976 -8.787 1.00 84.14 O ATOM 1148 O5' DA B 13 37.334 -47.196 -8.632 1.00 89.87 O ATOM 1149 C5' DA B 13 36.875 -47.950 -9.731 1.00 77.54 C ATOM 1150 C4' DA B 13 35.378 -47.777 -9.847 1.00 85.14 C ATOM 1151 O4' DA B 13 35.045 -46.375 -9.650 1.00 85.06 O ATOM 1152 C3' DA B 13 34.817 -48.158 -11.208 1.00 93.13 C ATOM 1153 O3' DA B 13 33.507 -48.695 -11.066 1.00102.91 O ATOM 1154 C2' DA B 13 34.805 -46.806 -11.913 1.00 89.88 C ATOM 1155 C1' DA B 13 34.338 -45.906 -10.779 1.00 77.84 C ATOM 1156 N9 DA B 13 34.631 -44.493 -11.006 1.00 72.73 N ATOM 1157 C8 DA B 13 35.850 -43.875 -10.954 1.00 68.72 C ATOM 1158 N7 DA B 13 35.805 -42.588 -11.209 1.00 60.07 N ATOM 1159 C5 DA B 13 34.464 -42.342 -11.444 1.00 57.11 C ATOM 1160 C6 DA B 13 33.757 -41.169 -11.769 1.00 56.52 C ATOM 1161 N6 DA B 13 34.341 -39.979 -11.916 1.00 59.54 N ATOM 1162 N1 DA B 13 32.421 -41.265 -11.941 1.00 56.63 N ATOM 1163 C2 DA B 13 31.842 -42.462 -11.792 1.00 68.73 C ATOM 1164 N3 DA B 13 32.401 -43.636 -11.486 1.00 72.31 N ATOM 1165 C4 DA B 13 33.727 -43.505 -11.324 1.00 68.18 C TER 1166 DA B 13 ATOM 1167 O5' DC C 14 31.031 -31.925 -15.116 1.00 79.38 O ATOM 1168 C5' DC C 14 30.185 -31.634 -16.226 1.00 84.35 C ATOM 1169 C4' DC C 14 29.582 -32.906 -16.799 1.00 79.20 C ATOM 1170 O4' DC C 14 30.626 -33.702 -17.409 1.00 78.84 O ATOM 1171 C3' DC C 14 28.934 -33.827 -15.773 1.00 82.14 C ATOM 1172 O3' DC C 14 27.564 -33.496 -15.608 1.00 81.01 O ATOM 1173 C2' DC C 14 29.083 -35.208 -16.401 1.00 65.62 C ATOM 1174 C1' DC C 14 30.390 -35.080 -17.174 1.00 70.07 C ATOM 1175 N1 DC C 14 31.568 -35.664 -16.465 1.00 61.82 N ATOM 1176 C2 DC C 14 31.584 -37.033 -16.167 1.00 58.95 C ATOM 1177 O2 DC C 14 30.614 -37.732 -16.488 1.00 57.22 O ATOM 1178 N3 DC C 14 32.661 -37.553 -15.528 1.00 50.19 N ATOM 1179 C4 DC C 14 33.685 -36.763 -15.197 1.00 54.33 C ATOM 1180 N4 DC C 14 34.725 -37.320 -14.567 1.00 49.34 N ATOM 1181 C5 DC C 14 33.689 -35.368 -15.498 1.00 50.70 C ATOM 1182 C6 DC C 14 32.621 -34.865 -16.126 1.00 51.74 C ATOM 1183 P DT C 15 26.860 -33.678 -14.177 1.00 83.30 P ATOM 1184 OP1 DT C 15 25.540 -33.014 -14.234 1.00 81.71 O ATOM 1185 OP2 DT C 15 27.842 -33.300 -13.138 1.00 72.67 O ATOM 1186 O5' DT C 15 26.618 -35.257 -14.070 1.00 72.09 O ATOM 1187 C5' DT C 15 25.671 -35.883 -14.931 1.00 77.58 C ATOM 1188 C4' DT C 15 25.588 -37.372 -14.653 1.00 84.08 C ATOM 1189 O4' DT C 15 26.929 -37.930 -14.688 1.00 84.54 O ATOM 1190 C3' DT C 15 25.042 -37.734 -13.279 1.00 82.55 C ATOM 1191 O3' DT C 15 24.448 -39.030 -13.298 1.00 98.94 O ATOM 1192 C2' DT C 15 26.320 -37.732 -12.455 1.00 76.54 C ATOM 1193 C1' DT C 15 27.236 -38.472 -13.419 1.00 72.08 C ATOM 1194 N1 DT C 15 28.679 -38.271 -13.116 1.00 68.37 N ATOM 1195 C2 DT C 15 29.462 -39.356 -12.778 1.00 67.70 C ATOM 1196 O2 DT C 15 29.042 -40.499 -12.718 1.00 74.68 O ATOM 1197 N3 DT C 15 30.772 -39.052 -12.512 1.00 62.74 N ATOM 1198 C4 DT C 15 31.361 -37.801 -12.546 1.00 62.24 C ATOM 1199 O4 DT C 15 32.550 -37.630 -12.290 1.00 56.99 O ATOM 1200 C5 DT C 15 30.482 -36.713 -12.903 1.00 54.64 C ATOM 1201 C7 DT C 15 31.001 -35.308 -12.974 1.00 54.95 C ATOM 1202 C6 DT C 15 29.201 -36.995 -13.164 1.00 59.87 C ATOM 1203 P DA C 16 23.523 -39.515 -12.073 1.00123.06 P ATOM 1204 OP1 DA C 16 22.790 -40.725 -12.507 1.00117.34 O ATOM 1205 OP2 DA C 16 22.778 -38.339 -11.572 1.00 86.37 O ATOM 1206 O5' DA C 16 24.579 -39.942 -10.953 1.00 83.91 O ATOM 1207 C5' DA C 16 25.698 -40.717 -11.345 1.00 87.32 C ATOM 1208 C4' DA C 16 25.667 -42.071 -10.680 1.00 93.32 C ATOM 1209 O4' DA C 16 27.017 -42.449 -10.331 1.00101.42 O ATOM 1210 C3' DA C 16 24.946 -42.085 -9.349 1.00 93.80 C ATOM 1211 O3' DA C 16 24.644 -43.425 -9.022 1.00 96.02 O ATOM 1212 C2' DA C 16 25.994 -41.494 -8.412 1.00 87.84 C ATOM 1213 C1' DA C 16 27.309 -41.958 -9.035 1.00 87.45 C ATOM 1214 N9 DA C 16 28.300 -40.890 -9.158 1.00 74.25 N ATOM 1215 C8 DA C 16 28.090 -39.594 -9.542 1.00 68.15 C ATOM 1216 N7 DA C 16 29.182 -38.864 -9.562 1.00 63.02 N ATOM 1217 C5 DA C 16 30.178 -39.743 -9.164 1.00 63.31 C ATOM 1218 C6 DA C 16 31.569 -39.596 -8.979 1.00 61.11 C ATOM 1219 N6 DA C 16 32.236 -38.453 -9.178 1.00 59.66 N ATOM 1220 N1 DA C 16 32.262 -40.682 -8.575 1.00 59.78 N ATOM 1221 C2 DA C 16 31.611 -41.832 -8.372 1.00 68.53 C ATOM 1222 N3 DA C 16 30.311 -42.090 -8.512 1.00 69.62 N ATOM 1223 C4 DA C 16 29.648 -40.995 -8.914 1.00 65.29 C ATOM 1224 P DC C 17 23.810 -43.762 -7.694 1.00108.75 P ATOM 1225 OP1 DC C 17 23.006 -44.974 -7.960 1.00 96.42 O ATOM 1226 OP2 DC C 17 23.154 -42.514 -7.239 1.00 94.21 O ATOM 1227 O5' DC C 17 24.940 -44.137 -6.630 1.00 93.08 O ATOM 1228 C5' DC C 17 25.669 -45.338 -6.809 1.00 90.52 C ATOM 1229 C4' DC C 17 26.951 -45.281 -6.010 1.00 80.68 C ATOM 1230 O4' DC C 17 27.740 -44.170 -6.481 1.00 79.71 O ATOM 1231 C3' DC C 17 26.762 -44.978 -4.531 1.00 90.25 C ATOM 1232 O3' DC C 17 26.498 -46.196 -3.815 1.00 91.39 O ATOM 1233 C2' DC C 17 28.080 -44.296 -4.155 1.00 92.96 C ATOM 1234 C1' DC C 17 28.714 -43.915 -5.493 1.00 81.56 C ATOM 1235 N1 DC C 17 29.134 -42.488 -5.599 1.00 75.13 N ATOM 1236 C2 DC C 17 30.470 -42.143 -5.369 1.00 68.58 C ATOM 1237 O2 DC C 17 31.283 -43.030 -5.082 1.00 74.08 O ATOM 1238 N3 DC C 17 30.838 -40.843 -5.470 1.00 57.42 N ATOM 1239 C4 DC C 17 29.930 -39.919 -5.785 1.00 59.64 C ATOM 1240 N4 DC C 17 30.347 -38.654 -5.872 1.00 58.65 N ATOM 1241 C5 DC C 17 28.563 -40.248 -6.023 1.00 59.15 C ATOM 1242 C6 DC C 17 28.214 -41.534 -5.920 1.00 67.97 C ATOM 1243 P DT C 18 27.483 -46.688 -2.639 1.00117.62 P ATOM 1244 OP1 DT C 18 26.992 -47.997 -2.155 1.00113.11 O ATOM 1245 OP2 DT C 18 27.635 -45.577 -1.672 1.00100.86 O ATOM 1246 O5' DT C 18 28.885 -46.904 -3.384 1.00101.84 O ATOM 1247 C5' DT C 18 29.908 -47.720 -2.811 1.00100.19 C ATOM 1248 C4' DT C 18 30.851 -46.956 -1.889 1.00 96.47 C ATOM 1249 O4' DT C 18 30.990 -45.570 -2.292 1.00 92.47 O ATOM 1250 C3' DT C 18 30.446 -46.918 -0.416 1.00 92.88 C ATOM 1251 O3' DT C 18 31.305 -47.802 0.314 1.00 99.71 O ATOM 1252 C2' DT C 18 30.602 -45.447 -0.012 1.00 97.05 C ATOM 1253 C1' DT C 18 31.416 -44.851 -1.155 1.00 89.40 C ATOM 1254 N1 DT C 18 31.196 -43.390 -1.398 1.00 79.21 N ATOM 1255 C2 DT C 18 32.249 -42.507 -1.259 1.00 77.90 C ATOM 1256 O2 DT C 18 33.374 -42.846 -0.936 1.00 79.18 O ATOM 1257 N3 DT C 18 31.934 -41.196 -1.513 1.00 71.55 N ATOM 1258 C4 DT C 18 30.701 -40.689 -1.885 1.00 67.05 C ATOM 1259 O4 DT C 18 30.510 -39.494 -2.093 1.00 59.15 O ATOM 1260 C5 DT C 18 29.650 -41.664 -2.011 1.00 69.02 C ATOM 1261 C7 DT C 18 28.273 -41.225 -2.408 1.00 67.54 C ATOM 1262 C6 DT C 18 29.941 -42.948 -1.766 1.00 73.07 C ATOM 1263 P DA C 19 31.789 -47.428 1.802 1.00122.66 P ATOM 1264 OP1 DA C 19 32.462 -48.615 2.375 1.00108.42 O ATOM 1265 OP2 DA C 19 30.643 -46.824 2.520 1.00102.04 O ATOM 1266 O5' DA C 19 32.885 -46.288 1.565 1.00107.28 O ATOM 1267 C5' DA C 19 34.215 -46.628 1.193 1.00102.67 C ATOM 1268 C4' DA C 19 35.213 -45.896 2.075 1.00104.33 C ATOM 1269 O4' DA C 19 34.969 -44.468 2.009 1.00 98.35 O ATOM 1270 C3' DA C 19 35.155 -46.229 3.559 1.00 90.45 C ATOM 1271 O3' DA C 19 36.445 -46.007 4.120 1.00 91.95 O ATOM 1272 C2' DA C 19 34.113 -45.241 4.074 1.00 83.54 C ATOM 1273 C1' DA C 19 34.374 -44.010 3.211 1.00 84.44 C ATOM 1274 N9 DA C 19 33.161 -43.280 2.851 1.00 80.73 N ATOM 1275 C8 DA C 19 31.884 -43.766 2.817 1.00 82.46 C ATOM 1276 N7 DA C 19 30.987 -42.881 2.448 1.00 81.39 N ATOM 1277 C5 DA C 19 31.727 -41.733 2.220 1.00 73.44 C ATOM 1278 C6 DA C 19 31.363 -40.437 1.805 1.00 65.44 C ATOM 1279 N6 DA C 19 30.106 -40.070 1.536 1.00 59.47 N ATOM 1280 N1 DA C 19 32.346 -39.522 1.679 1.00 66.69 N ATOM 1281 C2 DA C 19 33.605 -39.887 1.950 1.00 66.41 C ATOM 1282 N3 DA C 19 34.069 -41.072 2.346 1.00 70.99 N ATOM 1283 C4 DA C 19 33.069 -41.961 2.463 1.00 77.96 C ATOM 1284 P DG C 20 36.628 -45.858 5.710 1.00109.15 P ATOM 1285 OP1 DG C 20 38.000 -46.296 6.052 1.00 89.91 O ATOM 1286 OP2 DG C 20 35.467 -46.499 6.367 1.00 98.08 O ATOM 1287 O5' DG C 20 36.522 -44.279 5.955 1.00101.39 O ATOM 1288 C5' DG C 20 37.493 -43.406 5.383 1.00 89.24 C ATOM 1289 C4' DG C 20 37.351 -41.992 5.923 1.00 81.64 C ATOM 1290 O4' DG C 20 36.172 -41.355 5.362 1.00 78.58 O ATOM 1291 C3' DG C 20 37.207 -41.900 7.440 1.00 69.06 C ATOM 1292 O3' DG C 20 38.026 -40.843 7.923 1.00 71.79 O ATOM 1293 C2' DG C 20 35.723 -41.603 7.634 1.00 68.53 C ATOM 1294 C1' DG C 20 35.446 -40.742 6.409 1.00 71.74 C ATOM 1295 N9 DG C 20 34.033 -40.681 6.043 1.00 64.38 N ATOM 1296 C8 DG C 20 33.087 -41.661 6.223 1.00 67.05 C ATOM 1297 N7 DG C 20 31.900 -41.326 5.796 1.00 65.21 N ATOM 1298 C5 DG C 20 32.069 -40.040 5.302 1.00 56.23 C ATOM 1299 C6 DG C 20 31.131 -39.162 4.712 1.00 57.50 C ATOM 1300 O6 DG C 20 29.927 -39.355 4.501 1.00 64.83 O ATOM 1301 N1 DG C 20 31.712 -37.952 4.350 1.00 52.55 N ATOM 1302 C2 DG C 20 33.033 -37.628 4.535 1.00 56.66 C ATOM 1303 N2 DG C 20 33.406 -36.408 4.119 1.00 54.55 N ATOM 1304 N3 DG C 20 33.926 -38.441 5.088 1.00 60.75 N ATOM 1305 C4 DG C 20 33.374 -39.626 5.447 1.00 61.45 C ATOM 1306 P DC C 21 37.933 -40.381 9.460 1.00 88.32 P ATOM 1307 OP1 DC C 21 39.205 -39.712 9.811 1.00 74.19 O ATOM 1308 OP2 DC C 21 37.469 -41.536 10.262 1.00 62.08 O ATOM 1309 O5' DC C 21 36.776 -39.279 9.449 1.00 71.71 O ATOM 1310 C5' DC C 21 36.969 -38.073 8.724 1.00 58.18 C ATOM 1311 C4' DC C 21 35.731 -37.207 8.831 1.00 57.83 C ATOM 1312 O4' DC C 21 34.641 -37.834 8.121 1.00 65.65 O ATOM 1313 C3' DC C 21 35.220 -37.044 10.248 1.00 64.32 C ATOM 1314 O3' DC C 21 35.853 -35.917 10.824 1.00 60.82 O ATOM 1315 C2' DC C 21 33.719 -36.826 10.064 1.00 63.37 C ATOM 1316 C1' DC C 21 33.412 -37.505 8.729 1.00 52.33 C ATOM 1317 N1 DC C 21 32.646 -38.766 8.837 1.00 54.59 N ATOM 1318 C2 DC C 21 31.376 -38.838 8.260 1.00 60.36 C ATOM 1319 O2 DC C 21 30.922 -37.840 7.685 1.00 56.01 O ATOM 1320 N3 DC C 21 30.680 -40.001 8.351 1.00 72.12 N ATOM 1321 C4 DC C 21 31.213 -41.051 8.985 1.00 67.63 C ATOM 1322 N4 DC C 21 30.488 -42.172 9.049 1.00 74.52 N ATOM 1323 C5 DC C 21 32.510 -40.996 9.579 1.00 61.64 C ATOM 1324 C6 DC C 21 33.184 -39.844 9.479 1.00 68.02 C ATOM 1325 P DC C 22 36.056 -35.832 12.413 1.00 66.03 P ATOM 1326 OP1 DC C 22 37.033 -34.756 12.691 1.00 56.04 O ATOM 1327 OP2 DC C 22 36.296 -37.202 12.915 1.00 60.15 O ATOM 1328 O5' DC C 22 34.631 -35.352 12.941 1.00 60.44 O ATOM 1329 C5' DC C 22 34.147 -34.099 12.498 1.00 59.20 C ATOM 1330 C4' DC C 22 32.746 -33.885 13.027 1.00 58.79 C ATOM 1331 O4' DC C 22 31.787 -34.582 12.191 1.00 58.51 O ATOM 1332 C3' DC C 22 32.526 -34.405 14.441 1.00 58.80 C ATOM 1333 O3' DC C 22 31.782 -33.427 15.146 1.00 67.01 O ATOM 1334 C2' DC C 22 31.717 -35.680 14.213 1.00 49.28 C ATOM 1335 C1' DC C 22 30.860 -35.214 13.045 1.00 57.59 C ATOM 1336 N1 DC C 22 30.163 -36.300 12.307 1.00 53.79 N ATOM 1337 C2 DC C 22 29.024 -35.989 11.558 1.00 51.18 C ATOM 1338 O2 DC C 22 28.628 -34.818 11.528 1.00 51.76 O ATOM 1339 N3 DC C 22 28.386 -36.980 10.887 1.00 55.63 N ATOM 1340 C4 DC C 22 28.845 -38.233 10.949 1.00 65.83 C ATOM 1341 N4 DC C 22 28.180 -39.178 10.268 1.00 64.55 N ATOM 1342 C5 DC C 22 30.008 -38.570 11.710 1.00 57.06 C ATOM 1343 C6 DC C 22 30.627 -37.581 12.367 1.00 62.07 C ATOM 1344 P DA C 23 31.775 -33.415 16.752 1.00 65.52 P ATOM 1345 OP1 DA C 23 32.981 -32.697 17.209 1.00 57.75 O ATOM 1346 OP2 DA C 23 31.520 -34.797 17.219 1.00 57.04 O ATOM 1347 O5' DA C 23 30.500 -32.523 17.108 1.00 58.42 O ATOM 1348 C5' DA C 23 30.430 -31.199 16.628 1.00 52.74 C ATOM 1349 C4' DA C 23 29.013 -30.938 16.179 1.00 52.12 C ATOM 1350 O4' DA C 23 28.627 -32.000 15.273 1.00 70.84 O ATOM 1351 C3' DA C 23 27.992 -30.963 17.306 1.00 54.64 C ATOM 1352 O3' DA C 23 27.096 -29.879 17.141 1.00 65.34 O ATOM 1353 C2' DA C 23 27.284 -32.306 17.147 1.00 52.54 C ATOM 1354 C1' DA C 23 27.365 -32.512 15.645 1.00 55.08 C ATOM 1355 N9 DA C 23 27.310 -33.911 15.242 1.00 52.11 N ATOM 1356 C8 DA C 23 28.231 -34.885 15.514 1.00 53.84 C ATOM 1357 N7 DA C 23 27.916 -36.060 15.019 1.00 47.04 N ATOM 1358 C5 DA C 23 26.707 -35.838 14.377 1.00 44.92 C ATOM 1359 C6 DA C 23 25.846 -36.684 13.649 1.00 52.10 C ATOM 1360 N6 DA C 23 26.088 -37.985 13.441 1.00 53.84 N ATOM 1361 N1 DA C 23 24.722 -36.140 13.138 1.00 50.03 N ATOM 1362 C2 DA C 23 24.478 -34.841 13.342 1.00 44.13 C ATOM 1363 N3 DA C 23 25.209 -33.949 14.007 1.00 52.78 N ATOM 1364 C4 DA C 23 26.320 -34.517 14.503 1.00 45.58 C ATOM 1365 P DT C 24 26.163 -29.411 18.361 1.00 67.06 P ATOM 1366 OP1 DT C 24 25.882 -27.966 18.197 1.00 65.45 O ATOM 1367 OP2 DT C 24 26.770 -29.910 19.620 1.00 50.83 O ATOM 1368 O5' DT C 24 24.807 -30.201 18.103 1.00 54.18 O ATOM 1369 C5' DT C 24 24.055 -29.877 16.956 1.00 57.79 C ATOM 1370 C4' DT C 24 22.923 -30.868 16.808 1.00 64.15 C ATOM 1371 O4' DT C 24 23.460 -32.157 16.453 1.00 59.76 O ATOM 1372 C3' DT C 24 22.132 -31.101 18.089 1.00 69.89 C ATOM 1373 O3' DT C 24 20.872 -30.453 17.964 1.00 82.70 O ATOM 1374 C2' DT C 24 22.005 -32.622 18.210 1.00 63.67 C ATOM 1375 C1' DT C 24 22.515 -33.114 16.860 1.00 58.51 C ATOM 1376 N1 DT C 24 23.219 -34.410 16.894 1.00 49.30 N ATOM 1377 C2 DT C 24 22.694 -35.460 16.183 1.00 53.60 C ATOM 1378 O2 DT C 24 21.666 -35.369 15.534 1.00 59.94 O ATOM 1379 N3 DT C 24 23.422 -36.621 16.266 1.00 46.66 N ATOM 1380 C4 DT C 24 24.596 -36.818 16.972 1.00 49.87 C ATOM 1381 O4 DT C 24 25.176 -37.903 16.981 1.00 52.03 O ATOM 1382 C5 DT C 24 25.089 -35.667 17.692 1.00 44.35 C ATOM 1383 C7 DT C 24 26.355 -35.753 18.492 1.00 34.74 C ATOM 1384 C6 DT C 24 24.388 -34.530 17.617 1.00 47.49 C ATOM 1385 P DG C 25 19.958 -30.206 19.260 1.00 91.70 P ATOM 1386 OP1 DG C 25 19.082 -29.043 18.988 1.00 76.84 O ATOM 1387 OP2 DG C 25 20.840 -30.214 20.450 1.00 79.99 O ATOM 1388 O5' DG C 25 19.051 -31.512 19.321 1.00 77.16 O ATOM 1389 C5' DG C 25 18.298 -31.863 18.174 1.00 79.90 C ATOM 1390 C4' DG C 25 17.854 -33.305 18.286 1.00 80.44 C ATOM 1391 O4' DG C 25 18.990 -34.185 18.081 1.00 74.78 O ATOM 1392 C3' DG C 25 17.284 -33.670 19.652 1.00 79.56 C ATOM 1393 O3' DG C 25 16.138 -34.474 19.468 1.00 82.31 O ATOM 1394 C2' DG C 25 18.413 -34.472 20.292 1.00 74.19 C ATOM 1395 C1' DG C 25 18.891 -35.203 19.049 1.00 67.19 C ATOM 1396 N9 DG C 25 20.154 -35.919 19.208 1.00 67.68 N ATOM 1397 C8 DG C 25 21.305 -35.531 19.853 1.00 65.73 C ATOM 1398 N7 DG C 25 22.249 -36.436 19.810 1.00 60.07 N ATOM 1399 C5 DG C 25 21.682 -37.486 19.093 1.00 54.36 C ATOM 1400 C6 DG C 25 22.213 -38.743 18.721 1.00 57.57 C ATOM 1401 O6 DG C 25 23.340 -39.204 18.957 1.00 57.43 O ATOM 1402 N1 DG C 25 21.286 -39.497 18.001 1.00 55.92 N ATOM 1403 C2 DG C 25 20.008 -39.090 17.682 1.00 66.36 C ATOM 1404 N2 DG C 25 19.248 -39.946 16.982 1.00 65.42 N ATOM 1405 N3 DG C 25 19.501 -37.916 18.022 1.00 59.59 N ATOM 1406 C4 DG C 25 20.395 -37.178 18.721 1.00 53.36 C ATOM 1407 P DG C 26 14.948 -34.444 20.546 1.00 91.52 P ATOM 1408 OP1 DG C 26 14.032 -33.339 20.181 1.00 85.23 O ATOM 1409 OP2 DG C 26 15.554 -34.477 21.896 1.00 80.78 O ATOM 1410 O5' DG C 26 14.207 -35.841 20.316 1.00 72.15 O ATOM 1411 C5' DG C 26 13.854 -36.239 18.996 1.00 75.03 C ATOM 1412 C4' DG C 26 13.874 -37.752 18.867 1.00 65.80 C ATOM 1413 O4' DG C 26 15.248 -38.216 18.866 1.00 77.24 O ATOM 1414 C3' DG C 26 13.172 -38.501 19.997 1.00 74.60 C ATOM 1415 O3' DG C 26 12.447 -39.609 19.471 1.00 80.59 O ATOM 1416 C2' DG C 26 14.324 -38.953 20.891 1.00 70.32 C ATOM 1417 C1' DG C 26 15.419 -39.206 19.862 1.00 69.53 C ATOM 1418 N9 DG C 26 16.773 -39.107 20.401 1.00 64.50 N ATOM 1419 C8 DG C 26 17.346 -38.040 21.058 1.00 62.51 C ATOM 1420 N7 DG C 26 18.582 -38.257 21.421 1.00 54.46 N ATOM 1421 C5 DG C 26 18.848 -39.547 20.975 1.00 58.90 C ATOM 1422 C6 DG C 26 20.024 -40.329 21.078 1.00 58.48 C ATOM 1423 O6 DG C 26 21.108 -40.028 21.601 1.00 60.61 O ATOM 1424 N1 DG C 26 19.861 -41.584 20.492 1.00 58.43 N ATOM 1425 C2 DG C 26 18.709 -42.030 19.882 1.00 64.26 C ATOM 1426 N2 DG C 26 18.743 -43.272 19.374 1.00 54.00 N ATOM 1427 N3 DG C 26 17.599 -41.305 19.779 1.00 62.53 N ATOM 1428 C4 DG C 26 17.743 -40.081 20.346 1.00 62.52 C TER 1429 DG C 26 CONECT 1008 1022 CONECT 1022 1008 1023 1024 1025 CONECT 1023 1022 CONECT 1024 1022 CONECT 1025 1022 1026 CONECT 1026 1025 1027 CONECT 1027 1026 1028 1029 CONECT 1028 1027 1032 CONECT 1029 1027 1030 1031 CONECT 1030 1029 1043 CONECT 1031 1029 1032 CONECT 1032 1028 1031 1033 CONECT 1033 1032 1034 1042 CONECT 1034 1033 1035 CONECT 1035 1034 1036 CONECT 1036 1035 1037 1042 CONECT 1037 1036 1038 CONECT 1038 1037 1039 CONECT 1039 1038 1040 1041 CONECT 1040 1039 CONECT 1041 1039 1042 CONECT 1042 1033 1036 1041 CONECT 1043 1030 MASTER 290 0 1 6 4 0 0 6 1416 3 23 11 END
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Related entries of code: 4hdu
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3gx4
RCSB PDB
PDBbind
13aa, >3GX4_3|Chain... *
3gyh
RCSB PDB
PDBbind
13aa, >3GYH_3|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4hdu
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
S. pombe Alkyltransferase-like protein 1, ATL1
Ligand Name
damaged DNA containing 2-aminopurine (2-AP)
EC.Number
E.C.-.-.-.-
Resolution
2.85(Å)
Affinity (Kd/Ki/IC50)
Kd=9.3nM
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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