Browse entries in the PDBbind-CN Database
HEADER DNA BINDING PROTEIN/DNA 09-OCT-15 5E6A TITLE GLUCOCORTICOID RECEPTOR DNA BINDING DOMAIN - PLAU NF-KB RESPONSE TITLE 2 ELEMENT COMPLEX COMPND MOL_ID: 1; COMPND 2 MOLECULE: GLUCOCORTICOID RECEPTOR; COMPND 3 CHAIN: A, B; COMPND 4 FRAGMENT: UNP RESIDUES 391-480; COMPND 5 SYNONYM: GR,NUCLEAR RECEPTOR SUBFAMILY 3 GROUP C MEMBER 1; COMPND 6 ENGINEERED: YES; COMPND 7 MOL_ID: 2; COMPND 8 MOLECULE: DNA (5'-D(*CP*TP*GP*GP*GP*AP*AP*TP*TP*TP*CP*CP*TP*GP*AP*T)- COMPND 9 3'); COMPND 10 CHAIN: C; COMPND 11 ENGINEERED: YES; COMPND 12 MOL_ID: 3; COMPND 13 MOLECULE: DNA (5'-D(*AP*TP*CP*AP*GP*GP*AP*AP*AP*TP*TP*CP*CP*CP*AP*G)- COMPND 14 3'); COMPND 15 CHAIN: D; COMPND 16 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: NR3C1, GRL; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3) PLYSS; SOURCE 9 MOL_ID: 2; SOURCE 10 SYNTHETIC: YES; SOURCE 11 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 12 ORGANISM_TAXID: 9606; SOURCE 13 MOL_ID: 3; SOURCE 14 SYNTHETIC: YES; SOURCE 15 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 16 ORGANISM_TAXID: 9606 KEYWDS DNA BINDING PROTEIN, DNA BINDING PROTEIN-DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR W.H.HUDSON,E.A.RYE,A.G.HERBST,E.A.ORTLUND REVDAT 2 24-OCT-18 5E6A 1 JRNL REVDAT 1 08-FEB-17 5E6A 0 JRNL AUTH W.H.HUDSON,I.M.S.VERA,J.C.NWACHUKWU,E.R.WEIKUM,A.G.HERBST, JRNL AUTH 2 Q.YANG,D.L.BAIN,K.W.NETTLES,D.J.KOJETIN,E.A.ORTLUND JRNL TITL CRYPTIC GLUCOCORTICOID RECEPTOR-BINDING SITES PERVADE JRNL TITL 2 GENOMIC NF-KAPPA B RESPONSE ELEMENTS. JRNL REF NAT COMMUN V. 9 1337 2018 JRNL REFN ESSN 2041-1723 JRNL PMID 29626214 JRNL DOI 10.1038/S41467-018-03780-1 REMARK 2 REMARK 2 RESOLUTION. 2.20 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 : ML REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.20 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 35.11 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.340 REMARK 3 COMPLETENESS FOR RANGE (%) : 96.6 REMARK 3 NUMBER OF REFLECTIONS : 20243 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.239 REMARK 3 R VALUE (WORKING SET) : 0.236 REMARK 3 FREE R VALUE : 0.266 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 9.880 REMARK 3 FREE R VALUE TEST SET COUNT : 1999 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 35.1181 - 5.2891 0.94 1390 150 0.2040 0.2197 REMARK 3 2 5.2891 - 4.2003 0.97 1343 153 0.2084 0.2476 REMARK 3 3 4.2003 - 3.6700 0.97 1318 146 0.2167 0.2624 REMARK 3 4 3.6700 - 3.3348 0.97 1305 142 0.2221 0.2538 REMARK 3 5 3.3348 - 3.0959 0.96 1286 145 0.2357 0.2934 REMARK 3 6 3.0959 - 2.9135 0.98 1334 137 0.2678 0.2862 REMARK 3 7 2.9135 - 2.7676 0.98 1301 156 0.2608 0.2822 REMARK 3 8 2.7676 - 2.6472 0.98 1293 131 0.2672 0.2682 REMARK 3 9 2.6472 - 2.5453 0.99 1330 150 0.2695 0.3320 REMARK 3 10 2.5453 - 2.4575 0.98 1303 139 0.2880 0.3134 REMARK 3 11 2.4575 - 2.3807 0.99 1306 151 0.2817 0.3032 REMARK 3 12 2.3807 - 2.3126 0.98 1292 132 0.3034 0.2968 REMARK 3 13 2.3126 - 2.2518 0.97 1265 146 0.3210 0.3444 REMARK 3 14 2.2518 - 2.1968 0.88 1178 121 0.3321 0.3304 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 : NULL REMARK 3 B_SOL : NULL REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.270 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 27.740 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) : 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 : 0.005 1864 REMARK 3 ANGLE : 0.842 2636 REMARK 3 CHIRALITY : 0.034 288 REMARK 3 PLANARITY : 0.005 228 REMARK 3 DIHEDRAL : 21.820 746 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 5E6A COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 13-OCT-15. REMARK 100 THE DEPOSITION ID IS D_1000209304. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 01-JUL-14 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : NULL REMARK 200 NUMBER OF CRYSTALS USED : NULL REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 22-ID REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.00 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARMOSAIC 300 MM CCD REMARK 200 INTENSITY-INTEGRATION SOFTWARE : NULL REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 20243 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.150 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 100.0 REMARK 200 DATA REDUNDANCY : 7.100 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 16.2000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.15 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.23 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : 6.70 REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : 1.670 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL 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 (%): 56.10 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.80 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.05 M SODIUM CACODYLATE, 0.05 M REMARK 280 SPERMINE, AND 16% PEG 400, VAPOR DIFFUSION, HANGING DROP, REMARK 280 TEMPERATURE 298K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X+1/2,-Y,Z+1/2 REMARK 290 3555 -X,Y+1/2,-Z+1/2 REMARK 290 4555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 19.99650 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 51.81700 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 47.74850 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 51.81700 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 19.99650 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 47.74850 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TETRAMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TETRAMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 4450 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 12620 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -27.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, C, D, B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 MET A 393 REMARK 465 HIS A 394 REMARK 465 HIS A 395 REMARK 465 HIS A 396 REMARK 465 HIS A 397 REMARK 465 HIS A 398 REMARK 465 HIS A 399 REMARK 465 SER A 400 REMARK 465 SER A 401 REMARK 465 GLY A 402 REMARK 465 VAL A 403 REMARK 465 ASP A 404 REMARK 465 LEU A 405 REMARK 465 GLY A 406 REMARK 465 THR A 407 REMARK 465 GLU A 408 REMARK 465 ASN A 409 REMARK 465 LEU A 410 REMARK 465 TYR A 411 REMARK 465 PHE A 412 REMARK 465 GLN A 413 REMARK 465 SER A 414 REMARK 465 ASN A 415 REMARK 465 ALA A 416 REMARK 465 PRO A 417 REMARK 465 ARG A 491 REMARK 465 LYS A 492 REMARK 465 THR A 493 REMARK 465 LYS A 494 REMARK 465 LYS A 495 REMARK 465 LYS A 496 REMARK 465 ILE A 497 REMARK 465 LYS A 498 REMARK 465 GLY A 499 REMARK 465 ILE A 500 REMARK 465 GLN A 501 REMARK 465 GLN A 502 REMARK 465 ALA A 503 REMARK 465 THR A 504 REMARK 465 THR A 505 REMARK 465 GLY A 506 REMARK 465 MET B 393 REMARK 465 HIS B 394 REMARK 465 HIS B 395 REMARK 465 HIS B 396 REMARK 465 HIS B 397 REMARK 465 HIS B 398 REMARK 465 HIS B 399 REMARK 465 SER B 400 REMARK 465 SER B 401 REMARK 465 GLY B 402 REMARK 465 VAL B 403 REMARK 465 ASP B 404 REMARK 465 LEU B 405 REMARK 465 GLY B 406 REMARK 465 THR B 407 REMARK 465 GLU B 408 REMARK 465 ASN B 409 REMARK 465 LEU B 410 REMARK 465 TYR B 411 REMARK 465 PHE B 412 REMARK 465 GLN B 413 REMARK 465 SER B 414 REMARK 465 ASN B 415 REMARK 465 ALA B 416 REMARK 465 PRO B 417 REMARK 465 ARG B 491 REMARK 465 LYS B 492 REMARK 465 THR B 493 REMARK 465 LYS B 494 REMARK 465 LYS B 495 REMARK 465 LYS B 496 REMARK 465 ILE B 497 REMARK 465 LYS B 498 REMARK 465 GLY B 499 REMARK 465 ILE B 500 REMARK 465 GLN B 501 REMARK 465 GLN B 502 REMARK 465 ALA B 503 REMARK 465 THR B 504 REMARK 465 THR B 505 REMARK 465 GLY B 506 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 O HOH A 716 O HOH A 718 2.06 REMARK 500 NH2 ARG B 479 O HOH B 701 2.16 REMARK 500 O2 DT C 8 O HOH C 101 2.16 REMARK 500 O HOH C 104 O HOH C 109 2.17 REMARK 500 O HOH C 109 O HOH B 718 2.19 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 DA D 1 O4' - C1' - N9 ANGL. DEV. = 2.0 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 LYS A 419 -167.23 -161.77 REMARK 500 LEU A 420 87.20 63.45 REMARK 500 VAL A 423 -65.99 -95.53 REMARK 500 SER A 425 -1.57 70.81 REMARK 500 VAL B 423 -66.20 -101.54 REMARK 500 SER B 425 -1.01 70.38 REMARK 500 GLN B 452 -11.58 70.20 REMARK 500 REMARK 500 REMARK: NULL REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 601 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 421 SG REMARK 620 2 CYS A 424 SG 113.2 REMARK 620 3 CYS A 438 SG 116.6 101.8 REMARK 620 4 CYS A 441 SG 114.5 112.2 97.0 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 602 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 457 SG REMARK 620 2 CYS A 463 SG 106.1 REMARK 620 3 CYS A 473 SG 108.4 114.4 REMARK 620 4 CYS A 476 SG 109.4 112.7 105.6 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN B 602 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS B 421 SG REMARK 620 2 CYS B 424 SG 111.5 REMARK 620 3 CYS B 438 SG 118.7 104.5 REMARK 620 4 CYS B 441 SG 110.3 112.1 99.2 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN B 601 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS B 457 SG REMARK 620 2 CYS B 463 SG 103.6 REMARK 620 3 CYS B 473 SG 108.3 114.4 REMARK 620 4 CYS B 476 SG 110.4 114.9 105.1 REMARK 620 N 1 2 3 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue ZN A 601 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue ZN A 602 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue ZN B 601 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue ZN B 602 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 5E69 RELATED DB: PDB REMARK 900 RELATED ID: 5E6A RELATED DB: PDB REMARK 900 RELATED ID: 5E6B RELATED DB: PDB REMARK 900 RELATED ID: 5E6D RELATED DB: PDB DBREF 5E6A A 417 506 UNP P04150 GCR_HUMAN 391 480 DBREF 5E6A C 1 16 PDB 5E6A 5E6A 1 16 DBREF 5E6A D 1 16 PDB 5E6A 5E6A 1 16 DBREF 5E6A B 417 506 UNP P04150 GCR_HUMAN 391 480 SEQADV 5E6A MET A 393 UNP P04150 INITIATING METHIONINE SEQADV 5E6A HIS A 394 UNP P04150 EXPRESSION TAG SEQADV 5E6A HIS A 395 UNP P04150 EXPRESSION TAG SEQADV 5E6A HIS A 396 UNP P04150 EXPRESSION TAG SEQADV 5E6A HIS A 397 UNP P04150 EXPRESSION TAG SEQADV 5E6A HIS A 398 UNP P04150 EXPRESSION TAG SEQADV 5E6A HIS A 399 UNP P04150 EXPRESSION TAG SEQADV 5E6A SER A 400 UNP P04150 EXPRESSION TAG SEQADV 5E6A SER A 401 UNP P04150 EXPRESSION TAG SEQADV 5E6A GLY A 402 UNP P04150 EXPRESSION TAG SEQADV 5E6A VAL A 403 UNP P04150 EXPRESSION TAG SEQADV 5E6A ASP A 404 UNP P04150 EXPRESSION TAG SEQADV 5E6A LEU A 405 UNP P04150 EXPRESSION TAG SEQADV 5E6A GLY A 406 UNP P04150 EXPRESSION TAG SEQADV 5E6A THR A 407 UNP P04150 EXPRESSION TAG SEQADV 5E6A GLU A 408 UNP P04150 EXPRESSION TAG SEQADV 5E6A ASN A 409 UNP P04150 EXPRESSION TAG SEQADV 5E6A LEU A 410 UNP P04150 EXPRESSION TAG SEQADV 5E6A TYR A 411 UNP P04150 EXPRESSION TAG SEQADV 5E6A PHE A 412 UNP P04150 EXPRESSION TAG SEQADV 5E6A GLN A 413 UNP P04150 EXPRESSION TAG SEQADV 5E6A SER A 414 UNP P04150 EXPRESSION TAG SEQADV 5E6A ASN A 415 UNP P04150 EXPRESSION TAG SEQADV 5E6A ALA A 416 UNP P04150 EXPRESSION TAG SEQADV 5E6A MET B 393 UNP P04150 INITIATING METHIONINE SEQADV 5E6A HIS B 394 UNP P04150 EXPRESSION TAG SEQADV 5E6A HIS B 395 UNP P04150 EXPRESSION TAG SEQADV 5E6A HIS B 396 UNP P04150 EXPRESSION TAG SEQADV 5E6A HIS B 397 UNP P04150 EXPRESSION TAG SEQADV 5E6A HIS B 398 UNP P04150 EXPRESSION TAG SEQADV 5E6A HIS B 399 UNP P04150 EXPRESSION TAG SEQADV 5E6A SER B 400 UNP P04150 EXPRESSION TAG SEQADV 5E6A SER B 401 UNP P04150 EXPRESSION TAG SEQADV 5E6A GLY B 402 UNP P04150 EXPRESSION TAG SEQADV 5E6A VAL B 403 UNP P04150 EXPRESSION TAG SEQADV 5E6A ASP B 404 UNP P04150 EXPRESSION TAG SEQADV 5E6A LEU B 405 UNP P04150 EXPRESSION TAG SEQADV 5E6A GLY B 406 UNP P04150 EXPRESSION TAG SEQADV 5E6A THR B 407 UNP P04150 EXPRESSION TAG SEQADV 5E6A GLU B 408 UNP P04150 EXPRESSION TAG SEQADV 5E6A ASN B 409 UNP P04150 EXPRESSION TAG SEQADV 5E6A LEU B 410 UNP P04150 EXPRESSION TAG SEQADV 5E6A TYR B 411 UNP P04150 EXPRESSION TAG SEQADV 5E6A PHE B 412 UNP P04150 EXPRESSION TAG SEQADV 5E6A GLN B 413 UNP P04150 EXPRESSION TAG SEQADV 5E6A SER B 414 UNP P04150 EXPRESSION TAG SEQADV 5E6A ASN B 415 UNP P04150 EXPRESSION TAG SEQADV 5E6A ALA B 416 UNP P04150 EXPRESSION TAG SEQRES 1 A 114 MET HIS HIS HIS HIS HIS HIS SER SER GLY VAL ASP LEU SEQRES 2 A 114 GLY THR GLU ASN LEU TYR PHE GLN SER ASN ALA PRO PRO SEQRES 3 A 114 LYS LEU CYS LEU VAL CYS SER ASP GLU ALA SER GLY CYS SEQRES 4 A 114 HIS TYR GLY VAL LEU THR CYS GLY SER CYS LYS VAL PHE SEQRES 5 A 114 PHE LYS ARG ALA VAL GLU GLY GLN HIS ASN TYR LEU CYS SEQRES 6 A 114 ALA GLY ARG ASN ASP CYS ILE ILE ASP LYS ILE ARG ARG SEQRES 7 A 114 LYS ASN CYS PRO ALA CYS ARG TYR ARG LYS CYS LEU GLN SEQRES 8 A 114 ALA GLY MET ASN LEU GLU ALA ARG LYS THR LYS LYS LYS SEQRES 9 A 114 ILE LYS GLY ILE GLN GLN ALA THR THR GLY SEQRES 1 C 16 DC DT DG DG DG DA DA DT DT DT DC DC DT SEQRES 2 C 16 DG DA DT SEQRES 1 D 16 DA DT DC DA DG DG DA DA DA DT DT DC DC SEQRES 2 D 16 DC DA DG SEQRES 1 B 114 MET HIS HIS HIS HIS HIS HIS SER SER GLY VAL ASP LEU SEQRES 2 B 114 GLY THR GLU ASN LEU TYR PHE GLN SER ASN ALA PRO PRO SEQRES 3 B 114 LYS LEU CYS LEU VAL CYS SER ASP GLU ALA SER GLY CYS SEQRES 4 B 114 HIS TYR GLY VAL LEU THR CYS GLY SER CYS LYS VAL PHE SEQRES 5 B 114 PHE LYS ARG ALA VAL GLU GLY GLN HIS ASN TYR LEU CYS SEQRES 6 B 114 ALA GLY ARG ASN ASP CYS ILE ILE ASP LYS ILE ARG ARG SEQRES 7 B 114 LYS ASN CYS PRO ALA CYS ARG TYR ARG LYS CYS LEU GLN SEQRES 8 B 114 ALA GLY MET ASN LEU GLU ALA ARG LYS THR LYS LYS LYS SEQRES 9 B 114 ILE LYS GLY ILE GLN GLN ALA THR THR GLY HET ZN A 601 1 HET ZN A 602 1 HET ZN B 601 1 HET ZN B 602 1 HETNAM ZN ZINC ION FORMUL 5 ZN 4(ZN 2+) FORMUL 9 HOH *51(H2 O) HELIX 1 AA1 CYS A 438 GLY A 451 1 14 HELIX 2 AA2 CYS A 473 ALA A 484 1 12 HELIX 3 AA3 CYS B 438 GLY B 451 1 14 HELIX 4 AA4 ILE B 468 ASN B 472 5 5 HELIX 5 AA5 CYS B 473 ALA B 484 1 12 SHEET 1 AA1 2 GLY A 430 HIS A 432 0 SHEET 2 AA1 2 VAL A 435 THR A 437 -1 O VAL A 435 N HIS A 432 SHEET 1 AA2 2 GLY B 430 HIS B 432 0 SHEET 2 AA2 2 VAL B 435 THR B 437 -1 O VAL B 435 N HIS B 432 LINK SG CYS A 421 ZN ZN A 601 1555 1555 2.41 LINK SG CYS A 424 ZN ZN A 601 1555 1555 2.26 LINK SG CYS A 438 ZN ZN A 601 1555 1555 2.45 LINK SG CYS A 441 ZN ZN A 601 1555 1555 2.31 LINK SG CYS A 457 ZN ZN A 602 1555 1555 2.41 LINK SG CYS A 463 ZN ZN A 602 1555 1555 2.31 LINK SG CYS A 473 ZN ZN A 602 1555 1555 2.36 LINK SG CYS A 476 ZN ZN A 602 1555 1555 2.30 LINK SG CYS B 421 ZN ZN B 602 1555 1555 2.38 LINK SG CYS B 424 ZN ZN B 602 1555 1555 2.26 LINK SG CYS B 438 ZN ZN B 602 1555 1555 2.38 LINK SG CYS B 441 ZN ZN B 602 1555 1555 2.33 LINK SG CYS B 457 ZN ZN B 601 1555 1555 2.35 LINK SG CYS B 463 ZN ZN B 601 1555 1555 2.34 LINK SG CYS B 473 ZN ZN B 601 1555 1555 2.35 LINK SG CYS B 476 ZN ZN B 601 1555 1555 2.34 SITE 1 AC1 4 CYS A 421 CYS A 424 CYS A 438 CYS A 441 SITE 1 AC2 4 CYS A 457 CYS A 463 CYS A 473 CYS A 476 SITE 1 AC3 4 CYS B 457 CYS B 463 CYS B 473 CYS B 476 SITE 1 AC4 4 CYS B 421 CYS B 424 CYS B 438 CYS B 441 CRYST1 39.993 95.497 103.634 90.00 90.00 90.00 P 21 21 21 8 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.025004 0.000000 0.000000 0.00000 SCALE2 0.000000 0.010472 0.000000 0.00000 SCALE3 0.000000 0.000000 0.009649 0.00000 ATOM 1 N PRO A 418 -18.367 21.878 22.690 1.00 84.49 N ATOM 2 CA PRO A 418 -18.063 21.943 21.255 1.00 78.24 C ATOM 3 C PRO A 418 -18.405 20.654 20.513 1.00 74.02 C ATOM 4 O PRO A 418 -18.506 19.585 21.116 1.00 74.68 O ATOM 5 CB PRO A 418 -16.551 22.195 21.236 1.00 78.29 C ATOM 6 CG PRO A 418 -16.287 22.927 22.492 1.00 82.26 C ATOM 7 CD PRO A 418 -17.248 22.380 23.514 1.00 84.89 C ATOM 8 N LYS A 419 -18.604 20.784 19.206 1.00 72.21 N ATOM 9 CA LYS A 419 -18.816 19.664 18.286 1.00 66.16 C ATOM 10 C LYS A 419 -18.537 20.220 16.893 1.00 62.28 C ATOM 11 O LYS A 419 -17.972 21.312 16.785 1.00 62.86 O ATOM 12 CB LYS A 419 -20.224 19.082 18.400 1.00 65.83 C ATOM 13 CG LYS A 419 -21.347 20.100 18.342 1.00 65.54 C ATOM 14 CD LYS A 419 -22.697 19.424 18.124 1.00 67.21 C ATOM 15 CE LYS A 419 -22.567 18.145 17.301 1.00 67.27 C ATOM 16 NZ LYS A 419 -23.889 17.637 16.828 1.00 67.61 N ATOM 17 N LEU A 420 -18.901 19.493 15.836 1.00 56.64 N ATOM 18 CA LEU A 420 -18.755 20.042 14.483 1.00 53.65 C ATOM 19 C LEU A 420 -17.307 20.328 14.074 1.00 50.53 C ATOM 20 O LEU A 420 -16.797 21.426 14.291 1.00 54.90 O ATOM 21 CB LEU A 420 -19.596 21.310 14.314 1.00 55.06 C ATOM 22 CG LEU A 420 -20.896 21.121 13.534 1.00 52.70 C ATOM 23 CD1 LEU A 420 -21.769 20.061 14.187 1.00 56.35 C ATOM 24 CD2 LEU A 420 -21.643 22.438 13.402 1.00 53.44 C ATOM 25 N CYS A 421 -16.650 19.305 13.532 1.00 48.82 N ATOM 26 CA CYS A 421 -15.238 19.341 13.142 1.00 46.58 C ATOM 27 C CYS A 421 -14.812 20.627 12.432 1.00 44.35 C ATOM 28 O CYS A 421 -15.484 21.113 11.528 1.00 44.76 O ATOM 29 CB CYS A 421 -14.962 18.145 12.220 1.00 44.08 C ATOM 30 SG CYS A 421 -13.532 18.258 11.095 1.00 38.59 S ATOM 31 N LEU A 422 -13.683 21.174 12.874 1.00 42.27 N ATOM 32 CA LEU A 422 -13.227 22.488 12.433 1.00 42.73 C ATOM 33 C LEU A 422 -12.708 22.493 11.000 1.00 43.27 C ATOM 34 O LEU A 422 -12.446 23.554 10.438 1.00 42.57 O ATOM 35 CB LEU A 422 -12.138 23.008 13.373 1.00 42.67 C ATOM 36 CG LEU A 422 -12.578 23.314 14.807 1.00 45.91 C ATOM 37 CD1 LEU A 422 -11.470 24.023 15.566 1.00 47.73 C ATOM 38 CD2 LEU A 422 -13.854 24.142 14.813 1.00 46.92 C ATOM 39 N VAL A 423 -12.560 21.312 10.411 1.00 39.74 N ATOM 40 CA VAL A 423 -12.062 21.219 9.045 1.00 40.31 C ATOM 41 C VAL A 423 -13.203 21.124 8.032 1.00 41.87 C ATOM 42 O VAL A 423 -13.379 22.016 7.204 1.00 39.94 O ATOM 43 CB VAL A 423 -11.123 20.009 8.867 1.00 39.53 C ATOM 44 CG1 VAL A 423 -10.646 19.915 7.423 1.00 38.74 C ATOM 45 CG2 VAL A 423 -9.938 20.115 9.815 1.00 38.77 C ATOM 46 N CYS A 424 -13.952 20.027 8.076 1.00 40.43 N ATOM 47 CA CYS A 424 -15.034 19.803 7.117 1.00 43.92 C ATOM 48 C CYS A 424 -16.449 20.111 7.630 1.00 41.07 C ATOM 49 O CYS A 424 -17.417 19.921 6.895 1.00 40.61 O ATOM 50 CB CYS A 424 -14.987 18.361 6.621 1.00 37.90 C ATOM 51 SG CYS A 424 -15.438 17.160 7.872 1.00 40.26 S ATOM 52 N SER A 425 -16.567 20.539 8.887 1.00 42.93 N ATOM 53 CA SER A 425 -17.861 20.869 9.513 1.00 45.11 C ATOM 54 C SER A 425 -18.749 19.650 9.804 1.00 45.95 C ATOM 55 O SER A 425 -19.849 19.800 10.336 1.00 45.76 O ATOM 56 CB SER A 425 -18.645 21.878 8.665 1.00 41.89 C ATOM 57 OG SER A 425 -17.939 23.100 8.541 1.00 44.69 O ATOM 58 N ASP A 426 -18.288 18.455 9.442 1.00 43.53 N ATOM 59 CA ASP A 426 -18.996 17.222 9.791 1.00 45.74 C ATOM 60 C ASP A 426 -18.950 17.026 11.304 1.00 46.52 C ATOM 61 O ASP A 426 -18.146 17.661 11.988 1.00 45.05 O ATOM 62 CB ASP A 426 -18.385 16.016 9.071 1.00 45.92 C ATOM 63 CG ASP A 426 -19.288 14.797 9.087 1.00 48.43 C ATOM 64 OD1 ASP A 426 -20.475 14.933 9.450 1.00 51.94 O ATOM 65 OD2 ASP A 426 -18.808 13.701 8.725 1.00 49.49 O ATOM 66 N GLU A 427 -19.833 16.182 11.830 1.00 46.90 N ATOM 67 CA GLU A 427 -19.878 15.931 13.269 1.00 51.55 C ATOM 68 C GLU A 427 -18.523 15.453 13.788 1.00 48.12 C ATOM 69 O GLU A 427 -17.953 14.493 13.271 1.00 45.24 O ATOM 70 CB GLU A 427 -20.958 14.901 13.607 1.00 53.01 C ATOM 71 CG GLU A 427 -20.834 14.325 15.010 1.00 58.07 C ATOM 72 CD GLU A 427 -21.389 12.918 15.121 1.00 64.18 C ATOM 73 OE1 GLU A 427 -20.781 11.987 14.549 1.00 64.59 O ATOM 74 OE2 GLU A 427 -22.431 12.741 15.787 1.00 69.74 O ATOM 75 N ALA A 428 -18.014 16.135 14.809 1.00 45.57 N ATOM 76 CA ALA A 428 -16.701 15.825 15.365 1.00 47.50 C ATOM 77 C ALA A 428 -16.766 14.669 16.361 1.00 48.89 C ATOM 78 O ALA A 428 -17.705 14.574 17.151 1.00 50.50 O ATOM 79 CB ALA A 428 -16.111 17.057 16.027 1.00 46.21 C ATOM 80 N SER A 429 -15.767 13.792 16.316 1.00 46.93 N ATOM 81 CA SER A 429 -15.707 12.653 17.227 1.00 45.90 C ATOM 82 C SER A 429 -14.825 12.916 18.448 1.00 48.41 C ATOM 83 O SER A 429 -14.729 12.073 19.339 1.00 48.77 O ATOM 84 CB SER A 429 -15.201 11.412 16.491 1.00 44.34 C ATOM 85 OG SER A 429 -13.856 11.582 16.081 1.00 45.87 O ATOM 86 N GLY A 430 -14.181 14.078 18.490 1.00 45.14 N ATOM 87 CA GLY A 430 -13.327 14.419 19.616 1.00 46.96 C ATOM 88 C GLY A 430 -12.160 15.323 19.265 1.00 46.20 C ATOM 89 O GLY A 430 -12.120 15.914 18.187 1.00 43.56 O ATOM 90 N CYS A 431 -11.204 15.430 20.183 1.00 43.54 N ATOM 91 CA CYS A 431 -10.024 16.259 19.965 1.00 45.29 C ATOM 92 C CYS A 431 -8.894 15.413 19.387 1.00 46.80 C ATOM 93 O CYS A 431 -8.339 14.555 20.072 1.00 47.22 O ATOM 94 CB CYS A 431 -9.586 16.920 21.276 1.00 45.85 C ATOM 95 SG CYS A 431 -8.355 18.236 21.105 1.00 56.47 S ATOM 96 N HIS A 432 -8.553 15.662 18.125 1.00 43.71 N ATOM 97 CA HIS A 432 -7.557 14.850 17.434 1.00 45.24 C ATOM 98 C HIS A 432 -6.389 15.692 16.940 1.00 43.51 C ATOM 99 O HIS A 432 -6.573 16.635 16.169 1.00 43.46 O ATOM 100 CB HIS A 432 -8.193 14.102 16.261 1.00 41.80 C ATOM 101 CG HIS A 432 -9.314 13.194 16.659 1.00 44.81 C ATOM 102 ND1 HIS A 432 -9.134 12.112 17.496 1.00 44.24 N ATOM 103 CD2 HIS A 432 -10.628 13.201 16.333 1.00 44.99 C ATOM 104 CE1 HIS A 432 -10.288 11.495 17.669 1.00 43.46 C ATOM 105 NE2 HIS A 432 -11.212 12.136 16.975 1.00 44.67 N ATOM 106 N TYR A 433 -5.190 15.331 17.390 1.00 43.22 N ATOM 107 CA TYR A 433 -3.965 16.054 17.066 1.00 44.14 C ATOM 108 C TYR A 433 -4.093 17.538 17.408 1.00 44.31 C ATOM 109 O TYR A 433 -3.622 18.403 16.669 1.00 41.53 O ATOM 110 CB TYR A 433 -3.600 15.857 15.590 1.00 43.56 C ATOM 111 CG TYR A 433 -3.408 14.400 15.226 1.00 43.94 C ATOM 112 CD1 TYR A 433 -2.366 13.661 15.774 1.00 45.28 C ATOM 113 CD2 TYR A 433 -4.274 13.759 14.349 1.00 41.59 C ATOM 114 CE1 TYR A 433 -2.188 12.327 15.455 1.00 43.54 C ATOM 115 CE2 TYR A 433 -4.102 12.423 14.022 1.00 41.88 C ATOM 116 CZ TYR A 433 -3.058 11.713 14.580 1.00 44.45 C ATOM 117 OH TYR A 433 -2.879 10.385 14.263 1.00 43.09 O ATOM 118 N GLY A 434 -4.743 17.813 18.538 1.00 43.08 N ATOM 119 CA GLY A 434 -4.842 19.159 19.074 1.00 44.09 C ATOM 120 C GLY A 434 -6.086 19.927 18.669 1.00 43.80 C ATOM 121 O GLY A 434 -6.331 21.024 19.171 1.00 42.33 O ATOM 122 N VAL A 435 -6.876 19.357 17.765 1.00 43.45 N ATOM 123 CA VAL A 435 -8.024 20.061 17.200 1.00 44.11 C ATOM 124 C VAL A 435 -9.272 19.183 17.206 1.00 42.21 C ATOM 125 O VAL A 435 -9.187 17.973 16.999 1.00 42.75 O ATOM 126 CB VAL A 435 -7.728 20.530 15.748 1.00 41.82 C ATOM 127 CG1 VAL A 435 -8.930 21.238 15.137 1.00 40.57 C ATOM 128 CG2 VAL A 435 -6.507 21.435 15.718 1.00 39.21 C ATOM 129 N LEU A 436 -10.430 19.793 17.439 1.00 41.75 N ATOM 130 CA LEU A 436 -11.690 19.071 17.342 1.00 44.42 C ATOM 131 C LEU A 436 -11.956 18.722 15.880 1.00 43.76 C ATOM 132 O LEU A 436 -12.069 19.611 15.035 1.00 42.28 O ATOM 133 CB LEU A 436 -12.830 19.920 17.907 1.00 44.12 C ATOM 134 CG LEU A 436 -14.197 19.278 18.134 1.00 50.77 C ATOM 135 CD1 LEU A 436 -14.167 18.332 19.326 1.00 52.54 C ATOM 136 CD2 LEU A 436 -15.246 20.359 18.326 1.00 56.14 C ATOM 137 N THR A 437 -12.068 17.427 15.588 1.00 42.58 N ATOM 138 CA THR A 437 -12.252 16.951 14.217 1.00 43.42 C ATOM 139 C THR A 437 -13.110 15.691 14.151 1.00 43.55 C ATOM 140 O THR A 437 -13.326 15.015 15.158 1.00 43.49 O ATOM 141 CB THR A 437 -10.906 16.626 13.511 1.00 42.68 C ATOM 142 OG1 THR A 437 -10.249 15.549 14.191 1.00 44.97 O ATOM 143 CG2 THR A 437 -9.983 17.837 13.452 1.00 41.63 C ATOM 144 N CYS A 438 -13.604 15.398 12.953 1.00 41.55 N ATOM 145 CA CYS A 438 -14.243 14.122 12.655 1.00 42.09 C ATOM 146 C CYS A 438 -13.180 13.037 12.508 1.00 40.41 C ATOM 147 O CYS A 438 -11.995 13.336 12.366 1.00 39.34 O ATOM 148 CB CYS A 438 -15.093 14.217 11.387 1.00 41.82 C ATOM 149 SG CYS A 438 -14.151 14.361 9.849 1.00 40.18 S ATOM 150 N GLY A 439 -13.599 11.778 12.577 1.00 44.55 N ATOM 151 CA GLY A 439 -12.688 10.664 12.387 1.00 40.78 C ATOM 152 C GLY A 439 -11.985 10.656 11.038 1.00 39.30 C ATOM 153 O GLY A 439 -10.815 10.281 10.945 1.00 36.57 O ATOM 154 N SER A 440 -12.689 11.071 9.989 1.00 39.18 N ATOM 155 CA SER A 440 -12.130 11.015 8.640 1.00 40.13 C ATOM 156 C SER A 440 -10.982 12.012 8.468 1.00 37.22 C ATOM 157 O SER A 440 -9.969 11.696 7.842 1.00 36.77 O ATOM 158 CB SER A 440 -13.218 11.266 7.588 1.00 38.66 C ATOM 159 OG SER A 440 -13.606 12.630 7.544 1.00 41.54 O ATOM 160 N CYS A 441 -11.138 13.209 9.027 1.00 36.25 N ATOM 161 CA CYS A 441 -10.091 14.225 8.951 1.00 39.14 C ATOM 162 C CYS A 441 -8.902 13.864 9.837 1.00 39.37 C ATOM 163 O CYS A 441 -7.774 14.288 9.580 1.00 36.77 O ATOM 164 CB CYS A 441 -10.638 15.600 9.342 1.00 38.25 C ATOM 165 SG CYS A 441 -11.742 16.340 8.116 1.00 36.29 S ATOM 166 N LYS A 442 -9.165 13.084 10.883 1.00 39.96 N ATOM 167 CA LYS A 442 -8.111 12.600 11.769 1.00 39.68 C ATOM 168 C LYS A 442 -7.116 11.730 11.014 1.00 37.78 C ATOM 169 O LYS A 442 -5.912 11.988 11.034 1.00 37.78 O ATOM 170 CB LYS A 442 -8.705 11.812 12.937 1.00 41.16 C ATOM 171 CG LYS A 442 -7.666 11.108 13.800 1.00 41.66 C ATOM 172 CD LYS A 442 -8.319 10.314 14.920 1.00 43.75 C ATOM 173 CE LYS A 442 -8.566 8.867 14.528 1.00 47.71 C ATOM 174 NZ LYS A 442 -7.325 8.049 14.620 1.00 50.96 N ATOM 175 N VAL A 443 -7.626 10.701 10.343 1.00 38.75 N ATOM 176 CA VAL A 443 -6.771 9.777 9.609 1.00 38.51 C ATOM 177 C VAL A 443 -6.230 10.412 8.327 1.00 36.69 C ATOM 178 O VAL A 443 -5.148 10.051 7.863 1.00 37.83 O ATOM 179 CB VAL A 443 -7.513 8.460 9.267 1.00 41.85 C ATOM 180 CG1 VAL A 443 -7.911 7.731 10.545 1.00 40.74 C ATOM 181 CG2 VAL A 443 -8.735 8.726 8.401 1.00 40.61 C ATOM 182 N PHE A 444 -6.971 11.360 7.761 1.00 36.73 N ATOM 183 CA PHE A 444 -6.486 12.089 6.592 1.00 38.85 C ATOM 184 C PHE A 444 -5.217 12.861 6.937 1.00 35.80 C ATOM 185 O PHE A 444 -4.222 12.796 6.216 1.00 33.66 O ATOM 186 CB PHE A 444 -7.551 13.050 6.052 1.00 34.66 C ATOM 187 CG PHE A 444 -7.029 14.012 5.017 1.00 35.51 C ATOM 188 CD1 PHE A 444 -6.931 13.635 3.687 1.00 38.87 C ATOM 189 CD2 PHE A 444 -6.629 15.291 5.375 1.00 34.79 C ATOM 190 CE1 PHE A 444 -6.446 14.515 2.734 1.00 39.19 C ATOM 191 CE2 PHE A 444 -6.143 16.173 4.428 1.00 37.69 C ATOM 192 CZ PHE A 444 -6.053 15.785 3.105 1.00 37.84 C ATOM 193 N PHE A 445 -5.261 13.592 8.046 1.00 34.51 N ATOM 194 CA PHE A 445 -4.118 14.388 8.475 1.00 37.71 C ATOM 195 C PHE A 445 -2.913 13.505 8.775 1.00 36.95 C ATOM 196 O PHE A 445 -1.791 13.818 8.379 1.00 36.91 O ATOM 197 CB PHE A 445 -4.470 15.228 9.703 1.00 35.52 C ATOM 198 CG PHE A 445 -3.329 16.066 10.204 1.00 38.08 C ATOM 199 CD1 PHE A 445 -2.926 17.195 9.507 1.00 34.57 C ATOM 200 CD2 PHE A 445 -2.656 15.723 11.364 1.00 37.80 C ATOM 201 CE1 PHE A 445 -1.874 17.966 9.957 1.00 34.78 C ATOM 202 CE2 PHE A 445 -1.602 16.493 11.821 1.00 40.49 C ATOM 203 CZ PHE A 445 -1.211 17.617 11.115 1.00 39.24 C ATOM 204 N LYS A 446 -3.157 12.401 9.475 1.00 36.63 N ATOM 205 CA LYS A 446 -2.104 11.442 9.787 1.00 39.22 C ATOM 206 C LYS A 446 -1.424 10.941 8.516 1.00 38.18 C ATOM 207 O LYS A 446 -0.198 10.924 8.430 1.00 39.31 O ATOM 208 CB LYS A 446 -2.671 10.264 10.584 1.00 40.18 C ATOM 209 CG LYS A 446 -1.668 9.153 10.852 1.00 40.73 C ATOM 210 CD LYS A 446 -0.560 9.613 11.787 1.00 45.42 C ATOM 211 CE LYS A 446 0.299 8.439 12.240 1.00 49.46 C ATOM 212 NZ LYS A 446 1.426 8.871 13.112 1.00 51.86 N ATOM 213 N ARG A 447 -2.225 10.548 7.530 1.00 35.88 N ATOM 214 CA ARG A 447 -1.699 10.101 6.244 1.00 39.94 C ATOM 215 C ARG A 447 -0.909 11.201 5.539 1.00 40.77 C ATOM 216 O ARG A 447 0.204 10.975 5.066 1.00 40.34 O ATOM 217 CB ARG A 447 -2.831 9.627 5.329 1.00 40.89 C ATOM 218 CG ARG A 447 -3.388 8.257 5.669 1.00 43.43 C ATOM 219 CD ARG A 447 -4.205 7.697 4.512 1.00 45.98 C ATOM 220 NE ARG A 447 -5.272 8.604 4.095 1.00 47.28 N ATOM 221 CZ ARG A 447 -6.490 8.616 4.628 1.00 45.76 C ATOM 222 NH1 ARG A 447 -6.794 7.770 5.604 1.00 45.42 N ATOM 223 NH2 ARG A 447 -7.404 9.472 4.188 1.00 41.29 N ATOM 224 N ALA A 448 -1.499 12.390 5.473 1.00 39.12 N ATOM 225 CA ALA A 448 -0.906 13.509 4.747 1.00 40.94 C ATOM 226 C ALA A 448 0.424 13.938 5.351 1.00 44.39 C ATOM 227 O ALA A 448 1.376 14.239 4.632 1.00 46.06 O ATOM 228 CB ALA A 448 -1.870 14.683 4.715 1.00 38.46 C ATOM 229 N VAL A 449 0.487 13.954 6.677 1.00 41.53 N ATOM 230 CA VAL A 449 1.665 14.450 7.373 1.00 43.97 C ATOM 231 C VAL A 449 2.806 13.425 7.372 1.00 46.92 C ATOM 232 O VAL A 449 3.978 13.802 7.386 1.00 48.27 O ATOM 233 CB VAL A 449 1.313 14.866 8.825 1.00 43.00 C ATOM 234 CG1 VAL A 449 1.173 13.654 9.731 1.00 43.65 C ATOM 235 CG2 VAL A 449 2.356 15.805 9.372 1.00 45.59 C ATOM 236 N GLU A 450 2.470 12.136 7.342 1.00 46.76 N ATOM 237 CA GLU A 450 3.485 11.086 7.277 1.00 50.79 C ATOM 238 C GLU A 450 3.984 10.921 5.854 1.00 52.16 C ATOM 239 O GLU A 450 5.148 10.597 5.617 1.00 54.94 O ATOM 240 CB GLU A 450 2.937 9.754 7.795 1.00 49.88 C ATOM 241 CG GLU A 450 2.588 9.751 9.276 1.00 50.74 C ATOM 242 CD GLU A 450 3.810 9.705 10.177 1.00 56.77 C ATOM 243 OE1 GLU A 450 4.945 9.648 9.657 1.00 60.12 O ATOM 244 OE2 GLU A 450 3.634 9.729 11.414 1.00 61.52 O ATOM 245 N GLY A 451 3.090 11.139 4.901 1.00 49.51 N ATOM 246 CA GLY A 451 3.475 11.119 3.508 1.00 55.74 C ATOM 247 C GLY A 451 4.174 12.413 3.152 1.00 59.87 C ATOM 248 O GLY A 451 4.470 13.235 4.033 1.00 59.47 O ATOM 249 N GLN A 452 4.437 12.597 1.861 1.00 62.82 N ATOM 250 CA GLN A 452 5.046 13.830 1.379 1.00 67.17 C ATOM 251 C GLN A 452 4.042 14.872 0.868 1.00 66.99 C ATOM 252 O GLN A 452 4.466 15.963 0.456 1.00 67.83 O ATOM 253 CB GLN A 452 6.100 13.529 0.307 1.00 69.13 C ATOM 254 CG GLN A 452 7.341 12.778 0.833 1.00 68.94 C ATOM 255 CD GLN A 452 8.370 12.513 -0.250 1.00 71.36 C ATOM 256 OE1 GLN A 452 8.068 11.900 -1.276 1.00 75.20 O ATOM 257 NE2 GLN A 452 9.598 12.970 -0.022 1.00 70.85 N ATOM 258 N HIS A 453 2.730 14.643 1.042 1.00 65.95 N ATOM 259 CA HIS A 453 1.707 15.679 0.672 1.00 65.65 C ATOM 260 C HIS A 453 1.939 16.273 -0.701 1.00 68.54 C ATOM 261 O HIS A 453 2.225 17.467 -0.808 1.00 68.97 O ATOM 262 CB HIS A 453 1.574 16.937 1.629 1.00 62.97 C ATOM 263 CG HIS A 453 2.559 17.069 2.777 1.00 58.15 C ATOM 264 ND1 HIS A 453 3.728 16.348 2.903 1.00 62.53 N ATOM 265 CD2 HIS A 453 2.700 18.116 3.635 1.00 56.51 C ATOM 266 CE1 HIS A 453 4.420 16.790 3.936 1.00 58.82 C ATOM 267 NE2 HIS A 453 3.831 17.886 4.387 1.00 53.99 N ATOM 268 N ASN A 454 1.810 15.481 -1.750 1.00 71.11 N ATOM 269 CA ASN A 454 2.147 16.030 -3.044 1.00 71.84 C ATOM 270 C ASN A 454 1.135 17.069 -3.522 1.00 64.91 C ATOM 271 O ASN A 454 1.364 17.715 -4.530 1.00 63.27 O ATOM 272 CB ASN A 454 2.280 14.917 -4.068 1.00 77.65 C ATOM 273 CG ASN A 454 2.884 13.668 -3.477 1.00 88.26 C ATOM 274 OD1 ASN A 454 2.176 12.832 -2.920 1.00 84.08 O ATOM 275 ND2 ASN A 454 4.200 13.529 -3.596 1.00 84.11 N ATOM 276 N TYR A 455 0.058 17.267 -2.765 1.00 62.12 N ATOM 277 CA TYR A 455 -1.195 17.854 -3.268 1.00 55.81 C ATOM 278 C TYR A 455 -1.118 19.166 -4.067 1.00 52.80 C ATOM 279 O TYR A 455 -0.412 20.106 -3.702 1.00 52.27 O ATOM 280 CB TYR A 455 -2.143 18.081 -2.090 1.00 52.10 C ATOM 281 CG TYR A 455 -2.188 16.927 -1.124 1.00 53.06 C ATOM 282 CD1 TYR A 455 -2.299 15.620 -1.579 1.00 52.86 C ATOM 283 CD2 TYR A 455 -2.093 17.141 0.244 1.00 53.19 C ATOM 284 CE1 TYR A 455 -2.327 14.562 -0.700 1.00 54.19 C ATOM 285 CE2 TYR A 455 -2.121 16.085 1.134 1.00 51.20 C ATOM 286 CZ TYR A 455 -2.238 14.799 0.655 1.00 53.80 C ATOM 287 OH TYR A 455 -2.266 13.743 1.535 1.00 54.79 O ATOM 288 N LEU A 456 -1.884 19.205 -5.155 1.00 47.60 N ATOM 289 CA LEU A 456 -2.063 20.407 -5.967 1.00 48.36 C ATOM 290 C LEU A 456 -3.543 20.770 -6.054 1.00 44.75 C ATOM 291 O LEU A 456 -4.381 19.919 -6.356 1.00 42.11 O ATOM 292 CB LEU A 456 -1.499 20.207 -7.377 1.00 47.77 C ATOM 293 CG LEU A 456 -0.014 19.873 -7.523 1.00 47.52 C ATOM 294 CD1 LEU A 456 0.297 19.463 -8.952 1.00 48.59 C ATOM 295 CD2 LEU A 456 0.844 21.057 -7.108 1.00 46.71 C ATOM 296 N CYS A 457 -3.864 22.032 -5.786 1.00 41.33 N ATOM 297 CA CYS A 457 -5.231 22.511 -5.938 1.00 41.09 C ATOM 298 C CYS A 457 -5.514 22.855 -7.396 1.00 41.03 C ATOM 299 O CYS A 457 -4.730 23.554 -8.037 1.00 41.58 O ATOM 300 CB CYS A 457 -5.481 23.730 -5.050 1.00 40.11 C ATOM 301 SG CYS A 457 -7.130 24.459 -5.224 1.00 37.11 S ATOM 302 N ALA A 458 -6.631 22.359 -7.917 1.00 39.88 N ATOM 303 CA ALA A 458 -7.031 22.661 -9.287 1.00 40.58 C ATOM 304 C ALA A 458 -7.748 24.007 -9.346 1.00 39.48 C ATOM 305 O ALA A 458 -7.993 24.551 -10.424 1.00 35.19 O ATOM 306 CB ALA A 458 -7.919 21.558 -9.839 1.00 38.33 C ATOM 307 N GLY A 459 -8.095 24.525 -8.172 1.00 39.30 N ATOM 308 CA GLY A 459 -8.749 25.813 -8.045 1.00 36.56 C ATOM 309 C GLY A 459 -7.815 26.928 -7.608 1.00 42.12 C ATOM 310 O GLY A 459 -6.643 26.966 -7.980 1.00 42.66 O ATOM 311 N ARG A 460 -8.371 27.857 -6.836 1.00 38.34 N ATOM 312 CA ARG A 460 -7.670 29.040 -6.337 1.00 43.47 C ATOM 313 C ARG A 460 -7.127 28.880 -4.909 1.00 43.21 C ATOM 314 O ARG A 460 -6.742 29.864 -4.277 1.00 43.23 O ATOM 315 CB ARG A 460 -8.591 30.255 -6.444 1.00 41.43 C ATOM 316 CG ARG A 460 -8.941 30.561 -7.896 1.00 47.31 C ATOM 317 CD ARG A 460 -9.938 31.692 -8.059 1.00 50.59 C ATOM 318 NE ARG A 460 -10.371 31.797 -9.450 1.00 56.80 N ATOM 319 CZ ARG A 460 -11.246 32.689 -9.903 1.00 60.71 C ATOM 320 NH1 ARG A 460 -11.792 33.570 -9.075 1.00 60.31 N ATOM 321 NH2 ARG A 460 -11.575 32.700 -11.188 1.00 69.74 N ATOM 322 N ASN A 461 -7.159 27.648 -4.403 1.00 41.56 N ATOM 323 CA ASN A 461 -6.813 27.299 -3.018 1.00 42.32 C ATOM 324 C ASN A 461 -7.792 27.874 -1.998 1.00 39.09 C ATOM 325 O ASN A 461 -7.455 28.023 -0.826 1.00 39.78 O ATOM 326 CB ASN A 461 -5.396 27.782 -2.658 1.00 42.39 C ATOM 327 CG ASN A 461 -4.306 27.079 -3.445 1.00 44.17 C ATOM 328 OD1 ASN A 461 -3.704 27.663 -4.347 1.00 48.91 O ATOM 329 ND2 ASN A 461 -4.018 25.834 -3.081 1.00 41.74 N ATOM 330 N ASP A 462 -8.983 28.237 -2.459 1.00 41.12 N ATOM 331 CA ASP A 462 -10.101 28.598 -1.584 1.00 41.78 C ATOM 332 C ASP A 462 -11.205 27.537 -1.486 1.00 38.47 C ATOM 333 O ASP A 462 -12.292 27.843 -1.002 1.00 43.53 O ATOM 334 CB ASP A 462 -10.698 29.945 -1.997 1.00 44.34 C ATOM 335 CG ASP A 462 -10.841 30.086 -3.484 1.00 41.98 C ATOM 336 OD1 ASP A 462 -10.873 29.051 -4.182 1.00 41.23 O ATOM 337 OD2 ASP A 462 -10.919 31.240 -3.953 1.00 52.12 O ATOM 338 N CYS A 463 -10.962 26.333 -2.008 1.00 39.40 N ATOM 339 CA CYS A 463 -12.005 25.303 -2.130 1.00 38.95 C ATOM 340 C CYS A 463 -12.823 25.082 -0.862 1.00 37.16 C ATOM 341 O CYS A 463 -12.289 25.096 0.246 1.00 39.67 O ATOM 342 CB CYS A 463 -11.392 23.954 -2.533 1.00 35.95 C ATOM 343 SG CYS A 463 -10.702 23.851 -4.190 1.00 37.18 S ATOM 344 N ILE A 464 -14.130 24.903 -1.040 1.00 36.71 N ATOM 345 CA ILE A 464 -15.022 24.572 0.065 1.00 36.78 C ATOM 346 C ILE A 464 -14.789 23.136 0.522 1.00 38.40 C ATOM 347 O ILE A 464 -14.851 22.201 -0.278 1.00 40.30 O ATOM 348 CB ILE A 464 -16.512 24.747 -0.320 1.00 38.95 C ATOM 349 CG1 ILE A 464 -16.803 26.185 -0.758 1.00 37.52 C ATOM 350 CG2 ILE A 464 -17.413 24.351 0.840 1.00 40.01 C ATOM 351 CD1 ILE A 464 -17.799 26.284 -1.895 1.00 46.75 C ATOM 352 N ILE A 465 -14.515 22.965 1.809 1.00 38.85 N ATOM 353 CA ILE A 465 -14.291 21.638 2.363 1.00 38.91 C ATOM 354 C ILE A 465 -15.400 21.267 3.338 1.00 40.81 C ATOM 355 O ILE A 465 -15.494 21.822 4.433 1.00 37.63 O ATOM 356 CB ILE A 465 -12.931 21.546 3.076 1.00 38.54 C ATOM 357 CG1 ILE A 465 -11.800 21.855 2.092 1.00 37.77 C ATOM 358 CG2 ILE A 465 -12.745 20.171 3.700 1.00 36.70 C ATOM 359 CD1 ILE A 465 -11.734 20.899 0.919 1.00 38.31 C ATOM 360 N ASP A 466 -16.240 20.324 2.925 1.00 38.63 N ATOM 361 CA ASP A 466 -17.302 19.812 3.777 1.00 41.67 C ATOM 362 C ASP A 466 -17.481 18.321 3.518 1.00 41.63 C ATOM 363 O ASP A 466 -16.705 17.725 2.772 1.00 41.08 O ATOM 364 CB ASP A 466 -18.612 20.573 3.546 1.00 41.73 C ATOM 365 CG ASP A 466 -19.134 20.438 2.127 1.00 43.85 C ATOM 366 OD1 ASP A 466 -18.387 19.956 1.248 1.00 41.01 O ATOM 367 OD2 ASP A 466 -20.302 20.816 1.891 1.00 45.71 O ATOM 368 N LYS A 467 -18.503 17.729 4.129 1.00 43.48 N ATOM 369 CA LYS A 467 -18.741 16.290 4.026 1.00 43.74 C ATOM 370 C LYS A 467 -18.819 15.820 2.573 1.00 42.34 C ATOM 371 O LYS A 467 -18.344 14.737 2.237 1.00 44.47 O ATOM 372 CB LYS A 467 -20.026 15.912 4.769 1.00 43.58 C ATOM 373 CG LYS A 467 -20.236 14.415 4.946 1.00 48.10 C ATOM 374 CD LYS A 467 -21.505 14.133 5.737 1.00 51.35 C ATOM 375 CE LYS A 467 -21.831 12.650 5.763 1.00 53.89 C ATOM 376 NZ LYS A 467 -21.012 11.925 6.772 1.00 59.55 N ATOM 377 N ILE A 468 -19.408 16.647 1.715 1.00 42.79 N ATOM 378 CA ILE A 468 -19.551 16.317 0.299 1.00 43.87 C ATOM 379 C ILE A 468 -18.268 16.517 -0.512 1.00 43.12 C ATOM 380 O ILE A 468 -17.887 15.662 -1.313 1.00 43.98 O ATOM 381 CB ILE A 468 -20.656 17.166 -0.358 1.00 43.31 C ATOM 382 CG1 ILE A 468 -21.904 17.211 0.525 1.00 44.13 C ATOM 383 CG2 ILE A 468 -20.975 16.644 -1.755 1.00 42.85 C ATOM 384 CD1 ILE A 468 -22.900 18.280 0.107 1.00 43.62 C ATOM 385 N ARG A 469 -17.624 17.663 -0.319 1.00 41.05 N ATOM 386 CA ARG A 469 -16.529 18.086 -1.191 1.00 40.47 C ATOM 387 C ARG A 469 -15.106 17.833 -0.676 1.00 41.21 C ATOM 388 O ARG A 469 -14.142 18.111 -1.390 1.00 40.24 O ATOM 389 CB ARG A 469 -16.693 19.577 -1.502 1.00 38.51 C ATOM 390 CG ARG A 469 -17.822 19.869 -2.478 1.00 39.72 C ATOM 391 CD ARG A 469 -18.292 21.314 -2.399 1.00 38.10 C ATOM 392 NE ARG A 469 -19.282 21.497 -1.342 1.00 40.12 N ATOM 393 CZ ARG A 469 -20.125 22.522 -1.274 1.00 38.98 C ATOM 394 NH1 ARG A 469 -20.105 23.468 -2.204 1.00 40.05 N ATOM 395 NH2 ARG A 469 -20.991 22.601 -0.274 1.00 43.55 N ATOM 396 N ARG A 470 -14.964 17.303 0.537 1.00 39.22 N ATOM 397 CA ARG A 470 -13.634 17.161 1.140 1.00 40.04 C ATOM 398 C ARG A 470 -12.726 16.200 0.368 1.00 39.14 C ATOM 399 O ARG A 470 -11.501 16.319 0.424 1.00 38.48 O ATOM 400 CB ARG A 470 -13.744 16.707 2.601 1.00 38.72 C ATOM 401 CG ARG A 470 -14.391 15.347 2.804 1.00 37.36 C ATOM 402 CD ARG A 470 -14.696 15.098 4.278 1.00 40.23 C ATOM 403 NE ARG A 470 -15.357 13.813 4.486 1.00 40.58 N ATOM 404 CZ ARG A 470 -16.026 13.480 5.586 1.00 41.95 C ATOM 405 NH1 ARG A 470 -16.133 14.338 6.593 1.00 39.29 N ATOM 406 NH2 ARG A 470 -16.596 12.287 5.677 1.00 40.39 N ATOM 407 N LYS A 471 -13.324 15.257 -0.354 1.00 35.68 N ATOM 408 CA LYS A 471 -12.559 14.310 -1.159 1.00 36.62 C ATOM 409 C LYS A 471 -11.921 14.986 -2.371 1.00 40.94 C ATOM 410 O LYS A 471 -10.864 14.565 -2.843 1.00 38.67 O ATOM 411 CB LYS A 471 -13.450 13.158 -1.628 1.00 40.12 C ATOM 412 CG LYS A 471 -14.017 12.295 -0.512 1.00 41.04 C ATOM 413 CD LYS A 471 -14.841 11.147 -1.080 1.00 42.94 C ATOM 414 CE LYS A 471 -15.320 10.204 0.014 1.00 44.14 C ATOM 415 NZ LYS A 471 -16.240 10.880 0.973 1.00 45.87 N ATOM 416 N ASN A 472 -12.574 16.033 -2.868 1.00 37.78 N ATOM 417 CA ASN A 472 -12.150 16.706 -4.093 1.00 38.92 C ATOM 418 C ASN A 472 -10.753 17.312 -4.026 1.00 38.12 C ATOM 419 O ASN A 472 -9.965 17.171 -4.961 1.00 39.05 O ATOM 420 CB ASN A 472 -13.148 17.805 -4.462 1.00 38.09 C ATOM 421 CG ASN A 472 -14.486 17.255 -4.913 1.00 39.54 C ATOM 422 OD1 ASN A 472 -14.845 16.121 -4.598 1.00 45.15 O ATOM 423 ND2 ASN A 472 -15.232 18.062 -5.659 1.00 42.21 N ATOM 424 N CYS A 473 -10.449 17.997 -2.929 1.00 34.20 N ATOM 425 CA CYS A 473 -9.196 18.733 -2.847 1.00 37.73 C ATOM 426 C CYS A 473 -8.450 18.506 -1.538 1.00 36.48 C ATOM 427 O CYS A 473 -8.636 19.253 -0.579 1.00 34.52 O ATOM 428 CB CYS A 473 -9.453 20.229 -3.037 1.00 33.92 C ATOM 429 SG CYS A 473 -7.958 21.179 -3.359 1.00 35.97 S ATOM 430 N PRO A 474 -7.600 17.467 -1.498 1.00 38.82 N ATOM 431 CA PRO A 474 -6.727 17.221 -0.346 1.00 39.58 C ATOM 432 C PRO A 474 -5.768 18.380 -0.084 1.00 37.54 C ATOM 433 O PRO A 474 -5.314 18.543 1.046 1.00 37.87 O ATOM 434 CB PRO A 474 -5.959 15.951 -0.744 1.00 39.13 C ATOM 435 CG PRO A 474 -6.155 15.811 -2.219 1.00 39.59 C ATOM 436 CD PRO A 474 -7.496 16.397 -2.504 1.00 37.87 C ATOM 437 N ALA A 475 -5.470 19.170 -1.113 1.00 37.63 N ATOM 438 CA ALA A 475 -4.613 20.343 -0.958 1.00 37.06 C ATOM 439 C ALA A 475 -5.234 21.346 0.004 1.00 35.25 C ATOM 440 O ALA A 475 -4.607 21.757 0.982 1.00 33.92 O ATOM 441 CB ALA A 475 -4.353 20.996 -2.306 1.00 41.57 C ATOM 442 N CYS A 476 -6.473 21.731 -0.274 1.00 35.22 N ATOM 443 CA CYS A 476 -7.176 22.682 0.574 1.00 35.48 C ATOM 444 C CYS A 476 -7.570 22.060 1.912 1.00 33.21 C ATOM 445 O CYS A 476 -7.663 22.758 2.915 1.00 31.53 O ATOM 446 CB CYS A 476 -8.412 23.225 -0.145 1.00 35.58 C ATOM 447 SG CYS A 476 -8.031 24.381 -1.488 1.00 32.53 S ATOM 448 N ARG A 477 -7.799 20.750 1.927 1.00 34.19 N ATOM 449 CA ARG A 477 -8.155 20.061 3.166 1.00 33.51 C ATOM 450 C ARG A 477 -6.965 20.024 4.120 1.00 31.62 C ATOM 451 O ARG A 477 -7.113 20.238 5.323 1.00 33.34 O ATOM 452 CB ARG A 477 -8.650 18.640 2.880 1.00 35.66 C ATOM 453 CG ARG A 477 -9.242 17.924 4.095 1.00 34.65 C ATOM 454 CD ARG A 477 -9.695 16.509 3.745 1.00 36.30 C ATOM 455 NE ARG A 477 -10.407 15.860 4.845 1.00 36.39 N ATOM 456 CZ ARG A 477 -10.923 14.635 4.783 1.00 37.18 C ATOM 457 NH1 ARG A 477 -10.809 13.921 3.673 1.00 36.05 N ATOM 458 NH2 ARG A 477 -11.555 14.122 5.831 1.00 38.39 N ATOM 459 N TYR A 478 -5.782 19.758 3.574 1.00 32.05 N ATOM 460 CA TYR A 478 -4.561 19.734 4.370 1.00 34.45 C ATOM 461 C TYR A 478 -4.217 21.129 4.878 1.00 33.89 C ATOM 462 O TYR A 478 -3.729 21.286 5.999 1.00 34.62 O ATOM 463 CB TYR A 478 -3.398 19.162 3.557 1.00 36.20 C ATOM 464 CG TYR A 478 -2.094 19.065 4.319 1.00 37.64 C ATOM 465 CD1 TYR A 478 -1.976 18.246 5.436 1.00 37.44 C ATOM 466 CD2 TYR A 478 -0.976 19.780 3.911 1.00 41.00 C ATOM 467 CE1 TYR A 478 -0.782 18.150 6.130 1.00 39.66 C ATOM 468 CE2 TYR A 478 0.216 19.694 4.599 1.00 41.39 C ATOM 469 CZ TYR A 478 0.312 18.875 5.705 1.00 42.82 C ATOM 470 OH TYR A 478 1.505 18.788 6.388 1.00 41.84 O ATOM 471 N ARG A 479 -4.472 22.138 4.050 1.00 30.90 N ATOM 472 CA ARG A 479 -4.259 23.525 4.449 1.00 35.09 C ATOM 473 C ARG A 479 -5.138 23.875 5.645 1.00 32.89 C ATOM 474 O ARG A 479 -4.670 24.461 6.620 1.00 31.97 O ATOM 475 CB ARG A 479 -4.542 24.481 3.284 1.00 33.75 C ATOM 476 CG ARG A 479 -4.516 25.953 3.681 1.00 37.22 C ATOM 477 CD ARG A 479 -4.733 26.878 2.488 1.00 37.75 C ATOM 478 NE ARG A 479 -5.919 26.524 1.713 1.00 37.53 N ATOM 479 CZ ARG A 479 -7.165 26.828 2.068 1.00 39.64 C ATOM 480 NH1 ARG A 479 -7.396 27.487 3.196 1.00 35.29 N ATOM 481 NH2 ARG A 479 -8.181 26.465 1.296 1.00 35.53 N ATOM 482 N LYS A 480 -6.411 23.496 5.570 1.00 32.77 N ATOM 483 CA LYS A 480 -7.353 23.770 6.651 1.00 34.62 C ATOM 484 C LYS A 480 -7.006 22.983 7.915 1.00 35.24 C ATOM 485 O LYS A 480 -7.319 23.416 9.023 1.00 35.82 O ATOM 486 CB LYS A 480 -8.785 23.455 6.209 1.00 34.26 C ATOM 487 CG LYS A 480 -9.321 24.384 5.124 1.00 34.55 C ATOM 488 CD LYS A 480 -10.815 24.188 4.917 1.00 35.08 C ATOM 489 CE LYS A 480 -11.597 24.644 6.143 1.00 40.84 C ATOM 490 NZ LYS A 480 -13.046 24.296 6.067 1.00 39.53 N ATOM 491 N CYS A 481 -6.364 21.830 7.749 1.00 34.33 N ATOM 492 CA CYS A 481 -5.880 21.064 8.895 1.00 36.94 C ATOM 493 C CYS A 481 -4.789 21.838 9.629 1.00 34.10 C ATOM 494 O CYS A 481 -4.809 21.945 10.854 1.00 34.27 O ATOM 495 CB CYS A 481 -5.346 19.697 8.459 1.00 32.38 C ATOM 496 SG CYS A 481 -6.613 18.471 8.062 1.00 35.83 S ATOM 497 N LEU A 482 -3.843 22.379 8.867 1.00 33.00 N ATOM 498 CA LEU A 482 -2.734 23.141 9.432 1.00 36.07 C ATOM 499 C LEU A 482 -3.201 24.466 10.025 1.00 35.90 C ATOM 500 O LEU A 482 -2.778 24.848 11.115 1.00 36.71 O ATOM 501 CB LEU A 482 -1.664 23.398 8.369 1.00 34.34 C ATOM 502 CG LEU A 482 -0.942 22.164 7.825 1.00 37.26 C ATOM 503 CD1 LEU A 482 0.007 22.554 6.703 1.00 36.97 C ATOM 504 CD2 LEU A 482 -0.193 21.443 8.937 1.00 37.40 C ATOM 505 N GLN A 483 -4.069 25.165 9.299 1.00 36.99 N ATOM 506 CA GLN A 483 -4.599 26.441 9.765 1.00 39.14 C ATOM 507 C GLN A 483 -5.361 26.268 11.077 1.00 37.27 C ATOM 508 O GLN A 483 -5.357 27.157 11.926 1.00 35.30 O ATOM 509 CB GLN A 483 -5.505 27.071 8.703 1.00 35.17 C ATOM 510 CG GLN A 483 -4.757 27.642 7.507 1.00 40.56 C ATOM 511 CD GLN A 483 -5.689 28.174 6.429 1.00 41.50 C ATOM 512 OE1 GLN A 483 -6.899 27.945 6.469 1.00 44.92 O ATOM 513 NE2 GLN A 483 -5.128 28.890 5.463 1.00 39.23 N ATOM 514 N ALA A 484 -6.001 25.115 11.242 1.00 35.36 N ATOM 515 CA ALA A 484 -6.750 24.827 12.460 1.00 35.89 C ATOM 516 C ALA A 484 -5.812 24.489 13.618 1.00 38.23 C ATOM 517 O ALA A 484 -6.225 24.481 14.778 1.00 36.56 O ATOM 518 CB ALA A 484 -7.733 23.691 12.223 1.00 34.44 C ATOM 519 N GLY A 485 -4.552 24.211 13.300 1.00 35.26 N ATOM 520 CA GLY A 485 -3.554 23.961 14.323 1.00 34.11 C ATOM 521 C GLY A 485 -3.225 22.500 14.576 1.00 37.47 C ATOM 522 O GLY A 485 -2.599 22.178 15.584 1.00 35.06 O ATOM 523 N MET A 486 -3.640 21.611 13.674 1.00 36.23 N ATOM 524 CA MET A 486 -3.354 20.183 13.833 1.00 39.07 C ATOM 525 C MET A 486 -1.853 19.903 13.765 1.00 39.53 C ATOM 526 O MET A 486 -1.159 20.416 12.888 1.00 38.55 O ATOM 527 CB MET A 486 -4.088 19.355 12.771 1.00 36.13 C ATOM 528 CG MET A 486 -5.604 19.401 12.872 1.00 36.33 C ATOM 529 SD MET A 486 -6.431 18.302 11.704 1.00 38.61 S ATOM 530 CE MET A 486 -6.201 16.711 12.497 1.00 35.94 C ATOM 531 N ASN A 487 -1.365 19.102 14.708 1.00 39.79 N ATOM 532 CA ASN A 487 0.044 18.740 14.784 1.00 43.94 C ATOM 533 C ASN A 487 0.226 17.387 15.484 1.00 47.41 C ATOM 534 O ASN A 487 -0.565 17.016 16.359 1.00 45.58 O ATOM 535 CB ASN A 487 0.829 19.844 15.492 1.00 45.17 C ATOM 536 CG ASN A 487 0.404 20.032 16.931 1.00 48.05 C ATOM 537 OD1 ASN A 487 1.023 19.488 17.836 1.00 52.09 O ATOM 538 ND2 ASN A 487 -0.649 20.810 17.150 1.00 42.16 N ATOM 539 N LEU A 488 1.264 16.647 15.096 1.00 49.56 N ATOM 540 CA LEU A 488 1.397 15.239 15.503 1.00 51.66 C ATOM 541 C LEU A 488 1.723 15.035 16.977 1.00 54.62 C ATOM 542 O LEU A 488 1.265 14.080 17.580 1.00 54.44 O ATOM 543 CB LEU A 488 2.464 14.538 14.669 1.00 49.83 C ATOM 544 CG LEU A 488 2.039 13.994 13.313 1.00 48.59 C ATOM 545 CD1 LEU A 488 3.006 12.916 12.835 1.00 48.45 C ATOM 546 CD2 LEU A 488 0.621 13.448 13.390 1.00 48.62 C ATOM 547 N GLU A 489 2.483 15.952 17.562 1.00 56.66 N ATOM 548 CA GLU A 489 2.992 15.763 18.914 1.00 59.12 C ATOM 549 C GLU A 489 1.999 16.306 19.932 1.00 58.34 C ATOM 550 O GLU A 489 2.249 16.228 21.148 1.00 62.10 O ATOM 551 CB GLU A 489 4.371 16.432 19.096 1.00 62.27 C ATOM 552 CG GLU A 489 5.519 15.829 18.259 1.00 62.97 C ATOM 553 CD GLU A 489 5.718 14.351 18.502 1.00 67.85 C ATOM 554 OE1 GLU A 489 5.686 13.913 19.681 1.00 70.67 O ATOM 555 OE2 GLU A 489 5.924 13.637 17.494 1.00 67.84 O ATOM 556 N ALA A 490 0.861 16.810 19.447 1.00 56.64 N ATOM 557 CA ALA A 490 -0.189 17.298 20.344 1.00 55.56 C ATOM 558 C ALA A 490 -0.987 16.166 20.970 1.00 57.09 C ATOM 559 O ALA A 490 -0.487 15.432 21.812 1.00 60.54 O ATOM 560 CB ALA A 490 -1.137 18.242 19.610 1.00 50.26 C TER 561 ALA A 490 ATOM 562 O5' DC C 1 -17.239 6.405 27.934 1.00 60.22 O ATOM 563 C5' DC C 1 -17.414 7.473 28.857 1.00 58.92 C ATOM 564 C4' DC C 1 -16.080 8.110 29.201 1.00 59.19 C ATOM 565 O4' DC C 1 -15.254 7.151 29.894 1.00 58.51 O ATOM 566 C3' DC C 1 -15.253 8.541 28.004 1.00 57.90 C ATOM 567 O3' DC C 1 -15.635 9.853 27.605 1.00 61.58 O ATOM 568 C2' DC C 1 -13.830 8.520 28.561 1.00 56.36 C ATOM 569 C1' DC C 1 -13.889 7.412 29.621 1.00 56.37 C ATOM 570 N1 DC C 1 -13.234 6.138 29.201 1.00 53.82 N ATOM 571 C2 DC C 1 -11.841 6.023 29.261 1.00 53.90 C ATOM 572 O2 DC C 1 -11.173 6.986 29.656 1.00 54.45 O ATOM 573 N3 DC C 1 -11.260 4.857 28.881 1.00 53.16 N ATOM 574 C4 DC C 1 -12.016 3.842 28.460 1.00 52.82 C ATOM 575 N4 DC C 1 -11.399 2.712 28.097 1.00 52.17 N ATOM 576 C5 DC C 1 -13.437 3.939 28.394 1.00 53.34 C ATOM 577 C6 DC C 1 -13.998 5.093 28.771 1.00 53.95 C ATOM 578 P DT C 2 -15.473 10.319 26.075 1.00 64.62 P ATOM 579 OP1 DT C 2 -16.076 11.665 25.960 1.00 61.26 O ATOM 580 OP2 DT C 2 -15.947 9.219 25.205 1.00 58.29 O ATOM 581 O5' DT C 2 -13.892 10.449 25.878 1.00 55.45 O ATOM 582 C5' DT C 2 -13.163 11.436 26.597 1.00 51.80 C ATOM 583 C4' DT C 2 -11.675 11.256 26.373 1.00 52.46 C ATOM 584 O4' DT C 2 -11.275 9.975 26.893 1.00 54.49 O ATOM 585 C3' DT C 2 -11.259 11.235 24.913 1.00 51.75 C ATOM 586 O3' DT C 2 -10.960 12.556 24.485 1.00 52.24 O ATOM 587 C2' DT C 2 -10.009 10.351 24.912 1.00 50.81 C ATOM 588 C1' DT C 2 -10.167 9.488 26.167 1.00 52.16 C ATOM 589 N1 DT C 2 -10.392 8.046 25.880 1.00 52.95 N ATOM 590 C2 DT C 2 -9.310 7.203 25.792 1.00 52.73 C ATOM 591 O2 DT C 2 -8.159 7.579 25.930 1.00 53.02 O ATOM 592 N3 DT C 2 -9.623 5.896 25.533 1.00 53.29 N ATOM 593 C4 DT C 2 -10.886 5.358 25.360 1.00 52.15 C ATOM 594 O4 DT C 2 -11.066 4.168 25.131 1.00 53.04 O ATOM 595 C5 DT C 2 -11.977 6.297 25.466 1.00 52.89 C ATOM 596 C7 DT C 2 -13.392 5.830 25.294 1.00 53.57 C ATOM 597 C6 DT C 2 -11.681 7.580 25.719 1.00 52.51 C ATOM 598 P DG C 3 -10.979 12.931 22.923 1.00 51.61 P ATOM 599 OP1 DG C 3 -10.847 14.401 22.834 1.00 46.76 O ATOM 600 OP2 DG C 3 -12.132 12.248 22.295 1.00 46.70 O ATOM 601 O5' DG C 3 -9.649 12.256 22.347 1.00 48.13 O ATOM 602 C5' DG C 3 -8.376 12.642 22.852 1.00 47.46 C ATOM 603 C4' DG C 3 -7.298 11.689 22.370 1.00 48.19 C ATOM 604 O4' DG C 3 -7.606 10.337 22.813 1.00 48.32 O ATOM 605 C3' DG C 3 -7.144 11.610 20.847 1.00 46.75 C ATOM 606 O3' DG C 3 -5.768 11.581 20.502 1.00 50.27 O ATOM 607 C2' DG C 3 -7.829 10.293 20.502 1.00 45.70 C ATOM 608 C1' DG C 3 -7.477 9.461 21.719 1.00 49.28 C ATOM 609 N9 DG C 3 -8.362 8.318 21.906 1.00 48.56 N ATOM 610 C8 DG C 3 -9.735 8.327 21.939 1.00 48.89 C ATOM 611 N7 DG C 3 -10.258 7.144 22.103 1.00 49.89 N ATOM 612 C5 DG C 3 -9.160 6.296 22.177 1.00 49.34 C ATOM 613 C6 DG C 3 -9.103 4.893 22.352 1.00 51.54 C ATOM 614 O6 DG C 3 -10.043 4.097 22.480 1.00 51.62 O ATOM 615 N1 DG C 3 -7.788 4.430 22.371 1.00 51.62 N ATOM 616 C2 DG C 3 -6.672 5.224 22.239 1.00 51.05 C ATOM 617 N2 DG C 3 -5.486 4.599 22.282 1.00 50.79 N ATOM 618 N3 DG C 3 -6.715 6.539 22.075 1.00 48.98 N ATOM 619 C4 DG C 3 -7.987 7.004 22.053 1.00 49.01 C ATOM 620 P DG C 4 -5.300 11.824 18.983 1.00 48.30 P ATOM 621 OP1 DG C 4 -4.593 13.122 18.949 1.00 45.50 O ATOM 622 OP2 DG C 4 -6.449 11.581 18.082 1.00 45.20 O ATOM 623 O5' DG C 4 -4.246 10.655 18.722 1.00 50.01 O ATOM 624 C5' DG C 4 -3.234 10.380 19.684 1.00 47.83 C ATOM 625 C4' DG C 4 -2.531 9.073 19.363 1.00 46.78 C ATOM 626 O4' DG C 4 -3.382 7.960 19.737 1.00 46.69 O ATOM 627 C3' DG C 4 -2.187 8.874 17.890 1.00 48.31 C ATOM 628 O3' DG C 4 -0.925 8.242 17.766 1.00 50.25 O ATOM 629 C2' DG C 4 -3.317 7.983 17.378 1.00 49.10 C ATOM 630 C1' DG C 4 -3.666 7.156 18.611 1.00 49.24 C ATOM 631 N9 DG C 4 -5.075 6.775 18.668 1.00 48.51 N ATOM 632 C8 DG C 4 -6.159 7.618 18.635 1.00 47.77 C ATOM 633 N7 DG C 4 -7.303 6.996 18.703 1.00 49.10 N ATOM 634 C5 DG C 4 -6.956 5.654 18.789 1.00 49.51 C ATOM 635 C6 DG C 4 -7.776 4.506 18.888 1.00 48.84 C ATOM 636 O6 DG C 4 -9.012 4.446 18.920 1.00 49.50 O ATOM 637 N1 DG C 4 -7.021 3.338 18.951 1.00 48.89 N ATOM 638 C2 DG C 4 -5.647 3.287 18.925 1.00 49.18 C ATOM 639 N2 DG C 4 -5.097 2.068 18.997 1.00 49.78 N ATOM 640 N3 DG C 4 -4.867 4.356 18.833 1.00 50.19 N ATOM 641 C4 DG C 4 -5.587 5.501 18.769 1.00 49.28 C ATOM 642 P DG C 5 -0.202 8.158 16.333 1.00 52.12 P ATOM 643 OP1 DG C 5 1.255 8.093 16.583 1.00 54.94 O ATOM 644 OP2 DG C 5 -0.760 9.221 15.465 1.00 47.77 O ATOM 645 O5' DG C 5 -0.671 6.748 15.754 1.00 49.34 O ATOM 646 C5' DG C 5 -0.297 5.561 16.429 1.00 52.84 C ATOM 647 C4' DG C 5 -0.964 4.348 15.812 1.00 51.78 C ATOM 648 O4' DG C 5 -2.373 4.321 16.162 1.00 51.40 O ATOM 649 C3' DG C 5 -0.911 4.274 14.279 1.00 54.94 C ATOM 650 O3' DG C 5 -0.582 2.954 13.896 1.00 60.29 O ATOM 651 C2' DG C 5 -2.344 4.614 13.876 1.00 54.08 C ATOM 652 C1' DG C 5 -3.095 3.957 15.017 1.00 52.40 C ATOM 653 N9 DG C 5 -4.482 4.387 15.159 1.00 51.70 N ATOM 654 C8 DG C 5 -4.968 5.673 15.121 1.00 50.50 C ATOM 655 N7 DG C 5 -6.263 5.741 15.275 1.00 49.80 N ATOM 656 C5 DG C 5 -6.659 4.416 15.424 1.00 48.96 C ATOM 657 C6 DG C 5 -7.947 3.864 15.624 1.00 50.81 C ATOM 658 O6 DG C 5 -9.031 4.456 15.715 1.00 51.09 O ATOM 659 N1 DG C 5 -7.903 2.474 15.724 1.00 52.04 N ATOM 660 C2 DG C 5 -6.760 1.716 15.639 1.00 51.15 C ATOM 661 N2 DG C 5 -6.916 0.389 15.758 1.00 51.49 N ATOM 662 N3 DG C 5 -5.548 2.221 15.452 1.00 51.22 N ATOM 663 C4 DG C 5 -5.574 3.573 15.354 1.00 51.38 C ATOM 664 P DA C 6 0.215 2.661 12.534 1.00 62.38 P ATOM 665 OP1 DA C 6 1.647 2.942 12.784 1.00 61.32 O ATOM 666 OP2 DA C 6 -0.492 3.345 11.427 1.00 59.97 O ATOM 667 O5' DA C 6 0.026 1.088 12.340 1.00 61.40 O ATOM 668 C5' DA C 6 -0.050 0.243 13.484 1.00 60.45 C ATOM 669 C4' DA C 6 -1.164 -0.774 13.329 1.00 60.16 C ATOM 670 O4' DA C 6 -2.443 -0.145 13.609 1.00 58.43 O ATOM 671 C3' DA C 6 -1.278 -1.388 11.935 1.00 61.53 C ATOM 672 O3' DA C 6 -1.427 -2.795 12.037 1.00 64.80 O ATOM 673 C2' DA C 6 -2.523 -0.724 11.342 1.00 59.63 C ATOM 674 C1' DA C 6 -3.360 -0.446 12.581 1.00 57.67 C ATOM 675 N9 DA C 6 -4.263 0.693 12.427 1.00 54.97 N ATOM 676 C8 DA C 6 -3.911 1.997 12.214 1.00 54.82 C ATOM 677 N7 DA C 6 -4.933 2.814 12.118 1.00 54.38 N ATOM 678 C5 DA C 6 -6.034 1.990 12.279 1.00 53.72 C ATOM 679 C6 DA C 6 -7.420 2.247 12.280 1.00 52.02 C ATOM 680 N6 DA C 6 -7.942 3.465 12.106 1.00 50.48 N ATOM 681 N1 DA C 6 -8.250 1.200 12.468 1.00 52.90 N ATOM 682 C2 DA C 6 -7.722 -0.018 12.642 1.00 53.09 C ATOM 683 N3 DA C 6 -6.440 -0.382 12.660 1.00 54.13 N ATOM 684 C4 DA C 6 -5.640 0.679 12.471 1.00 53.09 C ATOM 685 P DA C 7 -1.362 -3.710 10.720 1.00 67.72 P ATOM 686 OP1 DA C 7 -0.705 -4.984 11.090 1.00 71.15 O ATOM 687 OP2 DA C 7 -0.810 -2.886 9.622 1.00 64.05 O ATOM 688 O5' DA C 7 -2.899 -4.003 10.396 1.00 62.68 O ATOM 689 C5' DA C 7 -3.762 -4.442 11.434 1.00 60.94 C ATOM 690 C4' DA C 7 -5.192 -4.538 10.941 1.00 61.34 C ATOM 691 O4' DA C 7 -5.794 -3.218 10.929 1.00 60.64 O ATOM 692 C3' DA C 7 -5.349 -5.102 9.530 1.00 60.95 C ATOM 693 O3' DA C 7 -6.347 -6.110 9.531 1.00 63.73 O ATOM 694 C2' DA C 7 -5.762 -3.887 8.691 1.00 59.08 C ATOM 695 C1' DA C 7 -6.476 -3.017 9.714 1.00 57.54 C ATOM 696 N9 DA C 7 -6.431 -1.590 9.404 1.00 56.60 N ATOM 697 C8 DA C 7 -5.324 -0.849 9.096 1.00 55.86 C ATOM 698 N7 DA C 7 -5.579 0.420 8.877 1.00 53.53 N ATOM 699 C5 DA C 7 -6.948 0.520 9.059 1.00 52.79 C ATOM 700 C6 DA C 7 -7.840 1.607 8.970 1.00 52.58 C ATOM 701 N6 DA C 7 -7.457 2.850 8.662 1.00 50.94 N ATOM 702 N1 DA C 7 -9.146 1.367 9.213 1.00 53.68 N ATOM 703 C2 DA C 7 -9.525 0.120 9.523 1.00 53.07 C ATOM 704 N3 DA C 7 -8.781 -0.980 9.634 1.00 52.74 N ATOM 705 C4 DA C 7 -7.490 -0.709 9.387 1.00 53.79 C ATOM 706 P DT C 8 -6.549 -7.062 8.253 1.00 68.48 P ATOM 707 OP1 DT C 8 -6.716 -8.445 8.752 1.00 67.99 O ATOM 708 OP2 DT C 8 -5.485 -6.760 7.269 1.00 66.10 O ATOM 709 O5' DT C 8 -7.939 -6.564 7.648 1.00 63.46 O ATOM 710 C5' DT C 8 -9.016 -6.259 8.524 1.00 61.73 C ATOM 711 C4' DT C 8 -10.050 -5.407 7.820 1.00 61.70 C ATOM 712 O4' DT C 8 -9.600 -4.039 7.784 1.00 60.29 O ATOM 713 C3' DT C 8 -10.315 -5.805 6.370 1.00 61.36 C ATOM 714 O3' DT C 8 -11.605 -6.380 6.258 1.00 62.87 O ATOM 715 C2' DT C 8 -10.197 -4.494 5.568 1.00 58.18 C ATOM 716 C1' DT C 8 -10.134 -3.418 6.647 1.00 58.22 C ATOM 717 N1 DT C 8 -9.253 -2.266 6.290 1.00 55.21 N ATOM 718 C2 DT C 8 -9.792 -1.004 6.221 1.00 53.91 C ATOM 719 O2 DT C 8 -10.966 -0.767 6.437 1.00 54.30 O ATOM 720 N3 DT C 8 -8.900 -0.018 5.891 1.00 52.47 N ATOM 721 C4 DT C 8 -7.550 -0.166 5.626 1.00 52.85 C ATOM 722 O4 DT C 8 -6.830 0.785 5.336 1.00 52.43 O ATOM 723 C5 DT C 8 -7.049 -1.517 5.715 1.00 53.81 C ATOM 724 C7 DT C 8 -5.601 -1.804 5.449 1.00 53.55 C ATOM 725 C6 DT C 8 -7.914 -2.490 6.040 1.00 54.68 C ATOM 726 P DT C 9 -12.078 -7.041 4.874 1.00 67.59 P ATOM 727 OP1 DT C 9 -12.963 -8.180 5.207 1.00 66.46 O ATOM 728 OP2 DT C 9 -10.875 -7.258 4.037 1.00 64.52 O ATOM 729 O5' DT C 9 -12.949 -5.890 4.193 1.00 63.01 O ATOM 730 C5' DT C 9 -13.872 -5.155 4.980 1.00 62.23 C ATOM 731 C4' DT C 9 -14.297 -3.889 4.263 1.00 62.32 C ATOM 732 O4' DT C 9 -13.216 -2.925 4.283 1.00 60.19 O ATOM 733 C3' DT C 9 -14.683 -4.081 2.795 1.00 60.43 C ATOM 734 O3' DT C 9 -16.011 -3.623 2.592 1.00 62.39 O ATOM 735 C2' DT C 9 -13.655 -3.243 2.017 1.00 59.07 C ATOM 736 C1' DT C 9 -13.190 -2.238 3.061 1.00 58.35 C ATOM 737 N1 DT C 9 -11.799 -1.735 2.842 1.00 55.95 N ATOM 738 C2 DT C 9 -11.570 -0.378 2.815 1.00 54.58 C ATOM 739 O2 DT C 9 -12.451 0.451 2.954 1.00 53.16 O ATOM 740 N3 DT C 9 -10.262 -0.021 2.616 1.00 50.23 N ATOM 741 C4 DT C 9 -9.182 -0.867 2.446 1.00 54.08 C ATOM 742 O4 DT C 9 -8.041 -0.447 2.273 1.00 53.03 O ATOM 743 C5 DT C 9 -9.490 -2.279 2.487 1.00 54.52 C ATOM 744 C7 DT C 9 -8.400 -3.295 2.315 1.00 52.56 C ATOM 745 C6 DT C 9 -10.769 -2.639 2.682 1.00 54.68 C ATOM 746 P DT C 10 -16.800 -3.964 1.235 1.00 68.89 P ATOM 747 OP1 DT C 10 -18.189 -4.306 1.614 1.00 64.57 O ATOM 748 OP2 DT C 10 -15.989 -4.919 0.445 1.00 63.85 O ATOM 749 O5' DT C 10 -16.812 -2.567 0.458 1.00 65.21 O ATOM 750 C5' DT C 10 -17.101 -1.373 1.173 1.00 62.25 C ATOM 751 C4' DT C 10 -16.651 -0.153 0.394 1.00 61.04 C ATOM 752 O4' DT C 10 -15.223 0.028 0.542 1.00 59.92 O ATOM 753 C3' DT C 10 -16.921 -0.214 -1.113 1.00 60.32 C ATOM 754 O3' DT C 10 -17.772 0.859 -1.488 1.00 62.19 O ATOM 755 C2' DT C 10 -15.529 -0.091 -1.754 1.00 59.03 C ATOM 756 C1' DT C 10 -14.724 0.572 -0.649 1.00 59.17 C ATOM 757 N1 DT C 10 -13.257 0.300 -0.724 1.00 56.52 N ATOM 758 C2 DT C 10 -12.381 1.359 -0.775 1.00 53.94 C ATOM 759 O2 DT C 10 -12.739 2.523 -0.758 1.00 54.10 O ATOM 760 N3 DT C 10 -11.060 1.007 -0.844 1.00 53.03 N ATOM 761 C4 DT C 10 -10.537 -0.272 -0.867 1.00 53.32 C ATOM 762 O4 DT C 10 -9.330 -0.485 -0.930 1.00 53.62 O ATOM 763 C5 DT C 10 -11.510 -1.338 -0.813 1.00 54.69 C ATOM 764 C7 DT C 10 -11.062 -2.770 -0.834 1.00 55.24 C ATOM 765 C6 DT C 10 -12.809 -1.005 -0.745 1.00 55.13 C ATOM 766 P DC C 11 -18.389 0.929 -2.969 1.00 66.58 P ATOM 767 OP1 DC C 11 -19.802 1.352 -2.839 1.00 63.82 O ATOM 768 OP2 DC C 11 -18.061 -0.332 -3.670 1.00 61.22 O ATOM 769 O5' DC C 11 -17.558 2.106 -3.660 1.00 63.35 O ATOM 770 C5' DC C 11 -17.340 3.322 -2.956 1.00 60.71 C ATOM 771 C4' DC C 11 -16.218 4.119 -3.592 1.00 59.67 C ATOM 772 O4' DC C 11 -14.949 3.498 -3.289 1.00 60.52 O ATOM 773 C3' DC C 11 -16.294 4.229 -5.118 1.00 58.55 C ATOM 774 O3' DC C 11 -16.422 5.595 -5.493 1.00 60.44 O ATOM 775 C2' DC C 11 -14.978 3.613 -5.620 1.00 57.03 C ATOM 776 C1' DC C 11 -14.087 3.650 -4.386 1.00 56.39 C ATOM 777 N1 DC C 11 -13.079 2.547 -4.341 1.00 55.06 N ATOM 778 C2 DC C 11 -11.714 2.853 -4.279 1.00 53.47 C ATOM 779 O2 DC C 11 -11.361 4.039 -4.267 1.00 50.78 O ATOM 780 N3 DC C 11 -10.814 1.838 -4.234 1.00 52.98 N ATOM 781 C4 DC C 11 -11.235 0.572 -4.249 1.00 52.90 C ATOM 782 N4 DC C 11 -10.311 -0.394 -4.204 1.00 53.49 N ATOM 783 C5 DC C 11 -12.620 0.241 -4.311 1.00 53.61 C ATOM 784 C6 DC C 11 -13.498 1.249 -4.356 1.00 55.02 C ATOM 785 P DC C 12 -16.678 6.002 -7.027 1.00 62.92 P ATOM 786 OP1 DC C 12 -17.591 7.167 -7.025 1.00 63.57 O ATOM 787 OP2 DC C 12 -17.040 4.784 -7.787 1.00 59.04 O ATOM 788 O5' DC C 12 -15.241 6.486 -7.525 1.00 57.93 O ATOM 789 C5' DC C 12 -14.500 7.410 -6.740 1.00 52.63 C ATOM 790 C4' DC C 12 -13.127 7.644 -7.339 1.00 52.29 C ATOM 791 O4' DC C 12 -12.258 6.531 -7.016 1.00 51.33 O ATOM 792 C3' DC C 12 -13.106 7.797 -8.861 1.00 49.36 C ATOM 793 O3' DC C 12 -12.399 8.984 -9.210 1.00 47.41 O ATOM 794 C2' DC C 12 -12.399 6.527 -9.358 1.00 48.08 C ATOM 795 C1' DC C 12 -11.545 6.126 -8.160 1.00 50.35 C ATOM 796 N1 DC C 12 -11.304 4.647 -8.050 1.00 48.46 N ATOM 797 C2 DC C 12 -9.992 4.156 -7.993 1.00 48.93 C ATOM 798 O2 DC C 12 -9.047 4.949 -8.051 1.00 49.93 O ATOM 799 N3 DC C 12 -9.796 2.818 -7.880 1.00 50.61 N ATOM 800 C4 DC C 12 -10.840 1.992 -7.819 1.00 49.63 C ATOM 801 N4 DC C 12 -10.596 0.682 -7.708 1.00 50.93 N ATOM 802 C5 DC C 12 -12.182 2.473 -7.870 1.00 49.88 C ATOM 803 C6 DC C 12 -12.365 3.793 -7.982 1.00 51.27 C ATOM 804 P DT C 13 -12.414 9.540 -10.718 1.00 48.81 P ATOM 805 OP1 DT C 13 -12.306 11.014 -10.640 1.00 46.65 O ATOM 806 OP2 DT C 13 -13.549 8.931 -11.447 1.00 45.91 O ATOM 807 O5' DT C 13 -11.048 8.976 -11.321 1.00 47.12 O ATOM 808 C5' DT C 13 -9.835 9.220 -10.625 1.00 45.44 C ATOM 809 C4' DT C 13 -8.733 8.298 -11.103 1.00 46.85 C ATOM 810 O4' DT C 13 -9.015 6.944 -10.703 1.00 49.87 O ATOM 811 C3' DT C 13 -8.536 8.252 -12.619 1.00 46.62 C ATOM 812 O3' DT C 13 -7.314 8.894 -12.952 1.00 47.05 O ATOM 813 C2' DT C 13 -8.509 6.746 -12.962 1.00 47.81 C ATOM 814 C1' DT C 13 -8.355 6.092 -11.595 1.00 48.83 C ATOM 815 N1 DT C 13 -8.964 4.733 -11.486 1.00 48.99 N ATOM 816 C2 DT C 13 -8.148 3.653 -11.245 1.00 50.07 C ATOM 817 O2 DT C 13 -6.939 3.743 -11.129 1.00 51.65 O ATOM 818 N3 DT C 13 -8.800 2.452 -11.147 1.00 49.66 N ATOM 819 C4 DT C 13 -10.160 2.230 -11.259 1.00 49.78 C ATOM 820 O4 DT C 13 -10.651 1.110 -11.156 1.00 52.24 O ATOM 821 C5 DT C 13 -10.961 3.407 -11.507 1.00 49.71 C ATOM 822 C7 DT C 13 -12.450 3.291 -11.648 1.00 49.33 C ATOM 823 C6 DT C 13 -10.332 4.589 -11.605 1.00 47.97 C ATOM 824 P DG C 14 -6.979 9.269 -14.476 1.00 47.16 P ATOM 825 OP1 DG C 14 -6.078 10.443 -14.461 1.00 47.74 O ATOM 826 OP2 DG C 14 -8.257 9.327 -15.219 1.00 46.45 O ATOM 827 O5' DG C 14 -6.149 8.006 -14.995 1.00 47.55 O ATOM 828 C5' DG C 14 -5.006 7.577 -14.273 1.00 48.57 C ATOM 829 C4' DG C 14 -4.562 6.201 -14.729 1.00 51.36 C ATOM 830 O4' DG C 14 -5.473 5.193 -14.224 1.00 49.30 O ATOM 831 C3' DG C 14 -4.503 6.005 -16.250 1.00 53.44 C ATOM 832 O3' DG C 14 -3.215 5.532 -16.612 1.00 56.38 O ATOM 833 C2' DG C 14 -5.591 4.959 -16.525 1.00 51.74 C ATOM 834 C1' DG C 14 -5.634 4.208 -15.208 1.00 50.81 C ATOM 835 N9 DG C 14 -6.892 3.504 -14.975 1.00 50.87 N ATOM 836 C8 DG C 14 -8.164 3.986 -15.174 1.00 48.80 C ATOM 837 N7 DG C 14 -9.098 3.123 -14.881 1.00 49.24 N ATOM 838 C5 DG C 14 -8.401 1.995 -14.465 1.00 50.25 C ATOM 839 C6 DG C 14 -8.879 0.737 -14.024 1.00 51.46 C ATOM 840 O6 DG C 14 -10.053 0.358 -13.910 1.00 51.89 O ATOM 841 N1 DG C 14 -7.834 -0.125 -13.695 1.00 52.61 N ATOM 842 C2 DG C 14 -6.499 0.189 -13.783 1.00 52.63 C ATOM 843 N2 DG C 14 -5.637 -0.773 -13.421 1.00 53.38 N ATOM 844 N3 DG C 14 -6.038 1.363 -14.194 1.00 50.42 N ATOM 845 C4 DG C 14 -7.042 2.213 -14.518 1.00 50.81 C ATOM 846 P DA C 15 -2.768 5.422 -18.152 1.00 55.01 P ATOM 847 OP1 DA C 15 -1.595 6.306 -18.325 1.00 57.03 O ATOM 848 OP2 DA C 15 -3.946 5.600 -19.031 1.00 55.66 O ATOM 849 O5' DA C 15 -2.282 3.905 -18.275 1.00 59.43 O ATOM 850 C5' DA C 15 -1.467 3.347 -17.250 1.00 55.40 C ATOM 851 C4' DA C 15 -1.575 1.833 -17.229 1.00 57.04 C ATOM 852 O4' DA C 15 -2.890 1.443 -16.753 1.00 56.38 O ATOM 853 C3' DA C 15 -1.384 1.154 -18.587 1.00 58.51 C ATOM 854 O3' DA C 15 -0.457 0.085 -18.465 1.00 61.56 O ATOM 855 C2' DA C 15 -2.784 0.651 -18.948 1.00 55.81 C ATOM 856 C1' DA C 15 -3.407 0.427 -17.579 1.00 57.35 C ATOM 857 N9 DA C 15 -4.865 0.533 -17.582 1.00 54.19 N ATOM 858 C8 DA C 15 -5.610 1.622 -17.941 1.00 53.74 C ATOM 859 N7 DA C 15 -6.905 1.432 -17.845 1.00 52.68 N ATOM 860 C5 DA C 15 -7.017 0.129 -17.390 1.00 50.90 C ATOM 861 C6 DA C 15 -8.133 -0.676 -17.084 1.00 52.53 C ATOM 862 N6 DA C 15 -9.397 -0.256 -17.200 1.00 52.54 N ATOM 863 N1 DA C 15 -7.897 -1.933 -16.654 1.00 53.46 N ATOM 864 C2 DA C 15 -6.630 -2.349 -16.540 1.00 53.79 C ATOM 865 N3 DA C 15 -5.503 -1.685 -16.797 1.00 54.53 N ATOM 866 C4 DA C 15 -5.769 -0.440 -17.222 1.00 52.13 C ATOM 867 P DT C 16 0.117 -0.647 -19.775 1.00 67.92 P ATOM 868 OP1 DT C 16 1.533 -0.982 -19.504 1.00 68.38 O ATOM 869 OP2 DT C 16 -0.234 0.176 -20.956 1.00 59.72 O ATOM 870 O5' DT C 16 -0.722 -2.006 -19.843 1.00 59.93 O ATOM 871 C5' DT C 16 -0.771 -2.858 -18.706 1.00 59.02 C ATOM 872 C4' DT C 16 -1.635 -4.077 -18.975 1.00 59.92 C ATOM 873 O4' DT C 16 -3.036 -3.732 -18.819 1.00 59.25 O ATOM 874 C3' DT C 16 -1.494 -4.676 -20.378 1.00 60.28 C ATOM 875 O3' DT C 16 -1.381 -6.090 -20.289 1.00 60.41 O ATOM 876 C2' DT C 16 -2.792 -4.258 -21.072 1.00 58.86 C ATOM 877 C1' DT C 16 -3.763 -4.252 -19.905 1.00 56.91 C ATOM 878 N1 DT C 16 -4.967 -3.399 -20.124 1.00 54.77 N ATOM 879 C2 DT C 16 -6.211 -3.907 -19.830 1.00 54.99 C ATOM 880 O2 DT C 16 -6.387 -5.032 -19.396 1.00 55.61 O ATOM 881 N3 DT C 16 -7.250 -3.047 -20.061 1.00 54.00 N ATOM 882 C4 DT C 16 -7.172 -1.756 -20.546 1.00 53.28 C ATOM 883 O4 DT C 16 -8.167 -1.060 -20.720 1.00 52.99 O ATOM 884 C5 DT C 16 -5.838 -1.284 -20.835 1.00 53.12 C ATOM 885 C7 DT C 16 -5.629 0.102 -21.368 1.00 52.23 C ATOM 886 C6 DT C 16 -4.812 -2.118 -20.611 1.00 53.91 C TER 887 DT C 16 ATOM 888 O5' DA D 1 -17.116 -8.113 -18.795 1.00 69.93 O ATOM 889 C5' DA D 1 -16.371 -9.111 -19.484 1.00 69.71 C ATOM 890 C4' DA D 1 -14.932 -9.133 -19.011 1.00 70.05 C ATOM 891 O4' DA D 1 -14.203 -8.009 -19.585 1.00 65.97 O ATOM 892 C3' DA D 1 -14.750 -9.014 -17.492 1.00 71.34 C ATOM 893 O3' DA D 1 -13.734 -9.912 -17.058 1.00 76.14 O ATOM 894 C2' DA D 1 -14.297 -7.567 -17.330 1.00 67.23 C ATOM 895 C1' DA D 1 -13.432 -7.435 -18.563 1.00 64.00 C ATOM 896 N9 DA D 1 -13.086 -6.060 -18.903 1.00 60.49 N ATOM 897 C8 DA D 1 -13.936 -4.997 -19.039 1.00 59.74 C ATOM 898 N7 DA D 1 -13.327 -3.871 -19.335 1.00 59.57 N ATOM 899 C5 DA D 1 -11.987 -4.221 -19.389 1.00 57.41 C ATOM 900 C6 DA D 1 -10.820 -3.478 -19.658 1.00 55.83 C ATOM 901 N6 DA D 1 -10.827 -2.171 -19.935 1.00 54.96 N ATOM 902 N1 DA D 1 -9.640 -4.136 -19.633 1.00 54.66 N ATOM 903 C2 DA D 1 -9.637 -5.445 -19.358 1.00 56.61 C ATOM 904 N3 DA D 1 -10.666 -6.246 -19.090 1.00 58.73 N ATOM 905 C4 DA D 1 -11.823 -5.565 -19.122 1.00 58.74 C ATOM 906 P DT D 2 -13.992 -10.919 -15.830 1.00 86.13 P ATOM 907 OP1 DT D 2 -13.056 -12.055 -15.989 1.00 79.61 O ATOM 908 OP2 DT D 2 -15.448 -11.169 -15.751 1.00 85.02 O ATOM 909 O5' DT D 2 -13.573 -10.085 -14.526 1.00 74.30 O ATOM 910 C5' DT D 2 -12.686 -8.972 -14.632 1.00 70.08 C ATOM 911 C4' DT D 2 -11.278 -9.416 -14.984 1.00 69.79 C ATOM 912 O4' DT D 2 -10.725 -8.511 -15.975 1.00 67.48 O ATOM 913 C3' DT D 2 -10.305 -9.394 -13.818 1.00 70.47 C ATOM 914 O3' DT D 2 -9.321 -10.406 -13.954 1.00 71.85 O ATOM 915 C2' DT D 2 -9.696 -8.001 -13.898 1.00 66.56 C ATOM 916 C1' DT D 2 -9.733 -7.685 -15.391 1.00 64.54 C ATOM 917 N1 DT D 2 -10.065 -6.248 -15.669 1.00 60.17 N ATOM 918 C2 DT D 2 -9.057 -5.383 -16.032 1.00 59.64 C ATOM 919 O2 DT D 2 -7.895 -5.725 -16.160 1.00 61.41 O ATOM 920 N3 DT D 2 -9.462 -4.093 -16.252 1.00 57.32 N ATOM 921 C4 DT D 2 -10.744 -3.588 -16.140 1.00 56.33 C ATOM 922 O4 DT D 2 -11.007 -2.409 -16.359 1.00 55.90 O ATOM 923 C5 DT D 2 -11.753 -4.545 -15.749 1.00 58.05 C ATOM 924 C7 DT D 2 -13.181 -4.115 -15.594 1.00 58.40 C ATOM 925 C6 DT D 2 -11.369 -5.813 -15.531 1.00 60.00 C ATOM 926 P DC D 3 -8.541 -10.927 -12.648 1.00 75.93 P ATOM 927 OP1 DC D 3 -7.770 -12.133 -13.028 1.00 71.57 O ATOM 928 OP2 DC D 3 -9.541 -11.003 -11.557 1.00 71.42 O ATOM 929 O5' DC D 3 -7.522 -9.735 -12.303 1.00 67.82 O ATOM 930 C5' DC D 3 -6.444 -9.441 -13.194 1.00 67.33 C ATOM 931 C4' DC D 3 -5.791 -8.109 -12.849 1.00 66.27 C ATOM 932 O4' DC D 3 -6.646 -7.019 -13.247 1.00 66.57 O ATOM 933 C3' DC D 3 -5.494 -7.887 -11.363 1.00 65.08 C ATOM 934 O3' DC D 3 -4.088 -7.935 -11.143 1.00 66.33 O ATOM 935 C2' DC D 3 -6.075 -6.491 -11.055 1.00 63.27 C ATOM 936 C1' DC D 3 -6.342 -5.915 -12.441 1.00 62.84 C ATOM 937 N1 DC D 3 -7.493 -4.958 -12.492 1.00 59.05 N ATOM 938 C2 DC D 3 -7.294 -3.652 -12.957 1.00 56.79 C ATOM 939 O2 DC D 3 -6.162 -3.305 -13.316 1.00 57.14 O ATOM 940 N3 DC D 3 -8.352 -2.803 -13.000 1.00 56.18 N ATOM 941 C4 DC D 3 -9.557 -3.217 -12.604 1.00 56.00 C ATOM 942 N4 DC D 3 -10.569 -2.346 -12.663 1.00 55.35 N ATOM 943 C5 DC D 3 -9.777 -4.543 -12.130 1.00 58.38 C ATOM 944 C6 DC D 3 -8.728 -5.368 -12.089 1.00 59.57 C ATOM 945 P DA D 4 -3.493 -7.943 -9.651 1.00 70.52 P ATOM 946 OP1 DA D 4 -2.330 -8.859 -9.643 1.00 68.28 O ATOM 947 OP2 DA D 4 -4.609 -8.156 -8.701 1.00 66.37 O ATOM 948 O5' DA D 4 -2.969 -6.449 -9.449 1.00 65.44 O ATOM 949 C5' DA D 4 -2.145 -5.849 -10.436 1.00 64.56 C ATOM 950 C4' DA D 4 -1.865 -4.400 -10.085 1.00 66.21 C ATOM 951 O4' DA D 4 -3.015 -3.581 -10.436 1.00 63.29 O ATOM 952 C3' DA D 4 -1.596 -4.146 -8.605 1.00 66.35 C ATOM 953 O3' DA D 4 -0.562 -3.194 -8.469 1.00 69.85 O ATOM 954 C2' DA D 4 -2.935 -3.611 -8.095 1.00 63.19 C ATOM 955 C1' DA D 4 -3.449 -2.852 -9.306 1.00 61.48 C ATOM 956 N9 DA D 4 -4.905 -2.760 -9.345 1.00 59.45 N ATOM 957 C8 DA D 4 -5.798 -3.736 -8.998 1.00 59.44 C ATOM 958 N7 DA D 4 -7.053 -3.378 -9.129 1.00 58.00 N ATOM 959 C5 DA D 4 -6.979 -2.074 -9.591 1.00 55.89 C ATOM 960 C6 DA D 4 -7.968 -1.131 -9.929 1.00 54.24 C ATOM 961 N6 DA D 4 -9.279 -1.378 -9.845 1.00 55.40 N ATOM 962 N1 DA D 4 -7.556 0.081 -10.357 1.00 53.32 N ATOM 963 C2 DA D 4 -6.242 0.324 -10.438 1.00 54.19 C ATOM 964 N3 DA D 4 -5.221 -0.482 -10.151 1.00 55.79 N ATOM 965 C4 DA D 4 -5.662 -1.676 -9.728 1.00 56.41 C ATOM 966 P DG D 5 0.226 -3.029 -7.079 1.00 73.32 P ATOM 967 OP1 DG D 5 1.607 -3.532 -7.268 1.00 71.01 O ATOM 968 OP2 DG D 5 -0.630 -3.562 -5.993 1.00 67.78 O ATOM 969 O5' DG D 5 0.283 -1.450 -6.890 1.00 69.53 O ATOM 970 C5' DG D 5 0.524 -0.618 -8.014 1.00 65.28 C ATOM 971 C4' DG D 5 0.002 0.778 -7.757 1.00 66.80 C ATOM 972 O4' DG D 5 -1.426 0.822 -8.009 1.00 64.93 O ATOM 973 C3' DG D 5 0.216 1.290 -6.336 1.00 65.51 C ATOM 974 O3' DG D 5 0.713 2.619 -6.377 1.00 65.93 O ATOM 975 C2' DG D 5 -1.176 1.215 -5.707 1.00 63.22 C ATOM 976 C1' DG D 5 -2.091 1.397 -6.912 1.00 61.51 C ATOM 977 N9 DG D 5 -3.382 0.731 -6.768 1.00 59.61 N ATOM 978 C8 DG D 5 -3.603 -0.555 -6.341 1.00 59.80 C ATOM 979 N7 DG D 5 -4.864 -0.887 -6.315 1.00 57.73 N ATOM 980 C5 DG D 5 -5.524 0.249 -6.766 1.00 55.65 C ATOM 981 C6 DG D 5 -6.907 0.488 -6.953 1.00 54.01 C ATOM 982 O6 DG D 5 -7.856 -0.284 -6.749 1.00 52.68 O ATOM 983 N1 DG D 5 -7.147 1.778 -7.426 1.00 52.64 N ATOM 984 C2 DG D 5 -6.174 2.715 -7.686 1.00 55.31 C ATOM 985 N2 DG D 5 -6.599 3.904 -8.137 1.00 53.99 N ATOM 986 N3 DG D 5 -4.875 2.503 -7.516 1.00 56.71 N ATOM 987 C4 DG D 5 -4.624 1.253 -7.056 1.00 56.78 C ATOM 988 P DG D 6 1.167 3.349 -5.023 1.00 68.79 P ATOM 989 OP1 DG D 6 2.346 4.186 -5.334 1.00 66.60 O ATOM 990 OP2 DG D 6 1.243 2.323 -3.955 1.00 68.67 O ATOM 991 O5' DG D 6 -0.063 4.311 -4.695 1.00 66.02 O ATOM 992 C5' DG D 6 -0.621 5.116 -5.724 1.00 63.17 C ATOM 993 C4' DG D 6 -1.906 5.764 -5.253 1.00 61.96 C ATOM 994 O4' DG D 6 -2.994 4.817 -5.367 1.00 59.96 O ATOM 995 C3' DG D 6 -1.885 6.232 -3.795 1.00 60.95 C ATOM 996 O3' DG D 6 -2.135 7.629 -3.735 1.00 63.10 O ATOM 997 C2' DG D 6 -2.992 5.418 -3.107 1.00 58.58 C ATOM 998 C1' DG D 6 -3.860 4.967 -4.273 1.00 58.61 C ATOM 999 N9 DG D 6 -4.522 3.687 -4.038 1.00 55.80 N ATOM 1000 C8 DG D 6 -3.927 2.501 -3.680 1.00 55.50 C ATOM 1001 N7 DG D 6 -4.772 1.517 -3.541 1.00 54.06 N ATOM 1002 C5 DG D 6 -6.006 2.087 -3.826 1.00 53.75 C ATOM 1003 C6 DG D 6 -7.297 1.508 -3.836 1.00 53.43 C ATOM 1004 O6 DG D 6 -7.615 0.336 -3.589 1.00 52.92 O ATOM 1005 N1 DG D 6 -8.276 2.440 -4.178 1.00 52.36 N ATOM 1006 C2 DG D 6 -8.036 3.762 -4.471 1.00 51.96 C ATOM 1007 N2 DG D 6 -9.106 4.508 -4.778 1.00 50.83 N ATOM 1008 N3 DG D 6 -6.831 4.315 -4.464 1.00 51.96 N ATOM 1009 C4 DG D 6 -5.868 3.422 -4.134 1.00 53.99 C ATOM 1010 P DA D 7 -2.062 8.415 -2.335 1.00 63.24 P ATOM 1011 OP1 DA D 7 -1.381 9.703 -2.590 1.00 66.85 O ATOM 1012 OP2 DA D 7 -1.529 7.502 -1.298 1.00 60.63 O ATOM 1013 O5' DA D 7 -3.595 8.708 -2.003 1.00 55.77 O ATOM 1014 C5' DA D 7 -4.441 9.235 -3.015 1.00 53.85 C ATOM 1015 C4' DA D 7 -5.889 9.224 -2.568 1.00 51.29 C ATOM 1016 O4' DA D 7 -6.398 7.865 -2.593 1.00 50.26 O ATOM 1017 C3' DA D 7 -6.129 9.749 -1.153 1.00 46.80 C ATOM 1018 O3' DA D 7 -7.267 10.593 -1.144 1.00 40.47 O ATOM 1019 C2' DA D 7 -6.360 8.477 -0.336 1.00 47.33 C ATOM 1020 C1' DA D 7 -7.008 7.559 -1.361 1.00 47.20 C ATOM 1021 N9 DA D 7 -6.794 6.141 -1.086 1.00 50.37 N ATOM 1022 C8 DA D 7 -5.605 5.528 -0.802 1.00 51.02 C ATOM 1023 N7 DA D 7 -5.710 4.237 -0.601 1.00 50.22 N ATOM 1024 C5 DA D 7 -7.061 3.983 -0.767 1.00 50.30 C ATOM 1025 C6 DA D 7 -7.822 2.800 -0.685 1.00 51.18 C ATOM 1026 N6 DA D 7 -7.294 1.604 -0.403 1.00 50.13 N ATOM 1027 N1 DA D 7 -9.150 2.894 -0.905 1.00 50.40 N ATOM 1028 C2 DA D 7 -9.675 4.094 -1.186 1.00 49.84 C ATOM 1029 N3 DA D 7 -9.062 5.273 -1.290 1.00 48.18 N ATOM 1030 C4 DA D 7 -7.745 5.147 -1.067 1.00 48.30 C ATOM 1031 P DA D 8 -7.625 11.462 0.158 1.00 45.70 P ATOM 1032 OP1 DA D 8 -7.969 12.830 -0.291 1.00 44.52 O ATOM 1033 OP2 DA D 8 -6.561 11.264 1.166 1.00 44.69 O ATOM 1034 O5' DA D 8 -8.944 10.763 0.713 1.00 45.59 O ATOM 1035 C5' DA D 8 -9.982 10.411 -0.184 1.00 43.13 C ATOM 1036 C4' DA D 8 -10.988 9.512 0.502 1.00 43.43 C ATOM 1037 O4' DA D 8 -10.488 8.155 0.522 1.00 43.99 O ATOM 1038 C3' DA D 8 -11.290 9.889 1.954 1.00 41.37 C ATOM 1039 O3' DA D 8 -12.682 10.080 2.116 1.00 42.19 O ATOM 1040 C2' DA D 8 -10.774 8.699 2.775 1.00 44.43 C ATOM 1041 C1' DA D 8 -10.779 7.564 1.761 1.00 45.39 C ATOM 1042 N9 DA D 8 -9.764 6.548 2.023 1.00 46.50 N ATOM 1043 C8 DA D 8 -8.420 6.750 2.173 1.00 46.75 C ATOM 1044 N7 DA D 8 -7.740 5.651 2.395 1.00 48.55 N ATOM 1045 C5 DA D 8 -8.704 4.657 2.386 1.00 48.64 C ATOM 1046 C6 DA D 8 -8.629 3.263 2.561 1.00 48.47 C ATOM 1047 N6 DA D 8 -7.485 2.610 2.791 1.00 48.61 N ATOM 1048 N1 DA D 8 -9.780 2.562 2.493 1.00 51.35 N ATOM 1049 C2 DA D 8 -10.924 3.219 2.263 1.00 49.73 C ATOM 1050 N3 DA D 8 -11.119 4.524 2.081 1.00 46.66 N ATOM 1051 C4 DA D 8 -9.958 5.193 2.156 1.00 47.91 C ATOM 1052 P DA D 9 -13.252 10.866 3.394 1.00 42.61 P ATOM 1053 OP1 DA D 9 -14.375 11.708 2.927 1.00 42.67 O ATOM 1054 OP2 DA D 9 -12.114 11.480 4.114 1.00 39.64 O ATOM 1055 O5' DA D 9 -13.851 9.702 4.304 1.00 44.39 O ATOM 1056 C5' DA D 9 -14.810 8.815 3.755 1.00 43.77 C ATOM 1057 C4' DA D 9 -15.033 7.631 4.671 1.00 46.44 C ATOM 1058 O4' DA D 9 -13.918 6.704 4.562 1.00 43.55 O ATOM 1059 C3' DA D 9 -15.160 7.977 6.159 1.00 46.86 C ATOM 1060 O3' DA D 9 -16.241 7.246 6.710 1.00 52.35 O ATOM 1061 C2' DA D 9 -13.822 7.516 6.736 1.00 46.02 C ATOM 1062 C1' DA D 9 -13.525 6.316 5.855 1.00 48.60 C ATOM 1063 N9 DA D 9 -12.115 5.936 5.830 1.00 49.02 N ATOM 1064 C8 DA D 9 -11.030 6.771 5.836 1.00 46.14 C ATOM 1065 N7 DA D 9 -9.878 6.140 5.813 1.00 45.37 N ATOM 1066 C5 DA D 9 -10.233 4.801 5.792 1.00 48.15 C ATOM 1067 C6 DA D 9 -9.471 3.615 5.764 1.00 48.23 C ATOM 1068 N6 DA D 9 -8.134 3.598 5.751 1.00 46.67 N ATOM 1069 N1 DA D 9 -10.139 2.444 5.748 1.00 50.06 N ATOM 1070 C2 DA D 9 -11.477 2.463 5.762 1.00 50.05 C ATOM 1071 N3 DA D 9 -12.299 3.509 5.789 1.00 48.82 N ATOM 1072 C4 DA D 9 -11.607 4.659 5.803 1.00 48.71 C ATOM 1073 P DT D 10 -16.864 7.619 8.144 1.00 51.27 P ATOM 1074 OP1 DT D 10 -18.168 8.276 7.898 1.00 52.65 O ATOM 1075 OP2 DT D 10 -15.843 8.295 8.977 1.00 46.77 O ATOM 1076 O5' DT D 10 -17.148 6.181 8.791 1.00 54.28 O ATOM 1077 C5' DT D 10 -17.703 5.130 7.979 1.00 51.98 C ATOM 1078 C4' DT D 10 -17.054 3.783 8.284 1.00 53.92 C ATOM 1079 O4' DT D 10 -15.632 3.860 8.051 1.00 54.83 O ATOM 1080 C3' DT D 10 -17.214 3.313 9.731 1.00 53.85 C ATOM 1081 O3' DT D 10 -18.019 2.147 9.807 1.00 58.32 O ATOM 1082 C2' DT D 10 -15.785 3.041 10.228 1.00 52.96 C ATOM 1083 C1' DT D 10 -14.977 2.995 8.939 1.00 53.10 C ATOM 1084 N1 DT D 10 -13.558 3.463 9.098 1.00 50.21 N ATOM 1085 C2 DT D 10 -12.533 2.552 8.994 1.00 50.93 C ATOM 1086 O2 DT D 10 -12.711 1.370 8.765 1.00 52.72 O ATOM 1087 N3 DT D 10 -11.277 3.077 9.162 1.00 48.77 N ATOM 1088 C4 DT D 10 -10.949 4.394 9.424 1.00 49.22 C ATOM 1089 O4 DT D 10 -9.786 4.767 9.558 1.00 51.55 O ATOM 1090 C5 DT D 10 -12.071 5.299 9.529 1.00 50.10 C ATOM 1091 C7 DT D 10 -11.840 6.757 9.814 1.00 47.05 C ATOM 1092 C6 DT D 10 -13.308 4.794 9.365 1.00 49.65 C ATOM 1093 P DT D 11 -18.617 1.690 11.232 1.00 60.64 P ATOM 1094 OP1 DT D 11 -19.953 1.092 11.003 1.00 60.73 O ATOM 1095 OP2 DT D 11 -18.483 2.811 12.175 1.00 55.29 O ATOM 1096 O5' DT D 11 -17.604 0.574 11.730 1.00 57.90 O ATOM 1097 C5' DT D 11 -17.255 -0.470 10.850 1.00 55.83 C ATOM 1098 C4' DT D 11 -16.050 -1.253 11.390 1.00 56.31 C ATOM 1099 O4' DT D 11 -14.842 -0.472 11.231 1.00 56.11 O ATOM 1100 C3' DT D 11 -16.108 -1.642 12.888 1.00 56.70 C ATOM 1101 O3' DT D 11 -16.047 -3.069 13.030 1.00 59.39 O ATOM 1102 C2' DT D 11 -14.882 -0.951 13.514 1.00 57.02 C ATOM 1103 C1' DT D 11 -13.977 -0.727 12.304 1.00 55.03 C ATOM 1104 N1 DT D 11 -13.072 0.444 12.434 1.00 52.96 N ATOM 1105 C2 DT D 11 -11.701 0.266 12.368 1.00 52.12 C ATOM 1106 O2 DT D 11 -11.174 -0.818 12.179 1.00 56.48 O ATOM 1107 N3 DT D 11 -10.966 1.419 12.510 1.00 51.43 N ATOM 1108 C4 DT D 11 -11.455 2.702 12.725 1.00 51.16 C ATOM 1109 O4 DT D 11 -10.712 3.693 12.844 1.00 51.43 O ATOM 1110 C5 DT D 11 -12.896 2.800 12.803 1.00 51.71 C ATOM 1111 C7 DT D 11 -13.531 4.124 13.034 1.00 50.28 C ATOM 1112 C6 DT D 11 -13.624 1.684 12.658 1.00 53.64 C ATOM 1113 P DC D 12 -16.331 -3.803 14.441 1.00 65.44 P ATOM 1114 OP1 DC D 12 -16.832 -5.181 14.226 1.00 65.07 O ATOM 1115 OP2 DC D 12 -17.148 -2.902 15.259 1.00 60.27 O ATOM 1116 O5' DC D 12 -14.888 -3.941 15.106 1.00 57.39 O ATOM 1117 C5' DC D 12 -13.831 -4.536 14.372 1.00 55.29 C ATOM 1118 C4' DC D 12 -12.483 -4.181 14.982 1.00 54.28 C ATOM 1119 O4' DC D 12 -12.198 -2.784 14.772 1.00 53.15 O ATOM 1120 C3' DC D 12 -12.367 -4.405 16.494 1.00 50.20 C ATOM 1121 O3' DC D 12 -11.561 -5.549 16.753 1.00 52.51 O ATOM 1122 C2' DC D 12 -11.711 -3.118 17.032 1.00 50.59 C ATOM 1123 C1' DC D 12 -11.303 -2.369 15.766 1.00 51.74 C ATOM 1124 N1 DC D 12 -11.392 -0.884 15.898 1.00 51.18 N ATOM 1125 C2 DC D 12 -10.225 -0.114 15.853 1.00 51.13 C ATOM 1126 O2 DC D 12 -9.135 -0.679 15.700 1.00 50.78 O ATOM 1127 N3 DC D 12 -10.324 1.234 15.977 1.00 51.36 N ATOM 1128 C4 DC D 12 -11.518 1.804 16.139 1.00 51.47 C ATOM 1129 N4 DC D 12 -11.565 3.136 16.256 1.00 52.11 N ATOM 1130 C5 DC D 12 -12.718 1.035 16.190 1.00 51.75 C ATOM 1131 C6 DC D 12 -12.609 -0.292 16.067 1.00 50.93 C ATOM 1132 P DC D 13 -11.380 -6.092 18.255 1.00 48.82 P ATOM 1133 OP1 DC D 13 -11.159 -7.550 18.158 1.00 47.51 O ATOM 1134 OP2 DC D 13 -12.488 -5.560 19.081 1.00 48.22 O ATOM 1135 O5' DC D 13 -10.020 -5.412 18.747 1.00 46.76 O ATOM 1136 C5' DC D 13 -8.796 -5.751 18.107 1.00 49.87 C ATOM 1137 C4' DC D 13 -7.655 -4.893 18.623 1.00 49.76 C ATOM 1138 O4' DC D 13 -7.907 -3.500 18.300 1.00 49.29 O ATOM 1139 C3' DC D 13 -7.430 -4.947 20.139 1.00 48.19 C ATOM 1140 O3' DC D 13 -6.042 -5.108 20.418 1.00 50.47 O ATOM 1141 C2' DC D 13 -7.941 -3.590 20.619 1.00 49.58 C ATOM 1142 C1' DC D 13 -7.610 -2.713 19.426 1.00 49.31 C ATOM 1143 N1 DC D 13 -8.413 -1.462 19.364 1.00 49.41 N ATOM 1144 C2 DC D 13 -7.762 -0.231 19.239 1.00 50.09 C ATOM 1145 O2 DC D 13 -6.527 -0.207 19.176 1.00 49.97 O ATOM 1146 N3 DC D 13 -8.505 0.902 19.190 1.00 49.73 N ATOM 1147 C4 DC D 13 -9.835 0.832 19.261 1.00 50.34 C ATOM 1148 N4 DC D 13 -10.526 1.976 19.208 1.00 50.41 N ATOM 1149 C5 DC D 13 -10.517 -0.415 19.390 1.00 50.27 C ATOM 1150 C6 DC D 13 -9.773 -1.525 19.439 1.00 49.87 C ATOM 1151 P DC D 14 -5.549 -5.520 21.893 1.00 53.22 P ATOM 1152 OP1 DC D 14 -4.644 -6.680 21.736 1.00 50.50 O ATOM 1153 OP2 DC D 14 -6.732 -5.616 22.778 1.00 47.91 O ATOM 1154 O5' DC D 14 -4.685 -4.264 22.372 1.00 48.83 O ATOM 1155 C5' DC D 14 -3.505 -3.908 21.664 1.00 51.87 C ATOM 1156 C4' DC D 14 -3.155 -2.451 21.900 1.00 53.10 C ATOM 1157 O4' DC D 14 -4.197 -1.617 21.366 1.00 50.80 O ATOM 1158 C3' DC D 14 -3.053 -2.049 23.358 1.00 52.74 C ATOM 1159 O3' DC D 14 -1.730 -2.281 23.827 1.00 54.17 O ATOM 1160 C2' DC D 14 -3.381 -0.551 23.330 1.00 53.69 C ATOM 1161 C1' DC D 14 -4.181 -0.373 22.034 1.00 52.36 C ATOM 1162 N1 DC D 14 -5.589 0.072 22.251 1.00 51.02 N ATOM 1163 C2 DC D 14 -5.882 1.439 22.294 1.00 50.99 C ATOM 1164 O2 DC D 14 -4.965 2.257 22.159 1.00 52.18 O ATOM 1165 N3 DC D 14 -7.167 1.830 22.486 1.00 51.08 N ATOM 1166 C4 DC D 14 -8.128 0.916 22.628 1.00 50.21 C ATOM 1167 N4 DC D 14 -9.380 1.350 22.815 1.00 50.29 N ATOM 1168 C5 DC D 14 -7.849 -0.482 22.586 1.00 51.54 C ATOM 1169 C6 DC D 14 -6.578 -0.856 22.396 1.00 50.55 C ATOM 1170 P DA D 15 -1.417 -2.292 25.403 1.00 58.26 P ATOM 1171 OP1 DA D 15 -0.133 -3.002 25.596 1.00 60.43 O ATOM 1172 OP2 DA D 15 -2.635 -2.751 26.107 1.00 56.36 O ATOM 1173 O5' DA D 15 -1.224 -0.750 25.771 1.00 57.73 O ATOM 1174 C5' DA D 15 -0.355 0.063 25.000 1.00 59.16 C ATOM 1175 C4' DA D 15 -0.477 1.515 25.419 1.00 59.40 C ATOM 1176 O4' DA D 15 -1.784 2.024 25.036 1.00 58.63 O ATOM 1177 C3' DA D 15 -0.343 1.756 26.919 1.00 62.30 C ATOM 1178 O3' DA D 15 0.465 2.897 27.153 1.00 64.85 O ATOM 1179 C2' DA D 15 -1.785 1.974 27.382 1.00 61.07 C ATOM 1180 C1' DA D 15 -2.425 2.603 26.153 1.00 58.45 C ATOM 1181 N9 DA D 15 -3.861 2.340 26.045 1.00 56.52 N ATOM 1182 C8 DA D 15 -4.477 1.119 26.053 1.00 54.20 C ATOM 1183 N7 DA D 15 -5.783 1.182 25.934 1.00 53.64 N ATOM 1184 C5 DA D 15 -6.045 2.538 25.843 1.00 53.29 C ATOM 1185 C6 DA D 15 -7.243 3.267 25.702 1.00 52.77 C ATOM 1186 N6 DA D 15 -8.449 2.694 25.625 1.00 52.91 N ATOM 1187 N1 DA D 15 -7.154 4.612 25.642 1.00 53.34 N ATOM 1188 C2 DA D 15 -5.945 5.182 25.718 1.00 53.79 C ATOM 1189 N3 DA D 15 -4.752 4.605 25.852 1.00 55.74 N ATOM 1190 C4 DA D 15 -4.872 3.269 25.909 1.00 54.61 C ATOM 1191 P DG D 16 0.924 3.268 28.646 1.00 72.44 P ATOM 1192 OP1 DG D 16 2.266 3.889 28.563 1.00 67.12 O ATOM 1193 OP2 DG D 16 0.710 2.074 29.496 1.00 67.59 O ATOM 1194 O5' DG D 16 -0.131 4.379 29.093 1.00 65.53 O ATOM 1195 C5' DG D 16 -0.447 5.445 28.210 1.00 63.28 C ATOM 1196 C4' DG D 16 -1.505 6.339 28.820 1.00 63.67 C ATOM 1197 O4' DG D 16 -2.821 5.842 28.475 1.00 62.67 O ATOM 1198 C3' DG D 16 -1.457 6.425 30.346 1.00 64.57 C ATOM 1199 O3' DG D 16 -1.401 7.783 30.752 1.00 65.97 O ATOM 1200 C2' DG D 16 -2.752 5.741 30.804 1.00 63.07 C ATOM 1201 C1' DG D 16 -3.660 5.923 29.598 1.00 60.70 C ATOM 1202 N9 DG D 16 -4.686 4.890 29.477 1.00 58.03 N ATOM 1203 C8 DG D 16 -4.493 3.529 29.485 1.00 58.20 C ATOM 1204 N7 DG D 16 -5.598 2.847 29.352 1.00 56.91 N ATOM 1205 C5 DG D 16 -6.587 3.818 29.247 1.00 56.06 C ATOM 1206 C6 DG D 16 -7.986 3.680 29.085 1.00 55.03 C ATOM 1207 O6 DG D 16 -8.651 2.637 29.000 1.00 54.77 O ATOM 1208 N1 DG D 16 -8.622 4.917 29.023 1.00 54.29 N ATOM 1209 C2 DG D 16 -7.986 6.133 29.106 1.00 55.40 C ATOM 1210 N2 DG D 16 -8.769 7.219 29.026 1.00 53.88 N ATOM 1211 N3 DG D 16 -6.675 6.277 29.258 1.00 56.69 N ATOM 1212 C4 DG D 16 -6.041 5.081 29.321 1.00 56.31 C TER 1213 DG D 16 ATOM 1214 N PRO B 418 2.980 15.243 -31.239 1.00 78.73 N ATOM 1215 CA PRO B 418 2.713 16.649 -31.552 1.00 77.18 C ATOM 1216 C PRO B 418 1.224 17.019 -31.551 1.00 77.10 C ATOM 1217 O PRO B 418 0.836 17.967 -32.233 1.00 78.08 O ATOM 1218 CB PRO B 418 3.320 16.815 -32.953 1.00 77.94 C ATOM 1219 CG PRO B 418 4.187 15.560 -33.187 1.00 79.71 C ATOM 1220 CD PRO B 418 4.204 14.776 -31.904 1.00 79.56 C ATOM 1221 N LYS B 419 0.407 16.280 -30.805 1.00 71.44 N ATOM 1222 CA LYS B 419 -0.966 16.710 -30.529 1.00 68.53 C ATOM 1223 C LYS B 419 -1.496 16.137 -29.215 1.00 63.76 C ATOM 1224 O LYS B 419 -1.062 15.077 -28.764 1.00 61.72 O ATOM 1225 CB LYS B 419 -1.906 16.341 -31.677 1.00 67.97 C ATOM 1226 CG LYS B 419 -2.373 17.562 -32.458 1.00 68.33 C ATOM 1227 CD LYS B 419 -3.161 18.503 -31.546 1.00 70.98 C ATOM 1228 CE LYS B 419 -4.094 19.425 -32.325 1.00 72.14 C ATOM 1229 NZ LYS B 419 -4.254 20.754 -31.657 1.00 72.52 N ATOM 1230 N LEU B 420 -2.455 16.843 -28.621 1.00 61.49 N ATOM 1231 CA LEU B 420 -2.840 16.608 -27.233 1.00 57.08 C ATOM 1232 C LEU B 420 -4.333 16.357 -27.025 1.00 53.59 C ATOM 1233 O LEU B 420 -5.160 16.685 -27.876 1.00 53.44 O ATOM 1234 CB LEU B 420 -2.412 17.806 -26.383 1.00 56.47 C ATOM 1235 CG LEU B 420 -0.954 18.244 -26.530 1.00 57.63 C ATOM 1236 CD1 LEU B 420 -0.710 19.542 -25.780 1.00 57.32 C ATOM 1237 CD2 LEU B 420 -0.009 17.154 -26.044 1.00 55.17 C ATOM 1238 N CYS B 421 -4.660 15.775 -25.874 1.00 51.16 N ATOM 1239 CA CYS B 421 -6.043 15.576 -25.458 1.00 49.16 C ATOM 1240 C CYS B 421 -6.755 16.916 -25.288 1.00 48.89 C ATOM 1241 O CYS B 421 -6.238 17.819 -24.634 1.00 48.06 O ATOM 1242 CB CYS B 421 -6.089 14.779 -24.151 1.00 49.15 C ATOM 1243 SG CYS B 421 -7.706 14.685 -23.358 1.00 43.93 S ATOM 1244 N LEU B 422 -7.942 17.042 -25.873 1.00 47.35 N ATOM 1245 CA LEU B 422 -8.685 18.298 -25.820 1.00 46.90 C ATOM 1246 C LEU B 422 -9.265 18.571 -24.433 1.00 47.21 C ATOM 1247 O LEU B 422 -9.822 19.640 -24.189 1.00 45.82 O ATOM 1248 CB LEU B 422 -9.808 18.307 -26.862 1.00 48.54 C ATOM 1249 CG LEU B 422 -9.391 18.449 -28.329 1.00 52.35 C ATOM 1250 CD1 LEU B 422 -10.594 18.781 -29.202 1.00 51.50 C ATOM 1251 CD2 LEU B 422 -8.307 19.504 -28.485 1.00 50.84 C ATOM 1252 N VAL B 423 -9.139 17.604 -23.531 1.00 45.11 N ATOM 1253 CA VAL B 423 -9.653 17.760 -22.176 1.00 45.80 C ATOM 1254 C VAL B 423 -8.536 18.094 -21.184 1.00 46.19 C ATOM 1255 O VAL B 423 -8.517 19.180 -20.607 1.00 46.89 O ATOM 1256 CB VAL B 423 -10.395 16.490 -21.704 1.00 45.19 C ATOM 1257 CG1 VAL B 423 -10.881 16.656 -20.273 1.00 43.16 C ATOM 1258 CG2 VAL B 423 -11.562 16.179 -22.631 1.00 44.11 C ATOM 1259 N CYS B 424 -7.622 17.152 -20.970 1.00 43.92 N ATOM 1260 CA CYS B 424 -6.551 17.336 -19.990 1.00 47.84 C ATOM 1261 C CYS B 424 -5.183 17.748 -20.556 1.00 48.82 C ATOM 1262 O CYS B 424 -4.225 17.880 -19.793 1.00 49.76 O ATOM 1263 CB CYS B 424 -6.380 16.057 -19.175 1.00 46.17 C ATOM 1264 SG CYS B 424 -5.661 14.712 -20.113 1.00 47.43 S ATOM 1265 N SER B 425 -5.082 17.897 -21.878 1.00 48.50 N ATOM 1266 CA SER B 425 -3.836 18.305 -22.551 1.00 49.68 C ATOM 1267 C SER B 425 -2.733 17.237 -22.539 1.00 50.20 C ATOM 1268 O SER B 425 -1.646 17.462 -23.069 1.00 53.43 O ATOM 1269 CB SER B 425 -3.289 19.609 -21.957 1.00 51.58 C ATOM 1270 OG SER B 425 -4.172 20.689 -22.201 1.00 53.83 O ATOM 1271 N ASP B 426 -3.002 16.092 -21.920 1.00 49.57 N ATOM 1272 CA ASP B 426 -2.095 14.945 -21.988 1.00 51.31 C ATOM 1273 C ASP B 426 -2.062 14.410 -23.419 1.00 53.66 C ATOM 1274 O ASP B 426 -2.919 14.762 -24.231 1.00 53.07 O ATOM 1275 CB ASP B 426 -2.529 13.851 -21.009 1.00 50.44 C ATOM 1276 CG ASP B 426 -1.440 12.833 -20.741 1.00 53.18 C ATOM 1277 OD1 ASP B 426 -0.282 13.074 -21.140 1.00 56.21 O ATOM 1278 OD2 ASP B 426 -1.745 11.793 -20.120 1.00 53.42 O ATOM 1279 N GLU B 427 -1.054 13.603 -23.744 1.00 55.61 N ATOM 1280 CA GLU B 427 -0.939 13.038 -25.088 1.00 55.21 C ATOM 1281 C GLU B 427 -2.205 12.284 -25.491 1.00 54.00 C ATOM 1282 O GLU B 427 -2.669 11.397 -24.773 1.00 54.99 O ATOM 1283 CB GLU B 427 0.266 12.098 -25.186 1.00 57.76 C ATOM 1284 CG GLU B 427 1.374 12.359 -24.184 1.00 60.15 C ATOM 1285 CD GLU B 427 2.666 11.654 -24.562 1.00 67.80 C ATOM 1286 OE1 GLU B 427 2.628 10.428 -24.801 1.00 68.33 O ATOM 1287 OE2 GLU B 427 3.719 12.325 -24.621 1.00 70.84 O ATOM 1288 N ALA B 428 -2.757 12.644 -26.645 1.00 53.45 N ATOM 1289 CA ALA B 428 -3.980 12.022 -27.137 1.00 53.16 C ATOM 1290 C ALA B 428 -3.678 10.708 -27.850 1.00 54.28 C ATOM 1291 O ALA B 428 -2.720 10.614 -28.616 1.00 57.74 O ATOM 1292 CB ALA B 428 -4.717 12.970 -28.063 1.00 51.43 C ATOM 1293 N SER B 429 -4.495 9.693 -27.585 1.00 53.59 N ATOM 1294 CA SER B 429 -4.299 8.375 -28.178 1.00 52.40 C ATOM 1295 C SER B 429 -5.150 8.159 -29.427 1.00 54.35 C ATOM 1296 O SER B 429 -5.048 7.121 -30.079 1.00 56.25 O ATOM 1297 CB SER B 429 -4.611 7.286 -27.153 1.00 52.51 C ATOM 1298 OG SER B 429 -5.986 7.299 -26.811 1.00 52.26 O ATOM 1299 N GLY B 430 -5.991 9.134 -29.758 1.00 52.53 N ATOM 1300 CA GLY B 430 -6.859 9.017 -30.915 1.00 50.51 C ATOM 1301 C GLY B 430 -8.176 9.751 -30.757 1.00 51.44 C ATOM 1302 O GLY B 430 -8.358 10.524 -29.818 1.00 51.31 O ATOM 1303 N CYS B 431 -9.100 9.501 -31.680 1.00 49.33 N ATOM 1304 CA CYS B 431 -10.408 10.145 -31.655 1.00 49.60 C ATOM 1305 C CYS B 431 -11.417 9.268 -30.921 1.00 51.53 C ATOM 1306 O CYS B 431 -11.793 8.200 -31.405 1.00 51.66 O ATOM 1307 CB CYS B 431 -10.886 10.433 -33.081 1.00 49.90 C ATOM 1308 SG CYS B 431 -12.350 11.485 -33.200 1.00 57.20 S ATOM 1309 N HIS B 432 -11.859 9.726 -29.754 1.00 49.73 N ATOM 1310 CA HIS B 432 -12.742 8.930 -28.910 1.00 49.98 C ATOM 1311 C HIS B 432 -14.048 9.655 -28.619 1.00 50.93 C ATOM 1312 O HIS B 432 -14.048 10.766 -28.087 1.00 50.22 O ATOM 1313 CB HIS B 432 -12.039 8.567 -27.601 1.00 47.49 C ATOM 1314 CG HIS B 432 -10.738 7.850 -27.799 1.00 49.56 C ATOM 1315 ND1 HIS B 432 -10.656 6.614 -28.396 1.00 49.18 N ATOM 1316 CD2 HIS B 432 -9.470 8.204 -27.482 1.00 50.14 C ATOM 1317 CE1 HIS B 432 -9.389 6.231 -28.439 1.00 49.39 C ATOM 1318 NE2 HIS B 432 -8.652 7.177 -27.891 1.00 50.23 N ATOM 1319 N TYR B 433 -15.154 9.007 -28.976 1.00 49.47 N ATOM 1320 CA TYR B 433 -16.494 9.564 -28.815 1.00 51.88 C ATOM 1321 C TYR B 433 -16.625 10.928 -29.495 1.00 53.61 C ATOM 1322 O TYR B 433 -17.338 11.808 -29.014 1.00 54.73 O ATOM 1323 CB TYR B 433 -16.860 9.664 -27.331 1.00 52.10 C ATOM 1324 CG TYR B 433 -16.782 8.340 -26.599 1.00 53.00 C ATOM 1325 CD1 TYR B 433 -17.586 7.269 -26.972 1.00 53.48 C ATOM 1326 CD2 TYR B 433 -15.910 8.162 -25.532 1.00 49.63 C ATOM 1327 CE1 TYR B 433 -17.519 6.057 -26.308 1.00 52.02 C ATOM 1328 CE2 TYR B 433 -15.838 6.954 -24.860 1.00 50.65 C ATOM 1329 CZ TYR B 433 -16.644 5.905 -25.253 1.00 52.84 C ATOM 1330 OH TYR B 433 -16.576 4.703 -24.587 1.00 51.78 O ATOM 1331 N GLY B 434 -15.928 11.090 -30.617 1.00 52.88 N ATOM 1332 CA GLY B 434 -16.044 12.287 -31.431 1.00 53.51 C ATOM 1333 C GLY B 434 -14.944 13.313 -31.232 1.00 53.38 C ATOM 1334 O GLY B 434 -14.804 14.241 -32.030 1.00 54.29 O ATOM 1335 N VAL B 435 -14.159 13.150 -30.172 1.00 51.57 N ATOM 1336 CA VAL B 435 -13.155 14.143 -29.801 1.00 50.08 C ATOM 1337 C VAL B 435 -11.781 13.509 -29.592 1.00 49.60 C ATOM 1338 O VAL B 435 -11.675 12.411 -29.045 1.00 49.73 O ATOM 1339 CB VAL B 435 -13.574 14.891 -28.511 1.00 50.73 C ATOM 1340 CG1 VAL B 435 -12.509 15.889 -28.082 1.00 50.11 C ATOM 1341 CG2 VAL B 435 -14.910 15.589 -28.710 1.00 50.51 C ATOM 1342 N LEU B 436 -10.733 14.197 -30.040 1.00 47.06 N ATOM 1343 CA LEU B 436 -9.370 13.760 -29.767 1.00 47.88 C ATOM 1344 C LEU B 436 -9.116 13.799 -28.259 1.00 49.63 C ATOM 1345 O LEU B 436 -9.213 14.858 -27.638 1.00 48.18 O ATOM 1346 CB LEU B 436 -8.373 14.657 -30.505 1.00 46.75 C ATOM 1347 CG LEU B 436 -6.912 14.220 -30.623 1.00 52.69 C ATOM 1348 CD1 LEU B 436 -6.774 13.035 -31.568 1.00 51.96 C ATOM 1349 CD2 LEU B 436 -6.042 15.382 -31.080 1.00 54.92 C ATOM 1350 N THR B 437 -8.765 12.653 -27.678 1.00 48.55 N ATOM 1351 CA THR B 437 -8.580 12.540 -26.229 1.00 48.44 C ATOM 1352 C THR B 437 -7.525 11.503 -25.865 1.00 50.79 C ATOM 1353 O THR B 437 -7.161 10.656 -26.682 1.00 50.51 O ATOM 1354 CB THR B 437 -9.892 12.141 -25.486 1.00 47.18 C ATOM 1355 OG1 THR B 437 -10.322 10.846 -25.921 1.00 50.53 O ATOM 1356 CG2 THR B 437 -11.012 13.153 -25.700 1.00 47.48 C ATOM 1357 N CYS B 438 -7.034 11.583 -24.632 1.00 48.13 N ATOM 1358 CA CYS B 438 -6.209 10.527 -24.059 1.00 47.38 C ATOM 1359 C CYS B 438 -7.093 9.348 -23.661 1.00 44.72 C ATOM 1360 O CYS B 438 -8.310 9.491 -23.541 1.00 46.86 O ATOM 1361 CB CYS B 438 -5.421 11.037 -22.850 1.00 49.11 C ATOM 1362 SG CYS B 438 -6.418 11.344 -21.371 1.00 43.46 S ATOM 1363 N GLY B 439 -6.482 8.183 -23.476 1.00 45.97 N ATOM 1364 CA GLY B 439 -7.209 6.998 -23.053 1.00 46.07 C ATOM 1365 C GLY B 439 -7.933 7.154 -21.726 1.00 45.11 C ATOM 1366 O GLY B 439 -9.037 6.638 -21.552 1.00 46.21 O ATOM 1367 N SER B 440 -7.317 7.868 -20.788 1.00 43.51 N ATOM 1368 CA SER B 440 -7.904 8.050 -19.462 1.00 43.51 C ATOM 1369 C SER B 440 -9.198 8.859 -19.523 1.00 39.60 C ATOM 1370 O SER B 440 -10.181 8.516 -18.873 1.00 38.51 O ATOM 1371 CB SER B 440 -6.905 8.726 -18.518 1.00 44.28 C ATOM 1372 OG SER B 440 -6.682 10.076 -18.884 1.00 42.90 O ATOM 1373 N CYS B 441 -9.197 9.929 -20.311 1.00 40.51 N ATOM 1374 CA CYS B 441 -10.390 10.755 -20.456 1.00 40.51 C ATOM 1375 C CYS B 441 -11.486 10.021 -21.220 1.00 41.77 C ATOM 1376 O CYS B 441 -12.672 10.274 -21.012 1.00 40.31 O ATOM 1377 CB CYS B 441 -10.051 12.073 -21.151 1.00 44.23 C ATOM 1378 SG CYS B 441 -9.181 13.247 -20.087 1.00 39.03 S ATOM 1379 N LYS B 442 -11.084 9.110 -22.102 1.00 42.87 N ATOM 1380 CA LYS B 442 -12.040 8.283 -22.827 1.00 44.46 C ATOM 1381 C LYS B 442 -12.852 7.427 -21.863 1.00 43.04 C ATOM 1382 O LYS B 442 -14.082 7.442 -21.893 1.00 44.60 O ATOM 1383 CB LYS B 442 -11.329 7.386 -23.846 1.00 45.94 C ATOM 1384 CG LYS B 442 -12.221 6.295 -24.426 1.00 47.23 C ATOM 1385 CD LYS B 442 -11.455 5.367 -25.356 1.00 47.89 C ATOM 1386 CE LYS B 442 -12.318 4.188 -25.787 1.00 52.07 C ATOM 1387 NZ LYS B 442 -11.670 3.366 -26.852 1.00 50.61 N ATOM 1388 N VAL B 443 -12.158 6.690 -21.002 1.00 43.12 N ATOM 1389 CA VAL B 443 -12.821 5.769 -20.086 1.00 44.12 C ATOM 1390 C VAL B 443 -13.523 6.524 -18.953 1.00 45.03 C ATOM 1391 O VAL B 443 -14.527 6.054 -18.416 1.00 47.01 O ATOM 1392 CB VAL B 443 -11.821 4.734 -19.505 1.00 43.94 C ATOM 1393 CG1 VAL B 443 -10.798 5.404 -18.600 1.00 45.30 C ATOM 1394 CG2 VAL B 443 -12.557 3.628 -18.761 1.00 46.92 C ATOM 1395 N PHE B 444 -13.011 7.701 -18.603 1.00 44.69 N ATOM 1396 CA PHE B 444 -13.671 8.531 -17.601 1.00 43.77 C ATOM 1397 C PHE B 444 -15.052 8.945 -18.091 1.00 42.79 C ATOM 1398 O PHE B 444 -16.045 8.789 -17.382 1.00 42.61 O ATOM 1399 CB PHE B 444 -12.837 9.773 -17.270 1.00 41.49 C ATOM 1400 CG PHE B 444 -13.577 10.795 -16.448 1.00 40.51 C ATOM 1401 CD1 PHE B 444 -13.685 10.652 -15.073 1.00 42.10 C ATOM 1402 CD2 PHE B 444 -14.165 11.897 -17.050 1.00 41.65 C ATOM 1403 CE1 PHE B 444 -14.367 11.590 -14.313 1.00 43.07 C ATOM 1404 CE2 PHE B 444 -14.849 12.838 -16.296 1.00 42.06 C ATOM 1405 CZ PHE B 444 -14.949 12.684 -14.926 1.00 42.19 C ATOM 1406 N PHE B 445 -15.100 9.470 -19.312 1.00 42.06 N ATOM 1407 CA PHE B 445 -16.347 9.935 -19.904 1.00 46.41 C ATOM 1408 C PHE B 445 -17.367 8.807 -20.006 1.00 49.20 C ATOM 1409 O PHE B 445 -18.521 8.967 -19.606 1.00 50.02 O ATOM 1410 CB PHE B 445 -16.091 10.539 -21.285 1.00 45.87 C ATOM 1411 CG PHE B 445 -17.334 11.022 -21.974 1.00 48.67 C ATOM 1412 CD1 PHE B 445 -17.962 12.185 -21.562 1.00 48.36 C ATOM 1413 CD2 PHE B 445 -17.872 10.315 -23.037 1.00 50.18 C ATOM 1414 CE1 PHE B 445 -19.107 12.633 -22.194 1.00 49.80 C ATOM 1415 CE2 PHE B 445 -19.017 10.759 -23.673 1.00 52.00 C ATOM 1416 CZ PHE B 445 -19.634 11.919 -23.251 1.00 52.91 C ATOM 1417 N LYS B 446 -16.929 7.670 -20.539 1.00 48.72 N ATOM 1418 CA LYS B 446 -17.771 6.483 -20.639 1.00 50.68 C ATOM 1419 C LYS B 446 -18.358 6.118 -19.282 1.00 52.70 C ATOM 1420 O LYS B 446 -19.562 5.915 -19.157 1.00 56.49 O ATOM 1421 CB LYS B 446 -16.974 5.304 -21.201 1.00 50.89 C ATOM 1422 CG LYS B 446 -17.719 3.974 -21.185 1.00 54.15 C ATOM 1423 CD LYS B 446 -18.860 3.952 -22.191 1.00 56.02 C ATOM 1424 CE LYS B 446 -19.411 2.543 -22.365 1.00 61.55 C ATOM 1425 NZ LYS B 446 -20.529 2.491 -23.349 1.00 60.92 N ATOM 1426 N ARG B 447 -17.500 6.051 -18.269 1.00 49.05 N ATOM 1427 CA ARG B 447 -17.927 5.729 -16.911 1.00 52.28 C ATOM 1428 C ARG B 447 -18.868 6.781 -16.324 1.00 56.25 C ATOM 1429 O ARG B 447 -19.772 6.451 -15.560 1.00 59.14 O ATOM 1430 CB ARG B 447 -16.709 5.564 -15.999 1.00 51.58 C ATOM 1431 CG ARG B 447 -16.006 4.224 -16.129 1.00 50.63 C ATOM 1432 CD ARG B 447 -14.619 4.273 -15.510 1.00 50.69 C ATOM 1433 NE ARG B 447 -13.998 2.953 -15.454 1.00 50.72 N ATOM 1434 CZ ARG B 447 -12.707 2.743 -15.215 1.00 50.27 C ATOM 1435 NH1 ARG B 447 -11.889 3.768 -15.018 1.00 46.80 N ATOM 1436 NH2 ARG B 447 -12.232 1.506 -15.181 1.00 50.83 N ATOM 1437 N ALA B 448 -18.652 8.044 -16.678 1.00 53.67 N ATOM 1438 CA ALA B 448 -19.448 9.138 -16.124 1.00 55.94 C ATOM 1439 C ALA B 448 -20.880 9.129 -16.654 1.00 56.98 C ATOM 1440 O ALA B 448 -21.834 9.280 -15.889 1.00 58.94 O ATOM 1441 CB ALA B 448 -18.786 10.475 -16.420 1.00 51.10 C ATOM 1442 N VAL B 449 -21.025 8.958 -17.965 1.00 55.70 N ATOM 1443 CA VAL B 449 -22.342 8.904 -18.592 1.00 58.12 C ATOM 1444 C VAL B 449 -23.089 7.657 -18.129 1.00 62.06 C ATOM 1445 O VAL B 449 -24.257 7.718 -17.745 1.00 63.22 O ATOM 1446 CB VAL B 449 -22.237 8.901 -20.127 1.00 57.52 C ATOM 1447 CG1 VAL B 449 -23.623 8.862 -20.756 1.00 59.75 C ATOM 1448 CG2 VAL B 449 -21.461 10.117 -20.607 1.00 55.33 C ATOM 1449 N GLU B 450 -22.382 6.533 -18.171 1.00 61.03 N ATOM 1450 CA GLU B 450 -22.872 5.235 -17.720 1.00 64.55 C ATOM 1451 C GLU B 450 -23.275 5.223 -16.250 1.00 67.12 C ATOM 1452 O GLU B 450 -24.150 4.460 -15.840 1.00 69.69 O ATOM 1453 CB GLU B 450 -21.780 4.181 -17.938 1.00 65.36 C ATOM 1454 CG GLU B 450 -22.249 2.791 -18.329 1.00 71.19 C ATOM 1455 CD GLU B 450 -21.092 1.810 -18.430 1.00 74.48 C ATOM 1456 OE1 GLU B 450 -20.073 2.020 -17.737 1.00 78.47 O ATOM 1457 OE2 GLU B 450 -21.198 0.830 -19.198 1.00 74.39 O ATOM 1458 N GLY B 451 -22.616 6.069 -15.464 1.00 67.46 N ATOM 1459 CA GLY B 451 -22.493 5.861 -14.031 1.00 69.80 C ATOM 1460 C GLY B 451 -23.290 6.649 -13.001 1.00 74.79 C ATOM 1461 O GLY B 451 -22.823 6.762 -11.868 1.00 76.19 O ATOM 1462 N GLN B 452 -24.437 7.226 -13.367 1.00 75.38 N ATOM 1463 CA GLN B 452 -25.352 7.825 -12.376 1.00 78.08 C ATOM 1464 C GLN B 452 -24.795 9.116 -11.745 1.00 79.37 C ATOM 1465 O GLN B 452 -25.530 9.880 -11.118 1.00 78.06 O ATOM 1466 CB GLN B 452 -25.676 6.776 -11.285 1.00 81.05 C ATOM 1467 CG GLN B 452 -26.292 7.257 -9.948 1.00 82.15 C ATOM 1468 CD GLN B 452 -27.708 7.824 -10.061 1.00 84.01 C ATOM 1469 OE1 GLN B 452 -28.000 8.659 -10.922 1.00 83.84 O ATOM 1470 NE2 GLN B 452 -28.594 7.375 -9.166 1.00 83.50 N ATOM 1471 N HIS B 453 -23.513 9.385 -11.977 1.00 77.67 N ATOM 1472 CA HIS B 453 -22.744 10.312 -11.152 1.00 73.45 C ATOM 1473 C HIS B 453 -23.306 11.724 -11.021 1.00 71.30 C ATOM 1474 O HIS B 453 -23.552 12.414 -12.013 1.00 71.51 O ATOM 1475 CB HIS B 453 -21.316 10.404 -11.685 1.00 70.57 C ATOM 1476 CG HIS B 453 -20.543 9.132 -11.551 1.00 70.93 C ATOM 1477 ND1 HIS B 453 -20.579 8.139 -12.504 1.00 71.26 N ATOM 1478 CD2 HIS B 453 -19.743 8.676 -10.559 1.00 72.10 C ATOM 1479 CE1 HIS B 453 -19.814 7.134 -12.116 1.00 70.83 C ATOM 1480 NE2 HIS B 453 -19.297 7.434 -10.939 1.00 70.97 N ATOM 1481 N ASN B 454 -23.511 12.130 -9.771 1.00 70.99 N ATOM 1482 CA ASN B 454 -23.721 13.526 -9.428 1.00 68.60 C ATOM 1483 C ASN B 454 -22.391 14.091 -8.965 1.00 61.42 C ATOM 1484 O ASN B 454 -21.894 13.731 -7.898 1.00 63.07 O ATOM 1485 CB ASN B 454 -24.774 13.688 -8.327 1.00 71.94 C ATOM 1486 CG ASN B 454 -26.142 13.179 -8.738 1.00 75.13 C ATOM 1487 OD1 ASN B 454 -26.752 13.691 -9.678 1.00 78.74 O ATOM 1488 ND2 ASN B 454 -26.639 12.176 -8.022 1.00 75.55 N ATOM 1489 N TYR B 455 -21.812 14.973 -9.769 1.00 54.98 N ATOM 1490 CA TYR B 455 -20.520 15.551 -9.443 1.00 50.57 C ATOM 1491 C TYR B 455 -20.699 16.946 -8.873 1.00 45.24 C ATOM 1492 O TYR B 455 -21.554 17.705 -9.328 1.00 43.93 O ATOM 1493 CB TYR B 455 -19.622 15.602 -10.678 1.00 50.06 C ATOM 1494 CG TYR B 455 -19.185 14.255 -11.209 1.00 50.56 C ATOM 1495 CD1 TYR B 455 -18.782 13.239 -10.351 1.00 53.20 C ATOM 1496 CD2 TYR B 455 -19.164 14.006 -12.575 1.00 49.64 C ATOM 1497 CE1 TYR B 455 -18.375 12.010 -10.842 1.00 54.14 C ATOM 1498 CE2 TYR B 455 -18.762 12.785 -13.074 1.00 50.86 C ATOM 1499 CZ TYR B 455 -18.366 11.791 -12.206 1.00 55.79 C ATOM 1500 OH TYR B 455 -17.969 10.573 -12.708 1.00 56.06 O ATOM 1501 N LEU B 456 -19.893 17.282 -7.872 1.00 41.95 N ATOM 1502 CA LEU B 456 -19.925 18.618 -7.300 1.00 39.77 C ATOM 1503 C LEU B 456 -18.526 19.218 -7.218 1.00 37.38 C ATOM 1504 O LEU B 456 -17.636 18.669 -6.569 1.00 35.00 O ATOM 1505 CB LEU B 456 -20.573 18.600 -5.913 1.00 38.08 C ATOM 1506 CG LEU B 456 -20.648 19.950 -5.198 1.00 38.89 C ATOM 1507 CD1 LEU B 456 -21.360 20.984 -6.063 1.00 37.73 C ATOM 1508 CD2 LEU B 456 -21.344 19.807 -3.853 1.00 38.43 C ATOM 1509 N CYS B 457 -18.342 20.347 -7.892 1.00 34.47 N ATOM 1510 CA CYS B 457 -17.102 21.102 -7.805 1.00 33.79 C ATOM 1511 C CYS B 457 -16.989 21.769 -6.437 1.00 33.69 C ATOM 1512 O CYS B 457 -17.967 22.307 -5.920 1.00 30.83 O ATOM 1513 CB CYS B 457 -17.042 22.149 -8.918 1.00 34.30 C ATOM 1514 SG CYS B 457 -15.542 23.147 -8.969 1.00 33.35 S ATOM 1515 N ALA B 458 -15.798 21.721 -5.850 1.00 32.55 N ATOM 1516 CA ALA B 458 -15.548 22.389 -4.576 1.00 35.07 C ATOM 1517 C ALA B 458 -15.150 23.836 -4.833 1.00 35.47 C ATOM 1518 O ALA B 458 -15.043 24.646 -3.913 1.00 34.53 O ATOM 1519 CB ALA B 458 -14.467 21.663 -3.792 1.00 34.23 C ATOM 1520 N GLY B 459 -14.918 24.132 -6.107 1.00 37.21 N ATOM 1521 CA GLY B 459 -14.517 25.447 -6.569 1.00 37.24 C ATOM 1522 C GLY B 459 -15.633 26.259 -7.202 1.00 41.53 C ATOM 1523 O GLY B 459 -16.776 26.260 -6.745 1.00 42.00 O ATOM 1524 N ARG B 460 -15.250 27.013 -8.226 1.00 38.51 N ATOM 1525 CA ARG B 460 -16.138 27.881 -8.993 1.00 39.96 C ATOM 1526 C ARG B 460 -16.646 27.285 -10.320 1.00 42.41 C ATOM 1527 O ARG B 460 -17.225 28.002 -11.138 1.00 41.40 O ATOM 1528 CB ARG B 460 -15.427 29.208 -9.231 1.00 42.73 C ATOM 1529 CG ARG B 460 -15.114 29.920 -7.916 1.00 45.36 C ATOM 1530 CD ARG B 460 -14.266 31.163 -8.106 1.00 47.14 C ATOM 1531 NE ARG B 460 -14.084 31.895 -6.854 1.00 48.80 N ATOM 1532 CZ ARG B 460 -13.209 31.560 -5.912 1.00 47.14 C ATOM 1533 NH1 ARG B 460 -12.439 30.493 -6.070 1.00 46.18 N ATOM 1534 NH2 ARG B 460 -13.105 32.287 -4.808 1.00 50.17 N ATOM 1535 N ASN B 461 -16.383 25.994 -10.535 1.00 40.11 N ATOM 1536 CA ASN B 461 -16.577 25.302 -11.821 1.00 40.75 C ATOM 1537 C ASN B 461 -15.642 25.831 -12.911 1.00 40.26 C ATOM 1538 O ASN B 461 -15.901 25.651 -14.099 1.00 44.61 O ATOM 1539 CB ASN B 461 -18.032 25.429 -12.319 1.00 38.60 C ATOM 1540 CG ASN B 461 -18.939 24.312 -11.826 1.00 39.75 C ATOM 1541 OD1 ASN B 461 -18.477 23.278 -11.356 1.00 38.23 O ATOM 1542 ND2 ASN B 461 -20.248 24.515 -11.956 1.00 37.21 N ATOM 1543 N ASP B 462 -14.573 26.506 -12.500 1.00 42.88 N ATOM 1544 CA ASP B 462 -13.502 26.930 -13.407 1.00 46.81 C ATOM 1545 C ASP B 462 -12.211 26.103 -13.314 1.00 43.66 C ATOM 1546 O ASP B 462 -11.192 26.502 -13.875 1.00 48.79 O ATOM 1547 CB ASP B 462 -13.187 28.418 -13.213 1.00 48.09 C ATOM 1548 CG ASP B 462 -13.024 28.802 -11.766 1.00 50.05 C ATOM 1549 OD1 ASP B 462 -12.898 27.898 -10.916 1.00 49.53 O ATOM 1550 OD2 ASP B 462 -13.012 30.017 -11.478 1.00 60.27 O ATOM 1551 N CYS B 463 -12.238 24.993 -12.578 1.00 41.93 N ATOM 1552 CA CYS B 463 -11.025 24.232 -12.244 1.00 39.22 C ATOM 1553 C CYS B 463 -10.087 23.935 -13.417 1.00 42.81 C ATOM 1554 O CYS B 463 -10.527 23.641 -14.530 1.00 43.62 O ATOM 1555 CB CYS B 463 -11.401 22.892 -11.596 1.00 37.78 C ATOM 1556 SG CYS B 463 -11.975 22.967 -9.884 1.00 34.28 S ATOM 1557 N ILE B 464 -8.788 24.048 -13.152 1.00 39.42 N ATOM 1558 CA ILE B 464 -7.755 23.650 -14.102 1.00 39.99 C ATOM 1559 C ILE B 464 -7.733 22.133 -14.262 1.00 41.91 C ATOM 1560 O ILE B 464 -7.596 21.401 -13.280 1.00 41.10 O ATOM 1561 CB ILE B 464 -6.354 24.118 -13.650 1.00 41.35 C ATOM 1562 CG1 ILE B 464 -6.340 25.627 -13.387 1.00 42.19 C ATOM 1563 CG2 ILE B 464 -5.301 23.729 -14.677 1.00 43.09 C ATOM 1564 CD1 ILE B 464 -6.526 26.468 -14.629 1.00 43.79 C ATOM 1565 N ILE B 465 -7.870 21.663 -15.497 1.00 41.79 N ATOM 1566 CA ILE B 465 -7.822 20.232 -15.768 1.00 44.52 C ATOM 1567 C ILE B 465 -6.616 19.877 -16.631 1.00 44.99 C ATOM 1568 O ILE B 465 -6.556 20.227 -17.810 1.00 41.56 O ATOM 1569 CB ILE B 465 -9.110 19.743 -16.460 1.00 44.66 C ATOM 1570 CG1 ILE B 465 -10.321 19.981 -15.555 1.00 41.84 C ATOM 1571 CG2 ILE B 465 -8.999 18.268 -16.817 1.00 41.11 C ATOM 1572 CD1 ILE B 465 -10.267 19.221 -14.248 1.00 40.68 C ATOM 1573 N ASP B 466 -5.658 19.182 -16.030 1.00 44.50 N ATOM 1574 CA ASP B 466 -4.491 18.696 -16.755 1.00 48.58 C ATOM 1575 C ASP B 466 -4.148 17.286 -16.285 1.00 48.09 C ATOM 1576 O ASP B 466 -4.903 16.689 -15.519 1.00 47.56 O ATOM 1577 CB ASP B 466 -3.297 19.646 -16.581 1.00 49.33 C ATOM 1578 CG ASP B 466 -2.936 19.891 -15.123 1.00 47.85 C ATOM 1579 OD1 ASP B 466 -3.336 19.094 -14.250 1.00 49.12 O ATOM 1580 OD2 ASP B 466 -2.242 20.892 -14.848 1.00 50.27 O ATOM 1581 N LYS B 467 -3.015 16.766 -16.748 1.00 50.52 N ATOM 1582 CA LYS B 467 -2.602 15.394 -16.455 1.00 49.72 C ATOM 1583 C LYS B 467 -2.648 15.064 -14.963 1.00 50.08 C ATOM 1584 O LYS B 467 -3.098 13.987 -14.573 1.00 49.44 O ATOM 1585 CB LYS B 467 -1.192 15.143 -17.001 1.00 52.14 C ATOM 1586 CG LYS B 467 -0.710 13.707 -16.862 1.00 52.66 C ATOM 1587 CD LYS B 467 0.677 13.533 -17.464 1.00 55.47 C ATOM 1588 CE LYS B 467 1.237 12.146 -17.183 1.00 55.56 C ATOM 1589 NZ LYS B 467 0.629 11.110 -18.063 1.00 55.11 N ATOM 1590 N ILE B 468 -2.173 15.989 -14.134 1.00 50.59 N ATOM 1591 CA ILE B 468 -2.178 15.795 -12.685 1.00 51.22 C ATOM 1592 C ILE B 468 -3.515 16.131 -12.014 1.00 50.49 C ATOM 1593 O ILE B 468 -3.999 15.376 -11.169 1.00 48.63 O ATOM 1594 CB ILE B 468 -1.078 16.639 -12.011 1.00 51.51 C ATOM 1595 CG1 ILE B 468 0.229 16.547 -12.801 1.00 53.48 C ATOM 1596 CG2 ILE B 468 -0.881 16.206 -10.565 1.00 52.51 C ATOM 1597 CD1 ILE B 468 0.988 17.858 -12.879 1.00 53.80 C ATOM 1598 N ARG B 469 -4.112 17.257 -12.402 1.00 47.10 N ATOM 1599 CA ARG B 469 -5.257 17.811 -11.675 1.00 47.02 C ATOM 1600 C ARG B 469 -6.613 17.273 -12.123 1.00 44.69 C ATOM 1601 O ARG B 469 -7.633 17.573 -11.503 1.00 42.87 O ATOM 1602 CB ARG B 469 -5.270 19.338 -11.795 1.00 46.10 C ATOM 1603 CG ARG B 469 -4.128 20.041 -11.082 1.00 44.77 C ATOM 1604 CD ARG B 469 -4.109 21.526 -11.425 1.00 44.58 C ATOM 1605 NE ARG B 469 -3.074 22.245 -10.688 1.00 47.77 N ATOM 1606 CZ ARG B 469 -1.805 22.331 -11.073 1.00 48.92 C ATOM 1607 NH1 ARG B 469 -1.406 21.743 -12.194 1.00 48.99 N ATOM 1608 NH2 ARG B 469 -0.932 23.004 -10.335 1.00 49.03 N ATOM 1609 N ARG B 470 -6.631 16.488 -13.197 1.00 45.17 N ATOM 1610 CA ARG B 470 -7.884 15.952 -13.722 1.00 43.43 C ATOM 1611 C ARG B 470 -8.563 15.025 -12.716 1.00 42.42 C ATOM 1612 O ARG B 470 -9.780 14.847 -12.751 1.00 41.68 O ATOM 1613 CB ARG B 470 -7.642 15.213 -15.041 1.00 45.61 C ATOM 1614 CG ARG B 470 -6.703 14.027 -14.921 1.00 45.25 C ATOM 1615 CD ARG B 470 -6.281 13.500 -16.285 1.00 45.13 C ATOM 1616 NE ARG B 470 -5.485 12.283 -16.156 1.00 45.78 N ATOM 1617 CZ ARG B 470 -4.636 11.838 -17.077 1.00 47.41 C ATOM 1618 NH1 ARG B 470 -4.463 12.511 -18.207 1.00 46.37 N ATOM 1619 NH2 ARG B 470 -3.957 10.720 -16.864 1.00 47.02 N ATOM 1620 N LYS B 471 -7.770 14.445 -11.819 1.00 43.04 N ATOM 1621 CA LYS B 471 -8.297 13.568 -10.780 1.00 43.23 C ATOM 1622 C LYS B 471 -9.086 14.343 -9.731 1.00 44.80 C ATOM 1623 O LYS B 471 -10.010 13.807 -9.119 1.00 45.82 O ATOM 1624 CB LYS B 471 -7.164 12.800 -10.093 1.00 46.78 C ATOM 1625 CG LYS B 471 -6.484 11.749 -10.955 1.00 47.58 C ATOM 1626 CD LYS B 471 -5.485 10.951 -10.130 1.00 52.67 C ATOM 1627 CE LYS B 471 -4.866 9.821 -10.936 1.00 54.93 C ATOM 1628 NZ LYS B 471 -4.061 10.329 -12.079 1.00 62.05 N ATOM 1629 N ASN B 472 -8.709 15.602 -9.525 1.00 43.67 N ATOM 1630 CA ASN B 472 -9.280 16.422 -8.459 1.00 43.20 C ATOM 1631 C ASN B 472 -10.771 16.683 -8.617 1.00 42.96 C ATOM 1632 O ASN B 472 -11.540 16.528 -7.667 1.00 42.25 O ATOM 1633 CB ASN B 472 -8.547 17.763 -8.375 1.00 41.78 C ATOM 1634 CG ASN B 472 -7.090 17.609 -7.990 1.00 43.99 C ATOM 1635 OD1 ASN B 472 -6.512 16.529 -8.117 1.00 47.07 O ATOM 1636 ND2 ASN B 472 -6.486 18.693 -7.520 1.00 45.82 N ATOM 1637 N CYS B 473 -11.178 17.084 -9.816 1.00 39.60 N ATOM 1638 CA CYS B 473 -12.547 17.534 -10.023 1.00 40.47 C ATOM 1639 C CYS B 473 -13.198 16.884 -11.236 1.00 38.38 C ATOM 1640 O CYS B 473 -13.105 17.406 -12.347 1.00 37.34 O ATOM 1641 CB CYS B 473 -12.585 19.057 -10.166 1.00 36.33 C ATOM 1642 SG CYS B 473 -14.247 19.752 -10.106 1.00 36.82 S ATOM 1643 N PRO B 474 -13.855 15.734 -11.024 1.00 40.71 N ATOM 1644 CA PRO B 474 -14.616 15.060 -12.082 1.00 40.87 C ATOM 1645 C PRO B 474 -15.750 15.931 -12.618 1.00 41.09 C ATOM 1646 O PRO B 474 -16.174 15.744 -13.756 1.00 39.65 O ATOM 1647 CB PRO B 474 -15.167 13.809 -11.383 1.00 41.82 C ATOM 1648 CG PRO B 474 -15.054 14.090 -9.917 1.00 42.92 C ATOM 1649 CD PRO B 474 -13.851 14.962 -9.771 1.00 42.38 C ATOM 1650 N ALA B 475 -16.226 16.870 -11.805 1.00 37.80 N ATOM 1651 CA ALA B 475 -17.277 17.793 -12.225 1.00 39.28 C ATOM 1652 C ALA B 475 -16.826 18.651 -13.401 1.00 39.04 C ATOM 1653 O ALA B 475 -17.497 18.707 -14.432 1.00 38.66 O ATOM 1654 CB ALA B 475 -17.701 18.675 -11.063 1.00 38.64 C ATOM 1655 N CYS B 476 -15.687 19.315 -13.242 1.00 36.70 N ATOM 1656 CA CYS B 476 -15.152 20.168 -14.296 1.00 40.09 C ATOM 1657 C CYS B 476 -14.586 19.336 -15.443 1.00 40.08 C ATOM 1658 O CYS B 476 -14.615 19.759 -16.598 1.00 38.83 O ATOM 1659 CB CYS B 476 -14.079 21.104 -13.736 1.00 38.24 C ATOM 1660 SG CYS B 476 -14.726 22.417 -12.660 1.00 36.96 S ATOM 1661 N ARG B 477 -14.072 18.153 -15.122 1.00 37.23 N ATOM 1662 CA ARG B 477 -13.541 17.258 -16.143 1.00 40.09 C ATOM 1663 C ARG B 477 -14.662 16.796 -17.066 1.00 39.97 C ATOM 1664 O ARG B 477 -14.514 16.793 -18.288 1.00 37.64 O ATOM 1665 CB ARG B 477 -12.842 16.053 -15.507 1.00 40.86 C ATOM 1666 CG ARG B 477 -12.088 15.180 -16.506 1.00 40.82 C ATOM 1667 CD ARG B 477 -11.411 13.997 -15.827 1.00 41.58 C ATOM 1668 NE ARG B 477 -10.561 13.249 -16.752 1.00 40.37 N ATOM 1669 CZ ARG B 477 -9.868 12.164 -16.421 1.00 42.21 C ATOM 1670 NH1 ARG B 477 -9.922 11.692 -15.183 1.00 37.93 N ATOM 1671 NH2 ARG B 477 -9.121 11.549 -17.328 1.00 41.39 N ATOM 1672 N TYR B 478 -15.788 16.414 -16.468 1.00 38.88 N ATOM 1673 CA TYR B 478 -16.952 15.972 -17.225 1.00 40.94 C ATOM 1674 C TYR B 478 -17.532 17.112 -18.053 1.00 42.59 C ATOM 1675 O TYR B 478 -17.943 16.911 -19.196 1.00 43.31 O ATOM 1676 CB TYR B 478 -18.017 15.406 -16.284 1.00 43.62 C ATOM 1677 CG TYR B 478 -19.248 14.877 -16.984 1.00 46.46 C ATOM 1678 CD1 TYR B 478 -19.162 13.819 -17.879 1.00 46.65 C ATOM 1679 CD2 TYR B 478 -20.499 15.426 -16.737 1.00 48.36 C ATOM 1680 CE1 TYR B 478 -20.286 13.329 -18.517 1.00 49.47 C ATOM 1681 CE2 TYR B 478 -21.629 14.944 -17.369 1.00 50.70 C ATOM 1682 CZ TYR B 478 -21.517 13.895 -18.256 1.00 50.57 C ATOM 1683 OH TYR B 478 -22.641 13.413 -18.886 1.00 55.76 O ATOM 1684 N ARG B 479 -17.561 18.309 -17.475 1.00 40.97 N ATOM 1685 CA ARG B 479 -18.052 19.484 -18.187 1.00 43.17 C ATOM 1686 C ARG B 479 -17.194 19.764 -19.417 1.00 41.44 C ATOM 1687 O ARG B 479 -17.716 20.072 -20.487 1.00 43.61 O ATOM 1688 CB ARG B 479 -18.080 20.711 -17.270 1.00 43.16 C ATOM 1689 CG ARG B 479 -18.393 22.013 -18.000 1.00 44.55 C ATOM 1690 CD ARG B 479 -18.427 23.204 -17.055 1.00 46.63 C ATOM 1691 NE ARG B 479 -17.251 23.251 -16.191 1.00 49.58 N ATOM 1692 CZ ARG B 479 -16.071 23.745 -16.554 1.00 49.36 C ATOM 1693 NH1 ARG B 479 -15.899 24.237 -17.774 1.00 50.34 N ATOM 1694 NH2 ARG B 479 -15.061 23.744 -15.695 1.00 47.19 N ATOM 1695 N LYS B 480 -15.879 19.647 -19.261 1.00 40.17 N ATOM 1696 CA LYS B 480 -14.960 19.867 -20.373 1.00 42.17 C ATOM 1697 C LYS B 480 -15.118 18.800 -21.453 1.00 43.70 C ATOM 1698 O LYS B 480 -14.907 19.074 -22.634 1.00 41.82 O ATOM 1699 CB LYS B 480 -13.513 19.904 -19.880 1.00 41.88 C ATOM 1700 CG LYS B 480 -13.161 21.160 -19.103 1.00 46.82 C ATOM 1701 CD LYS B 480 -11.662 21.288 -18.900 1.00 49.54 C ATOM 1702 CE LYS B 480 -11.334 22.430 -17.952 1.00 51.63 C ATOM 1703 NZ LYS B 480 -11.960 23.712 -18.377 1.00 54.24 N ATOM 1704 N CYS B 481 -15.483 17.586 -21.046 1.00 40.18 N ATOM 1705 CA CYS B 481 -15.778 16.522 -22.001 1.00 44.67 C ATOM 1706 C CYS B 481 -16.968 16.911 -22.871 1.00 45.33 C ATOM 1707 O CYS B 481 -16.929 16.774 -24.093 1.00 45.81 O ATOM 1708 CB CYS B 481 -16.065 15.201 -21.283 1.00 42.13 C ATOM 1709 SG CYS B 481 -14.615 14.376 -20.593 1.00 40.49 S ATOM 1710 N LEU B 482 -18.020 17.406 -22.228 1.00 45.16 N ATOM 1711 CA LEU B 482 -19.231 17.809 -22.931 1.00 45.19 C ATOM 1712 C LEU B 482 -18.994 19.038 -23.801 1.00 46.38 C ATOM 1713 O LEU B 482 -19.448 19.092 -24.944 1.00 48.45 O ATOM 1714 CB LEU B 482 -20.357 18.083 -21.934 1.00 44.11 C ATOM 1715 CG LEU B 482 -20.815 16.885 -21.103 1.00 45.52 C ATOM 1716 CD1 LEU B 482 -21.887 17.302 -20.110 1.00 47.82 C ATOM 1717 CD2 LEU B 482 -21.316 15.767 -22.005 1.00 47.25 C ATOM 1718 N GLN B 483 -18.280 20.020 -23.258 1.00 46.80 N ATOM 1719 CA GLN B 483 -17.994 21.253 -23.986 1.00 46.75 C ATOM 1720 C GLN B 483 -17.137 20.989 -25.220 1.00 47.97 C ATOM 1721 O GLN B 483 -17.237 21.702 -26.218 1.00 49.55 O ATOM 1722 CB GLN B 483 -17.302 22.269 -23.073 1.00 47.02 C ATOM 1723 CG GLN B 483 -18.211 22.867 -22.008 1.00 48.68 C ATOM 1724 CD GLN B 483 -17.484 23.835 -21.094 1.00 50.34 C ATOM 1725 OE1 GLN B 483 -16.260 23.961 -21.151 1.00 52.04 O ATOM 1726 NE2 GLN B 483 -18.236 24.529 -20.246 1.00 48.17 N ATOM 1727 N ALA B 484 -16.298 19.961 -25.148 1.00 46.94 N ATOM 1728 CA ALA B 484 -15.455 19.585 -26.277 1.00 47.36 C ATOM 1729 C ALA B 484 -16.257 18.824 -27.331 1.00 48.74 C ATOM 1730 O ALA B 484 -15.806 18.659 -28.464 1.00 49.63 O ATOM 1731 CB ALA B 484 -14.273 18.753 -25.805 1.00 47.03 C ATOM 1732 N GLY B 485 -17.446 18.365 -26.954 1.00 48.10 N ATOM 1733 CA GLY B 485 -18.329 17.686 -27.885 1.00 49.51 C ATOM 1734 C GLY B 485 -18.356 16.171 -27.780 1.00 53.49 C ATOM 1735 O GLY B 485 -18.871 15.498 -28.672 1.00 54.61 O ATOM 1736 N MET B 486 -17.804 15.627 -26.699 1.00 50.34 N ATOM 1737 CA MET B 486 -17.811 14.181 -26.493 1.00 53.28 C ATOM 1738 C MET B 486 -19.230 13.654 -26.303 1.00 55.49 C ATOM 1739 O MET B 486 -19.998 14.186 -25.503 1.00 53.69 O ATOM 1740 CB MET B 486 -16.954 13.794 -25.285 1.00 49.26 C ATOM 1741 CG MET B 486 -15.476 14.112 -25.426 1.00 50.08 C ATOM 1742 SD MET B 486 -14.503 13.412 -24.078 1.00 49.25 S ATOM 1743 CE MET B 486 -14.596 11.667 -24.479 1.00 46.12 C ATOM 1744 N ASN B 487 -19.577 12.615 -27.055 1.00 57.58 N ATOM 1745 CA ASN B 487 -20.868 11.955 -26.900 1.00 61.85 C ATOM 1746 C ASN B 487 -20.807 10.493 -27.329 1.00 63.66 C ATOM 1747 O ASN B 487 -20.026 10.131 -28.208 1.00 64.91 O ATOM 1748 CB ASN B 487 -21.946 12.699 -27.691 1.00 64.21 C ATOM 1749 CG ASN B 487 -21.558 12.922 -29.137 1.00 70.10 C ATOM 1750 OD1 ASN B 487 -20.374 12.966 -29.475 1.00 69.69 O ATOM 1751 ND2 ASN B 487 -22.555 13.059 -30.004 1.00 73.85 N ATOM 1752 N LEU B 488 -21.631 9.657 -26.703 1.00 66.08 N ATOM 1753 CA LEU B 488 -21.679 8.233 -27.025 1.00 67.51 C ATOM 1754 C LEU B 488 -22.179 8.011 -28.452 1.00 72.34 C ATOM 1755 O LEU B 488 -21.927 6.968 -29.057 1.00 73.11 O ATOM 1756 CB LEU B 488 -22.570 7.489 -26.028 1.00 67.08 C ATOM 1757 CG LEU B 488 -22.081 7.445 -24.577 1.00 63.27 C ATOM 1758 CD1 LEU B 488 -22.862 6.415 -23.778 1.00 62.37 C ATOM 1759 CD2 LEU B 488 -20.587 7.159 -24.510 1.00 60.98 C ATOM 1760 N GLU B 489 -22.889 9.003 -28.981 1.00 75.96 N ATOM 1761 CA GLU B 489 -23.340 8.986 -30.366 1.00 78.21 C ATOM 1762 C GLU B 489 -22.316 9.728 -31.230 1.00 81.44 C ATOM 1763 O GLU B 489 -22.174 10.947 -31.137 1.00 98.10 O ATOM 1764 CB GLU B 489 -24.744 9.609 -30.466 1.00 80.78 C ATOM 1765 CG GLU B 489 -25.043 10.456 -31.704 1.00 81.86 C ATOM 1766 CD GLU B 489 -25.392 9.641 -32.935 1.00 84.02 C ATOM 1767 OE1 GLU B 489 -25.108 8.425 -32.965 1.00 85.18 O ATOM 1768 OE2 GLU B 489 -25.959 10.227 -33.880 1.00 85.40 O ATOM 1769 N ALA B 490 -21.595 8.981 -32.061 1.00 82.19 N ATOM 1770 CA ALA B 490 -20.529 9.549 -32.886 1.00 80.44 C ATOM 1771 C ALA B 490 -20.017 8.528 -33.894 1.00 81.65 C ATOM 1772 O ALA B 490 -19.957 8.802 -35.092 1.00 82.31 O ATOM 1773 CB ALA B 490 -19.379 10.051 -32.012 1.00 73.17 C TER 1774 ALA B 490 HETATM 1775 ZN ZN A 601 -13.714 16.702 9.262 1.00 37.31 ZN HETATM 1776 ZN ZN A 602 -8.525 23.458 -3.537 1.00 32.94 ZN HETATM 1777 ZN ZN B 601 -14.065 22.069 -10.444 1.00 32.78 ZN HETATM 1778 ZN ZN B 602 -7.220 13.587 -21.306 1.00 44.03 ZN HETATM 1779 O HOH A 701 -10.571 26.953 -5.355 1.00 42.30 O HETATM 1780 O HOH A 702 -2.129 22.229 1.071 1.00 37.26 O HETATM 1781 O HOH A 703 2.777 17.351 13.131 1.00 46.40 O HETATM 1782 O HOH A 704 -7.311 29.984 0.877 1.00 43.29 O HETATM 1783 O HOH A 705 -16.612 23.417 6.164 1.00 43.03 O HETATM 1784 O HOH A 706 -10.156 10.241 5.656 1.00 39.60 O HETATM 1785 O HOH A 707 -5.027 25.258 -0.490 1.00 38.97 O HETATM 1786 O HOH A 708 -10.940 26.928 1.738 1.00 40.19 O HETATM 1787 O HOH A 709 -10.001 28.102 4.377 1.00 45.34 O HETATM 1788 O HOH A 710 -20.199 18.885 6.267 1.00 50.93 O HETATM 1789 O HOH A 711 -15.665 11.013 10.344 1.00 48.63 O HETATM 1790 O HOH A 712 -5.765 18.404 -4.151 1.00 42.10 O HETATM 1791 O HOH A 713 -10.734 22.575 18.605 1.00 49.24 O HETATM 1792 O HOH A 714 -5.475 15.754 20.788 1.00 45.63 O HETATM 1793 O HOH A 715 -9.312 25.850 9.276 1.00 39.52 O HETATM 1794 O HOH A 716 -9.134 21.166 -6.340 1.00 38.66 O HETATM 1795 O HOH A 717 -16.846 11.043 12.853 1.00 52.86 O HETATM 1796 O HOH A 718 -11.053 21.641 -6.907 1.00 40.63 O HETATM 1797 O HOH C 101 -12.848 -1.011 7.479 1.00 56.91 O HETATM 1798 O HOH C 102 -13.904 7.305 -13.195 1.00 45.28 O HETATM 1799 O HOH C 103 -11.224 12.438 -12.531 1.00 42.34 O HETATM 1800 O HOH C 104 -11.500 11.719 -8.179 1.00 46.62 O HETATM 1801 O HOH C 105 -10.064 7.517 -16.270 1.00 45.16 O HETATM 1802 O HOH C 106 -9.989 7.833 17.795 1.00 48.51 O HETATM 1803 O HOH C 107 -4.130 1.813 4.587 1.00 60.87 O HETATM 1804 O HOH C 108 -8.746 -2.758 -5.237 1.00 57.42 O HETATM 1805 O HOH C 109 -13.402 11.690 -7.133 1.00 52.82 O HETATM 1806 O HOH D 101 2.012 0.198 28.804 1.00 68.23 O HETATM 1807 O HOH D 102 -9.441 14.577 1.275 1.00 39.51 O HETATM 1808 O HOH D 103 -15.045 3.264 4.802 1.00 54.99 O HETATM 1809 O HOH B 701 -12.972 24.276 -15.853 1.00 53.82 O HETATM 1810 O HOH B 702 -13.134 25.984 -9.736 1.00 38.83 O HETATM 1811 O HOH B 703 -14.608 31.614 -12.054 1.00 51.17 O HETATM 1812 O HOH B 704 -23.312 10.582 -25.139 1.00 64.66 O HETATM 1813 O HOH B 705 -18.279 24.127 -4.175 1.00 38.65 O HETATM 1814 O HOH B 706 -1.851 17.784 -18.871 1.00 51.91 O HETATM 1815 O HOH B 707 -9.852 25.288 -18.030 1.00 61.24 O HETATM 1816 O HOH B 708 -2.186 9.458 -18.872 1.00 53.43 O HETATM 1817 O HOH B 709 -5.294 21.549 -19.882 1.00 51.51 O HETATM 1818 O HOH B 710 -10.237 27.762 -16.286 1.00 59.42 O HETATM 1819 O HOH B 711 -12.027 28.064 -7.593 1.00 38.80 O HETATM 1820 O HOH B 712 -20.320 21.471 -9.950 1.00 37.62 O HETATM 1821 O HOH B 713 -13.436 20.417 -7.182 1.00 35.08 O HETATM 1822 O HOH B 714 -16.250 16.888 -8.794 1.00 41.82 O HETATM 1823 O HOH B 715 -4.281 8.478 -20.684 1.00 56.46 O HETATM 1824 O HOH B 716 -15.471 27.605 -16.500 1.00 62.91 O HETATM 1825 O HOH B 717 -18.001 15.110 -6.470 1.00 47.91 O HETATM 1826 O HOH B 718 -12.465 13.495 -6.309 1.00 43.71 O HETATM 1827 O HOH B 719 -15.860 5.781 -11.884 1.00 51.06 O HETATM 1828 O HOH B 720 -18.606 12.066 -6.267 1.00 63.33 O HETATM 1829 O HOH B 721 -0.370 19.573 -18.890 1.00 69.89 O CONECT 30 1775 CONECT 51 1775 CONECT 149 1775 CONECT 165 1775 CONECT 301 1776 CONECT 343 1776 CONECT 429 1776 CONECT 447 1776 CONECT 1243 1778 CONECT 1264 1778 CONECT 1362 1778 CONECT 1378 1778 CONECT 1514 1777 CONECT 1556 1777 CONECT 1642 1777 CONECT 1660 1777 CONECT 1775 30 51 149 165 CONECT 1776 301 343 429 447 CONECT 1777 1514 1556 1642 1660 CONECT 1778 1243 1264 1362 1378 MASTER 415 0 4 5 4 0 4 6 1825 4 20 22 END
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Related entries of code: 5e6a
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
5e6a
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
Glucocorticoid receptor DNA binding domain
Ligand Name
PLAU NF-kappa B response element DNA
EC.Number
E.C.-.-.-.-
Resolution
2.2(Å)
Affinity (Kd/Ki/IC50)
Kd=50uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) Nat Commun Vol. 9: pp. 1337-1337
Links to External Databases
RCSB PDB
The mother database
PDBsum
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Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P04150
Entrez Gene ID
NCBI Entrez Gene ID:
2908
ASD
Information of known allosteric effects of PDB entries
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