Browse entries in the PDBbind-CN Database
HEADER TRANSCRIPTION/DNA 28-SEP-16 5GZB TITLE CRYSTAL STRUCTURE OF TRANSCRIPTION FACTOR TEAD4 IN COMPLEX WITH M-CAT TITLE 2 DNA COMPND MOL_ID: 1; COMPND 2 MOLECULE: TRANSCRIPTIONAL ENHANCER FACTOR TEF-3; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: UNP RESIDUES 36-139; COMPND 5 SYNONYM: TEA DOMAIN FAMILY MEMBER 4,TEAD-4,TRANSCRIPTION FACTOR 13- COMPND 6 LIKE 1,TRANSCRIPTION FACTOR RTEF-1; COMPND 7 ENGINEERED: YES; COMPND 8 MOL_ID: 2; COMPND 9 MOLECULE: DNA (5'-D(*TP*TP*GP*CP*AP*TP*TP*CP*CP*TP*CP*TP*C)-3'); COMPND 10 CHAIN: B; COMPND 11 SYNONYM: M-CAT ELEMENT; COMPND 12 ENGINEERED: YES; COMPND 13 MOL_ID: 3; COMPND 14 MOLECULE: DNA (5'-D(*GP*AP*GP*AP*GP*GP*AP*AP*TP*GP*CP*AP*A)-3'); COMPND 15 CHAIN: C; COMPND 16 SYNONYM: M-CAT ELEMENT; COMPND 17 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: TEAD4; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 9 MOL_ID: 2; SOURCE 10 SYNTHETIC: YES; SOURCE 11 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 12 ORGANISM_COMMON: HUMAN; SOURCE 13 ORGANISM_TAXID: 9606; SOURCE 14 MOL_ID: 3; SOURCE 15 SYNTHETIC: YES; SOURCE 16 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 17 ORGANISM_COMMON: HUMAN; SOURCE 18 ORGANISM_TAXID: 9606 KEYWDS TRANSCRIPTION FACTOR, DNA, TRANSCRIPTION-DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR F.HE,Z.B.SHI,Z.C.ZHOU REVDAT 2 09-AUG-17 5GZB 1 JRNL REVDAT 1 19-APR-17 5GZB 0 JRNL AUTH Z.B.SHI,F.HE,M.CHEN,L.HUA,W.WANG,S.JIAO,Z.C.ZHOU JRNL TITL DNA-BINDING MECHANISM OF THE HIPPO PATHWAY TRANSCRIPTION JRNL TITL 2 FACTOR TEAD4 JRNL REF ONCOGENE V. 36 4362 2017 JRNL REFN ESSN 1476-5594 JRNL PMID 28368398 JRNL DOI 10.1038/ONC.2017.24 REMARK 2 REMARK 2 RESOLUTION. 2.70 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX 1.9_1692 REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE, REMARK 3 : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER, REMARK 3 : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY, REMARK 3 : REETAL PAI,RANDY READ,JANE RICHARDSON, REMARK 3 : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI, REMARK 3 : NICHOLAS SAUTER,JACOB SMITH,LAURENT REMARK 3 : STORONI,TOM TERWILLIGER,PETER ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : NULL REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.70 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 37.50 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.340 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.2 REMARK 3 NUMBER OF REFLECTIONS : 20397 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.232 REMARK 3 R VALUE (WORKING SET) : 0.229 REMARK 3 FREE R VALUE : 0.256 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 9.970 REMARK 3 FREE R VALUE TEST SET COUNT : 2034 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 37.5066 - 6.6574 0.98 1221 130 0.1714 0.1865 REMARK 3 2 6.6574 - 5.2889 1.00 1220 143 0.2064 0.2143 REMARK 3 3 5.2889 - 4.6217 1.00 1248 128 0.2046 0.2421 REMARK 3 4 4.6217 - 4.1998 1.00 1242 138 0.1939 0.1829 REMARK 3 5 4.1998 - 3.8991 1.00 1219 145 0.2104 0.2525 REMARK 3 6 3.8991 - 3.6694 1.00 1231 140 0.2305 0.2950 REMARK 3 7 3.6694 - 3.4858 0.99 1219 136 0.2673 0.2858 REMARK 3 8 3.4858 - 3.3341 0.98 1210 141 0.2479 0.2443 REMARK 3 9 3.3341 - 3.2059 0.99 1209 131 0.2365 0.2598 REMARK 3 10 3.2059 - 3.0953 0.98 1220 141 0.2755 0.3421 REMARK 3 11 3.0953 - 2.9985 1.00 1229 134 0.3150 0.4044 REMARK 3 12 2.9985 - 2.9129 1.00 1215 147 0.3680 0.4247 REMARK 3 13 2.9129 - 2.8362 0.99 1239 123 0.3963 0.4144 REMARK 3 14 2.8362 - 2.7670 1.00 1235 132 0.4047 0.4949 REMARK 3 15 2.7670 - 2.7041 0.98 1206 125 0.4057 0.4671 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : NULL REMARK 3 SOLVENT RADIUS : 1.11 REMARK 3 SHRINKAGE RADIUS : 0.90 REMARK 3 K_SOL : NULL REMARK 3 B_SOL : NULL REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.490 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 34.780 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 81.19 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 TWINNING INFORMATION. REMARK 3 FRACTION: NULL REMARK 3 OPERATOR: NULL REMARK 3 REMARK 3 DEVIATIONS FROM IDEAL VALUES. REMARK 3 RMSD COUNT REMARK 3 BOND : 0.004 1307 REMARK 3 ANGLE : 0.636 1868 REMARK 3 CHIRALITY : 0.027 208 REMARK 3 PLANARITY : 0.002 148 REMARK 3 DIHEDRAL : 25.344 527 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 5GZB COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 30-SEP-16. REMARK 100 THE DEPOSITION ID IS D_1300001714. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 30-MAR-14 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 7.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : SSRF REMARK 200 BEAMLINE : BL17U REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.97924 REMARK 200 MONOCHROMATOR : SI 111 CHANNEL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : RAYONIX MX-225 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 20397 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.700 REMARK 200 RESOLUTION RANGE LOW (A) : 37.500 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.7 REMARK 200 DATA REDUNDANCY : 9.300 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 20.3000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.70 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.75 REMARK 200 COMPLETENESS FOR SHELL (%) : 98.9 REMARK 200 DATA REDUNDANCY IN SHELL : 9.10 REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : 1.500 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: SAD REMARK 200 SOFTWARE USED: PHENIX REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 74.33 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 4.79 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.6 M NA2HPO4, 0.6 M KH2PO4, 0.1 M REMARK 280 HEPES, PH 7.5, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 291K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: I 41 2 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X+1/2,-Y+1/2,Z+1/2 REMARK 290 3555 -Y,X+1/2,Z+1/4 REMARK 290 4555 Y+1/2,-X,Z+3/4 REMARK 290 5555 -X+1/2,Y,-Z+3/4 REMARK 290 6555 X,-Y+1/2,-Z+1/4 REMARK 290 7555 Y+1/2,X+1/2,-Z+1/2 REMARK 290 8555 -Y,-X,-Z REMARK 290 9555 X+1/2,Y+1/2,Z+1/2 REMARK 290 10555 -X,-Y,Z REMARK 290 11555 -Y+1/2,X,Z+3/4 REMARK 290 12555 Y,-X+1/2,Z+1/4 REMARK 290 13555 -X,Y+1/2,-Z+1/4 REMARK 290 14555 X+1/2,-Y,-Z+3/4 REMARK 290 15555 Y,X,-Z REMARK 290 16555 -Y+1/2,-X+1/2,-Z+1/2 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 59.29750 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 59.29750 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 55.12900 REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 59.29750 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 27.56450 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 59.29750 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 82.69350 REMARK 290 SMTRY1 5 -1.000000 0.000000 0.000000 59.29750 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 82.69350 REMARK 290 SMTRY1 6 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 59.29750 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 27.56450 REMARK 290 SMTRY1 7 0.000000 1.000000 0.000000 59.29750 REMARK 290 SMTRY2 7 1.000000 0.000000 0.000000 59.29750 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 55.12900 REMARK 290 SMTRY1 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 8 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 9 1.000000 0.000000 0.000000 59.29750 REMARK 290 SMTRY2 9 0.000000 1.000000 0.000000 59.29750 REMARK 290 SMTRY3 9 0.000000 0.000000 1.000000 55.12900 REMARK 290 SMTRY1 10 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 10 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 10 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 11 0.000000 -1.000000 0.000000 59.29750 REMARK 290 SMTRY2 11 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 11 0.000000 0.000000 1.000000 82.69350 REMARK 290 SMTRY1 12 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 12 -1.000000 0.000000 0.000000 59.29750 REMARK 290 SMTRY3 12 0.000000 0.000000 1.000000 27.56450 REMARK 290 SMTRY1 13 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 13 0.000000 1.000000 0.000000 59.29750 REMARK 290 SMTRY3 13 0.000000 0.000000 -1.000000 27.56450 REMARK 290 SMTRY1 14 1.000000 0.000000 0.000000 59.29750 REMARK 290 SMTRY2 14 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 14 0.000000 0.000000 -1.000000 82.69350 REMARK 290 SMTRY1 15 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 15 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 15 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 16 0.000000 -1.000000 0.000000 59.29750 REMARK 290 SMTRY2 16 -1.000000 0.000000 0.000000 59.29750 REMARK 290 SMTRY3 16 0.000000 0.000000 -1.000000 55.12900 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: 3760 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 9880 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -27.0 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 SER A 33 REMARK 465 THR A 34 REMARK 465 MSE A 35 REMARK 465 ASP A 36 REMARK 465 ASN A 37 REMARK 465 ASP A 38 REMARK 465 ALA A 39 REMARK 465 GLU A 40 REMARK 465 GLY A 41 REMARK 465 MSE A 133 REMARK 465 SER A 134 REMARK 465 SER A 135 REMARK 465 ALA A 136 REMARK 465 GLN A 137 REMARK 465 ILE A 138 REMARK 465 ILE A 139 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 THR A 89 OG1 CG2 REMARK 470 LYS A 91 CG CD CE NZ REMARK 470 GLU A 112 CD OE1 OE2 REMARK 470 LYS A 116 CG CD CE NZ REMARK 470 LEU A 117 CG CD1 CD2 REMARK 470 LYS A 118 CG CD CE NZ REMARK 470 ASP A 119 CG OD1 OD2 REMARK 470 ASP A 124 CG OD1 OD2 REMARK 470 GLN A 128 CG CD OE1 NE2 REMARK 470 DT B 1 O5' REMARK 470 DG C 1 O5' 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 C 3 O4' - C1' - N9 ANGL. DEV. = 1.8 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue GOL A 201 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue PO4 C 101 DBREF 5GZB A 36 139 UNP Q15561 TEAD4_HUMAN 36 139 DBREF 5GZB B 1 13 PDB 5GZB 5GZB 1 13 DBREF 5GZB C 1 13 PDB 5GZB 5GZB 1 13 SEQADV 5GZB SER A 33 UNP Q15561 EXPRESSION TAG SEQADV 5GZB THR A 34 UNP Q15561 EXPRESSION TAG SEQADV 5GZB MSE A 35 UNP Q15561 EXPRESSION TAG SEQRES 1 A 107 SER THR MSE ASP ASN ASP ALA GLU GLY VAL TRP SER PRO SEQRES 2 A 107 ASP ILE GLU GLN SER PHE GLN GLU ALA LEU ALA ILE TYR SEQRES 3 A 107 PRO PRO CYS GLY ARG ARG LYS ILE ILE LEU SER ASP GLU SEQRES 4 A 107 GLY LYS MSE TYR GLY ARG ASN GLU LEU ILE ALA ARG TYR SEQRES 5 A 107 ILE LYS LEU ARG THR GLY LYS THR ARG THR ARG LYS GLN SEQRES 6 A 107 VAL SER SER HIS ILE GLN VAL LEU ALA ARG ARG LYS ALA SEQRES 7 A 107 ARG GLU ILE GLN ALA LYS LEU LYS ASP GLN ALA ALA LYS SEQRES 8 A 107 ASP LYS ALA LEU GLN SER MSE ALA ALA MSE SER SER ALA SEQRES 9 A 107 GLN ILE ILE SEQRES 1 B 13 DT DT DG DC DA DT DT DC DC DT DC DT DC SEQRES 1 C 13 DG DA DG DA DG DG DA DA DT DG DC DA DA MODRES 5GZB MSE A 74 MET MODIFIED RESIDUE MODRES 5GZB MSE A 130 MET MODIFIED RESIDUE HET MSE A 74 8 HET MSE A 130 8 HET GOL A 201 6 HET PO4 C 101 5 HETNAM MSE SELENOMETHIONINE HETNAM GOL GLYCEROL HETNAM PO4 PHOSPHATE ION HETSYN GOL GLYCERIN; PROPANE-1,2,3-TRIOL FORMUL 1 MSE 2(C5 H11 N O2 SE) FORMUL 4 GOL C3 H8 O3 FORMUL 5 PO4 O4 P 3- FORMUL 6 HOH *(H2 O) HELIX 1 AA1 SER A 44 TYR A 58 1 15 HELIX 2 AA2 GLY A 76 THR A 89 1 14 HELIX 3 AA3 THR A 94 ILE A 113 1 20 HELIX 4 AA4 ILE A 113 GLN A 120 1 8 HELIX 5 AA5 GLN A 120 ALA A 132 1 13 SHEET 1 AA1 2 ILE A 67 LEU A 68 0 SHEET 2 AA1 2 MSE A 74 TYR A 75 -1 O TYR A 75 N ILE A 67 LINK C LYS A 73 N MSE A 74 1555 1555 1.33 LINK C MSE A 74 N TYR A 75 1555 1555 1.33 LINK C SER A 129 N MSE A 130 1555 1555 1.33 LINK C MSE A 130 N ALA A 131 1555 1555 1.33 SITE 1 AC1 3 PRO A 59 CYS A 61 ILE A 67 SITE 1 AC2 2 DG C 3 DA C 4 CRYST1 118.595 118.595 110.258 90.00 90.00 90.00 I 41 2 2 16 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 0.008432 0.000000 0.000000 0.00000 SCALE2 0.000000 0.008432 0.000000 0.00000 SCALE3 0.000000 0.000000 0.009070 0.00000 ATOM 1 N VAL A 42 64.805 42.144 30.711 1.00 80.98 N ATOM 2 CA VAL A 42 63.437 41.680 30.510 1.00100.09 C ATOM 3 C VAL A 42 63.160 41.484 29.023 1.00 95.17 C ATOM 4 O VAL A 42 62.583 40.476 28.613 1.00 94.29 O ATOM 5 CB VAL A 42 62.413 42.664 31.108 1.00 85.38 C ATOM 6 CG1 VAL A 42 61.003 42.328 30.642 1.00 73.15 C ATOM 7 CG2 VAL A 42 62.503 42.661 32.627 1.00101.58 C ATOM 8 N TRP A 43 63.577 42.453 28.217 1.00 83.81 N ATOM 9 CA TRP A 43 63.521 42.305 26.770 1.00 81.30 C ATOM 10 C TRP A 43 64.919 42.466 26.194 1.00 77.24 C ATOM 11 O TRP A 43 65.141 43.221 25.246 1.00 79.86 O ATOM 12 CB TRP A 43 62.536 43.302 26.162 1.00 74.60 C ATOM 13 CG TRP A 43 61.124 42.896 26.431 1.00 83.15 C ATOM 14 CD1 TRP A 43 60.223 43.533 27.233 1.00 91.63 C ATOM 15 CD2 TRP A 43 60.461 41.732 25.926 1.00 86.71 C ATOM 16 NE1 TRP A 43 59.033 42.844 27.246 1.00 88.97 N ATOM 17 CE2 TRP A 43 59.153 41.735 26.452 1.00 89.09 C ATOM 18 CE3 TRP A 43 60.841 40.694 25.070 1.00 80.31 C ATOM 19 CZ2 TRP A 43 58.226 40.738 26.150 1.00 88.69 C ATOM 20 CZ3 TRP A 43 59.920 39.706 24.773 1.00 74.41 C ATOM 21 CH2 TRP A 43 58.628 39.736 25.311 1.00 72.22 C ATOM 22 N SER A 44 65.851 41.733 26.798 1.00 78.63 N ATOM 23 CA SER A 44 67.254 41.696 26.399 1.00 93.54 C ATOM 24 C SER A 44 67.410 41.412 24.905 1.00 97.51 C ATOM 25 O SER A 44 66.552 40.759 24.312 1.00100.66 O ATOM 26 CB SER A 44 67.992 40.633 27.220 1.00 84.27 C ATOM 27 OG SER A 44 67.513 40.590 28.553 1.00 94.14 O ATOM 28 N PRO A 45 68.509 41.900 24.295 1.00100.95 N ATOM 29 CA PRO A 45 68.765 41.778 22.853 1.00102.29 C ATOM 30 C PRO A 45 68.528 40.380 22.281 1.00108.32 C ATOM 31 O PRO A 45 68.073 40.265 21.144 1.00107.03 O ATOM 32 CB PRO A 45 70.243 42.156 22.733 1.00101.28 C ATOM 33 CG PRO A 45 70.466 43.100 23.847 1.00108.09 C ATOM 34 CD PRO A 45 69.594 42.631 24.977 1.00100.98 C ATOM 35 N ASP A 46 68.831 39.342 23.053 1.00 94.32 N ATOM 36 CA ASP A 46 68.615 37.972 22.598 1.00102.72 C ATOM 37 C ASP A 46 67.137 37.594 22.666 1.00 99.01 C ATOM 38 O ASP A 46 66.580 37.076 21.698 1.00 98.86 O ATOM 39 CB ASP A 46 69.454 36.992 23.422 1.00106.88 C ATOM 40 CG ASP A 46 69.255 37.165 24.912 1.00111.93 C ATOM 41 OD1 ASP A 46 68.726 38.219 25.320 1.00116.02 O ATOM 42 OD2 ASP A 46 69.623 36.247 25.674 1.00109.50 O ATOM 43 N ILE A 47 66.507 37.851 23.810 1.00 91.78 N ATOM 44 CA ILE A 47 65.075 37.622 23.960 1.00 80.38 C ATOM 45 C ILE A 47 64.315 38.510 22.980 1.00 77.59 C ATOM 46 O ILE A 47 63.336 38.082 22.365 1.00 79.36 O ATOM 47 CB ILE A 47 64.598 37.895 25.405 1.00 76.16 C ATOM 48 CG1 ILE A 47 65.024 36.755 26.331 1.00 64.36 C ATOM 49 CG2 ILE A 47 63.088 38.037 25.460 1.00 63.44 C ATOM 50 CD1 ILE A 47 66.286 37.036 27.107 1.00 94.37 C ATOM 51 N GLU A 48 64.788 39.743 22.826 1.00 76.43 N ATOM 52 CA GLU A 48 64.205 40.676 21.870 1.00 81.61 C ATOM 53 C GLU A 48 64.366 40.172 20.443 1.00 77.46 C ATOM 54 O GLU A 48 63.474 40.344 19.610 1.00 74.69 O ATOM 55 CB GLU A 48 64.840 42.063 22.013 1.00 77.84 C ATOM 56 CG GLU A 48 64.419 43.060 20.942 1.00 68.25 C ATOM 57 CD GLU A 48 62.925 43.303 20.923 1.00 80.86 C ATOM 58 OE1 GLU A 48 62.288 43.148 21.983 1.00 81.95 O ATOM 59 OE2 GLU A 48 62.386 43.645 19.849 1.00 73.48 O ATOM 60 N GLN A 49 65.507 39.550 20.166 1.00 82.66 N ATOM 61 CA GLN A 49 65.766 38.992 18.845 1.00 87.87 C ATOM 62 C GLN A 49 64.742 37.917 18.504 1.00 82.32 C ATOM 63 O GLN A 49 64.073 37.995 17.475 1.00 86.13 O ATOM 64 CB GLN A 49 67.183 38.417 18.764 1.00 88.25 C ATOM 65 CG GLN A 49 67.459 37.577 17.521 1.00106.53 C ATOM 66 CD GLN A 49 67.547 38.400 16.244 1.00106.03 C ATOM 67 OE1 GLN A 49 66.593 39.073 15.853 1.00114.19 O ATOM 68 NE2 GLN A 49 68.696 38.338 15.583 1.00110.09 N ATOM 69 N SER A 50 64.614 36.926 19.381 1.00 81.58 N ATOM 70 CA SER A 50 63.696 35.812 19.162 1.00 74.46 C ATOM 71 C SER A 50 62.243 36.275 19.143 1.00 76.04 C ATOM 72 O SER A 50 61.403 35.679 18.468 1.00 86.63 O ATOM 73 CB SER A 50 63.893 34.739 20.234 1.00 77.88 C ATOM 74 OG SER A 50 63.813 35.293 21.535 1.00 85.65 O ATOM 75 N PHE A 51 61.949 37.334 19.890 1.00 74.19 N ATOM 76 CA PHE A 51 60.618 37.926 19.864 1.00 66.19 C ATOM 77 C PHE A 51 60.342 38.514 18.488 1.00 66.41 C ATOM 78 O PHE A 51 59.269 38.310 17.919 1.00 73.22 O ATOM 79 CB PHE A 51 60.474 39.000 20.943 1.00 62.13 C ATOM 80 CG PHE A 51 59.232 39.833 20.805 1.00 69.92 C ATOM 81 CD1 PHE A 51 58.012 39.363 21.262 1.00 59.45 C ATOM 82 CD2 PHE A 51 59.283 41.089 20.221 1.00 72.33 C ATOM 83 CE1 PHE A 51 56.866 40.127 21.135 1.00 62.81 C ATOM 84 CE2 PHE A 51 58.142 41.856 20.092 1.00 68.84 C ATOM 85 CZ PHE A 51 56.933 41.375 20.550 1.00 62.70 C ATOM 86 N GLN A 52 61.319 39.246 17.960 1.00 66.34 N ATOM 87 CA GLN A 52 61.225 39.795 16.613 1.00 80.73 C ATOM 88 C GLN A 52 61.125 38.667 15.591 1.00 75.74 C ATOM 89 O GLN A 52 60.456 38.798 14.566 1.00 80.02 O ATOM 90 CB GLN A 52 62.428 40.693 16.311 1.00 74.58 C ATOM 91 CG GLN A 52 62.350 42.073 16.952 1.00 75.52 C ATOM 92 CD GLN A 52 61.237 42.918 16.364 1.00 70.15 C ATOM 93 OE1 GLN A 52 60.947 42.835 15.170 1.00 74.72 O ATOM 94 NE2 GLN A 52 60.604 43.735 17.200 1.00 66.86 N ATOM 95 N GLU A 53 61.789 37.555 15.886 1.00 80.56 N ATOM 96 CA GLU A 53 61.711 36.369 15.043 1.00 81.33 C ATOM 97 C GLU A 53 60.302 35.784 15.060 1.00 75.14 C ATOM 98 O GLU A 53 59.762 35.413 14.017 1.00 71.44 O ATOM 99 CB GLU A 53 62.725 35.320 15.499 1.00 69.94 C ATOM 100 CG GLU A 53 64.175 35.731 15.311 1.00 89.78 C ATOM 101 CD GLU A 53 65.127 34.565 15.462 1.00 91.59 C ATOM 102 OE1 GLU A 53 66.184 34.565 14.798 1.00102.89 O ATOM 103 OE2 GLU A 53 64.812 33.643 16.242 1.00100.71 O ATOM 104 N ALA A 54 59.712 35.709 16.249 1.00 65.00 N ATOM 105 CA ALA A 54 58.358 35.191 16.404 1.00 50.55 C ATOM 106 C ALA A 54 57.353 36.013 15.602 1.00 63.97 C ATOM 107 O ALA A 54 56.453 35.458 14.972 1.00 76.11 O ATOM 108 CB ALA A 54 57.965 35.165 17.872 1.00 59.01 C ATOM 109 N LEU A 55 57.518 37.333 15.624 1.00 69.39 N ATOM 110 CA LEU A 55 56.615 38.238 14.916 1.00 67.87 C ATOM 111 C LEU A 55 56.609 37.968 13.415 1.00 62.96 C ATOM 112 O LEU A 55 55.591 38.148 12.745 1.00 54.13 O ATOM 113 CB LEU A 55 57.001 39.696 15.179 1.00 75.94 C ATOM 114 CG LEU A 55 56.885 40.209 16.615 1.00 64.21 C ATOM 115 CD1 LEU A 55 57.213 41.689 16.665 1.00 51.13 C ATOM 116 CD2 LEU A 55 55.493 39.953 17.166 1.00 57.96 C ATOM 117 N ALA A 56 57.754 37.539 12.896 1.00 61.70 N ATOM 118 CA ALA A 56 57.887 37.216 11.482 1.00 72.41 C ATOM 119 C ALA A 56 57.385 35.805 11.212 1.00 72.22 C ATOM 120 O ALA A 56 56.903 35.500 10.121 1.00 73.79 O ATOM 121 CB ALA A 56 59.333 37.361 11.039 1.00 74.38 C ATOM 122 N ILE A 57 57.502 34.950 12.221 1.00 71.13 N ATOM 123 CA ILE A 57 57.096 33.557 12.110 1.00 64.71 C ATOM 124 C ILE A 57 55.584 33.401 12.247 1.00 68.22 C ATOM 125 O ILE A 57 54.950 32.708 11.450 1.00 77.50 O ATOM 126 CB ILE A 57 57.804 32.693 13.168 1.00 57.77 C ATOM 127 CG1 ILE A 57 59.268 32.487 12.780 1.00 56.21 C ATOM 128 CG2 ILE A 57 57.116 31.355 13.314 1.00 61.71 C ATOM 129 CD1 ILE A 57 60.083 31.790 13.837 1.00 68.30 C ATOM 130 N TYR A 58 55.011 34.047 13.258 1.00 69.28 N ATOM 131 CA TYR A 58 53.567 34.013 13.464 1.00 66.98 C ATOM 132 C TYR A 58 52.935 35.351 13.093 1.00 69.79 C ATOM 133 O TYR A 58 52.939 36.286 13.895 1.00 74.20 O ATOM 134 CB TYR A 58 53.229 33.668 14.917 1.00 61.74 C ATOM 135 CG TYR A 58 53.908 32.425 15.448 1.00 63.01 C ATOM 136 CD1 TYR A 58 53.366 31.163 15.232 1.00 73.54 C ATOM 137 CD2 TYR A 58 55.085 32.515 16.178 1.00 66.84 C ATOM 138 CE1 TYR A 58 53.984 30.026 15.723 1.00 65.23 C ATOM 139 CE2 TYR A 58 55.710 31.385 16.673 1.00 72.33 C ATOM 140 CZ TYR A 58 55.155 30.144 16.443 1.00 75.60 C ATOM 141 OH TYR A 58 55.776 29.019 16.936 1.00 66.36 O ATOM 142 N PRO A 59 52.389 35.445 11.871 1.00 61.88 N ATOM 143 CA PRO A 59 51.732 36.666 11.389 1.00 62.41 C ATOM 144 C PRO A 59 50.548 37.073 12.262 1.00 67.21 C ATOM 145 O PRO A 59 49.895 36.206 12.843 1.00 74.09 O ATOM 146 CB PRO A 59 51.266 36.281 9.979 1.00 57.65 C ATOM 147 CG PRO A 59 51.224 34.791 9.988 1.00 69.85 C ATOM 148 CD PRO A 59 52.342 34.366 10.871 1.00 61.52 C ATOM 149 N PRO A 60 50.282 38.385 12.359 1.00 73.29 N ATOM 150 CA PRO A 60 49.210 38.937 13.195 1.00 63.27 C ATOM 151 C PRO A 60 47.836 38.348 12.884 1.00 67.08 C ATOM 152 O PRO A 60 47.541 38.033 11.731 1.00 68.24 O ATOM 153 CB PRO A 60 49.248 40.430 12.864 1.00 62.69 C ATOM 154 CG PRO A 60 50.656 40.678 12.462 1.00 55.62 C ATOM 155 CD PRO A 60 51.071 39.448 11.712 1.00 59.18 C ATOM 156 N CYS A 61 47.011 38.212 13.918 1.00 68.82 N ATOM 157 CA CYS A 61 45.691 37.604 13.793 1.00 68.72 C ATOM 158 C CYS A 61 44.650 38.541 13.193 1.00 66.49 C ATOM 159 O CYS A 61 44.750 39.762 13.313 1.00 78.10 O ATOM 160 CB CYS A 61 45.199 37.127 15.161 1.00 77.40 C ATOM 161 SG CYS A 61 45.634 35.429 15.582 1.00 99.59 S ATOM 162 N GLY A 62 43.642 37.955 12.554 1.00 86.34 N ATOM 163 CA GLY A 62 42.480 38.700 12.109 1.00 71.65 C ATOM 164 C GLY A 62 41.486 38.805 13.249 1.00 65.29 C ATOM 165 O GLY A 62 41.878 39.009 14.397 1.00 63.83 O ATOM 166 N ARG A 63 40.200 38.656 12.945 1.00 72.50 N ATOM 167 CA ARG A 63 39.176 38.728 13.982 1.00 72.41 C ATOM 168 C ARG A 63 39.198 37.483 14.869 1.00 79.51 C ATOM 169 O ARG A 63 38.948 37.567 16.071 1.00 78.59 O ATOM 170 CB ARG A 63 37.789 38.916 13.362 1.00 81.05 C ATOM 171 CG ARG A 63 36.666 39.021 14.387 1.00 93.38 C ATOM 172 CD ARG A 63 35.313 39.248 13.729 1.00112.77 C ATOM 173 NE ARG A 63 35.156 40.622 13.263 1.00130.18 N ATOM 174 CZ ARG A 63 34.703 41.620 14.016 1.00133.72 C ATOM 175 NH1 ARG A 63 34.357 41.399 15.276 1.00139.64 N ATOM 176 NH2 ARG A 63 34.593 42.840 13.507 1.00138.33 N ATOM 177 N ARG A 64 39.501 36.332 14.276 1.00 82.03 N ATOM 178 CA ARG A 64 39.585 35.089 15.036 1.00 67.03 C ATOM 179 C ARG A 64 40.914 35.012 15.780 1.00 62.56 C ATOM 180 O ARG A 64 41.982 35.007 15.169 1.00 78.20 O ATOM 181 CB ARG A 64 39.408 33.878 14.118 1.00 69.91 C ATOM 182 CG ARG A 64 39.431 32.542 14.843 1.00 68.33 C ATOM 183 CD ARG A 64 38.549 31.518 14.146 1.00 65.38 C ATOM 184 NE ARG A 64 37.220 31.461 14.747 1.00 72.87 N ATOM 185 CZ ARG A 64 36.091 31.332 14.059 1.00 78.55 C ATOM 186 NH1 ARG A 64 36.125 31.244 12.737 1.00 81.74 N ATOM 187 NH2 ARG A 64 34.927 31.290 14.693 1.00 69.30 N ATOM 188 N LYS A 65 40.835 34.950 17.104 1.00 64.97 N ATOM 189 CA LYS A 65 42.014 35.056 17.955 1.00 56.84 C ATOM 190 C LYS A 65 42.422 33.721 18.562 1.00 71.08 C ATOM 191 O LYS A 65 43.461 33.621 19.215 1.00 74.52 O ATOM 192 CB LYS A 65 41.757 36.064 19.075 1.00 59.40 C ATOM 193 CG LYS A 65 41.380 37.450 18.588 1.00 77.60 C ATOM 194 CD LYS A 65 42.483 38.035 17.728 1.00 75.15 C ATOM 195 CE LYS A 65 42.277 39.522 17.511 1.00 59.19 C ATOM 196 NZ LYS A 65 43.481 40.161 16.911 1.00 75.27 N ATOM 197 N ILE A 66 41.605 32.698 18.336 1.00 76.03 N ATOM 198 CA ILE A 66 41.760 31.434 19.041 1.00 65.95 C ATOM 199 C ILE A 66 41.752 30.226 18.109 1.00 65.56 C ATOM 200 O ILE A 66 40.959 30.154 17.170 1.00 78.42 O ATOM 201 CB ILE A 66 40.651 31.282 20.109 1.00 65.85 C ATOM 202 CG1 ILE A 66 41.113 31.928 21.416 1.00 70.36 C ATOM 203 CG2 ILE A 66 40.226 29.828 20.290 1.00 64.46 C ATOM 204 CD1 ILE A 66 42.518 31.547 21.808 1.00 77.61 C ATOM 205 N ILE A 67 42.649 29.282 18.375 1.00 69.19 N ATOM 206 CA ILE A 67 42.735 28.067 17.579 1.00 73.20 C ATOM 207 C ILE A 67 43.059 26.857 18.463 1.00 71.24 C ATOM 208 O ILE A 67 43.776 26.974 19.458 1.00 78.93 O ATOM 209 CB ILE A 67 43.792 28.217 16.460 1.00 71.17 C ATOM 210 CG1 ILE A 67 43.667 27.088 15.438 1.00 66.45 C ATOM 211 CG2 ILE A 67 45.193 28.311 17.039 1.00 72.97 C ATOM 212 CD1 ILE A 67 42.497 27.259 14.507 1.00 63.83 C ATOM 213 N LEU A 68 42.508 25.699 18.108 1.00 68.30 N ATOM 214 CA LEU A 68 42.708 24.485 18.895 1.00 69.17 C ATOM 215 C LEU A 68 43.655 23.506 18.210 1.00 64.73 C ATOM 216 O LEU A 68 43.540 23.252 17.011 1.00 69.44 O ATOM 217 CB LEU A 68 41.367 23.795 19.163 1.00 65.71 C ATOM 218 CG LEU A 68 40.694 24.041 20.515 1.00 71.54 C ATOM 219 CD1 LEU A 68 40.586 25.525 20.794 1.00 68.23 C ATOM 220 CD2 LEU A 68 39.319 23.390 20.552 1.00 72.22 C ATOM 221 N SER A 69 44.588 22.955 18.981 1.00 58.17 N ATOM 222 CA SER A 69 45.472 21.909 18.481 1.00 71.82 C ATOM 223 C SER A 69 44.704 20.601 18.327 1.00 71.20 C ATOM 224 O SER A 69 43.545 20.504 18.734 1.00 73.66 O ATOM 225 CB SER A 69 46.667 21.717 19.416 1.00 74.91 C ATOM 226 OG SER A 69 46.237 21.426 20.734 1.00 81.99 O ATOM 227 N ASP A 70 45.351 19.593 17.749 1.00 73.27 N ATOM 228 CA ASP A 70 44.705 18.302 17.534 1.00 73.51 C ATOM 229 C ASP A 70 44.427 17.587 18.855 1.00 67.40 C ATOM 230 O ASP A 70 43.602 16.676 18.913 1.00 83.03 O ATOM 231 CB ASP A 70 45.556 17.416 16.619 1.00 76.41 C ATOM 232 CG ASP A 70 46.960 17.198 17.149 1.00 76.84 C ATOM 233 OD1 ASP A 70 47.368 17.917 18.085 1.00 79.13 O ATOM 234 OD2 ASP A 70 47.659 16.306 16.624 1.00 82.92 O ATOM 235 N GLU A 71 45.116 18.006 19.913 1.00 72.91 N ATOM 236 CA GLU A 71 44.876 17.456 21.243 1.00 66.97 C ATOM 237 C GLU A 71 43.859 18.297 22.014 1.00 73.93 C ATOM 238 O GLU A 71 43.371 17.883 23.065 1.00 84.63 O ATOM 239 CB GLU A 71 46.186 17.351 22.027 1.00 67.18 C ATOM 240 CG GLU A 71 47.228 16.465 21.360 1.00 97.16 C ATOM 241 CD GLU A 71 48.411 16.169 22.261 1.00123.84 C ATOM 242 OE1 GLU A 71 48.641 16.937 23.219 1.00134.01 O ATOM 243 OE2 GLU A 71 49.113 15.166 22.010 1.00137.49 O ATOM 244 N GLY A 72 43.544 19.476 21.487 1.00 74.36 N ATOM 245 CA GLY A 72 42.474 20.291 22.035 1.00 69.92 C ATOM 246 C GLY A 72 42.929 21.461 22.887 1.00 74.28 C ATOM 247 O GLY A 72 42.107 22.176 23.456 1.00 72.81 O ATOM 248 N LYS A 73 44.238 21.660 22.987 1.00 77.90 N ATOM 249 CA LYS A 73 44.769 22.772 23.765 1.00 73.79 C ATOM 250 C LYS A 73 44.553 24.054 22.982 1.00 76.54 C ATOM 251 O LYS A 73 44.809 24.091 21.783 1.00 76.10 O ATOM 252 CB LYS A 73 46.250 22.555 24.078 1.00 79.95 C ATOM 253 CG LYS A 73 46.872 23.614 24.981 1.00 73.13 C ATOM 254 CD LYS A 73 48.354 23.298 25.257 1.00 75.89 C ATOM 255 CE LYS A 73 48.986 24.179 26.343 1.00 88.55 C ATOM 256 NZ LYS A 73 48.415 24.044 27.714 1.00 94.61 N HETATM 257 N MSE A 74 44.079 25.106 23.640 1.00 73.43 N HETATM 258 CA MSE A 74 43.653 26.288 22.898 1.00 68.52 C HETATM 259 C MSE A 74 44.776 27.305 22.752 1.00 82.06 C HETATM 260 O MSE A 74 45.433 27.668 23.730 1.00 75.50 O HETATM 261 CB MSE A 74 42.448 26.929 23.573 1.00 64.31 C HETATM 262 CG MSE A 74 41.905 28.151 22.866 1.00 72.87 C HETATM 263 SE MSE A 74 40.325 28.855 23.754 1.00109.85 SE HETATM 264 CE MSE A 74 41.223 29.562 25.314 1.00 68.39 C ATOM 265 N TYR A 75 44.977 27.772 21.523 1.00 87.55 N ATOM 266 CA TYR A 75 46.155 28.565 21.193 1.00 68.89 C ATOM 267 C TYR A 75 45.890 29.995 20.754 1.00 71.75 C ATOM 268 O TYR A 75 44.972 30.266 19.981 1.00 74.91 O ATOM 269 CB TYR A 75 46.950 27.857 20.094 1.00 74.22 C ATOM 270 CG TYR A 75 47.857 26.774 20.624 1.00 72.03 C ATOM 271 CD1 TYR A 75 47.600 26.170 21.851 1.00 97.32 C ATOM 272 CD2 TYR A 75 48.957 26.349 19.902 1.00 81.80 C ATOM 273 CE1 TYR A 75 48.403 25.196 22.348 1.00114.33 C ATOM 274 CE2 TYR A 75 49.779 25.364 20.392 1.00 96.00 C ATOM 275 CZ TYR A 75 49.497 24.788 21.615 1.00106.44 C ATOM 276 OH TYR A 75 50.324 23.807 22.092 1.00102.45 O ATOM 277 N GLY A 76 46.734 30.896 21.244 1.00 76.55 N ATOM 278 CA GLY A 76 46.746 32.272 20.794 1.00 68.71 C ATOM 279 C GLY A 76 48.107 32.632 20.225 1.00 66.97 C ATOM 280 O GLY A 76 49.075 31.888 20.398 1.00 60.21 O ATOM 281 N ARG A 77 48.187 33.773 19.548 1.00 72.23 N ATOM 282 CA ARG A 77 49.427 34.183 18.897 1.00 62.19 C ATOM 283 C ARG A 77 50.527 34.505 19.903 1.00 49.57 C ATOM 284 O ARG A 77 51.671 34.089 19.731 1.00 69.30 O ATOM 285 CB ARG A 77 49.176 35.387 17.991 1.00 68.77 C ATOM 286 CG ARG A 77 50.393 35.837 17.203 1.00 70.66 C ATOM 287 CD ARG A 77 49.994 36.833 16.130 1.00 72.75 C ATOM 288 NE ARG A 77 51.146 37.371 15.413 1.00 68.28 N ATOM 289 CZ ARG A 77 51.836 38.435 15.804 1.00 67.60 C ATOM 290 NH1 ARG A 77 51.497 39.076 16.914 1.00 63.20 N ATOM 291 NH2 ARG A 77 52.869 38.857 15.088 1.00 77.55 N ATOM 292 N ASN A 78 50.181 35.244 20.953 1.00 58.99 N ATOM 293 CA ASN A 78 51.157 35.603 21.975 1.00 60.18 C ATOM 294 C ASN A 78 51.656 34.370 22.719 1.00 60.58 C ATOM 295 O ASN A 78 52.815 34.306 23.130 1.00 66.97 O ATOM 296 CB ASN A 78 50.560 36.610 22.960 1.00 67.51 C ATOM 297 CG ASN A 78 49.997 37.837 22.268 1.00 62.67 C ATOM 298 OD1 ASN A 78 50.283 38.092 21.098 1.00 55.83 O ATOM 299 ND2 ASN A 78 49.189 38.605 22.991 1.00 70.82 N ATOM 300 N GLU A 79 50.775 33.389 22.878 1.00 69.71 N ATOM 301 CA GLU A 79 51.136 32.129 23.516 1.00 71.80 C ATOM 302 C GLU A 79 52.170 31.383 22.680 1.00 65.29 C ATOM 303 O GLU A 79 53.156 30.868 23.208 1.00 62.34 O ATOM 304 CB GLU A 79 49.896 31.260 23.726 1.00 68.91 C ATOM 305 CG GLU A 79 50.047 30.221 24.818 1.00 81.08 C ATOM 306 CD GLU A 79 48.932 29.201 24.795 1.00 90.73 C ATOM 307 OE1 GLU A 79 47.890 29.481 24.168 1.00 99.09 O ATOM 308 OE2 GLU A 79 49.095 28.122 25.403 1.00103.87 O ATOM 309 N LEU A 80 51.933 31.330 21.373 1.00 69.95 N ATOM 310 CA LEU A 80 52.882 30.740 20.435 1.00 54.09 C ATOM 311 C LEU A 80 54.198 31.501 20.452 1.00 70.31 C ATOM 312 O LEU A 80 55.275 30.901 20.453 1.00 78.14 O ATOM 313 CB LEU A 80 52.309 30.734 19.019 1.00 64.92 C ATOM 314 CG LEU A 80 51.156 29.777 18.733 1.00 62.48 C ATOM 315 CD1 LEU A 80 50.457 30.174 17.445 1.00 54.84 C ATOM 316 CD2 LEU A 80 51.672 28.352 18.645 1.00 63.05 C ATOM 317 N ILE A 81 54.096 32.828 20.452 1.00 72.40 N ATOM 318 CA ILE A 81 55.266 33.697 20.506 1.00 69.59 C ATOM 319 C ILE A 81 56.092 33.401 21.749 1.00 61.91 C ATOM 320 O ILE A 81 57.303 33.200 21.666 1.00 67.37 O ATOM 321 CB ILE A 81 54.867 35.187 20.497 1.00 69.69 C ATOM 322 CG1 ILE A 81 54.417 35.607 19.098 1.00 60.51 C ATOM 323 CG2 ILE A 81 56.030 36.060 20.945 1.00 62.35 C ATOM 324 CD1 ILE A 81 53.906 37.027 19.027 1.00 67.57 C ATOM 325 N ALA A 82 55.424 33.366 22.897 1.00 61.22 N ATOM 326 CA ALA A 82 56.071 33.035 24.161 1.00 59.64 C ATOM 327 C ALA A 82 56.722 31.659 24.090 1.00 77.33 C ATOM 328 O ALA A 82 57.846 31.463 24.553 1.00 75.34 O ATOM 329 CB ALA A 82 55.064 33.087 25.293 1.00 55.65 C ATOM 330 N ARG A 83 55.997 30.712 23.503 1.00 81.70 N ATOM 331 CA ARG A 83 56.493 29.358 23.293 1.00 67.59 C ATOM 332 C ARG A 83 57.772 29.360 22.464 1.00 67.86 C ATOM 333 O ARG A 83 58.748 28.696 22.813 1.00 82.24 O ATOM 334 CB ARG A 83 55.417 28.510 22.610 1.00 83.01 C ATOM 335 CG ARG A 83 55.858 27.124 22.166 1.00 74.67 C ATOM 336 CD ARG A 83 54.776 26.493 21.296 1.00 81.16 C ATOM 337 NE ARG A 83 54.859 25.037 21.250 1.00 78.49 N ATOM 338 CZ ARG A 83 55.240 24.346 20.181 1.00 70.97 C ATOM 339 NH1 ARG A 83 55.579 24.979 19.067 1.00 82.37 N ATOM 340 NH2 ARG A 83 55.284 23.021 20.226 1.00103.07 N ATOM 341 N TYR A 84 57.767 30.121 21.373 1.00 67.96 N ATOM 342 CA TYR A 84 58.915 30.170 20.474 1.00 67.76 C ATOM 343 C TYR A 84 60.139 30.797 21.134 1.00 71.68 C ATOM 344 O TYR A 84 61.274 30.436 20.813 1.00 76.10 O ATOM 345 CB TYR A 84 58.573 30.936 19.197 1.00 70.02 C ATOM 346 CG TYR A 84 59.771 31.136 18.301 1.00 63.33 C ATOM 347 CD1 TYR A 84 60.260 30.097 17.523 1.00 61.45 C ATOM 348 CD2 TYR A 84 60.425 32.360 18.248 1.00 72.38 C ATOM 349 CE1 TYR A 84 61.362 30.271 16.711 1.00 73.95 C ATOM 350 CE2 TYR A 84 61.526 32.544 17.439 1.00 79.01 C ATOM 351 CZ TYR A 84 61.991 31.497 16.672 1.00 75.94 C ATOM 352 OH TYR A 84 63.088 31.678 15.863 1.00 75.36 O ATOM 353 N ILE A 85 59.906 31.744 22.038 1.00 73.52 N ATOM 354 CA ILE A 85 60.986 32.346 22.812 1.00 73.26 C ATOM 355 C ILE A 85 61.771 31.256 23.525 1.00 77.92 C ATOM 356 O ILE A 85 62.979 31.123 23.342 1.00 84.80 O ATOM 357 CB ILE A 85 60.461 33.351 23.856 1.00 87.19 C ATOM 358 CG1 ILE A 85 59.751 34.520 23.171 1.00 72.94 C ATOM 359 CG2 ILE A 85 61.601 33.859 24.726 1.00 77.38 C ATOM 360 CD1 ILE A 85 60.688 35.479 22.489 1.00 82.20 C ATOM 361 N LYS A 86 61.059 30.467 24.323 1.00 85.83 N ATOM 362 CA LYS A 86 61.649 29.363 25.071 1.00 86.93 C ATOM 363 C LYS A 86 62.383 28.383 24.158 1.00 75.61 C ATOM 364 O LYS A 86 63.424 27.844 24.525 1.00 82.33 O ATOM 365 CB LYS A 86 60.563 28.631 25.859 1.00 80.06 C ATOM 366 CG LYS A 86 61.076 27.593 26.840 1.00 78.80 C ATOM 367 CD LYS A 86 60.490 27.835 28.221 1.00 84.83 C ATOM 368 CE LYS A 86 60.173 26.532 28.929 1.00 97.97 C ATOM 369 NZ LYS A 86 59.278 26.751 30.098 1.00 98.96 N ATOM 370 N LEU A 87 61.834 28.159 22.969 1.00 81.65 N ATOM 371 CA LEU A 87 62.441 27.247 22.005 1.00 77.31 C ATOM 372 C LEU A 87 63.827 27.719 21.580 1.00 77.40 C ATOM 373 O LEU A 87 64.764 26.925 21.500 1.00104.65 O ATOM 374 CB LEU A 87 61.547 27.093 20.773 1.00 86.59 C ATOM 375 CG LEU A 87 60.677 25.838 20.671 1.00 79.65 C ATOM 376 CD1 LEU A 87 59.724 25.729 21.851 1.00 73.03 C ATOM 377 CD2 LEU A 87 59.908 25.838 19.357 1.00 77.84 C ATOM 378 N ARG A 88 63.958 29.015 21.318 1.00 81.33 N ATOM 379 CA ARG A 88 65.211 29.552 20.803 1.00 91.79 C ATOM 380 C ARG A 88 66.080 30.174 21.893 1.00 87.84 C ATOM 381 O ARG A 88 67.293 29.969 21.919 1.00 94.11 O ATOM 382 CB ARG A 88 64.935 30.579 19.704 1.00 64.56 C ATOM 383 CG ARG A 88 66.191 31.205 19.133 1.00 98.47 C ATOM 384 CD ARG A 88 66.173 31.180 17.617 1.00123.28 C ATOM 385 NE ARG A 88 67.517 31.284 17.058 1.00151.72 N ATOM 386 CZ ARG A 88 67.863 30.823 15.861 1.00135.96 C ATOM 387 NH1 ARG A 88 66.961 30.222 15.098 1.00121.56 N ATOM 388 NH2 ARG A 88 69.110 30.957 15.428 1.00138.16 N ATOM 389 N THR A 89 65.461 30.935 22.788 1.00 97.62 N ATOM 390 CA THR A 89 66.200 31.558 23.879 1.00 90.55 C ATOM 391 C THR A 89 66.461 30.556 24.997 1.00 85.08 C ATOM 392 O THR A 89 67.599 30.367 25.426 1.00 92.48 O ATOM 393 CB THR A 89 65.448 32.773 24.460 1.00 72.50 C ATOM 394 N GLY A 90 65.396 29.907 25.454 1.00 84.09 N ATOM 395 CA GLY A 90 65.471 29.017 26.595 1.00 76.50 C ATOM 396 C GLY A 90 64.819 29.656 27.805 1.00 95.52 C ATOM 397 O GLY A 90 64.470 28.976 28.769 1.00 87.79 O ATOM 398 N LYS A 91 64.647 30.973 27.746 1.00 88.85 N ATOM 399 CA LYS A 91 64.083 31.721 28.863 1.00 85.64 C ATOM 400 C LYS A 91 62.557 31.707 28.851 1.00 89.08 C ATOM 401 O LYS A 91 61.933 31.462 27.817 1.00 85.09 O ATOM 402 CB LYS A 91 64.591 33.164 28.845 1.00 80.30 C ATOM 403 N THR A 92 61.964 31.975 30.010 1.00 82.90 N ATOM 404 CA THR A 92 60.513 31.988 30.149 1.00 82.31 C ATOM 405 C THR A 92 59.949 33.399 30.028 1.00 88.42 C ATOM 406 O THR A 92 60.345 34.305 30.762 1.00 80.04 O ATOM 407 CB THR A 92 60.073 31.388 31.498 1.00 89.89 C ATOM 408 OG1 THR A 92 60.512 30.026 31.583 1.00105.49 O ATOM 409 CG2 THR A 92 58.558 31.437 31.637 1.00 80.70 C ATOM 410 N ARG A 93 59.023 33.578 29.093 1.00 80.69 N ATOM 411 CA ARG A 93 58.342 34.854 28.922 1.00 82.64 C ATOM 412 C ARG A 93 56.836 34.638 28.892 1.00 82.05 C ATOM 413 O ARG A 93 56.313 33.986 27.993 1.00 80.05 O ATOM 414 CB ARG A 93 58.811 35.555 27.648 1.00 88.04 C ATOM 415 CG ARG A 93 60.236 36.076 27.720 1.00 89.81 C ATOM 416 CD ARG A 93 60.380 37.149 28.789 1.00 75.06 C ATOM 417 NE ARG A 93 61.726 37.714 28.805 1.00 89.35 N ATOM 418 CZ ARG A 93 62.621 37.488 29.762 1.00 98.33 C ATOM 419 NH1 ARG A 93 62.313 36.711 30.791 1.00103.63 N ATOM 420 NH2 ARG A 93 63.823 38.042 29.691 1.00103.89 N ATOM 421 N THR A 94 56.147 35.190 29.885 1.00 73.15 N ATOM 422 CA THR A 94 54.719 34.960 30.055 1.00 61.55 C ATOM 423 C THR A 94 53.899 35.468 28.874 1.00 70.75 C ATOM 424 O THR A 94 54.226 36.482 28.256 1.00 81.25 O ATOM 425 CB THR A 94 54.201 35.623 31.352 1.00 78.51 C ATOM 426 OG1 THR A 94 55.005 35.198 32.458 1.00 92.55 O ATOM 427 CG2 THR A 94 52.746 35.251 31.623 1.00 73.90 C ATOM 428 N ARG A 95 52.846 34.720 28.565 1.00 67.57 N ATOM 429 CA ARG A 95 51.818 35.104 27.609 1.00 70.34 C ATOM 430 C ARG A 95 51.399 36.570 27.730 1.00 75.09 C ATOM 431 O ARG A 95 51.119 37.230 26.728 1.00 77.09 O ATOM 432 CB ARG A 95 50.608 34.193 27.806 1.00 76.67 C ATOM 433 CG ARG A 95 49.380 34.570 27.031 1.00 61.30 C ATOM 434 CD ARG A 95 48.238 33.642 27.403 1.00 67.02 C ATOM 435 NE ARG A 95 47.509 34.105 28.579 1.00 53.58 N ATOM 436 CZ ARG A 95 46.434 34.885 28.527 1.00 59.14 C ATOM 437 NH1 ARG A 95 45.964 35.291 27.356 1.00 65.61 N ATOM 438 NH2 ARG A 95 45.829 35.258 29.646 1.00 71.45 N ATOM 439 N LYS A 96 51.367 37.074 28.960 1.00 78.00 N ATOM 440 CA LYS A 96 50.966 38.453 29.214 1.00 75.50 C ATOM 441 C LYS A 96 52.133 39.431 29.082 1.00 79.77 C ATOM 442 O LYS A 96 51.930 40.603 28.760 1.00 73.98 O ATOM 443 CB LYS A 96 50.332 38.575 30.602 1.00 55.50 C ATOM 444 CG LYS A 96 48.958 37.917 30.736 1.00 65.11 C ATOM 445 CD LYS A 96 47.814 38.873 30.382 1.00 58.72 C ATOM 446 CE LYS A 96 47.508 38.889 28.888 1.00 68.76 C ATOM 447 NZ LYS A 96 46.354 39.774 28.555 1.00 59.13 N ATOM 448 N GLN A 97 53.349 38.956 29.335 1.00 77.99 N ATOM 449 CA GLN A 97 54.536 39.778 29.118 1.00 71.86 C ATOM 450 C GLN A 97 54.652 40.128 27.642 1.00 75.92 C ATOM 451 O GLN A 97 55.009 41.250 27.282 1.00 84.77 O ATOM 452 CB GLN A 97 55.801 39.059 29.587 1.00 63.99 C ATOM 453 CG GLN A 97 55.933 38.954 31.093 1.00 72.31 C ATOM 454 CD GLN A 97 57.223 38.280 31.515 1.00 86.46 C ATOM 455 OE1 GLN A 97 57.707 37.367 30.847 1.00 87.22 O ATOM 456 NE2 GLN A 97 57.787 38.729 32.629 1.00 97.36 N ATOM 457 N VAL A 98 54.341 39.154 26.795 1.00 74.02 N ATOM 458 CA VAL A 98 54.359 39.352 25.354 1.00 61.67 C ATOM 459 C VAL A 98 53.315 40.380 24.940 1.00 65.35 C ATOM 460 O VAL A 98 53.614 41.314 24.198 1.00 78.45 O ATOM 461 CB VAL A 98 54.102 38.037 24.599 1.00 49.26 C ATOM 462 CG1 VAL A 98 53.881 38.310 23.118 1.00 64.54 C ATOM 463 CG2 VAL A 98 55.261 37.074 24.806 1.00 39.27 C ATOM 464 N SER A 99 52.094 40.205 25.437 1.00 66.44 N ATOM 465 CA SER A 99 50.990 41.103 25.115 1.00 62.74 C ATOM 466 C SER A 99 51.307 42.542 25.504 1.00 75.83 C ATOM 467 O SER A 99 50.906 43.484 24.820 1.00 60.40 O ATOM 468 CB SER A 99 49.710 40.646 25.816 1.00 54.43 C ATOM 469 OG SER A 99 49.827 40.784 27.220 1.00 61.22 O ATOM 470 N SER A 100 52.029 42.704 26.609 1.00 66.14 N ATOM 471 CA SER A 100 52.439 44.023 27.068 1.00 73.36 C ATOM 472 C SER A 100 53.433 44.648 26.099 1.00 73.04 C ATOM 473 O SER A 100 53.369 45.842 25.810 1.00 73.47 O ATOM 474 CB SER A 100 53.052 43.939 28.466 1.00 73.84 C ATOM 475 OG SER A 100 53.333 45.231 28.972 1.00 84.67 O ATOM 476 N HIS A 101 54.347 43.827 25.596 1.00 69.27 N ATOM 477 CA HIS A 101 55.364 44.301 24.670 1.00 62.39 C ATOM 478 C HIS A 101 54.760 44.669 23.321 1.00 60.91 C ATOM 479 O HIS A 101 55.097 45.703 22.749 1.00 84.40 O ATOM 480 CB HIS A 101 56.449 43.248 24.482 1.00 59.51 C ATOM 481 CG HIS A 101 57.745 43.809 23.990 1.00 73.24 C ATOM 482 ND1 HIS A 101 58.824 43.018 23.669 1.00 72.39 N ATOM 483 CD2 HIS A 101 58.132 45.088 23.774 1.00 81.28 C ATOM 484 CE1 HIS A 101 59.824 43.787 23.272 1.00 72.95 C ATOM 485 NE2 HIS A 101 59.431 45.044 23.325 1.00 92.66 N ATOM 486 N ILE A 102 53.873 43.812 22.818 1.00 63.75 N ATOM 487 CA ILE A 102 53.137 44.085 21.584 1.00 70.22 C ATOM 488 C ILE A 102 52.462 45.447 21.666 1.00 76.41 C ATOM 489 O ILE A 102 52.384 46.186 20.681 1.00 59.99 O ATOM 490 CB ILE A 102 52.062 43.007 21.310 1.00 65.18 C ATOM 491 CG1 ILE A 102 52.688 41.614 21.230 1.00 68.78 C ATOM 492 CG2 ILE A 102 51.304 43.311 20.025 1.00 45.57 C ATOM 493 CD1 ILE A 102 53.491 41.378 19.976 1.00 79.56 C ATOM 494 N GLN A 103 51.993 45.772 22.865 1.00 69.06 N ATOM 495 CA GLN A 103 51.271 47.007 23.113 1.00 59.40 C ATOM 496 C GLN A 103 52.176 48.231 23.037 1.00 69.54 C ATOM 497 O GLN A 103 51.844 49.207 22.368 1.00 69.41 O ATOM 498 CB GLN A 103 50.590 46.946 24.480 1.00 53.80 C ATOM 499 CG GLN A 103 49.372 47.838 24.601 1.00 57.07 C ATOM 500 CD GLN A 103 48.788 47.832 25.996 1.00 61.57 C ATOM 501 OE1 GLN A 103 49.495 47.606 26.978 1.00 58.04 O ATOM 502 NE2 GLN A 103 47.486 48.073 26.091 1.00 52.46 N ATOM 503 N VAL A 104 53.319 48.176 23.717 1.00 63.18 N ATOM 504 CA VAL A 104 54.203 49.336 23.789 1.00 67.51 C ATOM 505 C VAL A 104 54.816 49.658 22.428 1.00 70.89 C ATOM 506 O VAL A 104 55.066 50.822 22.122 1.00 83.87 O ATOM 507 CB VAL A 104 55.333 49.145 24.836 1.00 51.74 C ATOM 508 CG1 VAL A 104 54.748 48.734 26.175 1.00 53.46 C ATOM 509 CG2 VAL A 104 56.362 48.128 24.368 1.00 61.02 C ATOM 510 N LEU A 105 55.042 48.636 21.607 1.00 57.17 N ATOM 511 CA LEU A 105 55.569 48.858 20.267 1.00 59.66 C ATOM 512 C LEU A 105 54.511 49.562 19.430 1.00 67.10 C ATOM 513 O LEU A 105 54.823 50.426 18.610 1.00 83.36 O ATOM 514 CB LEU A 105 55.985 47.541 19.609 1.00 56.15 C ATOM 515 CG LEU A 105 56.985 46.658 20.360 1.00 61.21 C ATOM 516 CD1 LEU A 105 57.563 45.603 19.433 1.00 63.82 C ATOM 517 CD2 LEU A 105 58.094 47.485 20.991 1.00 68.81 C ATOM 518 N ALA A 106 53.255 49.189 19.653 1.00 64.86 N ATOM 519 CA ALA A 106 52.135 49.823 18.972 1.00 74.29 C ATOM 520 C ALA A 106 52.003 51.273 19.420 1.00 72.18 C ATOM 521 O ALA A 106 51.720 52.155 18.610 1.00 71.99 O ATOM 522 CB ALA A 106 50.846 49.060 19.237 1.00 40.49 C ATOM 523 N ARG A 107 52.213 51.509 20.713 1.00 71.60 N ATOM 524 CA ARG A 107 52.176 52.857 21.273 1.00 68.71 C ATOM 525 C ARG A 107 53.233 53.746 20.626 1.00 80.39 C ATOM 526 O ARG A 107 52.929 54.843 20.155 1.00 82.24 O ATOM 527 CB ARG A 107 52.395 52.826 22.790 1.00 65.15 C ATOM 528 CG ARG A 107 51.345 52.070 23.593 1.00 60.27 C ATOM 529 CD ARG A 107 49.950 52.642 23.406 1.00 61.04 C ATOM 530 NE ARG A 107 49.037 52.184 24.450 1.00 68.00 N ATOM 531 CZ ARG A 107 47.728 52.413 24.452 1.00 76.18 C ATOM 532 NH1 ARG A 107 47.171 53.092 23.458 1.00 69.13 N ATOM 533 NH2 ARG A 107 46.973 51.960 25.445 1.00 66.08 N ATOM 534 N ARG A 108 54.473 53.262 20.614 1.00 70.99 N ATOM 535 CA ARG A 108 55.600 54.007 20.062 1.00 68.23 C ATOM 536 C ARG A 108 55.357 54.452 18.626 1.00 81.44 C ATOM 537 O ARG A 108 55.449 55.637 18.312 1.00 97.51 O ATOM 538 CB ARG A 108 56.876 53.164 20.116 1.00 59.71 C ATOM 539 CG ARG A 108 57.417 52.903 21.509 1.00 67.38 C ATOM 540 CD ARG A 108 58.711 52.111 21.425 1.00 64.90 C ATOM 541 NE ARG A 108 59.080 51.498 22.696 1.00 67.76 N ATOM 542 CZ ARG A 108 59.862 50.429 22.803 1.00 75.09 C ATOM 543 NH1 ARG A 108 60.351 49.855 21.712 1.00 65.50 N ATOM 544 NH2 ARG A 108 60.153 49.932 23.997 1.00 75.79 N ATOM 545 N LYS A 109 55.050 53.491 17.760 1.00 80.17 N ATOM 546 CA LYS A 109 54.847 53.768 16.342 1.00 84.92 C ATOM 547 C LYS A 109 53.663 54.711 16.146 1.00 90.85 C ATOM 548 O LYS A 109 53.641 55.508 15.207 1.00 95.59 O ATOM 549 CB LYS A 109 54.647 52.462 15.563 1.00 75.04 C ATOM 550 CG LYS A 109 54.034 52.635 14.179 1.00 95.97 C ATOM 551 CD LYS A 109 54.436 51.511 13.230 1.00 98.21 C ATOM 552 CE LYS A 109 55.816 51.772 12.638 1.00109.77 C ATOM 553 NZ LYS A 109 56.245 50.713 11.684 1.00112.01 N ATOM 554 N ALA A 110 52.697 54.637 17.057 1.00 85.86 N ATOM 555 CA ALA A 110 51.544 55.527 17.025 1.00 80.12 C ATOM 556 C ALA A 110 51.937 56.951 17.406 1.00 92.71 C ATOM 557 O ALA A 110 51.258 57.911 17.037 1.00 91.96 O ATOM 558 CB ALA A 110 50.452 55.013 17.951 1.00 77.43 C ATOM 559 N ARG A 111 53.027 57.078 18.158 1.00 92.90 N ATOM 560 CA ARG A 111 53.537 58.385 18.553 1.00 87.36 C ATOM 561 C ARG A 111 54.436 58.979 17.478 1.00 93.30 C ATOM 562 O ARG A 111 54.223 60.108 17.038 1.00 93.73 O ATOM 563 CB ARG A 111 54.307 58.293 19.869 1.00 77.88 C ATOM 564 CG ARG A 111 53.440 58.068 21.089 1.00 88.42 C ATOM 565 CD ARG A 111 54.227 58.337 22.360 1.00 75.43 C ATOM 566 NE ARG A 111 55.404 57.482 22.473 1.00 81.38 N ATOM 567 CZ ARG A 111 55.619 56.644 23.481 1.00 90.57 C ATOM 568 NH1 ARG A 111 54.736 56.551 24.466 1.00103.64 N ATOM 569 NH2 ARG A 111 56.716 55.900 23.508 1.00 92.02 N ATOM 570 N GLU A 112 55.440 58.207 17.066 1.00 93.44 N ATOM 571 CA GLU A 112 56.418 58.642 16.073 1.00 84.52 C ATOM 572 C GLU A 112 55.765 59.205 14.809 1.00104.08 C ATOM 573 O GLU A 112 56.313 60.105 14.170 1.00112.77 O ATOM 574 CB GLU A 112 57.344 57.481 15.698 1.00 82.86 C ATOM 575 CG GLU A 112 58.328 57.084 16.792 1.00 86.07 C ATOM 576 N ILE A 113 54.594 58.681 14.457 1.00 99.60 N ATOM 577 CA ILE A 113 53.893 59.125 13.257 1.00 97.62 C ATOM 578 C ILE A 113 53.154 60.448 13.458 1.00101.77 C ATOM 579 O ILE A 113 53.037 61.246 12.531 1.00110.38 O ATOM 580 CB ILE A 113 52.900 58.028 12.750 1.00 98.37 C ATOM 581 CG1 ILE A 113 51.811 57.720 13.784 1.00102.31 C ATOM 582 CG2 ILE A 113 53.648 56.770 12.327 1.00 83.28 C ATOM 583 CD1 ILE A 113 50.498 58.462 13.574 1.00112.14 C ATOM 584 N GLN A 114 52.679 60.683 14.677 1.00 95.27 N ATOM 585 CA GLN A 114 51.863 61.858 14.976 1.00 97.48 C ATOM 586 C GLN A 114 52.741 62.995 15.475 1.00101.54 C ATOM 587 O GLN A 114 52.438 64.173 15.261 1.00103.11 O ATOM 588 CB GLN A 114 50.790 61.516 16.010 1.00 97.96 C ATOM 589 CG GLN A 114 50.071 62.718 16.620 1.00108.21 C ATOM 590 CD GLN A 114 50.273 62.872 18.124 1.00119.58 C ATOM 591 OE1 GLN A 114 50.900 62.039 18.780 1.00110.95 O ATOM 592 NE2 GLN A 114 49.753 63.965 18.671 1.00109.54 N ATOM 593 N ALA A 115 53.836 62.633 16.138 1.00108.92 N ATOM 594 CA ALA A 115 54.850 63.601 16.522 1.00 94.79 C ATOM 595 C ALA A 115 55.451 64.237 15.273 1.00100.65 C ATOM 596 O ALA A 115 55.997 65.338 15.330 1.00102.86 O ATOM 597 CB ALA A 115 55.929 62.938 17.365 1.00 83.52 C ATOM 598 N LYS A 116 55.364 63.519 14.156 1.00104.32 N ATOM 599 CA LYS A 116 55.729 64.063 12.859 1.00100.73 C ATOM 600 C LYS A 116 54.570 64.876 12.283 1.00108.88 C ATOM 601 O LYS A 116 54.782 65.862 11.577 1.00102.55 O ATOM 602 CB LYS A 116 56.126 62.942 11.899 1.00 71.82 C ATOM 603 N LEU A 117 53.345 64.460 12.591 1.00105.33 N ATOM 604 CA LEU A 117 52.158 65.169 12.121 1.00104.83 C ATOM 605 C LEU A 117 51.855 66.380 12.998 1.00110.36 C ATOM 606 O LEU A 117 50.901 67.118 12.746 1.00111.09 O ATOM 607 CB LEU A 117 50.948 64.232 12.084 1.00 92.03 C ATOM 608 N LYS A 118 52.671 66.579 14.029 1.00101.87 N ATOM 609 CA LYS A 118 52.502 67.707 14.936 1.00101.98 C ATOM 610 C LYS A 118 53.700 68.648 14.869 1.00110.36 C ATOM 611 O LYS A 118 53.575 69.846 15.123 1.00102.49 O ATOM 612 CB LYS A 118 52.298 67.218 16.371 1.00 87.38 C ATOM 613 N ASP A 119 54.861 68.099 14.522 1.00115.98 N ATOM 614 CA ASP A 119 56.079 68.895 14.407 1.00106.36 C ATOM 615 C ASP A 119 55.995 69.861 13.232 1.00115.71 C ATOM 616 O ASP A 119 56.696 70.871 13.200 1.00122.36 O ATOM 617 CB ASP A 119 57.304 67.990 14.252 1.00 89.78 C ATOM 618 N GLN A 120 55.134 69.546 12.270 1.00107.57 N ATOM 619 CA GLN A 120 54.959 70.391 11.095 1.00116.03 C ATOM 620 C GLN A 120 53.649 71.170 11.173 1.00113.76 C ATOM 621 O GLN A 120 53.514 72.240 10.578 1.00110.62 O ATOM 622 CB GLN A 120 55.005 69.547 9.819 1.00107.20 C ATOM 623 CG GLN A 120 54.910 70.353 8.534 1.00120.33 C ATOM 624 CD GLN A 120 56.040 70.049 7.572 1.00130.62 C ATOM 625 OE1 GLN A 120 56.750 69.054 7.724 1.00135.69 O ATOM 626 NE2 GLN A 120 56.215 70.908 6.574 1.00126.54 N ATOM 627 N ALA A 121 52.690 70.633 11.920 1.00104.15 N ATOM 628 CA ALA A 121 51.401 71.292 12.100 1.00106.52 C ATOM 629 C ALA A 121 51.556 72.596 12.876 1.00117.25 C ATOM 630 O ALA A 121 50.725 73.497 12.767 1.00114.73 O ATOM 631 CB ALA A 121 50.424 70.366 12.807 1.00106.85 C ATOM 632 N ALA A 122 52.625 72.690 13.661 1.00113.37 N ATOM 633 CA ALA A 122 52.925 73.909 14.403 1.00103.07 C ATOM 634 C ALA A 122 53.677 74.900 13.521 1.00103.70 C ATOM 635 O ALA A 122 53.539 76.114 13.676 1.00 98.57 O ATOM 636 CB ALA A 122 53.730 73.587 15.653 1.00 82.30 C ATOM 637 N LYS A 123 54.472 74.374 12.594 1.00105.65 N ATOM 638 CA LYS A 123 55.206 75.207 11.649 1.00 91.96 C ATOM 639 C LYS A 123 54.268 75.748 10.575 1.00108.21 C ATOM 640 O LYS A 123 54.469 76.844 10.053 1.00113.43 O ATOM 641 CB LYS A 123 56.349 74.416 11.008 1.00 84.45 C ATOM 642 CG LYS A 123 57.320 73.819 12.014 1.00 96.80 C ATOM 643 CD LYS A 123 58.503 73.154 11.329 1.00 93.84 C ATOM 644 CE LYS A 123 59.385 72.432 12.337 1.00 88.00 C ATOM 645 NZ LYS A 123 59.434 73.147 13.644 1.00 90.08 N ATOM 646 N ASP A 124 53.240 74.970 10.253 1.00116.91 N ATOM 647 CA ASP A 124 52.240 75.389 9.281 1.00109.38 C ATOM 648 C ASP A 124 51.301 76.424 9.892 1.00104.51 C ATOM 649 O ASP A 124 50.872 77.361 9.220 1.00 95.12 O ATOM 650 CB ASP A 124 51.444 74.185 8.774 1.00104.15 C ATOM 651 N LYS A 125 50.990 76.246 11.173 1.00113.36 N ATOM 652 CA LYS A 125 50.082 77.141 11.882 1.00108.35 C ATOM 653 C LYS A 125 50.692 78.527 12.059 1.00111.15 C ATOM 654 O LYS A 125 50.009 79.540 11.904 1.00115.90 O ATOM 655 CB LYS A 125 49.709 76.554 13.246 1.00105.57 C ATOM 656 CG LYS A 125 48.762 77.415 14.069 1.00 94.60 C ATOM 657 CD LYS A 125 48.448 76.760 15.406 1.00 95.29 C ATOM 658 CE LYS A 125 47.292 77.452 16.112 1.00111.04 C ATOM 659 NZ LYS A 125 47.717 78.694 16.813 1.00107.39 N ATOM 660 N ALA A 126 51.982 78.561 12.380 1.00110.49 N ATOM 661 CA ALA A 126 52.696 79.814 12.596 1.00103.74 C ATOM 662 C ALA A 126 52.716 80.671 11.335 1.00102.88 C ATOM 663 O ALA A 126 52.299 81.829 11.357 1.00113.18 O ATOM 664 CB ALA A 126 54.114 79.538 13.068 1.00 94.60 C ATOM 665 N LEU A 127 53.204 80.091 10.242 1.00101.20 N ATOM 666 CA LEU A 127 53.290 80.787 8.961 1.00 96.75 C ATOM 667 C LEU A 127 51.936 81.320 8.502 1.00107.70 C ATOM 668 O LEU A 127 51.862 82.356 7.844 1.00118.36 O ATOM 669 CB LEU A 127 53.871 79.859 7.889 1.00 80.62 C ATOM 670 CG LEU A 127 55.283 80.175 7.389 1.00 97.54 C ATOM 671 CD1 LEU A 127 56.321 79.928 8.472 1.00 96.34 C ATOM 672 CD2 LEU A 127 55.604 79.367 6.139 1.00 94.92 C ATOM 673 N GLN A 128 50.870 80.610 8.860 1.00103.86 N ATOM 674 CA GLN A 128 49.516 81.003 8.482 1.00100.34 C ATOM 675 C GLN A 128 48.959 82.076 9.412 1.00102.01 C ATOM 676 O GLN A 128 48.341 83.041 8.961 1.00115.67 O ATOM 677 CB GLN A 128 48.590 79.785 8.478 1.00100.95 C ATOM 678 N SER A 129 49.179 81.899 10.711 1.00 94.66 N ATOM 679 CA SER A 129 48.724 82.858 11.712 1.00102.68 C ATOM 680 C SER A 129 49.427 84.197 11.544 1.00116.33 C ATOM 681 O SER A 129 48.898 85.246 11.913 1.00113.17 O ATOM 682 CB SER A 129 48.964 82.313 13.122 1.00106.79 C ATOM 683 OG SER A 129 48.844 83.335 14.096 1.00106.69 O HETATM 684 N MSE A 130 50.627 84.147 10.978 1.00133.75 N HETATM 685 CA MSE A 130 51.443 85.335 10.786 1.00113.59 C HETATM 686 C MSE A 130 51.149 85.987 9.436 1.00118.76 C HETATM 687 O MSE A 130 51.207 87.210 9.303 1.00130.06 O HETATM 688 CB MSE A 130 52.924 84.969 10.914 1.00112.93 C HETATM 689 CG MSE A 130 53.894 85.911 10.233 1.00109.91 C HETATM 690 SE MSE A 130 55.728 85.282 10.426 1.00145.58 SE HETATM 691 CE MSE A 130 55.576 84.479 12.193 1.00108.76 C ATOM 692 N ALA A 131 50.810 85.169 8.443 1.00132.92 N ATOM 693 CA ALA A 131 50.462 85.678 7.118 1.00115.63 C ATOM 694 C ALA A 131 49.170 86.490 7.160 1.00119.48 C ATOM 695 O ALA A 131 48.870 87.244 6.234 1.00116.60 O ATOM 696 CB ALA A 131 50.336 84.536 6.123 1.00119.61 C ATOM 697 N ALA A 132 48.407 86.325 8.236 1.00124.65 N ATOM 698 CA ALA A 132 47.178 87.083 8.433 1.00118.07 C ATOM 699 C ALA A 132 47.484 88.514 8.861 1.00122.97 C ATOM 700 O ALA A 132 46.661 89.172 9.498 1.00122.99 O ATOM 701 CB ALA A 132 46.293 86.399 9.462 1.00104.04 C TER 702 ALA A 132 ATOM 703 C5' DT B 1 55.981 63.544 29.259 1.00 82.48 C ATOM 704 C4' DT B 1 56.804 62.400 28.694 1.00107.82 C ATOM 705 O4' DT B 1 57.315 61.594 29.783 1.00107.05 O ATOM 706 C3' DT B 1 56.035 61.423 27.825 1.00109.01 C ATOM 707 O3' DT B 1 56.942 60.728 26.975 1.00104.63 O ATOM 708 C2' DT B 1 55.426 60.497 28.870 1.00 82.49 C ATOM 709 C1' DT B 1 56.557 60.400 29.892 1.00 84.76 C ATOM 710 N1 DT B 1 56.078 60.288 31.289 1.00 85.30 N ATOM 711 C2 DT B 1 56.801 59.544 32.186 1.00 83.09 C ATOM 712 O2 DT B 1 57.829 58.962 31.892 1.00 89.06 O ATOM 713 N3 DT B 1 56.276 59.506 33.449 1.00 78.22 N ATOM 714 C4 DT B 1 55.123 60.125 33.895 1.00 88.11 C ATOM 715 O4 DT B 1 54.732 60.029 35.054 1.00 84.62 O ATOM 716 C5 DT B 1 54.411 60.891 32.900 1.00 84.34 C ATOM 717 C7 DT B 1 53.145 61.608 33.263 1.00 83.47 C ATOM 718 C6 DT B 1 54.918 60.935 31.659 1.00 87.04 C ATOM 719 P DT B 2 56.461 59.448 26.132 1.00 94.32 P ATOM 720 OP1 DT B 2 57.337 59.354 24.944 1.00 91.76 O ATOM 721 OP2 DT B 2 54.994 59.525 25.951 1.00 89.50 O ATOM 722 O5' DT B 2 56.791 58.210 27.089 1.00105.35 O ATOM 723 C5' DT B 2 58.141 57.786 27.263 1.00 96.36 C ATOM 724 C4' DT B 2 58.206 56.383 27.847 1.00 88.66 C ATOM 725 O4' DT B 2 57.716 56.399 29.215 1.00 87.35 O ATOM 726 C3' DT B 2 57.366 55.331 27.122 1.00 83.55 C ATOM 727 O3' DT B 2 58.006 54.065 27.213 1.00 89.25 O ATOM 728 C2' DT B 2 56.079 55.340 27.934 1.00 80.88 C ATOM 729 C1' DT B 2 56.647 55.486 29.335 1.00 77.96 C ATOM 730 N1 DT B 2 55.677 56.013 30.331 1.00 75.81 N ATOM 731 C2 DT B 2 55.851 55.702 31.656 1.00 72.77 C ATOM 732 O2 DT B 2 56.771 55.015 32.061 1.00 69.31 O ATOM 733 N3 DT B 2 54.908 56.227 32.498 1.00 59.07 N ATOM 734 C4 DT B 2 53.827 57.016 32.150 1.00 76.31 C ATOM 735 O4 DT B 2 53.030 57.442 32.981 1.00 80.60 O ATOM 736 C5 DT B 2 53.700 57.303 30.740 1.00 70.47 C ATOM 737 C7 DT B 2 52.567 58.148 30.241 1.00 76.32 C ATOM 738 C6 DT B 2 54.620 56.792 29.907 1.00 60.34 C ATOM 739 P DG B 3 58.757 53.429 25.944 1.00 91.45 P ATOM 740 OP1 DG B 3 59.876 54.334 25.595 1.00 99.99 O ATOM 741 OP2 DG B 3 57.737 53.099 24.922 1.00 70.47 O ATOM 742 O5' DG B 3 59.384 52.071 26.519 1.00 80.56 O ATOM 743 C5' DG B 3 60.507 52.122 27.401 1.00 83.52 C ATOM 744 C4' DG B 3 60.293 51.239 28.622 1.00 85.61 C ATOM 745 O4' DG B 3 59.223 51.784 29.439 1.00 83.67 O ATOM 746 C3' DG B 3 59.910 49.789 28.322 1.00 72.15 C ATOM 747 O3' DG B 3 60.629 48.906 29.184 1.00 85.14 O ATOM 748 C2' DG B 3 58.406 49.757 28.599 1.00 64.08 C ATOM 749 C1' DG B 3 58.274 50.779 29.718 1.00 68.93 C ATOM 750 N9 DG B 3 56.954 51.406 29.792 1.00 68.60 N ATOM 751 C8 DG B 3 56.177 51.831 28.741 1.00 70.25 C ATOM 752 N7 DG B 3 55.043 52.360 29.112 1.00 62.02 N ATOM 753 C5 DG B 3 55.072 52.287 30.499 1.00 59.43 C ATOM 754 C6 DG B 3 54.114 52.705 31.455 1.00 75.19 C ATOM 755 O6 DG B 3 53.016 53.244 31.257 1.00 74.01 O ATOM 756 N1 DG B 3 54.537 52.444 32.756 1.00 73.02 N ATOM 757 C2 DG B 3 55.733 51.852 33.091 1.00 71.58 C ATOM 758 N2 DG B 3 55.966 51.682 34.400 1.00 74.47 N ATOM 759 N3 DG B 3 56.638 51.455 32.205 1.00 66.77 N ATOM 760 C4 DG B 3 56.241 51.702 30.934 1.00 63.62 C ATOM 761 P DC B 4 60.745 47.343 28.824 1.00 84.13 P ATOM 762 OP1 DC B 4 61.805 46.736 29.660 1.00 67.34 O ATOM 763 OP2 DC B 4 60.836 47.238 27.351 1.00 76.41 O ATOM 764 O5' DC B 4 59.347 46.746 29.317 1.00 92.08 O ATOM 765 C5' DC B 4 59.325 45.718 30.287 1.00 79.01 C ATOM 766 C4' DC B 4 58.475 46.104 31.487 1.00 80.75 C ATOM 767 O4' DC B 4 57.802 47.356 31.259 1.00 88.24 O ATOM 768 C3' DC B 4 57.337 45.157 31.791 1.00 99.49 C ATOM 769 O3' DC B 4 57.812 44.032 32.505 1.00106.64 O ATOM 770 C2' DC B 4 56.417 46.025 32.656 1.00 97.69 C ATOM 771 C1' DC B 4 56.756 47.454 32.210 1.00 77.15 C ATOM 772 N1 DC B 4 55.593 48.179 31.614 1.00 71.76 N ATOM 773 C2 DC B 4 54.609 48.710 32.459 1.00 72.98 C ATOM 774 O2 DC B 4 54.726 48.573 33.683 1.00 77.71 O ATOM 775 N3 DC B 4 53.555 49.363 31.911 1.00 68.65 N ATOM 776 C4 DC B 4 53.463 49.488 30.588 1.00 72.31 C ATOM 777 N4 DC B 4 52.407 50.142 30.094 1.00 68.89 N ATOM 778 C5 DC B 4 54.453 48.953 29.711 1.00 65.09 C ATOM 779 C6 DC B 4 55.490 48.310 30.261 1.00 75.17 C ATOM 780 P DA B 5 56.976 42.662 32.483 1.00 92.92 P ATOM 781 OP1 DA B 5 57.845 41.606 33.046 1.00 95.55 O ATOM 782 OP2 DA B 5 56.403 42.513 31.125 1.00 73.23 O ATOM 783 O5' DA B 5 55.770 42.932 33.498 1.00 79.42 O ATOM 784 C5' DA B 5 56.048 43.320 34.837 1.00 78.86 C ATOM 785 C4' DA B 5 54.811 43.896 35.498 1.00 77.87 C ATOM 786 O4' DA B 5 54.276 44.961 34.678 1.00 84.78 O ATOM 787 C3' DA B 5 53.678 42.895 35.711 1.00 82.92 C ATOM 788 O3' DA B 5 53.345 42.836 37.086 1.00 95.71 O ATOM 789 C2' DA B 5 52.516 43.429 34.860 1.00 83.54 C ATOM 790 C1' DA B 5 52.873 44.896 34.664 1.00 75.80 C ATOM 791 N9 DA B 5 52.414 45.442 33.387 1.00 74.02 N ATOM 792 C8 DA B 5 52.978 45.238 32.158 1.00 77.31 C ATOM 793 N7 DA B 5 52.359 45.856 31.180 1.00 77.12 N ATOM 794 C5 DA B 5 51.317 46.516 31.810 1.00 68.13 C ATOM 795 C6 DA B 5 50.292 47.351 31.324 1.00 67.16 C ATOM 796 N6 DA B 5 50.153 47.669 30.032 1.00 61.65 N ATOM 797 N1 DA B 5 49.412 47.846 32.218 1.00 78.70 N ATOM 798 C2 DA B 5 49.555 47.524 33.510 1.00 77.59 C ATOM 799 N3 DA B 5 50.476 46.751 34.085 1.00 70.65 N ATOM 800 C4 DA B 5 51.335 46.273 33.172 1.00 74.52 C ATOM 801 P DT B 6 52.528 41.580 37.662 1.00101.23 P ATOM 802 OP1 DT B 6 52.942 41.370 39.067 1.00 95.84 O ATOM 803 OP2 DT B 6 52.648 40.478 36.683 1.00100.92 O ATOM 804 O5' DT B 6 51.019 42.090 37.646 1.00 79.76 O ATOM 805 C5' DT B 6 50.724 43.398 38.098 1.00 73.54 C ATOM 806 C4' DT B 6 49.352 43.825 37.630 1.00 80.92 C ATOM 807 O4' DT B 6 49.427 44.300 36.279 1.00 90.36 O ATOM 808 C3' DT B 6 48.317 42.710 37.602 1.00 85.24 C ATOM 809 O3' DT B 6 47.571 42.732 38.831 1.00 92.76 O ATOM 810 C2' DT B 6 47.452 43.026 36.360 1.00 86.54 C ATOM 811 C1' DT B 6 48.141 44.240 35.726 1.00 82.12 C ATOM 812 N1 DT B 6 48.271 44.161 34.239 1.00 77.73 N ATOM 813 C2 DT B 6 47.404 44.877 33.447 1.00 74.68 C ATOM 814 O2 DT B 6 46.512 45.575 33.895 1.00 80.57 O ATOM 815 N3 DT B 6 47.616 44.745 32.099 1.00 72.43 N ATOM 816 C4 DT B 6 48.592 43.985 31.478 1.00 75.35 C ATOM 817 O4 DT B 6 48.702 43.930 30.256 1.00 66.40 O ATOM 818 C5 DT B 6 49.471 43.263 32.366 1.00 65.57 C ATOM 819 C7 DT B 6 50.568 42.405 31.810 1.00 66.68 C ATOM 820 C6 DT B 6 49.271 43.386 33.688 1.00 76.51 C ATOM 821 P DT B 7 46.026 42.292 38.902 1.00101.10 P ATOM 822 OP1 DT B 7 45.678 42.212 40.338 1.00 95.61 O ATOM 823 OP2 DT B 7 45.793 41.114 38.037 1.00116.32 O ATOM 824 O5' DT B 7 45.246 43.547 38.300 1.00 74.24 O ATOM 825 C5' DT B 7 43.875 43.703 38.558 1.00 81.43 C ATOM 826 C4' DT B 7 43.215 44.529 37.475 1.00 81.94 C ATOM 827 O4' DT B 7 43.985 44.438 36.248 1.00 86.34 O ATOM 828 C3' DT B 7 41.796 44.080 37.123 1.00 87.85 C ATOM 829 O3' DT B 7 40.882 45.146 37.291 1.00 87.33 O ATOM 830 C2' DT B 7 41.890 43.639 35.661 1.00 85.74 C ATOM 831 C1' DT B 7 43.092 44.420 35.166 1.00 85.75 C ATOM 832 N1 DT B 7 43.761 43.793 33.983 1.00 88.62 N ATOM 833 C2 DT B 7 43.394 44.190 32.717 1.00 81.70 C ATOM 834 O2 DT B 7 42.549 45.041 32.504 1.00 80.12 O ATOM 835 N3 DT B 7 44.057 43.555 31.702 1.00 81.36 N ATOM 836 C4 DT B 7 45.029 42.579 31.820 1.00 76.33 C ATOM 837 O4 DT B 7 45.567 42.067 30.843 1.00 79.38 O ATOM 838 C5 DT B 7 45.366 42.204 33.173 1.00 66.89 C ATOM 839 C7 DT B 7 46.407 41.155 33.426 1.00 68.81 C ATOM 840 C6 DT B 7 44.721 42.820 34.178 1.00 82.60 C ATOM 841 P DC B 8 39.305 44.846 37.257 1.00112.69 P ATOM 842 OP1 DC B 8 38.624 45.894 38.048 1.00107.71 O ATOM 843 OP2 DC B 8 39.123 43.418 37.602 1.00 91.68 O ATOM 844 O5' DC B 8 38.913 45.033 35.719 1.00 87.41 O ATOM 845 C5' DC B 8 38.950 46.325 35.134 1.00 81.33 C ATOM 846 C4' DC B 8 38.460 46.282 33.700 1.00 86.80 C ATOM 847 O4' DC B 8 39.439 45.606 32.874 1.00 92.88 O ATOM 848 C3' DC B 8 37.135 45.550 33.495 1.00 78.16 C ATOM 849 O3' DC B 8 36.270 46.336 32.691 1.00 72.65 O ATOM 850 C2' DC B 8 37.534 44.246 32.798 1.00 79.46 C ATOM 851 C1' DC B 8 38.807 44.641 32.067 1.00 84.04 C ATOM 852 N1 DC B 8 39.757 43.511 31.884 1.00 76.51 N ATOM 853 C2 DC B 8 40.287 43.241 30.618 1.00 75.53 C ATOM 854 O2 DC B 8 39.947 43.944 29.659 1.00 82.99 O ATOM 855 N3 DC B 8 41.156 42.209 30.478 1.00 82.09 N ATOM 856 C4 DC B 8 41.497 41.475 31.538 1.00 81.94 C ATOM 857 N4 DC B 8 42.357 40.469 31.354 1.00 87.09 N ATOM 858 C5 DC B 8 40.970 41.739 32.835 1.00 74.61 C ATOM 859 C6 DC B 8 40.113 42.755 32.959 1.00 81.56 C ATOM 860 P DC B 9 34.754 45.870 32.438 1.00104.91 P ATOM 861 OP1 DC B 9 33.906 47.082 32.441 1.00101.17 O ATOM 862 OP2 DC B 9 34.457 44.762 33.375 1.00 92.85 O ATOM 863 O5' DC B 9 34.789 45.279 30.955 1.00 88.19 O ATOM 864 C5' DC B 9 35.323 46.069 29.901 1.00 76.73 C ATOM 865 C4' DC B 9 35.568 45.227 28.664 1.00 71.19 C ATOM 866 O4' DC B 9 36.659 44.321 28.901 1.00 81.26 O ATOM 867 C3' DC B 9 34.388 44.354 28.235 1.00 68.85 C ATOM 868 O3' DC B 9 33.819 44.873 27.045 1.00 66.93 O ATOM 869 C2' DC B 9 34.995 42.952 28.018 1.00 68.89 C ATOM 870 C1' DC B 9 36.496 43.216 28.058 1.00 79.94 C ATOM 871 N1 DC B 9 37.298 42.088 28.609 1.00 81.27 N ATOM 872 C2 DC B 9 38.087 41.315 27.750 1.00 81.31 C ATOM 873 O2 DC B 9 38.095 41.575 26.540 1.00 81.16 O ATOM 874 N3 DC B 9 38.819 40.298 28.269 1.00 72.96 N ATOM 875 C4 DC B 9 38.782 40.052 29.580 1.00 78.49 C ATOM 876 N4 DC B 9 39.520 39.042 30.047 1.00 69.90 N ATOM 877 C5 DC B 9 37.987 40.831 30.471 1.00 78.32 C ATOM 878 C6 DC B 9 37.271 41.831 29.947 1.00 77.78 C ATOM 879 P DT B 10 32.372 44.374 26.561 1.00 95.40 P ATOM 880 OP1 DT B 10 31.767 45.457 25.752 1.00 86.20 O ATOM 881 OP2 DT B 10 31.658 43.852 27.747 1.00 94.59 O ATOM 882 O5' DT B 10 32.705 43.136 25.610 1.00 90.19 O ATOM 883 C5' DT B 10 33.679 43.283 24.592 1.00 76.60 C ATOM 884 C4' DT B 10 34.103 41.934 24.047 1.00 66.01 C ATOM 885 O4' DT B 10 35.000 41.279 24.978 1.00 86.68 O ATOM 886 C3' DT B 10 32.963 40.938 23.793 1.00 71.15 C ATOM 887 O3' DT B 10 33.114 40.381 22.501 1.00 73.94 O ATOM 888 C2' DT B 10 33.176 39.878 24.877 1.00 66.60 C ATOM 889 C1' DT B 10 34.685 39.914 24.981 1.00 79.92 C ATOM 890 N1 DT B 10 35.243 39.290 26.203 1.00 73.69 N ATOM 891 C2 DT B 10 36.416 38.588 26.100 1.00 68.96 C ATOM 892 O2 DT B 10 37.019 38.452 25.050 1.00 74.42 O ATOM 893 N3 DT B 10 36.865 38.047 27.272 1.00 65.96 N ATOM 894 C4 DT B 10 36.269 38.138 28.514 1.00 75.49 C ATOM 895 O4 DT B 10 36.753 37.615 29.512 1.00 78.92 O ATOM 896 C5 DT B 10 35.036 38.891 28.555 1.00 70.39 C ATOM 897 C7 DT B 10 34.298 39.057 29.849 1.00 60.33 C ATOM 898 C6 DT B 10 34.586 39.426 27.409 1.00 63.39 C ATOM 899 P DC B 11 31.838 39.820 21.708 1.00103.21 P ATOM 900 OP1 DC B 11 31.722 40.626 20.470 1.00 82.28 O ATOM 901 OP2 DC B 11 30.705 39.750 22.657 1.00 97.20 O ATOM 902 O5' DC B 11 32.254 38.321 21.328 1.00 89.84 O ATOM 903 C5' DC B 11 33.007 38.079 20.153 1.00 79.17 C ATOM 904 C4' DC B 11 34.140 37.099 20.413 1.00 73.05 C ATOM 905 O4' DC B 11 34.684 37.303 21.729 1.00 77.95 O ATOM 906 C3' DC B 11 33.749 35.638 20.419 1.00 69.99 C ATOM 907 O3' DC B 11 33.691 35.148 19.089 1.00 68.43 O ATOM 908 C2' DC B 11 34.902 34.997 21.201 1.00 74.14 C ATOM 909 C1' DC B 11 35.426 36.149 22.072 1.00 59.02 C ATOM 910 N1 DC B 11 35.291 35.891 23.532 1.00 63.23 N ATOM 911 C2 DC B 11 36.236 35.085 24.177 1.00 76.85 C ATOM 912 O2 DC B 11 37.170 34.608 23.520 1.00 71.73 O ATOM 913 N3 DC B 11 36.104 34.852 25.505 1.00 73.18 N ATOM 914 C4 DC B 11 35.083 35.385 26.177 1.00 72.38 C ATOM 915 N4 DC B 11 34.994 35.127 27.486 1.00 69.99 N ATOM 916 C5 DC B 11 34.108 36.206 25.537 1.00 69.88 C ATOM 917 C6 DC B 11 34.249 36.430 24.226 1.00 69.73 C ATOM 918 P DT B 12 32.978 33.743 18.778 1.00 83.04 P ATOM 919 OP1 DT B 12 32.840 33.626 17.309 1.00 81.78 O ATOM 920 OP2 DT B 12 31.780 33.648 19.642 1.00 75.74 O ATOM 921 O5' DT B 12 34.033 32.652 19.284 1.00 71.26 O ATOM 922 C5' DT B 12 35.318 32.568 18.677 1.00 58.31 C ATOM 923 C4' DT B 12 36.086 31.372 19.207 1.00 69.61 C ATOM 924 O4' DT B 12 36.313 31.530 20.632 1.00 64.62 O ATOM 925 C3' DT B 12 35.381 30.031 19.033 1.00 67.83 C ATOM 926 O3' DT B 12 36.323 29.032 18.689 1.00 68.77 O ATOM 927 C2' DT B 12 34.765 29.776 20.406 1.00 62.65 C ATOM 928 C1' DT B 12 35.783 30.425 21.334 1.00 70.06 C ATOM 929 N1 DT B 12 35.191 30.924 22.607 1.00 65.88 N ATOM 930 C2 DT B 12 35.719 30.506 23.806 1.00 73.72 C ATOM 931 O2 DT B 12 36.661 29.739 23.890 1.00 77.71 O ATOM 932 N3 DT B 12 35.102 31.025 24.914 1.00 58.10 N ATOM 933 C4 DT B 12 34.032 31.900 24.942 1.00 55.11 C ATOM 934 O4 DT B 12 33.546 32.310 25.992 1.00 54.76 O ATOM 935 C5 DT B 12 33.525 32.296 23.649 1.00 60.07 C ATOM 936 C7 DT B 12 32.365 33.242 23.551 1.00 66.91 C ATOM 937 C6 DT B 12 34.122 31.795 22.558 1.00 59.62 C ATOM 938 P DC B 13 35.824 27.665 18.014 1.00 69.77 P ATOM 939 OP1 DC B 13 36.860 27.217 17.057 1.00 71.72 O ATOM 940 OP2 DC B 13 34.438 27.900 17.552 1.00 74.56 O ATOM 941 O5' DC B 13 35.780 26.637 19.234 1.00 77.35 O ATOM 942 C5' DC B 13 36.916 26.495 20.074 1.00 64.11 C ATOM 943 C4' DC B 13 36.531 25.859 21.395 1.00 71.38 C ATOM 944 O4' DC B 13 36.106 26.872 22.317 1.00 78.43 O ATOM 945 C3' DC B 13 35.351 24.906 21.327 1.00 61.67 C ATOM 946 O3' DC B 13 35.803 23.595 21.014 1.00 70.00 O ATOM 947 C2' DC B 13 34.761 24.972 22.746 1.00 71.54 C ATOM 948 C1' DC B 13 35.388 26.239 23.348 1.00 56.36 C ATOM 949 N1 DC B 13 34.387 27.189 23.898 1.00 58.62 N ATOM 950 C2 DC B 13 34.368 27.448 25.271 1.00 62.38 C ATOM 951 O2 DC B 13 35.196 26.888 26.000 1.00 58.28 O ATOM 952 N3 DC B 13 33.445 28.310 25.763 1.00 57.83 N ATOM 953 C4 DC B 13 32.570 28.891 24.941 1.00 62.97 C ATOM 954 N4 DC B 13 31.679 29.734 25.473 1.00 60.33 N ATOM 955 C5 DC B 13 32.571 28.636 23.538 1.00 55.01 C ATOM 956 C6 DC B 13 33.486 27.784 23.065 1.00 59.46 C TER 957 DC B 13 ATOM 958 C5' DG C 1 31.864 28.359 36.449 1.00 66.26 C ATOM 959 C4' DG C 1 33.061 27.620 35.878 1.00 70.31 C ATOM 960 O4' DG C 1 32.891 27.459 34.445 1.00 78.40 O ATOM 961 C3' DG C 1 34.396 28.330 36.041 1.00 73.03 C ATOM 962 O3' DG C 1 35.441 27.368 36.053 1.00 79.52 O ATOM 963 C2' DG C 1 34.448 29.184 34.783 1.00 68.60 C ATOM 964 C1' DG C 1 33.871 28.218 33.759 1.00 65.84 C ATOM 965 N9 DG C 1 33.232 28.877 32.627 1.00 60.19 N ATOM 966 C8 DG C 1 32.322 29.905 32.675 1.00 53.20 C ATOM 967 N7 DG C 1 31.914 30.291 31.498 1.00 65.02 N ATOM 968 C5 DG C 1 32.595 29.465 30.613 1.00 50.56 C ATOM 969 C6 DG C 1 32.558 29.415 29.200 1.00 64.71 C ATOM 970 O6 DG C 1 31.894 30.117 28.424 1.00 66.84 O ATOM 971 N1 DG C 1 33.403 28.428 28.697 1.00 59.54 N ATOM 972 C2 DG C 1 34.184 27.595 29.463 1.00 70.51 C ATOM 973 N2 DG C 1 34.935 26.704 28.798 1.00 56.60 N ATOM 974 N3 DG C 1 34.227 27.631 30.789 1.00 69.58 N ATOM 975 C4 DG C 1 33.410 28.588 31.294 1.00 64.27 C ATOM 976 P DA C 2 36.961 27.815 36.323 1.00 86.32 P ATOM 977 OP1 DA C 2 37.533 26.854 37.291 1.00 73.75 O ATOM 978 OP2 DA C 2 36.965 29.263 36.632 1.00 93.13 O ATOM 979 O5' DA C 2 37.679 27.596 34.909 1.00 82.58 O ATOM 980 C5' DA C 2 37.601 26.325 34.266 1.00 77.43 C ATOM 981 C4' DA C 2 38.403 26.306 32.975 1.00 70.74 C ATOM 982 O4' DA C 2 37.638 26.927 31.909 1.00 82.24 O ATOM 983 C3' DA C 2 39.734 27.046 33.027 1.00 73.16 C ATOM 984 O3' DA C 2 40.714 26.319 32.308 1.00 65.66 O ATOM 985 C2' DA C 2 39.416 28.382 32.357 1.00 70.45 C ATOM 986 C1' DA C 2 38.393 27.961 31.315 1.00 66.65 C ATOM 987 N9 DA C 2 37.473 29.025 30.929 1.00 58.53 N ATOM 988 C8 DA C 2 36.847 29.914 31.758 1.00 62.57 C ATOM 989 N7 DA C 2 36.058 30.755 31.132 1.00 68.27 N ATOM 990 C5 DA C 2 36.168 30.386 29.801 1.00 61.04 C ATOM 991 C6 DA C 2 35.577 30.888 28.625 1.00 64.36 C ATOM 992 N6 DA C 2 34.723 31.917 28.610 1.00 57.33 N ATOM 993 N1 DA C 2 35.902 30.291 27.459 1.00 62.94 N ATOM 994 C2 DA C 2 36.759 29.263 27.477 1.00 63.19 C ATOM 995 N3 DA C 2 37.375 28.705 28.517 1.00 66.82 N ATOM 996 C4 DA C 2 37.034 29.319 29.660 1.00 65.67 C ATOM 997 P DG C 3 42.270 26.633 32.541 1.00 77.08 P ATOM 998 OP1 DG C 3 43.030 25.370 32.399 1.00 70.43 O ATOM 999 OP2 DG C 3 42.360 27.433 33.782 1.00 75.04 O ATOM 1000 O5' DG C 3 42.647 27.581 31.315 1.00 82.08 O ATOM 1001 C5' DG C 3 42.443 27.118 29.994 1.00 60.85 C ATOM 1002 C4' DG C 3 42.402 28.271 29.014 1.00 60.99 C ATOM 1003 O4' DG C 3 41.173 29.012 29.168 1.00 69.18 O ATOM 1004 C3' DG C 3 43.523 29.303 29.173 1.00 66.56 C ATOM 1005 O3' DG C 3 44.465 29.155 28.114 1.00 76.21 O ATOM 1006 C2' DG C 3 42.796 30.667 29.117 1.00 75.30 C ATOM 1007 C1' DG C 3 41.402 30.283 28.635 1.00 61.86 C ATOM 1008 N9 DG C 3 40.337 31.201 29.045 1.00 55.75 N ATOM 1009 C8 DG C 3 40.014 31.594 30.323 1.00 62.21 C ATOM 1010 N7 DG C 3 39.014 32.434 30.369 1.00 65.78 N ATOM 1011 C5 DG C 3 38.653 32.610 29.037 1.00 47.56 C ATOM 1012 C6 DG C 3 37.635 33.408 28.461 1.00 62.97 C ATOM 1013 O6 DG C 3 36.817 34.144 29.033 1.00 67.48 O ATOM 1014 N1 DG C 3 37.614 33.295 27.072 1.00 57.53 N ATOM 1015 C2 DG C 3 38.468 32.513 26.332 1.00 63.95 C ATOM 1016 N2 DG C 3 38.294 32.533 25.000 1.00 60.46 N ATOM 1017 N3 DG C 3 39.424 31.763 26.858 1.00 57.64 N ATOM 1018 C4 DG C 3 39.459 31.860 28.211 1.00 58.43 C ATOM 1019 P DA C 4 45.752 30.114 28.021 1.00 71.78 P ATOM 1020 OP1 DA C 4 46.856 29.319 27.438 1.00 66.72 O ATOM 1021 OP2 DA C 4 45.937 30.785 29.329 1.00 66.82 O ATOM 1022 O5' DA C 4 45.326 31.206 26.935 1.00 70.49 O ATOM 1023 C5' DA C 4 45.194 30.817 25.577 1.00 68.28 C ATOM 1024 C4' DA C 4 44.418 31.851 24.784 1.00 55.07 C ATOM 1025 O4' DA C 4 43.124 32.040 25.377 1.00 59.57 O ATOM 1026 C3' DA C 4 45.027 33.235 24.766 1.00 57.55 C ATOM 1027 O3' DA C 4 45.984 33.328 23.729 1.00 66.62 O ATOM 1028 C2' DA C 4 43.819 34.131 24.485 1.00 64.55 C ATOM 1029 C1' DA C 4 42.648 33.334 25.064 1.00 55.87 C ATOM 1030 N9 DA C 4 42.090 33.917 26.275 1.00 54.16 N ATOM 1031 C8 DA C 4 42.520 33.718 27.555 1.00 55.16 C ATOM 1032 N7 DA C 4 41.822 34.363 28.454 1.00 56.56 N ATOM 1033 C5 DA C 4 40.866 35.032 27.713 1.00 52.05 C ATOM 1034 C6 DA C 4 39.818 35.895 28.081 1.00 52.54 C ATOM 1035 N6 DA C 4 39.558 36.235 29.347 1.00 68.38 N ATOM 1036 N1 DA C 4 39.042 36.395 27.096 1.00 60.71 N ATOM 1037 C2 DA C 4 39.305 36.051 25.831 1.00 53.44 C ATOM 1038 N3 DA C 4 40.262 35.248 25.363 1.00 63.50 N ATOM 1039 C4 DA C 4 41.015 34.767 26.367 1.00 58.91 C ATOM 1040 P DG C 5 46.946 34.609 23.649 1.00 58.74 P ATOM 1041 OP1 DG C 5 48.119 34.287 22.810 1.00 52.77 O ATOM 1042 OP2 DG C 5 47.132 35.094 25.026 1.00 54.77 O ATOM 1043 O5' DG C 5 46.051 35.721 22.945 1.00 59.66 O ATOM 1044 C5' DG C 5 45.507 35.501 21.663 1.00 60.78 C ATOM 1045 C4' DG C 5 44.798 36.748 21.184 1.00 59.43 C ATOM 1046 O4' DG C 5 43.754 37.096 22.129 1.00 62.26 O ATOM 1047 C3' DG C 5 45.687 37.980 21.074 1.00 52.84 C ATOM 1048 O3' DG C 5 45.258 38.790 19.999 1.00 63.22 O ATOM 1049 C2' DG C 5 45.483 38.675 22.415 1.00 56.55 C ATOM 1050 C1' DG C 5 44.026 38.350 22.722 1.00 54.41 C ATOM 1051 N9 DG C 5 43.748 38.258 24.152 1.00 51.36 N ATOM 1052 C8 DG C 5 44.544 37.680 25.111 1.00 57.54 C ATOM 1053 N7 DG C 5 44.047 37.753 26.313 1.00 53.06 N ATOM 1054 C5 DG C 5 42.843 38.423 26.142 1.00 48.07 C ATOM 1055 C6 DG C 5 41.863 38.791 27.093 1.00 62.71 C ATOM 1056 O6 DG C 5 41.868 38.592 28.316 1.00 60.01 O ATOM 1057 N1 DG C 5 40.793 39.460 26.500 1.00 60.51 N ATOM 1058 C2 DG C 5 40.685 39.734 25.157 1.00 59.49 C ATOM 1059 N2 DG C 5 39.580 40.387 24.772 1.00 61.12 N ATOM 1060 N3 DG C 5 41.596 39.394 24.254 1.00 53.65 N ATOM 1061 C4 DG C 5 42.644 38.742 24.817 1.00 45.34 C ATOM 1062 P DG C 6 46.148 40.039 19.523 1.00 67.39 P ATOM 1063 OP1 DG C 6 45.984 40.143 18.056 1.00 59.16 O ATOM 1064 OP2 DG C 6 47.501 39.908 20.114 1.00 63.85 O ATOM 1065 O5' DG C 6 45.436 41.292 20.208 1.00 60.94 O ATOM 1066 C5' DG C 6 44.059 41.525 19.974 1.00 52.66 C ATOM 1067 C4' DG C 6 43.536 42.647 20.850 1.00 53.22 C ATOM 1068 O4' DG C 6 43.293 42.154 22.197 1.00 60.31 O ATOM 1069 C3' DG C 6 44.472 43.851 21.008 1.00 68.45 C ATOM 1070 O3' DG C 6 43.700 45.044 20.987 1.00 78.11 O ATOM 1071 C2' DG C 6 45.075 43.613 22.388 1.00 62.51 C ATOM 1072 C1' DG C 6 43.862 43.062 23.106 1.00 57.90 C ATOM 1073 N9 DG C 6 44.167 42.374 24.354 1.00 54.27 N ATOM 1074 C8 DG C 6 45.260 41.587 24.630 1.00 58.04 C ATOM 1075 N7 DG C 6 45.262 41.113 25.847 1.00 60.56 N ATOM 1076 C5 DG C 6 44.097 41.621 26.411 1.00 61.55 C ATOM 1077 C6 DG C 6 43.561 41.453 27.710 1.00 54.99 C ATOM 1078 O6 DG C 6 44.022 40.795 28.652 1.00 63.78 O ATOM 1079 N1 DG C 6 42.360 42.142 27.864 1.00 60.22 N ATOM 1080 C2 DG C 6 41.757 42.900 26.888 1.00 75.28 C ATOM 1081 N2 DG C 6 40.600 43.493 27.222 1.00 65.32 N ATOM 1082 N3 DG C 6 42.249 43.065 25.670 1.00 67.16 N ATOM 1083 C4 DG C 6 43.416 42.400 25.504 1.00 54.66 C ATOM 1084 P DA C 7 44.398 46.487 20.866 1.00 71.63 P ATOM 1085 OP1 DA C 7 44.331 46.890 19.445 1.00 59.54 O ATOM 1086 OP2 DA C 7 45.700 46.474 21.570 1.00 67.70 O ATOM 1087 O5' DA C 7 43.424 47.434 21.703 1.00 60.64 O ATOM 1088 C5' DA C 7 42.016 47.258 21.607 1.00 64.81 C ATOM 1089 C4' DA C 7 41.323 47.707 22.881 1.00 62.39 C ATOM 1090 O4' DA C 7 41.647 46.789 23.963 1.00 76.22 O ATOM 1091 C3' DA C 7 41.719 49.093 23.380 1.00 74.91 C ATOM 1092 O3' DA C 7 40.593 49.715 24.000 1.00 86.96 O ATOM 1093 C2' DA C 7 42.816 48.771 24.390 1.00 73.74 C ATOM 1094 C1' DA C 7 42.271 47.496 25.015 1.00 60.84 C ATOM 1095 N9 DA C 7 43.304 46.649 25.600 1.00 66.82 N ATOM 1096 C8 DA C 7 44.466 46.241 25.009 1.00 62.43 C ATOM 1097 N7 DA C 7 45.212 45.481 25.776 1.00 65.27 N ATOM 1098 C5 DA C 7 44.487 45.383 26.953 1.00 65.00 C ATOM 1099 C6 DA C 7 44.734 44.711 28.166 1.00 65.77 C ATOM 1100 N6 DA C 7 45.832 43.984 28.395 1.00 63.80 N ATOM 1101 N1 DA C 7 43.806 44.819 29.140 1.00 65.79 N ATOM 1102 C2 DA C 7 42.708 45.548 28.908 1.00 70.77 C ATOM 1103 N3 DA C 7 42.367 46.222 27.810 1.00 73.84 N ATOM 1104 C4 DA C 7 43.308 46.097 26.862 1.00 63.42 C ATOM 1105 P DA C 8 40.626 51.269 24.418 1.00 81.40 P ATOM 1106 OP1 DA C 8 39.497 51.933 23.732 1.00 74.61 O ATOM 1107 OP2 DA C 8 42.001 51.788 24.247 1.00 60.36 O ATOM 1108 O5' DA C 8 40.318 51.234 25.985 1.00 65.24 O ATOM 1109 C5' DA C 8 41.023 50.326 26.801 1.00 54.62 C ATOM 1110 C4' DA C 8 40.522 50.346 28.222 1.00 61.00 C ATOM 1111 O4' DA C 8 41.216 49.318 28.964 1.00 87.22 O ATOM 1112 C3' DA C 8 40.841 51.614 28.975 1.00 77.27 C ATOM 1113 O3' DA C 8 40.052 51.679 30.154 1.00 89.42 O ATOM 1114 C2' DA C 8 42.309 51.390 29.303 1.00 80.38 C ATOM 1115 C1' DA C 8 42.321 49.897 29.637 1.00 67.18 C ATOM 1116 N9 DA C 8 43.538 49.220 29.203 1.00 72.79 N ATOM 1117 C8 DA C 8 44.150 49.324 27.985 1.00 69.87 C ATOM 1118 N7 DA C 8 45.242 48.604 27.879 1.00 66.40 N ATOM 1119 C5 DA C 8 45.353 47.987 29.115 1.00 67.07 C ATOM 1120 C6 DA C 8 46.300 47.090 29.647 1.00 77.48 C ATOM 1121 N6 DA C 8 47.357 46.644 28.961 1.00 70.40 N ATOM 1122 N1 DA C 8 46.115 46.664 30.914 1.00 75.47 N ATOM 1123 C2 DA C 8 45.054 47.112 31.596 1.00 86.27 C ATOM 1124 N3 DA C 8 44.101 47.955 31.204 1.00 83.80 N ATOM 1125 C4 DA C 8 44.311 48.359 29.942 1.00 74.78 C ATOM 1126 P DT C 9 39.722 53.098 30.831 1.00 95.15 P ATOM 1127 OP1 DT C 9 38.261 53.158 31.059 1.00106.25 O ATOM 1128 OP2 DT C 9 40.390 54.145 30.027 1.00 71.12 O ATOM 1129 O5' DT C 9 40.452 53.022 32.250 1.00 70.00 O ATOM 1130 C5' DT C 9 41.863 52.941 32.312 1.00 81.89 C ATOM 1131 C4' DT C 9 42.300 52.037 33.444 1.00 82.31 C ATOM 1132 O4' DT C 9 43.154 50.985 32.919 1.00 89.70 O ATOM 1133 C3' DT C 9 43.106 52.738 34.531 1.00 95.35 C ATOM 1134 O3' DT C 9 42.771 52.219 35.805 1.00103.85 O ATOM 1135 C2' DT C 9 44.547 52.421 34.152 1.00101.77 C ATOM 1136 C1' DT C 9 44.418 51.030 33.546 1.00 91.62 C ATOM 1137 N1 DT C 9 45.464 50.741 32.526 1.00 82.24 N ATOM 1138 C2 DT C 9 46.456 49.835 32.819 1.00 89.70 C ATOM 1139 O2 DT C 9 46.520 49.233 33.876 1.00 91.90 O ATOM 1140 N3 DT C 9 47.372 49.648 31.819 1.00 81.22 N ATOM 1141 C4 DT C 9 47.400 50.269 30.583 1.00 83.46 C ATOM 1142 O4 DT C 9 48.270 50.033 29.750 1.00 76.32 O ATOM 1143 C5 DT C 9 46.334 51.214 30.343 1.00 77.62 C ATOM 1144 C7 DT C 9 46.259 51.950 29.038 1.00 58.67 C ATOM 1145 C6 DT C 9 45.430 51.404 31.316 1.00 78.66 C ATOM 1146 P DG C 10 43.223 53.003 37.132 1.00102.73 P ATOM 1147 OP1 DG C 10 42.270 52.653 38.207 1.00102.39 O ATOM 1148 OP2 DG C 10 43.443 54.421 36.769 1.00 96.86 O ATOM 1149 O5' DG C 10 44.646 52.368 37.478 1.00 81.26 O ATOM 1150 C5' DG C 10 44.791 50.958 37.539 1.00 91.57 C ATOM 1151 C4' DG C 10 46.122 50.581 38.159 1.00 99.61 C ATOM 1152 O4' DG C 10 47.058 50.209 37.115 1.00122.52 O ATOM 1153 C3' DG C 10 46.794 51.688 38.961 1.00103.98 C ATOM 1154 O3' DG C 10 47.440 51.133 40.094 1.00116.55 O ATOM 1155 C2' DG C 10 47.795 52.278 37.968 1.00111.84 C ATOM 1156 C1' DG C 10 48.186 51.060 37.141 1.00105.85 C ATOM 1157 N9 DG C 10 48.536 51.386 35.763 1.00 89.80 N ATOM 1158 C8 DG C 10 47.807 52.152 34.887 1.00 88.12 C ATOM 1159 N7 DG C 10 48.359 52.271 33.714 1.00 80.52 N ATOM 1160 C5 DG C 10 49.531 51.534 33.814 1.00 75.69 C ATOM 1161 C6 DG C 10 50.543 51.298 32.855 1.00 80.71 C ATOM 1162 O6 DG C 10 50.603 51.709 31.687 1.00 80.25 O ATOM 1163 N1 DG C 10 51.560 50.496 33.366 1.00 75.96 N ATOM 1164 C2 DG C 10 51.595 49.988 34.643 1.00 78.33 C ATOM 1165 N2 DG C 10 52.659 49.235 34.954 1.00 69.45 N ATOM 1166 N3 DG C 10 50.652 50.201 35.552 1.00 84.23 N ATOM 1167 C4 DG C 10 49.654 50.981 35.070 1.00 81.59 C ATOM 1168 P DC C 11 48.239 52.078 41.118 1.00139.95 P ATOM 1169 OP1 DC C 11 48.185 51.427 42.446 1.00131.65 O ATOM 1170 OP2 DC C 11 47.739 53.462 40.958 1.00121.31 O ATOM 1171 O5' DC C 11 49.743 52.026 40.580 1.00137.74 O ATOM 1172 C5' DC C 11 50.354 50.768 40.309 1.00128.40 C ATOM 1173 C4' DC C 11 51.792 50.950 39.858 1.00139.28 C ATOM 1174 O4' DC C 11 51.828 51.252 38.438 1.00141.27 O ATOM 1175 C3' DC C 11 52.550 52.081 40.556 1.00141.91 C ATOM 1176 O3' DC C 11 53.857 51.647 40.902 1.00154.21 O ATOM 1177 C2' DC C 11 52.585 53.183 39.498 1.00134.00 C ATOM 1178 C1' DC C 11 52.660 52.366 38.220 1.00123.41 C ATOM 1179 N1 DC C 11 52.174 53.096 37.012 1.00108.87 N ATOM 1180 C2 DC C 11 52.911 53.036 35.824 1.00 93.94 C ATOM 1181 O2 DC C 11 53.955 52.374 35.795 1.00 85.61 O ATOM 1182 N3 DC C 11 52.457 53.705 34.734 1.00 85.22 N ATOM 1183 C4 DC C 11 51.325 54.408 34.806 1.00 96.30 C ATOM 1184 N4 DC C 11 50.917 55.052 33.707 1.00 82.76 N ATOM 1185 C5 DC C 11 50.561 54.482 36.009 1.00 94.95 C ATOM 1186 C6 DC C 11 51.018 53.818 37.076 1.00104.28 C ATOM 1187 P DA C 12 54.507 52.078 42.306 1.00155.13 P ATOM 1188 OP1 DA C 12 55.426 50.996 42.726 1.00131.10 O ATOM 1189 OP2 DA C 12 53.402 52.489 43.200 1.00143.46 O ATOM 1190 O5' DA C 12 55.351 53.390 41.951 1.00130.92 O ATOM 1191 C5' DA C 12 56.691 53.523 42.408 1.00133.94 C ATOM 1192 C4' DA C 12 57.656 52.835 41.459 1.00128.82 C ATOM 1193 O4' DA C 12 57.048 52.736 40.147 1.00126.36 O ATOM 1194 C3' DA C 12 58.961 53.575 41.234 1.00124.46 C ATOM 1195 O3' DA C 12 59.972 52.663 40.819 1.00112.10 O ATOM 1196 C2' DA C 12 58.579 54.534 40.115 1.00125.15 C ATOM 1197 C1' DA C 12 57.662 53.658 39.264 1.00116.47 C ATOM 1198 N9 DA C 12 56.614 54.407 38.577 1.00112.09 N ATOM 1199 C8 DA C 12 55.507 54.981 39.139 1.00111.03 C ATOM 1200 N7 DA C 12 54.731 55.591 38.275 1.00103.52 N ATOM 1201 C5 DA C 12 55.372 55.403 37.062 1.00 94.56 C ATOM 1202 C6 DA C 12 55.058 55.808 35.750 1.00 84.76 C ATOM 1203 N6 DA C 12 53.969 56.516 35.437 1.00 73.66 N ATOM 1204 N1 DA C 12 55.912 55.454 34.768 1.00 76.61 N ATOM 1205 C2 DA C 12 57.001 54.743 35.084 1.00 84.19 C ATOM 1206 N3 DA C 12 57.401 54.308 36.276 1.00 87.81 N ATOM 1207 C4 DA C 12 56.534 54.674 37.231 1.00 99.26 C ATOM 1208 P DA C 13 61.524 53.034 41.012 1.00136.76 P ATOM 1209 OP1 DA C 13 62.115 52.022 41.916 1.00132.73 O ATOM 1210 OP2 DA C 13 61.602 54.469 41.364 1.00135.27 O ATOM 1211 O5' DA C 13 62.147 52.854 39.548 1.00136.16 O ATOM 1212 C5' DA C 13 61.377 53.205 38.404 1.00135.59 C ATOM 1213 C4' DA C 13 62.253 53.787 37.311 1.00134.53 C ATOM 1214 O4' DA C 13 61.475 54.722 36.527 1.00117.97 O ATOM 1215 C3' DA C 13 63.441 54.592 37.803 1.00135.49 C ATOM 1216 O3' DA C 13 64.444 54.643 36.795 1.00111.73 O ATOM 1217 C2' DA C 13 62.817 55.963 38.040 1.00120.02 C ATOM 1218 C1' DA C 13 61.800 56.051 36.901 1.00110.72 C ATOM 1219 N9 DA C 13 60.566 56.739 37.270 1.00104.91 N ATOM 1220 C8 DA C 13 60.128 57.035 38.531 1.00104.04 C ATOM 1221 N7 DA C 13 58.974 57.660 38.558 1.00 97.42 N ATOM 1222 C5 DA C 13 58.633 57.784 37.221 1.00 93.95 C ATOM 1223 C6 DA C 13 57.522 58.359 36.572 1.00 98.22 C ATOM 1224 N6 DA C 13 56.506 58.939 37.221 1.00 95.28 N ATOM 1225 N1 DA C 13 57.495 58.313 35.224 1.00 85.43 N ATOM 1226 C2 DA C 13 58.514 57.731 34.578 1.00 95.38 C ATOM 1227 N3 DA C 13 59.606 57.160 35.077 1.00 98.23 N ATOM 1228 C4 DA C 13 59.605 57.221 36.415 1.00 94.80 C TER 1229 DA C 13 HETATM 1230 C1 GOL A 201 47.749 32.779 14.622 1.00 77.35 C HETATM 1231 O1 GOL A 201 47.601 31.390 14.427 1.00 73.51 O HETATM 1232 C2 GOL A 201 48.398 33.422 13.400 1.00 82.12 C HETATM 1233 O2 GOL A 201 49.777 33.124 13.389 1.00 74.87 O HETATM 1234 C3 GOL A 201 47.757 32.889 12.123 1.00 85.90 C HETATM 1235 O3 GOL A 201 47.383 33.969 11.296 1.00 71.96 O HETATM 1236 P PO4 C 101 41.671 34.932 32.470 1.00132.22 P HETATM 1237 O1 PO4 C 101 42.267 34.263 31.256 1.00 79.66 O HETATM 1238 O2 PO4 C 101 40.858 36.129 32.038 1.00113.76 O HETATM 1239 O3 PO4 C 101 42.783 35.380 33.388 1.00118.26 O HETATM 1240 O4 PO4 C 101 40.778 33.953 33.194 1.00129.22 O HETATM 1241 O HOH C 201 48.963 31.404 31.000 1.00 55.08 O CONECT 250 257 CONECT 257 250 258 CONECT 258 257 259 261 CONECT 259 258 260 265 CONECT 260 259 CONECT 261 258 262 CONECT 262 261 263 CONECT 263 262 264 CONECT 264 263 CONECT 265 259 CONECT 680 684 CONECT 684 680 685 CONECT 685 684 686 688 CONECT 686 685 687 692 CONECT 687 686 CONECT 688 685 689 CONECT 689 688 690 CONECT 690 689 691 CONECT 691 690 CONECT 692 686 CONECT 1230 1231 1232 CONECT 1231 1230 CONECT 1232 1230 1233 1234 CONECT 1233 1232 CONECT 1234 1232 1235 CONECT 1235 1234 CONECT 1236 1237 1238 1239 1240 CONECT 1237 1236 CONECT 1238 1236 CONECT 1239 1236 CONECT 1240 1236 MASTER 322 0 4 5 2 0 2 6 1238 3 31 11 END
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Related entries of code: 5gzb
Entries with 90% protein sequence similarity cutoff in PDBbind
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Complexes with the same small molecule ligand
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Ligand Name
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Entry Information
PDB ID
5gzb
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
Transcription Factor TEAD4
Ligand Name
M-CAT DNA
EC.Number
E.C.-.-.-.-
Resolution
2.7(Å)
Affinity (Kd/Ki/IC50)
Kd=0.23uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Oncogene Vol. 36: pp. 4362-4369
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):
Q15561
Entrez Gene ID
NCBI Entrez Gene ID:
7004
ASD
Information of known allosteric effects of PDB entries
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