Browse entries in the PDBbind-CN Database
HEADER TRANSCRIPTION/DNA 18-OCT-12 4HN6 TITLE GR DNA BINDING DOMAIN R460D/D462R - TSLP NGRE COMPLEX COMPND MOL_ID: 1; COMPND 2 MOLECULE: GLUCOCORTICOID RECEPTOR; COMPND 3 CHAIN: A, B; COMPND 4 SYNONYM: GR, NUCLEAR RECEPTOR SUBFAMILY 3 GROUP C MEMBER 1; COMPND 5 ENGINEERED: YES; COMPND 6 MUTATION: YES; COMPND 7 MOL_ID: 2; COMPND 8 MOLECULE: DNA (5'-D(*CP*GP*CP*CP*TP*CP*CP*GP*GP*GP*AP*GP*AP*GP*CP*T)- COMPND 9 3'); COMPND 10 CHAIN: C; COMPND 11 ENGINEERED: YES; COMPND 12 MOL_ID: 3; COMPND 13 MOLECULE: DNA (5'-D(*AP*GP*CP*TP*CP*TP*CP*CP*CP*GP*GP*AP*GP*GP*CP*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: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL-21; SOURCE 9 MOL_ID: 2; SOURCE 10 SYNTHETIC: YES; SOURCE 11 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; SOURCE 12 ORGANISM_TAXID: 32630; SOURCE 13 MOL_ID: 3; SOURCE 14 SYNTHETIC: YES; SOURCE 15 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; SOURCE 16 ORGANISM_TAXID: 32630 KEYWDS GLUCOCORTICOID RECEPTOR, STEROID RECEPTORS, DNA, NGRE, REPRESSION, KEYWDS 2 TRANSCRIPTION, TRANSCRIPTION-DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR W.H.HUDSON,C.E.YOUN,E.A.ORTLUND REVDAT 4 24-JAN-18 4HN6 1 AUTHOR REMARK REVDAT 3 16-JAN-13 4HN6 1 JRNL REVDAT 2 02-JAN-13 4HN6 1 JRNL REVDAT 1 12-DEC-12 4HN6 0 JRNL AUTH W.H.HUDSON,C.YOUN,E.A.ORTLUND JRNL TITL THE STRUCTURAL BASIS OF DIRECT GLUCOCORTICOID-MEDIATED JRNL TITL 2 TRANSREPRESSION. JRNL REF NAT.STRUCT.MOL.BIOL. V. 20 53 2013 JRNL REFN ISSN 1545-9993 JRNL PMID 23222642 JRNL DOI 10.1038/NSMB.2456 REMARK 2 REMARK 2 RESOLUTION. 2.55 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX (PHENIX.REFINE: 1.8_1069) 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) : 2.55 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 44.48 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.350 REMARK 3 COMPLETENESS FOR RANGE (%) : 96.6 REMARK 3 NUMBER OF REFLECTIONS : 11669 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.201 REMARK 3 R VALUE (WORKING SET) : 0.195 REMARK 3 FREE R VALUE : 0.248 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 10.000 REMARK 3 FREE R VALUE TEST SET COUNT : 1167 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 44.4860 - 5.0954 0.99 1458 162 0.1525 0.1816 REMARK 3 2 5.0954 - 4.0453 1.00 1375 153 0.1597 0.2043 REMARK 3 3 4.0453 - 3.5341 1.00 1345 149 0.1751 0.2515 REMARK 3 4 3.5341 - 3.2111 0.99 1336 148 0.1916 0.2448 REMARK 3 5 3.2111 - 2.9810 1.00 1335 148 0.2343 0.2741 REMARK 3 6 2.9810 - 2.8053 0.99 1316 147 0.2701 0.3605 REMARK 3 7 2.8053 - 2.6648 0.93 1225 137 0.2819 0.3342 REMARK 3 8 2.6648 - 2.5490 0.83 1112 123 0.3240 0.3681 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) : 0.340 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 25.780 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 : 0.010 1860 REMARK 3 ANGLE : 1.302 2633 REMARK 3 CHIRALITY : 0.075 286 REMARK 3 PLANARITY : 0.003 225 REMARK 3 DIHEDRAL : 24.164 735 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 4HN6 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 19-OCT-12. REMARK 100 THE DEPOSITION ID IS D_1000075674. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 09-DEC-11 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 7.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 22-BM 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 : SI 111 CHANNEL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARMOSAIC 225 MM CCD REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 11685 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.549 REMARK 200 RESOLUTION RANGE LOW (A) : 44.500 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 96.8 REMARK 200 DATA REDUNDANCY : NULL REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : NULL REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : NULL REMARK 200 COMPLETENESS FOR SHELL (%) : NULL REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 50.51 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.49 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 15 % PEG 2000 MME, 6 % GLYCEROL, 0.1M REMARK 280 HEPES PH 7.5, VAPOR DIFFUSION, HANGING DROP, 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 19.37000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 51.57500 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 43.93500 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 51.57500 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 19.37000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 43.93500 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: 3850 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 12990 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -26.0 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 PRO A 418 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 PRO B 418 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 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 GLN A 452 CG CD OE1 NE2 REMARK 480 REMARK 480 ZERO OCCUPANCY ATOM REMARK 480 THE FOLLOWING RESIDUES HAVE ATOMS MODELED WITH ZERO REMARK 480 OCCUPANCY. THE LOCATION AND PROPERTIES OF THESE ATOMS REMARK 480 MAY NOT BE RELIABLE. (M=MODEL NUMBER; RES=RESIDUE NAME; REMARK 480 C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 480 M RES C SSEQI ATOMS REMARK 480 GLU A 427 CD REMARK 480 GLY A 451 CA REMARK 480 ILE A 464 CD1 REMARK 480 LYS A 467 CD REMARK 480 LYS A 471 CE REMARK 480 ARG A 479 CZ REMARK 480 LEU A 482 CD2 REMARK 480 MET A 486 CE REMARK 480 LEU A 488 CD1 REMARK 480 GLU A 489 CD REMARK 480 DG C 868 O3' REMARK 480 DT C 872 P REMARK 480 DT D 845 C3' REMARK 480 DT D 847 O4' REMARK 480 DC D 849 C2' REMARK 480 GLU B 427 CG CD REMARK 480 GLU B 450 CD REMARK 480 GLN B 452 CD REMARK 480 HIS B 453 C REMARK 480 ASN B 454 C REMARK 480 LYS B 471 CD REMARK 480 TYR B 478 CE2 REMARK 480 LYS B 480 CE 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 DC C 859 O4' - C4' - C3' ANGL. DEV. = -2.6 DEGREES REMARK 500 DT C 861 O5' - C5' - C4' ANGL. DEV. = -5.8 DEGREES REMARK 500 DT C 861 O4' - C1' - N1 ANGL. DEV. = 2.1 DEGREES REMARK 500 DC C 862 O4' - C1' - N1 ANGL. DEV. = 2.9 DEGREES REMARK 500 DC C 863 C3' - C2' - C1' ANGL. DEV. = -5.8 DEGREES REMARK 500 DC C 863 O4' - C1' - N1 ANGL. DEV. = 5.0 DEGREES REMARK 500 DG C 865 C3' - C2' - C1' ANGL. DEV. = -5.1 DEGREES REMARK 500 DG C 865 O4' - C1' - N9 ANGL. DEV. = 2.7 DEGREES REMARK 500 DG C 868 C3' - C2' - C1' ANGL. DEV. = -6.5 DEGREES REMARK 500 DC C 871 O4' - C1' - N1 ANGL. DEV. = 4.0 DEGREES REMARK 500 DA D 842 O4' - C1' - N9 ANGL. DEV. = 1.9 DEGREES REMARK 500 DC D 846 C3' - C2' - C1' ANGL. DEV. = -4.9 DEGREES REMARK 500 DC D 850 O4' - C1' - N1 ANGL. DEV. = 3.0 DEGREES REMARK 500 DC D 856 O4' - C1' - N1 ANGL. DEV. = 1.9 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 ASP A 426 -178.51 -69.05 REMARK 500 GLN A 452 72.49 48.48 REMARK 500 ASN A 454 -85.26 -36.65 REMARK 500 TYR A 455 108.56 64.73 REMARK 500 ASP A 460 35.22 -141.51 REMARK 500 LEU A 488 33.24 -86.53 REMARK 500 GLU A 489 -65.68 -104.22 REMARK 500 GLN B 452 42.62 39.59 REMARK 500 GLU B 489 67.69 -114.43 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 B 602 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS B 457 SG REMARK 620 2 CYS B 463 SG 108.7 REMARK 620 3 CYS B 473 SG 113.2 109.8 REMARK 620 4 CYS B 476 SG 111.3 112.1 101.6 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 473 SG REMARK 620 2 CYS A 457 SG 118.2 REMARK 620 3 CYS A 463 SG 108.5 103.7 REMARK 620 4 CYS A 476 SG 102.0 115.0 109.2 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 421 SG REMARK 620 2 CYS B 438 SG 117.3 REMARK 620 3 CYS B 424 SG 110.9 102.8 REMARK 620 4 CYS B 441 SG 112.7 103.1 109.2 REMARK 620 N 1 2 3 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 424 SG REMARK 620 2 CYS A 441 SG 112.4 REMARK 620 3 CYS A 421 SG 111.8 102.4 REMARK 620 4 CYS A 438 SG 106.3 107.2 116.8 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: 4HN5 RELATED DB: PDB DBREF 4HN6 A 417 506 UNP P04150 GCR_HUMAN 417 506 DBREF 4HN6 B 417 506 UNP P04150 GCR_HUMAN 417 506 DBREF 4HN6 C 857 872 PDB 4HN6 4HN6 857 872 DBREF 4HN6 D 842 857 PDB 4HN6 4HN6 842 857 SEQADV 4HN6 MET A 393 UNP P04150 EXPRESSION TAG SEQADV 4HN6 HIS A 394 UNP P04150 EXPRESSION TAG SEQADV 4HN6 HIS A 395 UNP P04150 EXPRESSION TAG SEQADV 4HN6 HIS A 396 UNP P04150 EXPRESSION TAG SEQADV 4HN6 HIS A 397 UNP P04150 EXPRESSION TAG SEQADV 4HN6 HIS A 398 UNP P04150 EXPRESSION TAG SEQADV 4HN6 HIS A 399 UNP P04150 EXPRESSION TAG SEQADV 4HN6 SER A 400 UNP P04150 EXPRESSION TAG SEQADV 4HN6 SER A 401 UNP P04150 EXPRESSION TAG SEQADV 4HN6 GLY A 402 UNP P04150 EXPRESSION TAG SEQADV 4HN6 VAL A 403 UNP P04150 EXPRESSION TAG SEQADV 4HN6 ASP A 404 UNP P04150 EXPRESSION TAG SEQADV 4HN6 LEU A 405 UNP P04150 EXPRESSION TAG SEQADV 4HN6 GLY A 406 UNP P04150 EXPRESSION TAG SEQADV 4HN6 THR A 407 UNP P04150 EXPRESSION TAG SEQADV 4HN6 GLU A 408 UNP P04150 EXPRESSION TAG SEQADV 4HN6 ASN A 409 UNP P04150 EXPRESSION TAG SEQADV 4HN6 LEU A 410 UNP P04150 EXPRESSION TAG SEQADV 4HN6 TYR A 411 UNP P04150 EXPRESSION TAG SEQADV 4HN6 PHE A 412 UNP P04150 EXPRESSION TAG SEQADV 4HN6 GLN A 413 UNP P04150 EXPRESSION TAG SEQADV 4HN6 SER A 414 UNP P04150 EXPRESSION TAG SEQADV 4HN6 ASN A 415 UNP P04150 EXPRESSION TAG SEQADV 4HN6 ALA A 416 UNP P04150 EXPRESSION TAG SEQADV 4HN6 ASP A 460 UNP P04150 ARG 460 ENGINEERED MUTATION SEQADV 4HN6 ARG A 462 UNP P04150 ASP 462 ENGINEERED MUTATION SEQADV 4HN6 MET B 393 UNP P04150 EXPRESSION TAG SEQADV 4HN6 HIS B 394 UNP P04150 EXPRESSION TAG SEQADV 4HN6 HIS B 395 UNP P04150 EXPRESSION TAG SEQADV 4HN6 HIS B 396 UNP P04150 EXPRESSION TAG SEQADV 4HN6 HIS B 397 UNP P04150 EXPRESSION TAG SEQADV 4HN6 HIS B 398 UNP P04150 EXPRESSION TAG SEQADV 4HN6 HIS B 399 UNP P04150 EXPRESSION TAG SEQADV 4HN6 SER B 400 UNP P04150 EXPRESSION TAG SEQADV 4HN6 SER B 401 UNP P04150 EXPRESSION TAG SEQADV 4HN6 GLY B 402 UNP P04150 EXPRESSION TAG SEQADV 4HN6 VAL B 403 UNP P04150 EXPRESSION TAG SEQADV 4HN6 ASP B 404 UNP P04150 EXPRESSION TAG SEQADV 4HN6 LEU B 405 UNP P04150 EXPRESSION TAG SEQADV 4HN6 GLY B 406 UNP P04150 EXPRESSION TAG SEQADV 4HN6 THR B 407 UNP P04150 EXPRESSION TAG SEQADV 4HN6 GLU B 408 UNP P04150 EXPRESSION TAG SEQADV 4HN6 ASN B 409 UNP P04150 EXPRESSION TAG SEQADV 4HN6 LEU B 410 UNP P04150 EXPRESSION TAG SEQADV 4HN6 TYR B 411 UNP P04150 EXPRESSION TAG SEQADV 4HN6 PHE B 412 UNP P04150 EXPRESSION TAG SEQADV 4HN6 GLN B 413 UNP P04150 EXPRESSION TAG SEQADV 4HN6 SER B 414 UNP P04150 EXPRESSION TAG SEQADV 4HN6 ASN B 415 UNP P04150 EXPRESSION TAG SEQADV 4HN6 ALA B 416 UNP P04150 EXPRESSION TAG SEQADV 4HN6 ASP B 460 UNP P04150 ARG 460 ENGINEERED MUTATION SEQADV 4HN6 ARG B 462 UNP P04150 ASP 462 ENGINEERED MUTATION 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 ASP ASN ARG 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 DG DC DC DT DC DC DG DG DG DA DG DA SEQRES 2 C 16 DG DC DT SEQRES 1 D 16 DA DG DC DT DC DT DC DC DC DG DG DA DG SEQRES 2 D 16 DG DC 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 ASP ASN ARG 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 *43(H2 O) HELIX 1 1 CYS A 438 GLN A 452 1 15 HELIX 2 2 CYS A 473 ALA A 484 1 12 HELIX 3 3 CYS B 438 GLY B 451 1 14 HELIX 4 4 CYS B 473 ALA B 484 1 12 SHEET 1 A 2 CYS A 431 HIS A 432 0 SHEET 2 A 2 VAL A 435 LEU A 436 -1 O VAL A 435 N HIS A 432 SHEET 1 B 2 GLY B 430 HIS B 432 0 SHEET 2 B 2 VAL B 435 THR B 437 -1 O VAL B 435 N HIS B 432 LINK SG CYS B 457 ZN ZN B 602 1555 1555 2.12 LINK SG CYS A 473 ZN ZN A 602 1555 1555 2.22 LINK SG CYS B 463 ZN ZN B 602 1555 1555 2.29 LINK SG CYS B 421 ZN ZN B 601 1555 1555 2.30 LINK SG CYS B 473 ZN ZN B 602 1555 1555 2.30 LINK SG CYS A 457 ZN ZN A 602 1555 1555 2.30 LINK SG CYS B 476 ZN ZN B 602 1555 1555 2.33 LINK SG CYS A 424 ZN ZN A 601 1555 1555 2.33 LINK SG CYS A 463 ZN ZN A 602 1555 1555 2.33 LINK SG CYS B 438 ZN ZN B 601 1555 1555 2.34 LINK SG CYS A 441 ZN ZN A 601 1555 1555 2.35 LINK SG CYS A 421 ZN ZN A 601 1555 1555 2.35 LINK SG CYS B 424 ZN ZN B 601 1555 1555 2.37 LINK SG CYS A 438 ZN ZN A 601 1555 1555 2.39 LINK SG CYS B 441 ZN ZN B 601 1555 1555 2.40 LINK SG CYS A 476 ZN ZN A 602 1555 1555 2.43 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 421 CYS B 424 CYS B 438 CYS B 441 SITE 1 AC4 4 CYS B 457 CYS B 463 CYS B 473 CYS B 476 CRYST1 38.740 87.870 103.150 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 0.025813 0.000000 0.000000 0.00000 SCALE2 0.000000 0.011380 0.000000 0.00000 SCALE3 0.000000 0.000000 0.009695 0.00000 ATOM 1 N LYS A 419 -15.614 -22.421 19.622 1.00 49.89 N ATOM 2 CA LYS A 419 -16.208 -21.258 20.286 1.00 52.67 C ATOM 3 C LYS A 419 -15.762 -21.080 21.755 1.00 47.51 C ATOM 4 O LYS A 419 -16.169 -20.121 22.413 1.00 48.04 O ATOM 5 CB LYS A 419 -17.746 -21.317 20.218 1.00 47.91 C ATOM 6 CG LYS A 419 -18.378 -22.339 21.162 1.00 44.40 C ATOM 7 CD LYS A 419 -19.762 -21.902 21.607 1.00 46.58 C ATOM 8 CE LYS A 419 -20.678 -21.680 20.408 1.00 56.09 C ATOM 9 NZ LYS A 419 -20.730 -22.868 19.496 1.00 53.55 N ATOM 10 N LEU A 420 -14.940 -21.996 22.269 1.00 45.01 N ATOM 11 CA LEU A 420 -14.557 -21.968 23.689 1.00 42.59 C ATOM 12 C LEU A 420 -13.054 -21.742 23.916 1.00 41.74 C ATOM 13 O LEU A 420 -12.219 -22.407 23.289 1.00 44.30 O ATOM 14 CB LEU A 420 -15.027 -23.250 24.396 1.00 42.85 C ATOM 15 CG LEU A 420 -16.194 -23.073 25.382 1.00 45.80 C ATOM 16 CD1 LEU A 420 -17.388 -22.377 24.729 1.00 45.42 C ATOM 17 CD2 LEU A 420 -16.618 -24.396 26.005 1.00 39.14 C ATOM 18 N CYS A 421 -12.721 -20.802 24.807 1.00 41.00 N ATOM 19 CA CYS A 421 -11.325 -20.441 25.101 1.00 37.04 C ATOM 20 C CYS A 421 -10.533 -21.668 25.523 1.00 37.48 C ATOM 21 O CYS A 421 -10.927 -22.361 26.459 1.00 37.76 O ATOM 22 CB CYS A 421 -11.262 -19.379 26.211 1.00 35.17 C ATOM 23 SG CYS A 421 -9.589 -18.977 26.870 1.00 30.56 S ATOM 24 N LEU A 422 -9.425 -21.940 24.834 1.00 36.17 N ATOM 25 CA LEU A 422 -8.562 -23.086 25.164 1.00 36.43 C ATOM 26 C LEU A 422 -7.880 -23.013 26.540 1.00 33.90 C ATOM 27 O LEU A 422 -7.190 -23.944 26.939 1.00 37.42 O ATOM 28 CB LEU A 422 -7.497 -23.319 24.075 1.00 39.25 C ATOM 29 CG LEU A 422 -7.976 -23.958 22.759 1.00 42.55 C ATOM 30 CD1 LEU A 422 -6.821 -24.241 21.806 1.00 35.32 C ATOM 31 CD2 LEU A 422 -8.767 -25.237 23.025 1.00 38.65 C ATOM 32 N VAL A 423 -8.070 -21.917 27.261 1.00 31.94 N ATOM 33 CA VAL A 423 -7.444 -21.764 28.566 1.00 33.61 C ATOM 34 C VAL A 423 -8.455 -21.762 29.709 1.00 34.94 C ATOM 35 O VAL A 423 -8.298 -22.511 30.673 1.00 35.86 O ATOM 36 CB VAL A 423 -6.561 -20.502 28.631 1.00 33.89 C ATOM 37 CG1 VAL A 423 -6.244 -20.142 30.067 1.00 30.26 C ATOM 38 CG2 VAL A 423 -5.280 -20.728 27.850 1.00 31.68 C ATOM 39 N CYS A 424 -9.496 -20.942 29.601 1.00 33.27 N ATOM 40 CA CYS A 424 -10.467 -20.830 30.685 1.00 33.34 C ATOM 41 C CYS A 424 -11.871 -21.307 30.297 1.00 37.87 C ATOM 42 O CYS A 424 -12.787 -21.285 31.125 1.00 41.16 O ATOM 43 CB CYS A 424 -10.529 -19.395 31.208 1.00 30.12 C ATOM 44 SG CYS A 424 -11.513 -18.308 30.167 1.00 30.69 S ATOM 45 N SER A 425 -12.034 -21.733 29.045 1.00 39.16 N ATOM 46 CA SER A 425 -13.311 -22.259 28.524 1.00 40.00 C ATOM 47 C SER A 425 -14.499 -21.297 28.540 1.00 41.72 C ATOM 48 O SER A 425 -15.641 -21.724 28.378 1.00 48.55 O ATOM 49 CB SER A 425 -13.690 -23.587 29.189 1.00 35.16 C ATOM 50 OG SER A 425 -12.742 -24.586 28.849 1.00 40.26 O ATOM 51 N ASP A 426 -14.231 -20.006 28.725 1.00 40.23 N ATOM 52 CA ASP A 426 -15.232 -18.976 28.506 1.00 38.69 C ATOM 53 C ASP A 426 -15.509 -18.905 27.001 1.00 45.48 C ATOM 54 O ASP A 426 -14.940 -19.672 26.209 1.00 43.46 O ATOM 55 CB ASP A 426 -14.726 -17.628 29.015 1.00 35.80 C ATOM 56 CG ASP A 426 -15.851 -16.672 29.351 1.00 43.45 C ATOM 57 OD1 ASP A 426 -17.021 -17.107 29.308 1.00 49.75 O ATOM 58 OD2 ASP A 426 -15.574 -15.495 29.680 1.00 42.00 O ATOM 59 N GLU A 427 -16.384 -17.991 26.597 1.00 48.88 N ATOM 60 CA GLU A 427 -16.687 -17.832 25.181 1.00 45.61 C ATOM 61 C GLU A 427 -15.479 -17.204 24.504 1.00 43.43 C ATOM 62 O GLU A 427 -15.116 -16.066 24.814 1.00 42.17 O ATOM 63 CB GLU A 427 -17.931 -16.958 24.986 1.00 48.85 C ATOM 64 CG GLU A 427 -19.132 -17.359 25.847 1.00 47.48 C ATOM 65 CD GLU A 427 -20.368 -16.528 25.547 0.00 53.74 C ATOM 66 OE1 GLU A 427 -20.636 -16.283 24.350 1.00 54.76 O ATOM 67 OE2 GLU A 427 -21.066 -16.116 26.503 1.00 60.29 O ATOM 68 N ALA A 428 -14.852 -17.960 23.603 1.00 40.65 N ATOM 69 CA ALA A 428 -13.670 -17.496 22.877 1.00 41.97 C ATOM 70 C ALA A 428 -14.009 -16.387 21.884 1.00 42.44 C ATOM 71 O ALA A 428 -14.967 -16.495 21.123 1.00 45.18 O ATOM 72 CB ALA A 428 -12.985 -18.654 22.161 1.00 37.26 C ATOM 73 N SER A 429 -13.206 -15.328 21.891 1.00 40.86 N ATOM 74 CA SER A 429 -13.419 -14.192 21.003 1.00 43.52 C ATOM 75 C SER A 429 -12.516 -14.235 19.767 1.00 42.66 C ATOM 76 O SER A 429 -12.358 -13.236 19.078 1.00 46.36 O ATOM 77 CB SER A 429 -13.183 -12.878 21.752 1.00 42.95 C ATOM 78 OG SER A 429 -11.859 -12.409 21.538 1.00 39.78 O ATOM 79 N GLY A 430 -11.916 -15.381 19.489 1.00 41.46 N ATOM 80 CA GLY A 430 -11.079 -15.501 18.315 1.00 38.94 C ATOM 81 C GLY A 430 -9.721 -16.095 18.604 1.00 40.79 C ATOM 82 O GLY A 430 -9.509 -16.753 19.617 1.00 42.60 O ATOM 83 N CYS A 431 -8.784 -15.842 17.708 1.00 41.80 N ATOM 84 CA CYS A 431 -7.471 -16.452 17.784 1.00 41.47 C ATOM 85 C CYS A 431 -6.401 -15.433 18.209 1.00 41.59 C ATOM 86 O CYS A 431 -5.872 -14.709 17.374 1.00 44.85 O ATOM 87 CB CYS A 431 -7.143 -17.049 16.419 1.00 37.54 C ATOM 88 SG CYS A 431 -5.846 -18.255 16.407 1.00 52.49 S ATOM 89 N HIS A 432 -6.076 -15.385 19.502 1.00 38.75 N ATOM 90 CA HIS A 432 -5.086 -14.431 20.014 1.00 37.76 C ATOM 91 C HIS A 432 -3.738 -15.065 20.363 1.00 38.18 C ATOM 92 O HIS A 432 -3.677 -16.049 21.082 1.00 38.71 O ATOM 93 CB HIS A 432 -5.653 -13.684 21.220 1.00 36.05 C ATOM 94 CG HIS A 432 -7.056 -13.214 21.014 1.00 38.88 C ATOM 95 ND1 HIS A 432 -7.365 -12.115 20.241 1.00 40.33 N ATOM 96 CD2 HIS A 432 -8.235 -13.715 21.447 1.00 38.25 C ATOM 97 CE1 HIS A 432 -8.675 -11.948 20.224 1.00 40.79 C ATOM 98 NE2 HIS A 432 -9.226 -12.906 20.948 1.00 39.88 N ATOM 99 N TYR A 433 -2.661 -14.483 19.847 1.00 42.77 N ATOM 100 CA TYR A 433 -1.303 -14.990 20.050 1.00 41.25 C ATOM 101 C TYR A 433 -1.150 -16.494 19.747 1.00 45.72 C ATOM 102 O TYR A 433 -0.348 -17.194 20.376 1.00 42.79 O ATOM 103 CB TYR A 433 -0.793 -14.645 21.452 1.00 38.48 C ATOM 104 CG TYR A 433 -0.954 -13.185 21.825 1.00 41.46 C ATOM 105 CD1 TYR A 433 -0.226 -12.192 21.174 1.00 41.84 C ATOM 106 CD2 TYR A 433 -1.828 -12.798 22.838 1.00 38.99 C ATOM 107 CE1 TYR A 433 -0.368 -10.850 21.516 1.00 35.67 C ATOM 108 CE2 TYR A 433 -1.981 -11.465 23.186 1.00 36.21 C ATOM 109 CZ TYR A 433 -1.248 -10.492 22.525 1.00 37.33 C ATOM 110 OH TYR A 433 -1.404 -9.166 22.877 1.00 32.26 O ATOM 111 N GLY A 434 -1.926 -16.983 18.782 1.00 43.76 N ATOM 112 CA GLY A 434 -1.753 -18.335 18.278 1.00 43.17 C ATOM 113 C GLY A 434 -2.822 -19.328 18.694 1.00 44.95 C ATOM 114 O GLY A 434 -2.974 -20.392 18.083 1.00 47.25 O ATOM 115 N VAL A 435 -3.576 -18.980 19.730 1.00 43.75 N ATOM 116 CA VAL A 435 -4.515 -19.915 20.338 1.00 41.08 C ATOM 117 C VAL A 435 -5.932 -19.346 20.392 1.00 37.42 C ATOM 118 O VAL A 435 -6.127 -18.168 20.678 1.00 36.64 O ATOM 119 CB VAL A 435 -4.058 -20.272 21.766 1.00 37.10 C ATOM 120 CG1 VAL A 435 -5.003 -21.247 22.391 1.00 36.90 C ATOM 121 CG2 VAL A 435 -2.639 -20.829 21.748 1.00 39.43 C ATOM 122 N LEU A 436 -6.919 -20.186 20.106 1.00 35.49 N ATOM 123 CA LEU A 436 -8.307 -19.799 20.283 1.00 35.93 C ATOM 124 C LEU A 436 -8.582 -19.482 21.757 1.00 38.91 C ATOM 125 O LEU A 436 -8.675 -20.384 22.589 1.00 39.52 O ATOM 126 CB LEU A 436 -9.218 -20.925 19.806 1.00 39.20 C ATOM 127 CG LEU A 436 -10.716 -20.714 20.017 1.00 45.76 C ATOM 128 CD1 LEU A 436 -11.161 -19.436 19.326 1.00 48.34 C ATOM 129 CD2 LEU A 436 -11.505 -21.908 19.497 1.00 46.54 C ATOM 130 N THR A 437 -8.691 -18.198 22.088 1.00 38.23 N ATOM 131 CA THR A 437 -8.917 -17.793 23.473 1.00 38.27 C ATOM 132 C THR A 437 -9.954 -16.690 23.576 1.00 35.55 C ATOM 133 O THR A 437 -10.354 -16.106 22.584 1.00 38.35 O ATOM 134 CB THR A 437 -7.644 -17.240 24.123 1.00 33.11 C ATOM 135 OG1 THR A 437 -7.301 -16.011 23.486 1.00 37.47 O ATOM 136 CG2 THR A 437 -6.492 -18.200 23.982 1.00 33.53 C ATOM 137 N CYS A 438 -10.373 -16.402 24.799 1.00 36.66 N ATOM 138 CA CYS A 438 -11.273 -15.296 25.062 1.00 35.38 C ATOM 139 C CYS A 438 -10.460 -14.010 25.166 1.00 37.29 C ATOM 140 O CYS A 438 -9.235 -14.022 25.043 1.00 37.64 O ATOM 141 CB CYS A 438 -12.046 -15.527 26.361 1.00 31.24 C ATOM 142 SG CYS A 438 -11.045 -15.344 27.868 1.00 34.13 S ATOM 143 N GLY A 439 -11.146 -12.903 25.408 1.00 37.36 N ATOM 144 CA GLY A 439 -10.508 -11.607 25.403 1.00 33.46 C ATOM 145 C GLY A 439 -9.698 -11.331 26.641 1.00 30.66 C ATOM 146 O GLY A 439 -8.636 -10.725 26.562 1.00 35.59 O ATOM 147 N SER A 440 -10.199 -11.762 27.790 1.00 33.47 N ATOM 148 CA SER A 440 -9.482 -11.551 29.043 1.00 33.07 C ATOM 149 C SER A 440 -8.203 -12.402 29.134 1.00 32.02 C ATOM 150 O SER A 440 -7.212 -11.988 29.756 1.00 29.52 O ATOM 151 CB SER A 440 -10.392 -11.824 30.240 1.00 34.36 C ATOM 152 OG SER A 440 -10.573 -13.213 30.399 1.00 31.90 O ATOM 153 N CYS A 441 -8.216 -13.581 28.516 1.00 29.35 N ATOM 154 CA CYS A 441 -7.011 -14.405 28.455 1.00 29.11 C ATOM 155 C CYS A 441 -5.966 -13.788 27.519 1.00 30.47 C ATOM 156 O CYS A 441 -4.763 -13.838 27.798 1.00 27.93 O ATOM 157 CB CYS A 441 -7.326 -15.857 28.067 1.00 33.61 C ATOM 158 SG CYS A 441 -7.949 -16.939 29.430 1.00 33.92 S ATOM 159 N LYS A 442 -6.430 -13.191 26.424 1.00 31.76 N ATOM 160 CA LYS A 442 -5.558 -12.416 25.544 1.00 32.01 C ATOM 161 C LYS A 442 -4.770 -11.376 26.337 1.00 34.40 C ATOM 162 O LYS A 442 -3.536 -11.409 26.368 1.00 33.42 O ATOM 163 CB LYS A 442 -6.361 -11.724 24.434 1.00 35.77 C ATOM 164 CG LYS A 442 -5.515 -10.839 23.528 1.00 34.38 C ATOM 165 CD LYS A 442 -6.362 -10.039 22.534 1.00 40.33 C ATOM 166 CE LYS A 442 -7.052 -8.842 23.186 1.00 39.58 C ATOM 167 NZ LYS A 442 -7.834 -8.033 22.201 1.00 37.25 N ATOM 168 N VAL A 443 -5.481 -10.466 26.998 1.00 32.85 N ATOM 169 CA VAL A 443 -4.811 -9.392 27.728 1.00 34.04 C ATOM 170 C VAL A 443 -4.015 -9.885 28.932 1.00 32.25 C ATOM 171 O VAL A 443 -2.986 -9.290 29.264 1.00 31.88 O ATOM 172 CB VAL A 443 -5.782 -8.260 28.153 1.00 35.60 C ATOM 173 CG1 VAL A 443 -6.424 -7.635 26.924 1.00 36.25 C ATOM 174 CG2 VAL A 443 -6.844 -8.782 29.119 1.00 36.14 C ATOM 175 N PHE A 444 -4.485 -10.958 29.580 1.00 31.15 N ATOM 176 CA PHE A 444 -3.771 -11.515 30.726 1.00 28.38 C ATOM 177 C PHE A 444 -2.416 -12.044 30.293 1.00 28.79 C ATOM 178 O PHE A 444 -1.395 -11.778 30.936 1.00 29.56 O ATOM 179 CB PHE A 444 -4.536 -12.644 31.438 1.00 27.62 C ATOM 180 CG PHE A 444 -3.660 -13.449 32.366 1.00 25.78 C ATOM 181 CD1 PHE A 444 -3.403 -13.004 33.652 1.00 27.88 C ATOM 182 CD2 PHE A 444 -3.026 -14.608 31.927 1.00 25.10 C ATOM 183 CE1 PHE A 444 -2.561 -13.712 34.493 1.00 25.71 C ATOM 184 CE2 PHE A 444 -2.178 -15.313 32.763 1.00 23.94 C ATOM 185 CZ PHE A 444 -1.957 -14.867 34.049 1.00 23.35 C ATOM 186 N PHE A 445 -2.419 -12.824 29.221 1.00 25.72 N ATOM 187 CA PHE A 445 -1.196 -13.429 28.756 1.00 26.20 C ATOM 188 C PHE A 445 -0.150 -12.383 28.367 1.00 30.18 C ATOM 189 O PHE A 445 0.991 -12.460 28.800 1.00 31.89 O ATOM 190 CB PHE A 445 -1.476 -14.363 27.594 1.00 27.71 C ATOM 191 CG PHE A 445 -0.248 -14.980 27.033 0.74 32.84 C ATOM 192 CD1 PHE A 445 0.394 -15.996 27.713 1.00 31.08 C ATOM 193 CD2 PHE A 445 0.290 -14.526 25.841 1.00 36.09 C ATOM 194 CE1 PHE A 445 1.529 -16.557 27.208 1.00 32.66 C ATOM 195 CE2 PHE A 445 1.434 -15.088 25.334 1.00 36.44 C ATOM 196 CZ PHE A 445 2.051 -16.104 26.014 1.00 35.62 C ATOM 197 N LYS A 446 -0.552 -11.409 27.554 1.00 31.79 N ATOM 198 CA LYS A 446 0.305 -10.296 27.150 1.00 30.57 C ATOM 199 C LYS A 446 0.954 -9.602 28.351 1.00 34.64 C ATOM 200 O LYS A 446 2.151 -9.318 28.343 1.00 37.00 O ATOM 201 CB LYS A 446 -0.521 -9.295 26.331 1.00 34.19 C ATOM 202 CG LYS A 446 0.146 -7.954 25.999 1.00 37.45 C ATOM 203 CD LYS A 446 1.169 -8.062 24.866 1.00 41.20 C ATOM 204 CE LYS A 446 1.308 -6.741 24.112 1.00 34.91 C ATOM 205 NZ LYS A 446 1.128 -5.546 24.998 1.00 41.19 N ATOM 206 N ARG A 447 0.163 -9.352 29.390 1.00 30.81 N ATOM 207 CA ARG A 447 0.644 -8.667 30.584 1.00 32.54 C ATOM 208 C ARG A 447 1.578 -9.542 31.411 1.00 36.69 C ATOM 209 O ARG A 447 2.486 -9.048 32.074 1.00 39.18 O ATOM 210 CB ARG A 447 -0.541 -8.231 31.443 1.00 33.10 C ATOM 211 CG ARG A 447 -0.183 -7.383 32.652 1.00 36.71 C ATOM 212 CD ARG A 447 -1.440 -7.060 33.466 1.00 43.93 C ATOM 213 NE ARG A 447 -1.375 -5.724 34.049 1.00 53.73 N ATOM 214 CZ ARG A 447 -0.864 -5.447 35.247 1.00 62.38 C ATOM 215 NH1 ARG A 447 -0.376 -6.426 36.010 1.00 56.26 N ATOM 216 NH2 ARG A 447 -0.845 -4.186 35.683 1.00 57.60 N ATOM 217 N ALA A 448 1.336 -10.847 31.382 1.00 35.30 N ATOM 218 CA ALA A 448 2.136 -11.778 32.162 1.00 39.10 C ATOM 219 C ALA A 448 3.517 -11.915 31.542 1.00 35.19 C ATOM 220 O ALA A 448 4.528 -11.846 32.238 1.00 41.15 O ATOM 221 CB ALA A 448 1.440 -13.138 32.258 1.00 31.69 C ATOM 222 N VAL A 449 3.547 -12.095 30.227 1.00 32.45 N ATOM 223 CA VAL A 449 4.796 -12.249 29.503 1.00 36.26 C ATOM 224 C VAL A 449 5.674 -11.031 29.691 1.00 38.27 C ATOM 225 O VAL A 449 6.820 -11.134 30.131 1.00 40.33 O ATOM 226 CB VAL A 449 4.557 -12.416 28.008 1.00 36.64 C ATOM 227 CG1 VAL A 449 5.881 -12.510 27.292 1.00 38.25 C ATOM 228 CG2 VAL A 449 3.732 -13.653 27.747 1.00 35.22 C ATOM 229 N GLU A 450 5.123 -9.872 29.363 1.00 37.51 N ATOM 230 CA GLU A 450 5.876 -8.634 29.460 1.00 41.55 C ATOM 231 C GLU A 450 6.099 -8.204 30.898 1.00 46.13 C ATOM 232 O GLU A 450 7.105 -7.571 31.201 1.00 52.37 O ATOM 233 CB GLU A 450 5.192 -7.524 28.671 1.00 44.53 C ATOM 234 CG GLU A 450 5.316 -7.699 27.171 1.00 48.98 C ATOM 235 CD GLU A 450 4.449 -6.726 26.403 1.00 54.05 C ATOM 236 OE1 GLU A 450 3.884 -5.809 27.037 1.00 56.84 O ATOM 237 OE2 GLU A 450 4.326 -6.882 25.168 1.00 58.03 O ATOM 238 N GLY A 451 5.174 -8.559 31.783 1.00 45.17 N ATOM 239 CA GLY A 451 5.282 -8.182 33.177 0.00 48.60 C ATOM 240 C GLY A 451 6.501 -8.767 33.857 1.00 49.47 C ATOM 241 O GLY A 451 6.868 -8.316 34.946 1.00 55.59 O ATOM 242 N GLN A 452 7.135 -9.747 33.211 1.00 45.61 N ATOM 243 CA GLN A 452 8.261 -10.470 33.795 1.00 51.00 C ATOM 244 C GLN A 452 7.850 -10.881 35.192 1.00 58.62 C ATOM 245 O GLN A 452 8.304 -10.309 36.192 1.00 56.55 O ATOM 246 CB GLN A 452 9.522 -9.605 33.841 1.00 57.01 C ATOM 247 N HIS A 453 6.958 -11.860 35.252 1.00 59.64 N ATOM 248 CA HIS A 453 6.244 -12.124 36.485 1.00 60.83 C ATOM 249 C HIS A 453 6.600 -13.443 37.182 1.00 56.56 C ATOM 250 O HIS A 453 6.544 -14.524 36.591 1.00 52.59 O ATOM 251 CB HIS A 453 4.732 -12.005 36.244 1.00 61.15 C ATOM 252 CG HIS A 453 4.197 -10.611 36.406 1.00 61.35 C ATOM 253 ND1 HIS A 453 3.469 -9.970 35.422 1.00 56.54 N ATOM 254 CD2 HIS A 453 4.265 -9.743 37.446 1.00 61.60 C ATOM 255 CE1 HIS A 453 3.121 -8.768 35.844 1.00 55.94 C ATOM 256 NE2 HIS A 453 3.590 -8.605 37.070 1.00 66.09 N ATOM 257 N ASN A 454 6.999 -13.295 38.441 1.00 54.95 N ATOM 258 CA ASN A 454 7.137 -14.368 39.419 1.00 56.01 C ATOM 259 C ASN A 454 6.074 -15.458 39.315 1.00 48.10 C ATOM 260 O ASN A 454 6.292 -16.480 38.677 1.00 57.78 O ATOM 261 CB ASN A 454 7.021 -13.732 40.801 1.00 61.56 C ATOM 262 CG ASN A 454 5.952 -12.633 40.837 1.00 67.76 C ATOM 263 OD1 ASN A 454 5.886 -11.784 39.928 1.00 60.79 O ATOM 264 ND2 ASN A 454 5.083 -12.671 41.857 1.00 60.44 N ATOM 265 N TYR A 455 4.934 -15.219 39.961 1.00 43.66 N ATOM 266 CA TYR A 455 3.790 -16.137 40.020 1.00 37.20 C ATOM 267 C TYR A 455 4.082 -17.444 40.748 1.00 33.20 C ATOM 268 O TYR A 455 4.807 -18.317 40.254 1.00 36.59 O ATOM 269 CB TYR A 455 3.198 -16.419 38.640 1.00 37.11 C ATOM 270 CG TYR A 455 2.571 -15.226 37.965 1.00 37.47 C ATOM 271 CD1 TYR A 455 2.068 -14.172 38.707 1.00 37.86 C ATOM 272 CD2 TYR A 455 2.486 -15.158 36.575 1.00 37.65 C ATOM 273 CE1 TYR A 455 1.495 -13.075 38.084 1.00 43.14 C ATOM 274 CE2 TYR A 455 1.911 -14.074 35.942 1.00 37.78 C ATOM 275 CZ TYR A 455 1.417 -13.033 36.701 1.00 43.24 C ATOM 276 OH TYR A 455 0.848 -11.939 36.083 1.00 46.42 O ATOM 277 N LEU A 456 3.500 -17.565 41.934 1.00 25.76 N ATOM 278 CA LEU A 456 3.564 -18.790 42.707 1.00 26.90 C ATOM 279 C LEU A 456 2.141 -19.283 42.949 1.00 27.45 C ATOM 280 O LEU A 456 1.290 -18.507 43.372 1.00 24.83 O ATOM 281 CB LEU A 456 4.268 -18.533 44.038 1.00 24.22 C ATOM 282 CG LEU A 456 4.312 -19.632 45.105 1.00 24.91 C ATOM 283 CD1 LEU A 456 5.037 -20.866 44.594 1.00 23.11 C ATOM 284 CD2 LEU A 456 4.964 -19.102 46.396 1.00 22.56 C ATOM 285 N CYS A 457 1.882 -20.562 42.666 1.00 26.06 N ATOM 286 CA CYS A 457 0.590 -21.175 42.965 1.00 20.85 C ATOM 287 C CYS A 457 0.463 -21.423 44.473 1.00 20.13 C ATOM 288 O CYS A 457 1.408 -21.839 45.111 1.00 18.69 O ATOM 289 CB CYS A 457 0.434 -22.479 42.184 1.00 19.67 C ATOM 290 SG CYS A 457 -1.019 -23.478 42.628 1.00 17.33 S ATOM 291 N ALA A 458 -0.705 -21.145 45.047 1.00 23.98 N ATOM 292 CA ALA A 458 -0.917 -21.372 46.477 1.00 20.65 C ATOM 293 C ALA A 458 -1.409 -22.783 46.760 1.00 21.06 C ATOM 294 O ALA A 458 -1.501 -23.189 47.908 1.00 23.64 O ATOM 295 CB ALA A 458 -1.885 -20.370 47.035 1.00 17.12 C ATOM 296 N GLY A 459 -1.736 -23.520 45.706 1.00 21.82 N ATOM 297 CA GLY A 459 -2.168 -24.899 45.824 1.00 21.22 C ATOM 298 C GLY A 459 -1.039 -25.850 45.472 1.00 25.50 C ATOM 299 O GLY A 459 -0.044 -25.907 46.195 1.00 27.86 O ATOM 300 N ASP A 460 -1.181 -26.598 44.377 1.00 24.74 N ATOM 301 CA ASP A 460 -0.121 -27.515 43.956 1.00 22.62 C ATOM 302 C ASP A 460 0.081 -27.579 42.444 1.00 20.74 C ATOM 303 O ASP A 460 0.417 -28.623 41.914 1.00 23.39 O ATOM 304 CB ASP A 460 -0.315 -28.912 44.558 1.00 26.03 C ATOM 305 CG ASP A 460 -1.748 -29.422 44.426 1.00 35.54 C ATOM 306 OD1 ASP A 460 -2.360 -29.237 43.340 1.00 34.26 O ATOM 307 OD2 ASP A 460 -2.263 -30.007 45.415 1.00 38.27 O ATOM 308 N ASN A 461 -0.100 -26.436 41.782 1.00 22.26 N ATOM 309 CA ASN A 461 0.092 -26.255 40.335 1.00 23.04 C ATOM 310 C ASN A 461 -0.963 -26.965 39.502 1.00 26.35 C ATOM 311 O ASN A 461 -0.759 -27.244 38.317 1.00 28.70 O ATOM 312 CB ASN A 461 1.501 -26.653 39.874 1.00 23.62 C ATOM 313 CG ASN A 461 2.540 -25.553 40.092 1.00 21.64 C ATOM 314 OD1 ASN A 461 2.210 -24.385 40.314 1.00 22.88 O ATOM 315 ND2 ASN A 461 3.807 -25.931 40.014 1.00 20.21 N ATOM 316 N ARG A 462 -2.099 -27.239 40.133 1.00 27.02 N ATOM 317 CA ARG A 462 -3.182 -27.973 39.498 1.00 24.78 C ATOM 318 C ARG A 462 -4.500 -27.221 39.641 1.00 23.24 C ATOM 319 O ARG A 462 -5.565 -27.821 39.678 1.00 21.72 O ATOM 320 CB ARG A 462 -3.286 -29.383 40.091 1.00 23.42 C ATOM 321 CG ARG A 462 -2.161 -30.299 39.638 1.00 31.95 C ATOM 322 CD ARG A 462 -2.387 -31.737 40.068 1.00 37.95 C ATOM 323 NE ARG A 462 -2.656 -31.830 41.498 1.00 34.80 N ATOM 324 CZ ARG A 462 -2.672 -32.966 42.182 1.00 35.63 C ATOM 325 NH1 ARG A 462 -2.433 -34.113 41.565 1.00 39.44 N ATOM 326 NH2 ARG A 462 -2.923 -32.952 43.485 1.00 37.07 N ATOM 327 N CYS A 463 -4.423 -25.897 39.706 1.00 23.60 N ATOM 328 CA CYS A 463 -5.615 -25.079 39.855 1.00 20.65 C ATOM 329 C CYS A 463 -6.565 -25.224 38.670 1.00 22.66 C ATOM 330 O CYS A 463 -6.125 -25.369 37.536 1.00 23.84 O ATOM 331 CB CYS A 463 -5.232 -23.618 40.078 1.00 20.09 C ATOM 332 SG CYS A 463 -4.546 -23.305 41.740 1.00 25.15 S ATOM 333 N ILE A 464 -7.867 -25.202 38.952 1.00 24.81 N ATOM 334 CA ILE A 464 -8.897 -25.223 37.922 1.00 21.39 C ATOM 335 C ILE A 464 -9.019 -23.829 37.336 1.00 24.14 C ATOM 336 O ILE A 464 -9.390 -22.897 38.048 1.00 27.40 O ATOM 337 CB ILE A 464 -10.291 -25.594 38.500 1.00 22.54 C ATOM 338 CG1 ILE A 464 -10.320 -27.024 39.037 1.00 20.66 C ATOM 339 CG2 ILE A 464 -11.368 -25.422 37.436 1.00 23.01 C ATOM 340 CD1 ILE A 464 -10.939 -27.148 40.410 0.00 24.42 C ATOM 341 N ILE A 465 -8.722 -23.678 36.047 1.00 24.62 N ATOM 342 CA ILE A 465 -8.921 -22.389 35.375 1.00 29.09 C ATOM 343 C ILE A 465 -10.210 -22.315 34.529 1.00 28.99 C ATOM 344 O ILE A 465 -10.256 -22.778 33.386 1.00 28.64 O ATOM 345 CB ILE A 465 -7.700 -21.985 34.515 1.00 27.30 C ATOM 346 CG1 ILE A 465 -6.436 -21.984 35.369 1.00 26.44 C ATOM 347 CG2 ILE A 465 -7.918 -20.613 33.922 1.00 28.53 C ATOM 348 CD1 ILE A 465 -6.535 -21.039 36.556 1.00 31.51 C ATOM 349 N ASP A 466 -11.261 -21.740 35.100 1.00 27.66 N ATOM 350 CA ASP A 466 -12.459 -21.466 34.325 1.00 31.07 C ATOM 351 C ASP A 466 -12.926 -20.017 34.477 1.00 32.36 C ATOM 352 O ASP A 466 -12.258 -19.205 35.122 1.00 31.50 O ATOM 353 CB ASP A 466 -13.575 -22.481 34.613 1.00 30.55 C ATOM 354 CG ASP A 466 -14.019 -22.496 36.065 0.60 32.24 C ATOM 355 OD1 ASP A 466 -13.811 -21.497 36.783 1.00 33.27 O ATOM 356 OD2 ASP A 466 -14.603 -23.520 36.485 1.00 32.65 O ATOM 357 N LYS A 467 -14.059 -19.704 33.859 1.00 34.60 N ATOM 358 CA LYS A 467 -14.594 -18.347 33.834 1.00 37.50 C ATOM 359 C LYS A 467 -14.583 -17.738 35.224 1.00 34.97 C ATOM 360 O LYS A 467 -14.112 -16.624 35.435 1.00 33.51 O ATOM 361 CB LYS A 467 -16.034 -18.356 33.293 1.00 38.22 C ATOM 362 CG LYS A 467 -16.570 -17.001 32.870 1.00 39.48 C ATOM 363 CD LYS A 467 -18.043 -17.072 32.542 0.00 40.48 C ATOM 364 CE LYS A 467 -18.464 -15.840 31.778 1.00 40.45 C ATOM 365 NZ LYS A 467 -17.824 -14.611 32.337 1.00 46.64 N ATOM 366 N ILE A 468 -15.082 -18.499 36.185 1.00 34.87 N ATOM 367 CA ILE A 468 -15.303 -17.957 37.510 1.00 36.24 C ATOM 368 C ILE A 468 -14.065 -18.076 38.418 1.00 35.82 C ATOM 369 O ILE A 468 -14.032 -17.496 39.498 1.00 40.41 O ATOM 370 CB ILE A 468 -16.601 -18.573 38.129 1.00 41.27 C ATOM 371 CG1 ILE A 468 -16.986 -17.891 39.449 1.00 39.77 C ATOM 372 CG2 ILE A 468 -16.492 -20.102 38.244 1.00 39.68 C ATOM 373 CD1 ILE A 468 -18.283 -18.413 40.047 1.00 40.47 C ATOM 374 N ARG A 469 -13.030 -18.782 37.958 1.00 35.37 N ATOM 375 CA ARG A 469 -11.846 -19.037 38.785 1.00 30.92 C ATOM 376 C ARG A 469 -10.502 -18.593 38.227 1.00 33.99 C ATOM 377 O ARG A 469 -9.485 -18.688 38.932 1.00 31.99 O ATOM 378 CB ARG A 469 -11.696 -20.521 39.055 1.00 30.47 C ATOM 379 CG ARG A 469 -12.730 -21.107 39.925 1.00 33.43 C ATOM 380 CD ARG A 469 -12.439 -22.567 40.088 1.00 31.54 C ATOM 381 NE ARG A 469 -13.373 -23.136 41.033 1.00 33.97 N ATOM 382 CZ ARG A 469 -14.554 -23.612 40.686 1.00 34.98 C ATOM 383 NH1 ARG A 469 -14.918 -23.592 39.408 1.00 30.18 N ATOM 384 NH2 ARG A 469 -15.357 -24.107 41.619 1.00 36.43 N ATOM 385 N ARG A 470 -10.467 -18.150 36.974 1.00 31.10 N ATOM 386 CA ARG A 470 -9.190 -17.817 36.346 1.00 31.46 C ATOM 387 C ARG A 470 -8.437 -16.703 37.086 1.00 30.77 C ATOM 388 O ARG A 470 -7.217 -16.575 36.960 1.00 32.55 O ATOM 389 CB ARG A 470 -9.401 -17.446 34.883 1.00 33.84 C ATOM 390 CG ARG A 470 -10.218 -16.196 34.690 1.00 32.29 C ATOM 391 CD ARG A 470 -10.885 -16.219 33.339 1.00 30.26 C ATOM 392 NE ARG A 470 -11.737 -15.052 33.159 1.00 32.71 N ATOM 393 CZ ARG A 470 -12.636 -14.936 32.188 1.00 34.17 C ATOM 394 NH1 ARG A 470 -12.800 -15.919 31.312 1.00 34.35 N ATOM 395 NH2 ARG A 470 -13.370 -13.842 32.092 1.00 35.87 N ATOM 396 N LYS A 471 -9.165 -15.922 37.878 1.00 31.97 N ATOM 397 CA LYS A 471 -8.582 -14.817 38.633 1.00 30.01 C ATOM 398 C LYS A 471 -7.639 -15.272 39.760 1.00 28.64 C ATOM 399 O LYS A 471 -6.659 -14.587 40.080 1.00 29.74 O ATOM 400 CB LYS A 471 -9.691 -13.930 39.214 1.00 27.45 C ATOM 401 CG LYS A 471 -10.207 -12.835 38.291 1.00 31.02 C ATOM 402 CD LYS A 471 -11.175 -11.891 39.034 1.00 29.12 C ATOM 403 CE LYS A 471 -11.665 -10.753 38.153 0.00 33.68 C ATOM 404 NZ LYS A 471 -12.632 -11.214 37.122 1.00 33.78 N ATOM 405 N ASN A 472 -7.940 -16.412 40.369 1.00 27.88 N ATOM 406 CA ASN A 472 -7.234 -16.818 41.577 1.00 26.93 C ATOM 407 C ASN A 472 -5.789 -17.142 41.328 1.00 25.64 C ATOM 408 O ASN A 472 -4.923 -16.744 42.090 1.00 30.65 O ATOM 409 CB ASN A 472 -7.881 -18.039 42.213 1.00 29.69 C ATOM 410 CG ASN A 472 -9.335 -17.827 42.534 1.00 34.70 C ATOM 411 OD1 ASN A 472 -9.932 -16.803 42.176 1.00 34.94 O ATOM 412 ND2 ASN A 472 -9.929 -18.807 43.211 1.00 35.25 N ATOM 413 N CYS A 473 -5.512 -17.879 40.269 1.00 25.66 N ATOM 414 CA CYS A 473 -4.158 -18.366 40.123 1.00 28.05 C ATOM 415 C CYS A 473 -3.506 -17.980 38.800 1.00 28.32 C ATOM 416 O CYS A 473 -3.576 -18.720 37.820 1.00 30.13 O ATOM 417 CB CYS A 473 -4.102 -19.874 40.350 1.00 24.09 C ATOM 418 SG CYS A 473 -2.451 -20.454 40.667 1.00 24.08 S ATOM 419 N PRO A 474 -2.866 -16.806 38.778 1.00 28.43 N ATOM 420 CA PRO A 474 -2.071 -16.384 37.625 1.00 25.67 C ATOM 421 C PRO A 474 -1.034 -17.441 37.271 1.00 25.45 C ATOM 422 O PRO A 474 -0.812 -17.691 36.090 1.00 28.51 O ATOM 423 CB PRO A 474 -1.389 -15.121 38.132 1.00 27.52 C ATOM 424 CG PRO A 474 -2.334 -14.584 39.139 1.00 24.41 C ATOM 425 CD PRO A 474 -2.945 -15.760 39.812 1.00 21.58 C ATOM 426 N ALA A 475 -0.427 -18.070 38.273 1.00 26.58 N ATOM 427 CA ALA A 475 0.600 -19.074 38.017 1.00 23.47 C ATOM 428 C ALA A 475 0.083 -20.188 37.101 1.00 25.41 C ATOM 429 O ALA A 475 0.723 -20.550 36.112 1.00 24.46 O ATOM 430 CB ALA A 475 1.114 -19.640 39.312 1.00 21.27 C ATOM 431 N CYS A 476 -1.101 -20.701 37.408 1.00 25.51 N ATOM 432 CA CYS A 476 -1.666 -21.779 36.616 1.00 23.97 C ATOM 433 C CYS A 476 -2.250 -21.271 35.307 1.00 26.58 C ATOM 434 O CYS A 476 -2.174 -21.944 34.280 1.00 26.02 O ATOM 435 CB CYS A 476 -2.719 -22.541 37.413 1.00 23.60 C ATOM 436 SG CYS A 476 -2.049 -23.514 38.775 1.00 18.51 S ATOM 437 N ARG A 477 -2.849 -20.090 35.352 1.00 25.58 N ATOM 438 CA ARG A 477 -3.396 -19.490 34.150 1.00 26.74 C ATOM 439 C ARG A 477 -2.277 -19.288 33.136 1.00 28.16 C ATOM 440 O ARG A 477 -2.410 -19.648 31.967 1.00 29.11 O ATOM 441 CB ARG A 477 -4.065 -18.150 34.477 1.00 28.78 C ATOM 442 CG ARG A 477 -4.941 -17.587 33.358 1.00 24.19 C ATOM 443 CD ARG A 477 -5.678 -16.352 33.826 1.00 25.80 C ATOM 444 NE ARG A 477 -6.658 -15.883 32.851 1.00 26.67 N ATOM 445 CZ ARG A 477 -7.422 -14.806 33.021 1.00 29.84 C ATOM 446 NH1 ARG A 477 -7.324 -14.095 34.134 1.00 32.44 N ATOM 447 NH2 ARG A 477 -8.290 -14.439 32.082 1.00 29.50 N ATOM 448 N TYR A 478 -1.165 -18.725 33.590 1.00 26.36 N ATOM 449 CA TYR A 478 -0.035 -18.496 32.709 1.00 27.79 C ATOM 450 C TYR A 478 0.562 -19.824 32.214 1.00 28.77 C ATOM 451 O TYR A 478 0.839 -19.986 31.023 1.00 31.92 O ATOM 452 CB TYR A 478 1.003 -17.639 33.422 1.00 28.59 C ATOM 453 CG TYR A 478 2.153 -17.185 32.561 1.00 32.63 C ATOM 454 CD1 TYR A 478 1.939 -16.416 31.431 1.00 35.64 C ATOM 455 CD2 TYR A 478 3.463 -17.508 32.894 1.00 38.00 C ATOM 456 CE1 TYR A 478 3.000 -15.986 30.650 1.00 36.77 C ATOM 457 CE2 TYR A 478 4.528 -17.093 32.113 1.00 34.85 C ATOM 458 CZ TYR A 478 4.291 -16.332 30.998 1.00 33.81 C ATOM 459 OH TYR A 478 5.342 -15.911 30.228 1.00 36.51 O ATOM 460 N ARG A 479 0.745 -20.773 33.124 1.00 27.72 N ATOM 461 CA ARG A 479 1.218 -22.110 32.752 1.00 30.71 C ATOM 462 C ARG A 479 0.301 -22.724 31.697 1.00 29.56 C ATOM 463 O ARG A 479 0.753 -23.312 30.720 1.00 31.24 O ATOM 464 CB ARG A 479 1.315 -23.018 33.995 1.00 27.37 C ATOM 465 CG ARG A 479 1.745 -24.450 33.720 1.00 32.66 C ATOM 466 CD ARG A 479 1.544 -25.406 34.947 1.00 44.88 C ATOM 467 NE ARG A 479 0.197 -25.366 35.553 1.00 37.82 N ATOM 468 CZ ARG A 479 -0.933 -25.736 34.944 0.00 33.53 C ATOM 469 NH1 ARG A 479 -0.921 -26.179 33.692 1.00 37.40 N ATOM 470 NH2 ARG A 479 -2.092 -25.656 35.589 1.00 30.27 N ATOM 471 N LYS A 480 -0.998 -22.563 31.890 1.00 28.86 N ATOM 472 CA LYS A 480 -1.957 -23.136 30.977 1.00 27.26 C ATOM 473 C LYS A 480 -1.898 -22.393 29.641 1.00 34.93 C ATOM 474 O LYS A 480 -1.989 -23.004 28.572 1.00 35.09 O ATOM 475 CB LYS A 480 -3.354 -23.098 31.588 1.00 23.54 C ATOM 476 CG LYS A 480 -4.331 -23.993 30.881 1.00 32.41 C ATOM 477 CD LYS A 480 -5.655 -24.122 31.629 1.00 36.88 C ATOM 478 CE LYS A 480 -6.604 -25.071 30.873 1.00 37.59 C ATOM 479 NZ LYS A 480 -8.022 -25.005 31.355 1.00 31.65 N ATOM 480 N CYS A 481 -1.723 -21.074 29.710 1.00 33.12 N ATOM 481 CA CYS A 481 -1.564 -20.252 28.516 1.00 29.71 C ATOM 482 C CYS A 481 -0.412 -20.739 27.658 1.00 32.68 C ATOM 483 O CYS A 481 -0.576 -21.000 26.464 1.00 34.59 O ATOM 484 CB CYS A 481 -1.310 -18.801 28.905 1.00 29.97 C ATOM 485 SG CYS A 481 -2.808 -17.815 29.119 1.00 32.75 S ATOM 486 N LEU A 482 0.757 -20.850 28.278 1.00 31.14 N ATOM 487 CA LEU A 482 1.952 -21.334 27.595 1.00 32.25 C ATOM 488 C LEU A 482 1.786 -22.750 27.044 1.00 32.87 C ATOM 489 O LEU A 482 2.116 -23.019 25.892 1.00 38.10 O ATOM 490 CB LEU A 482 3.168 -21.249 28.516 1.00 26.90 C ATOM 491 CG LEU A 482 3.719 -19.839 28.659 1.00 28.39 C ATOM 492 CD1 LEU A 482 4.574 -19.802 29.888 1.00 32.40 C ATOM 493 CD2 LEU A 482 4.520 -19.444 27.430 0.00 32.26 C ATOM 494 N GLN A 483 1.261 -23.654 27.852 1.00 33.25 N ATOM 495 CA GLN A 483 1.050 -25.014 27.382 1.00 36.54 C ATOM 496 C GLN A 483 0.034 -25.098 26.245 1.00 38.66 C ATOM 497 O GLN A 483 0.082 -26.023 25.439 1.00 48.16 O ATOM 498 CB GLN A 483 0.650 -25.919 28.541 1.00 40.31 C ATOM 499 CG GLN A 483 1.769 -26.093 29.552 1.00 43.57 C ATOM 500 CD GLN A 483 1.299 -26.722 30.849 1.00 47.05 C ATOM 501 OE1 GLN A 483 0.096 -26.915 31.064 1.00 47.82 O ATOM 502 NE2 GLN A 483 2.250 -27.040 31.728 1.00 46.78 N ATOM 503 N ALA A 484 -0.879 -24.136 26.167 1.00 39.02 N ATOM 504 CA ALA A 484 -1.839 -24.103 25.061 1.00 40.81 C ATOM 505 C ALA A 484 -1.190 -23.618 23.759 1.00 41.82 C ATOM 506 O ALA A 484 -1.776 -23.732 22.686 1.00 42.63 O ATOM 507 CB ALA A 484 -3.051 -23.243 25.412 1.00 36.35 C ATOM 508 N GLY A 485 0.017 -23.074 23.856 1.00 40.05 N ATOM 509 CA GLY A 485 0.742 -22.651 22.674 1.00 40.16 C ATOM 510 C GLY A 485 0.705 -21.157 22.389 1.00 45.77 C ATOM 511 O GLY A 485 1.062 -20.731 21.290 1.00 50.49 O ATOM 512 N MET A 486 0.279 -20.356 23.364 1.00 42.74 N ATOM 513 CA MET A 486 0.270 -18.901 23.189 1.00 45.03 C ATOM 514 C MET A 486 1.690 -18.359 23.190 1.00 44.27 C ATOM 515 O MET A 486 2.455 -18.624 24.109 1.00 45.92 O ATOM 516 CB MET A 486 -0.533 -18.207 24.293 1.00 36.88 C ATOM 517 CG MET A 486 -1.999 -18.531 24.283 1.00 35.44 C ATOM 518 SD MET A 486 -2.893 -17.526 25.462 1.00 37.72 S ATOM 519 CE MET A 486 -2.851 -15.936 24.637 0.00 35.72 C ATOM 520 N ASN A 487 2.041 -17.600 22.163 1.00 44.25 N ATOM 521 CA ASN A 487 3.351 -16.959 22.103 1.00 51.42 C ATOM 522 C ASN A 487 3.217 -15.541 21.569 1.00 53.40 C ATOM 523 O ASN A 487 2.286 -15.237 20.817 1.00 51.72 O ATOM 524 CB ASN A 487 4.325 -17.774 21.238 1.00 51.38 C ATOM 525 CG ASN A 487 3.685 -18.280 19.950 1.00 57.88 C ATOM 526 OD1 ASN A 487 2.951 -17.553 19.280 1.00 63.04 O ATOM 527 ND2 ASN A 487 3.950 -19.539 19.608 1.00 63.90 N ATOM 528 N LEU A 488 4.142 -14.669 21.952 1.00 54.37 N ATOM 529 CA LEU A 488 4.079 -13.287 21.495 1.00 51.78 C ATOM 530 C LEU A 488 4.767 -13.092 20.142 1.00 59.84 C ATOM 531 O LEU A 488 5.347 -12.045 19.870 1.00 66.18 O ATOM 532 CB LEU A 488 4.636 -12.345 22.555 1.00 45.03 C ATOM 533 CG LEU A 488 3.569 -11.561 23.311 1.00 39.71 C ATOM 534 CD1 LEU A 488 2.313 -12.377 23.532 0.00 42.85 C ATOM 535 CD2 LEU A 488 4.126 -11.098 24.627 1.00 42.63 C ATOM 536 N GLU A 489 4.694 -14.118 19.298 1.00 65.45 N ATOM 537 CA GLU A 489 5.154 -14.027 17.916 1.00 67.45 C ATOM 538 C GLU A 489 3.926 -13.917 17.009 1.00 73.18 C ATOM 539 O GLU A 489 3.700 -12.880 16.367 1.00 70.75 O ATOM 540 CB GLU A 489 5.997 -15.254 17.540 1.00 67.54 C ATOM 541 CG GLU A 489 6.985 -15.023 16.396 1.00 76.40 C ATOM 542 CD GLU A 489 8.172 -14.154 16.801 0.00 75.32 C ATOM 543 OE1 GLU A 489 8.367 -13.944 18.018 1.00 76.74 O ATOM 544 OE2 GLU A 489 8.911 -13.682 15.906 1.00 80.07 O ATOM 545 N ALA A 490 3.128 -14.987 16.977 1.00 74.05 N ATOM 546 CA ALA A 490 1.876 -15.016 16.215 1.00 67.26 C ATOM 547 C ALA A 490 0.753 -14.322 16.982 1.00 65.56 C ATOM 548 O ALA A 490 0.987 -13.356 17.716 1.00 64.94 O ATOM 549 CB ALA A 490 1.482 -16.452 15.881 1.00 59.15 C TER 550 ALA A 490 ATOM 551 O5' DC C 857 -11.009 8.064 -1.814 1.00 41.63 O ATOM 552 C5' DC C 857 -12.181 8.681 -2.380 1.00 41.65 C ATOM 553 C4' DC C 857 -13.283 7.673 -2.687 1.00 40.64 C ATOM 554 O4' DC C 857 -12.725 6.473 -3.281 1.00 41.79 O ATOM 555 C3' DC C 857 -14.077 7.184 -1.475 1.00 41.83 C ATOM 556 O3' DC C 857 -15.355 7.775 -1.438 1.00 43.10 O ATOM 557 C2' DC C 857 -14.246 5.674 -1.649 1.00 42.25 C ATOM 558 C1' DC C 857 -13.586 5.385 -2.987 1.00 42.38 C ATOM 559 N1 DC C 857 -12.813 4.110 -2.981 1.00 39.99 N ATOM 560 C2 DC C 857 -13.497 2.915 -3.194 1.00 38.72 C ATOM 561 O2 DC C 857 -14.723 2.962 -3.365 1.00 37.23 O ATOM 562 N3 DC C 857 -12.793 1.753 -3.203 1.00 40.36 N ATOM 563 C4 DC C 857 -11.471 1.762 -3.004 1.00 39.08 C ATOM 564 N4 DC C 857 -10.814 0.593 -3.019 1.00 36.35 N ATOM 565 C5 DC C 857 -10.763 2.977 -2.778 1.00 37.22 C ATOM 566 C6 DC C 857 -11.466 4.113 -2.775 1.00 38.34 C ATOM 567 P DG C 858 -16.051 8.109 -0.024 1.00 45.64 P ATOM 568 OP1 DG C 858 -17.167 9.066 -0.297 1.00 37.84 O ATOM 569 OP2 DG C 858 -14.959 8.429 0.932 1.00 32.07 O ATOM 570 O5' DG C 858 -16.700 6.720 0.441 1.00 38.64 O ATOM 571 C5' DG C 858 -17.582 5.971 -0.397 1.00 40.84 C ATOM 572 C4' DG C 858 -17.888 4.630 0.266 1.00 42.46 C ATOM 573 O4' DG C 858 -16.891 3.643 -0.121 1.00 42.50 O ATOM 574 C3' DG C 858 -17.910 4.637 1.803 1.00 41.31 C ATOM 575 O3' DG C 858 -18.983 3.777 2.301 1.00 46.68 O ATOM 576 C2' DG C 858 -16.499 4.132 2.122 1.00 40.57 C ATOM 577 C1' DG C 858 -16.413 3.042 1.065 1.00 41.58 C ATOM 578 N9 DG C 858 -15.072 2.522 0.854 1.00 39.80 N ATOM 579 C8 DG C 858 -13.879 3.153 1.107 1.00 37.66 C ATOM 580 N7 DG C 858 -12.843 2.417 0.811 1.00 34.90 N ATOM 581 C5 DG C 858 -13.392 1.228 0.338 1.00 35.99 C ATOM 582 C6 DG C 858 -12.758 0.053 -0.129 1.00 37.05 C ATOM 583 O6 DG C 858 -11.540 -0.182 -0.227 1.00 33.62 O ATOM 584 N1 DG C 858 -13.699 -0.909 -0.507 1.00 40.65 N ATOM 585 C2 DG C 858 -15.071 -0.771 -0.444 1.00 39.75 C ATOM 586 N2 DG C 858 -15.801 -1.827 -0.861 1.00 39.43 N ATOM 587 N3 DG C 858 -15.670 0.333 -0.007 1.00 36.48 N ATOM 588 C4 DG C 858 -14.768 1.278 0.360 1.00 36.42 C ATOM 589 P DC C 859 -19.373 3.711 3.873 1.00 49.56 P ATOM 590 OP1 DC C 859 -20.838 3.905 3.969 1.00 48.98 O ATOM 591 OP2 DC C 859 -18.466 4.575 4.669 1.00 40.14 O ATOM 592 O5' DC C 859 -19.098 2.179 4.257 1.00 46.85 O ATOM 593 C5' DC C 859 -19.616 1.194 3.389 1.00 43.31 C ATOM 594 C4' DC C 859 -18.783 -0.067 3.462 1.00 47.04 C ATOM 595 O4' DC C 859 -17.450 0.171 2.960 1.00 45.04 O ATOM 596 C3' DC C 859 -18.502 -0.595 4.855 1.00 47.05 C ATOM 597 O3' DC C 859 -19.571 -1.407 5.357 1.00 49.61 O ATOM 598 C2' DC C 859 -17.258 -1.448 4.611 1.00 47.54 C ATOM 599 C1' DC C 859 -16.739 -1.003 3.255 1.00 39.21 C ATOM 600 N1 DC C 859 -15.296 -0.723 3.296 1.00 38.69 N ATOM 601 C2 DC C 859 -14.436 -1.751 2.918 1.00 40.19 C ATOM 602 O2 DC C 859 -14.946 -2.818 2.567 1.00 42.53 O ATOM 603 N3 DC C 859 -13.091 -1.546 2.940 1.00 39.57 N ATOM 604 C4 DC C 859 -12.607 -0.359 3.328 1.00 38.51 C ATOM 605 N4 DC C 859 -11.272 -0.201 3.336 1.00 34.94 N ATOM 606 C5 DC C 859 -13.478 0.704 3.727 1.00 33.99 C ATOM 607 C6 DC C 859 -14.802 0.484 3.699 1.00 37.98 C ATOM 608 P DC C 860 -19.489 -2.009 6.851 1.00 61.63 P ATOM 609 OP1 DC C 860 -20.870 -2.347 7.273 1.00 58.30 O ATOM 610 OP2 DC C 860 -18.673 -1.089 7.684 1.00 55.50 O ATOM 611 O5' DC C 860 -18.620 -3.346 6.689 1.00 52.09 O ATOM 612 C5' DC C 860 -19.119 -4.461 5.969 1.00 51.52 C ATOM 613 C4' DC C 860 -18.021 -5.488 5.801 1.00 49.43 C ATOM 614 O4' DC C 860 -16.908 -4.845 5.150 1.00 50.95 O ATOM 615 C3' DC C 860 -17.406 -6.008 7.091 1.00 50.85 C ATOM 616 O3' DC C 860 -18.098 -7.151 7.577 1.00 58.59 O ATOM 617 C2' DC C 860 -16.008 -6.430 6.661 1.00 51.24 C ATOM 618 C1' DC C 860 -15.723 -5.557 5.457 1.00 47.41 C ATOM 619 N1 DC C 860 -14.603 -4.608 5.683 1.00 42.82 N ATOM 620 C2 DC C 860 -13.310 -5.086 5.472 1.00 44.31 C ATOM 621 O2 DC C 860 -13.163 -6.272 5.122 1.00 45.62 O ATOM 622 N3 DC C 860 -12.267 -4.234 5.657 1.00 41.99 N ATOM 623 C4 DC C 860 -12.489 -2.972 6.029 1.00 37.91 C ATOM 624 N4 DC C 860 -11.421 -2.186 6.192 1.00 37.79 N ATOM 625 C5 DC C 860 -13.805 -2.473 6.251 1.00 38.37 C ATOM 626 C6 DC C 860 -14.826 -3.319 6.071 1.00 40.46 C ATOM 627 P DT C 861 -17.890 -7.635 9.098 1.00 59.69 P ATOM 628 OP1 DT C 861 -19.145 -8.295 9.522 1.00 58.99 O ATOM 629 OP2 DT C 861 -17.354 -6.505 9.894 1.00 53.72 O ATOM 630 O5' DT C 861 -16.694 -8.687 9.013 1.00 49.29 O ATOM 631 C5' DT C 861 -16.524 -9.596 7.950 1.00 49.83 C ATOM 632 C4' DT C 861 -15.135 -10.144 8.172 1.00 51.26 C ATOM 633 O4' DT C 861 -14.158 -9.134 7.819 1.00 50.22 O ATOM 634 C3' DT C 861 -14.886 -10.504 9.637 1.00 55.42 C ATOM 635 O3' DT C 861 -14.326 -11.819 9.710 1.00 67.95 O ATOM 636 C2' DT C 861 -13.935 -9.429 10.162 1.00 48.94 C ATOM 637 C1' DT C 861 -13.260 -8.920 8.894 1.00 48.19 C ATOM 638 N1 DT C 861 -12.869 -7.470 8.969 1.00 42.41 N ATOM 639 C2 DT C 861 -11.563 -7.149 8.691 1.00 40.72 C ATOM 640 O2 DT C 861 -10.747 -7.997 8.386 1.00 40.20 O ATOM 641 N3 DT C 861 -11.252 -5.813 8.780 1.00 40.50 N ATOM 642 C4 DT C 861 -12.111 -4.781 9.131 1.00 43.45 C ATOM 643 O4 DT C 861 -11.733 -3.604 9.188 1.00 40.11 O ATOM 644 C5 DT C 861 -13.473 -5.192 9.421 1.00 39.57 C ATOM 645 C7 DT C 861 -14.505 -4.177 9.812 1.00 37.59 C ATOM 646 C6 DT C 861 -13.781 -6.496 9.331 1.00 41.75 C ATOM 647 P DC C 862 -14.135 -12.556 11.128 1.00 66.12 P ATOM 648 OP1 DC C 862 -14.228 -14.009 10.858 1.00 64.79 O ATOM 649 OP2 DC C 862 -15.028 -11.893 12.116 1.00 50.72 O ATOM 650 O5' DC C 862 -12.617 -12.239 11.516 1.00 51.66 O ATOM 651 C5' DC C 862 -11.563 -12.646 10.648 1.00 50.91 C ATOM 652 C4' DC C 862 -10.253 -12.175 11.242 1.00 51.22 C ATOM 653 O4' DC C 862 -10.084 -10.755 10.997 1.00 55.94 O ATOM 654 C3' DC C 862 -10.209 -12.345 12.756 1.00 53.25 C ATOM 655 O3' DC C 862 -8.985 -12.920 13.149 1.00 54.43 O ATOM 656 C2' DC C 862 -10.350 -10.929 13.313 1.00 50.23 C ATOM 657 C1' DC C 862 -9.720 -10.105 12.200 1.00 49.49 C ATOM 658 N1 DC C 862 -10.208 -8.693 12.219 1.00 42.32 N ATOM 659 C2 DC C 862 -9.315 -7.666 11.906 1.00 39.84 C ATOM 660 O2 DC C 862 -8.148 -7.964 11.604 1.00 37.26 O ATOM 661 N3 DC C 862 -9.770 -6.384 11.942 1.00 40.62 N ATOM 662 C4 DC C 862 -11.040 -6.120 12.282 1.00 41.31 C ATOM 663 N4 DC C 862 -11.428 -4.839 12.305 1.00 40.85 N ATOM 664 C5 DC C 862 -11.966 -7.158 12.618 1.00 40.38 C ATOM 665 C6 DC C 862 -11.502 -8.416 12.575 1.00 43.06 C ATOM 666 P DC C 863 -8.857 -13.639 14.579 1.00 58.51 P ATOM 667 OP1 DC C 863 -8.475 -15.043 14.286 1.00 47.99 O ATOM 668 OP2 DC C 863 -10.032 -13.282 15.430 1.00 41.25 O ATOM 669 O5' DC C 863 -7.598 -12.920 15.240 1.00 48.97 O ATOM 670 C5' DC C 863 -6.385 -12.760 14.525 1.00 44.46 C ATOM 671 C4' DC C 863 -5.774 -11.473 15.032 1.00 45.98 C ATOM 672 O4' DC C 863 -6.642 -10.370 14.640 1.00 47.94 O ATOM 673 C3' DC C 863 -5.666 -11.381 16.558 1.00 41.84 C ATOM 674 O3' DC C 863 -4.452 -10.751 16.917 1.00 41.21 O ATOM 675 C2' DC C 863 -6.832 -10.470 16.923 1.00 41.12 C ATOM 676 C1' DC C 863 -6.679 -9.510 15.752 1.00 42.58 C ATOM 677 N1 DC C 863 -7.752 -8.497 15.672 1.00 40.14 N ATOM 678 C2 DC C 863 -7.404 -7.188 15.327 1.00 39.90 C ATOM 679 O2 DC C 863 -6.219 -6.920 15.065 1.00 39.87 O ATOM 680 N3 DC C 863 -8.386 -6.256 15.286 1.00 38.76 N ATOM 681 C4 DC C 863 -9.644 -6.595 15.573 1.00 39.26 C ATOM 682 N4 DC C 863 -10.572 -5.636 15.514 1.00 40.65 N ATOM 683 C5 DC C 863 -10.013 -7.925 15.932 1.00 39.90 C ATOM 684 C6 DC C 863 -9.037 -8.835 15.977 1.00 42.65 C ATOM 685 P DG C 864 -3.731 -11.115 18.302 1.00 44.10 P ATOM 686 OP1 DG C 864 -2.886 -12.300 18.023 1.00 49.02 O ATOM 687 OP2 DG C 864 -4.736 -11.046 19.394 1.00 36.17 O ATOM 688 O5' DG C 864 -2.729 -9.910 18.563 1.00 39.91 O ATOM 689 C5' DG C 864 -1.913 -9.408 17.532 1.00 37.87 C ATOM 690 C4' DG C 864 -1.749 -7.921 17.775 1.00 35.95 C ATOM 691 O4' DG C 864 -2.989 -7.245 17.468 1.00 33.97 O ATOM 692 C3' DG C 864 -1.406 -7.542 19.217 1.00 37.54 C ATOM 693 O3' DG C 864 -0.358 -6.608 19.193 1.00 32.86 O ATOM 694 C2' DG C 864 -2.670 -6.913 19.794 1.00 35.58 C ATOM 695 C1' DG C 864 -3.355 -6.396 18.541 1.00 36.30 C ATOM 696 N9 DG C 864 -4.806 -6.427 18.599 1.00 38.10 N ATOM 697 C8 DG C 864 -5.606 -7.543 18.673 1.00 36.49 C ATOM 698 N7 DG C 864 -6.875 -7.259 18.694 1.00 36.68 N ATOM 699 C5 DG C 864 -6.910 -5.872 18.620 1.00 38.10 C ATOM 700 C6 DG C 864 -8.017 -4.990 18.602 1.00 39.10 C ATOM 701 O6 DG C 864 -9.218 -5.292 18.651 1.00 39.63 O ATOM 702 N1 DG C 864 -7.619 -3.647 18.525 1.00 37.74 N ATOM 703 C2 DG C 864 -6.312 -3.212 18.470 1.00 35.56 C ATOM 704 N2 DG C 864 -6.136 -1.888 18.393 1.00 33.50 N ATOM 705 N3 DG C 864 -5.260 -4.028 18.482 1.00 37.06 N ATOM 706 C4 DG C 864 -5.641 -5.337 18.559 1.00 38.14 C ATOM 707 P DG C 865 0.560 -6.393 20.484 1.00 37.16 P ATOM 708 OP1 DG C 865 1.939 -6.072 20.024 1.00 33.14 O ATOM 709 OP2 DG C 865 0.318 -7.547 21.383 1.00 41.26 O ATOM 710 O5' DG C 865 -0.077 -5.102 21.179 1.00 39.59 O ATOM 711 C5' DG C 865 -0.140 -3.868 20.482 1.00 35.81 C ATOM 712 C4' DG C 865 -1.083 -2.917 21.196 1.00 39.45 C ATOM 713 O4' DG C 865 -2.465 -3.215 20.844 1.00 40.09 O ATOM 714 C3' DG C 865 -1.014 -2.937 22.725 1.00 37.25 C ATOM 715 O3' DG C 865 -1.163 -1.622 23.193 1.00 42.93 O ATOM 716 C2' DG C 865 -2.280 -3.683 23.095 1.00 37.99 C ATOM 717 C1' DG C 865 -3.185 -3.062 22.040 1.00 39.56 C ATOM 718 N9 DG C 865 -4.478 -3.708 21.954 1.00 37.24 N ATOM 719 C8 DG C 865 -4.733 -5.056 21.984 1.00 37.12 C ATOM 720 N7 DG C 865 -6.007 -5.334 21.908 1.00 39.59 N ATOM 721 C5 DG C 865 -6.625 -4.087 21.827 1.00 38.38 C ATOM 722 C6 DG C 865 -7.990 -3.756 21.727 1.00 35.17 C ATOM 723 O6 DG C 865 -8.955 -4.522 21.685 1.00 33.15 O ATOM 724 N1 DG C 865 -8.185 -2.377 21.667 1.00 38.49 N ATOM 725 C2 DG C 865 -7.196 -1.425 21.702 1.00 35.35 C ATOM 726 N2 DG C 865 -7.608 -0.145 21.641 1.00 32.66 N ATOM 727 N3 DG C 865 -5.905 -1.722 21.796 1.00 35.94 N ATOM 728 C4 DG C 865 -5.697 -3.068 21.855 1.00 39.33 C ATOM 729 P DG C 866 -0.098 -0.977 24.211 1.00 49.18 P ATOM 730 OP1 DG C 866 1.180 -0.824 23.472 1.00 43.73 O ATOM 731 OP2 DG C 866 -0.160 -1.721 25.493 1.00 43.03 O ATOM 732 O5' DG C 866 -0.713 0.469 24.495 1.00 50.13 O ATOM 733 C5' DG C 866 -1.320 1.153 23.408 1.00 42.03 C ATOM 734 C4' DG C 866 -2.374 2.138 23.885 1.00 45.35 C ATOM 735 O4' DG C 866 -3.700 1.584 23.708 1.00 46.34 O ATOM 736 C3' DG C 866 -2.291 2.607 25.335 1.00 47.98 C ATOM 737 O3' DG C 866 -2.567 4.013 25.312 1.00 58.64 O ATOM 738 C2' DG C 866 -3.361 1.784 26.049 1.00 43.31 C ATOM 739 C1' DG C 866 -4.394 1.558 24.943 1.00 46.49 C ATOM 740 N9 DG C 866 -5.063 0.257 24.979 1.00 43.24 N ATOM 741 C8 DG C 866 -4.424 -0.958 24.996 1.00 37.90 C ATOM 742 N7 DG C 866 -5.248 -1.962 25.013 1.00 41.70 N ATOM 743 C5 DG C 866 -6.518 -1.390 24.997 1.00 38.58 C ATOM 744 C6 DG C 866 -7.796 -2.009 25.002 1.00 35.98 C ATOM 745 O6 DG C 866 -8.066 -3.220 25.023 1.00 35.04 O ATOM 746 N1 DG C 866 -8.821 -1.062 24.976 1.00 39.99 N ATOM 747 C2 DG C 866 -8.639 0.311 24.953 1.00 40.41 C ATOM 748 N2 DG C 866 -9.756 1.063 24.932 1.00 34.97 N ATOM 749 N3 DG C 866 -7.442 0.898 24.946 1.00 39.77 N ATOM 750 C4 DG C 866 -6.425 -0.013 24.968 1.00 40.58 C ATOM 751 P DA C 867 -2.539 4.889 26.662 1.00 66.15 P ATOM 752 OP1 DA C 867 -2.434 6.312 26.265 1.00 63.40 O ATOM 753 OP2 DA C 867 -1.545 4.303 27.596 1.00 60.21 O ATOM 754 O5' DA C 867 -4.001 4.693 27.244 1.00 49.51 O ATOM 755 C5' DA C 867 -5.058 4.939 26.339 1.00 51.75 C ATOM 756 C4' DA C 867 -6.392 4.786 27.033 1.00 54.43 C ATOM 757 O4' DA C 867 -6.816 3.400 27.012 1.00 49.93 O ATOM 758 C3' DA C 867 -6.378 5.196 28.499 1.00 56.12 C ATOM 759 O3' DA C 867 -7.624 5.807 28.775 1.00 60.21 O ATOM 760 C2' DA C 867 -6.228 3.853 29.215 1.00 51.91 C ATOM 761 C1' DA C 867 -7.129 3.000 28.334 1.00 48.53 C ATOM 762 N9 DA C 867 -6.921 1.558 28.404 1.00 45.21 N ATOM 763 C8 DA C 867 -5.729 0.888 28.508 1.00 43.88 C ATOM 764 N7 DA C 867 -5.861 -0.424 28.534 1.00 42.98 N ATOM 765 C5 DA C 867 -7.232 -0.617 28.430 1.00 42.13 C ATOM 766 C6 DA C 867 -8.019 -1.775 28.394 1.00 38.76 C ATOM 767 N6 DA C 867 -7.480 -2.989 28.467 1.00 38.05 N ATOM 768 N1 DA C 867 -9.361 -1.629 28.287 1.00 39.13 N ATOM 769 C2 DA C 867 -9.877 -0.397 28.216 1.00 38.11 C ATOM 770 N3 DA C 867 -9.236 0.771 28.239 1.00 40.44 N ATOM 771 C4 DA C 867 -7.906 0.590 28.345 1.00 43.01 C ATOM 772 P DG C 868 -7.706 7.135 29.678 1.00 69.47 P ATOM 773 OP1 DG C 868 -7.969 8.279 28.768 1.00 69.75 O ATOM 774 OP2 DG C 868 -6.516 7.142 30.570 1.00 58.41 O ATOM 775 O5' DG C 868 -9.018 6.893 30.564 1.00 62.44 O ATOM 776 C5' DG C 868 -10.157 6.267 29.963 1.00 58.61 C ATOM 777 C4' DG C 868 -10.835 5.295 30.914 1.00 59.33 C ATOM 778 O4' DG C 868 -10.282 3.948 30.822 1.00 59.85 O ATOM 779 C3' DG C 868 -10.719 5.640 32.389 1.00 55.81 C ATOM 780 O3' DG C 868 -11.851 5.105 32.981 0.00 56.03 O ATOM 781 C2' DG C 868 -9.531 4.800 32.819 1.00 51.90 C ATOM 782 C1' DG C 868 -9.989 3.523 32.139 1.00 52.18 C ATOM 783 N9 DG C 868 -8.976 2.493 32.059 1.00 48.59 N ATOM 784 C8 DG C 868 -7.611 2.666 32.117 1.00 48.62 C ATOM 785 N7 DG C 868 -6.943 1.554 32.010 1.00 45.79 N ATOM 786 C5 DG C 868 -7.944 0.591 31.872 1.00 44.93 C ATOM 787 C6 DG C 868 -7.825 -0.802 31.712 1.00 41.68 C ATOM 788 O6 DG C 868 -6.773 -1.459 31.657 1.00 42.84 O ATOM 789 N1 DG C 868 -9.075 -1.417 31.612 1.00 40.90 N ATOM 790 C2 DG C 868 -10.286 -0.768 31.654 1.00 42.02 C ATOM 791 N2 DG C 868 -11.367 -1.551 31.538 1.00 41.39 N ATOM 792 N3 DG C 868 -10.419 0.546 31.797 1.00 43.83 N ATOM 793 C4 DG C 868 -9.204 1.150 31.898 1.00 45.35 C ATOM 794 P DA C 869 -12.988 6.078 33.537 1.00 65.51 P ATOM 795 OP1 DA C 869 -13.656 6.706 32.368 1.00 53.48 O ATOM 796 OP2 DA C 869 -12.331 6.879 34.602 1.00 59.90 O ATOM 797 O5' DA C 869 -14.042 5.074 34.194 1.00 59.24 O ATOM 798 C5' DA C 869 -14.664 4.124 33.345 1.00 55.49 C ATOM 799 C4' DA C 869 -15.103 2.922 34.156 1.00 58.55 C ATOM 800 O4' DA C 869 -14.087 1.880 34.155 1.00 55.87 O ATOM 801 C3' DA C 869 -15.398 3.235 35.615 1.00 58.93 C ATOM 802 O3' DA C 869 -16.599 2.511 35.953 1.00 59.20 O ATOM 803 C2' DA C 869 -14.107 2.802 36.326 1.00 53.80 C ATOM 804 C1' DA C 869 -13.605 1.636 35.468 1.00 53.19 C ATOM 805 N9 DA C 869 -12.145 1.434 35.392 1.00 50.32 N ATOM 806 C8 DA C 869 -11.156 2.383 35.453 1.00 46.93 C ATOM 807 N7 DA C 869 -9.937 1.902 35.344 1.00 42.11 N ATOM 808 C5 DA C 869 -10.136 0.538 35.196 1.00 43.86 C ATOM 809 C6 DA C 869 -9.240 -0.542 35.029 1.00 42.41 C ATOM 810 N6 DA C 869 -7.917 -0.370 34.988 1.00 39.08 N ATOM 811 N1 DA C 869 -9.752 -1.794 34.908 1.00 41.08 N ATOM 812 C2 DA C 869 -11.085 -1.950 34.951 1.00 41.24 C ATOM 813 N3 DA C 869 -12.027 -1.013 35.104 1.00 43.63 N ATOM 814 C4 DA C 869 -11.486 0.224 35.221 1.00 47.52 C ATOM 815 P DG C 870 -17.205 2.553 37.441 0.37 56.23 P ATOM 816 OP1 DG C 870 -18.675 2.452 37.306 1.00 54.01 O ATOM 817 OP2 DG C 870 -16.592 3.665 38.200 1.00 55.99 O ATOM 818 O5' DG C 870 -16.666 1.202 38.089 1.00 55.02 O ATOM 819 C5' DG C 870 -16.682 0.035 37.281 1.00 53.75 C ATOM 820 C4' DG C 870 -15.888 -1.048 37.971 1.00 50.30 C ATOM 821 O4' DG C 870 -14.477 -0.961 37.644 1.00 54.06 O ATOM 822 C3' DG C 870 -15.980 -0.951 39.486 1.00 51.43 C ATOM 823 O3' DG C 870 -16.347 -2.228 39.960 1.00 56.42 O ATOM 824 C2' DG C 870 -14.576 -0.539 39.922 1.00 49.14 C ATOM 825 C1' DG C 870 -13.758 -1.206 38.828 1.00 46.76 C ATOM 826 N9 DG C 870 -12.415 -0.676 38.690 1.00 42.32 N ATOM 827 C8 DG C 870 -11.996 0.631 38.687 1.00 44.09 C ATOM 828 N7 DG C 870 -10.701 0.757 38.548 1.00 44.76 N ATOM 829 C5 DG C 870 -10.239 -0.554 38.458 1.00 42.17 C ATOM 830 C6 DG C 870 -8.927 -1.073 38.305 1.00 39.48 C ATOM 831 O6 DG C 870 -7.859 -0.459 38.208 1.00 39.81 O ATOM 832 N1 DG C 870 -8.917 -2.469 38.265 1.00 40.26 N ATOM 833 C2 DG C 870 -10.044 -3.267 38.365 1.00 44.75 C ATOM 834 N2 DG C 870 -9.859 -4.600 38.316 1.00 42.22 N ATOM 835 N3 DG C 870 -11.279 -2.789 38.508 1.00 44.10 N ATOM 836 C4 DG C 870 -11.291 -1.438 38.544 1.00 42.14 C ATOM 837 P DC C 871 -16.940 -2.397 41.437 0.45 52.71 P ATOM 838 OP1 DC C 871 -17.514 -3.761 41.472 1.00 41.24 O ATOM 839 OP2 DC C 871 -17.801 -1.226 41.738 1.00 49.96 O ATOM 840 O5' DC C 871 -15.646 -2.264 42.369 1.00 53.71 O ATOM 841 C5' DC C 871 -15.300 -3.267 43.298 1.00 55.47 C ATOM 842 C4' DC C 871 -14.826 -4.541 42.625 1.00 52.77 C ATOM 843 O4' DC C 871 -13.870 -4.229 41.578 1.00 51.88 O ATOM 844 C3' DC C 871 -14.114 -5.435 43.625 1.00 54.16 C ATOM 845 O3' DC C 871 -14.219 -6.823 43.361 1.00 51.44 O ATOM 846 C2' DC C 871 -12.678 -4.964 43.493 1.00 52.76 C ATOM 847 C1' DC C 871 -12.559 -4.527 42.038 1.00 53.53 C ATOM 848 N1 DC C 871 -11.633 -3.340 41.940 1.00 48.67 N ATOM 849 C2 DC C 871 -10.259 -3.576 41.775 1.00 44.87 C ATOM 850 O2 DC C 871 -9.857 -4.752 41.693 1.00 49.10 O ATOM 851 N3 DC C 871 -9.414 -2.514 41.705 1.00 39.03 N ATOM 852 C4 DC C 871 -9.898 -1.272 41.789 1.00 42.01 C ATOM 853 N4 DC C 871 -9.028 -0.262 41.702 1.00 42.05 N ATOM 854 C5 DC C 871 -11.291 -1.008 41.973 1.00 43.38 C ATOM 855 C6 DC C 871 -12.113 -2.062 42.052 1.00 46.79 C ATOM 856 P DT C 872 -14.054 -7.844 44.579 0.00 52.18 P ATOM 857 OP1 DT C 872 -14.277 -9.219 44.093 1.00 55.24 O ATOM 858 OP2 DT C 872 -14.845 -7.254 45.683 1.00 49.47 O ATOM 859 O5' DT C 872 -12.516 -7.713 44.963 1.00 50.19 O ATOM 860 C5' DT C 872 -11.497 -8.132 44.046 1.00 55.73 C ATOM 861 C4' DT C 872 -10.126 -7.957 44.697 1.00 59.26 C ATOM 862 O4' DT C 872 -9.532 -6.650 44.425 1.00 54.43 O ATOM 863 C3' DT C 872 -10.138 -8.096 46.224 1.00 55.41 C ATOM 864 O3' DT C 872 -9.004 -8.867 46.642 1.00 61.71 O ATOM 865 C2' DT C 872 -10.063 -6.647 46.706 1.00 47.64 C ATOM 866 C1' DT C 872 -9.102 -6.098 45.657 1.00 47.87 C ATOM 867 N1 DT C 872 -9.126 -4.631 45.527 1.00 45.91 N ATOM 868 C2 DT C 872 -7.936 -3.966 45.295 1.00 43.62 C ATOM 869 O2 DT C 872 -6.858 -4.529 45.193 1.00 43.79 O ATOM 870 N3 DT C 872 -8.068 -2.605 45.190 1.00 40.05 N ATOM 871 C4 DT C 872 -9.240 -1.867 45.295 1.00 43.68 C ATOM 872 O4 DT C 872 -9.250 -0.642 45.176 1.00 41.49 O ATOM 873 C5 DT C 872 -10.446 -2.629 45.547 1.00 42.10 C ATOM 874 C7 DT C 872 -11.771 -1.930 45.676 1.00 42.25 C ATOM 875 C6 DT C 872 -10.330 -3.961 45.653 1.00 42.51 C TER 876 DT C 872 ATOM 877 O5' DA D 842 1.103 3.722 43.031 1.00 64.32 O ATOM 878 C5' DA D 842 0.033 3.020 43.638 1.00 62.13 C ATOM 879 C4' DA D 842 0.444 1.654 44.162 1.00 60.08 C ATOM 880 O4' DA D 842 -0.494 1.228 45.182 1.00 55.26 O ATOM 881 C3' DA D 842 0.445 0.568 43.093 1.00 59.27 C ATOM 882 O3' DA D 842 1.678 -0.112 43.078 1.00 63.67 O ATOM 883 C2' DA D 842 -0.661 -0.413 43.473 1.00 56.02 C ATOM 884 C1' DA D 842 -1.334 0.205 44.682 1.00 51.78 C ATOM 885 N9 DA D 842 -2.661 0.740 44.388 1.00 49.02 N ATOM 886 C8 DA D 842 -3.027 1.997 43.978 1.00 49.73 C ATOM 887 N7 DA D 842 -4.321 2.154 43.814 1.00 46.05 N ATOM 888 C5 DA D 842 -4.828 0.906 44.142 1.00 44.99 C ATOM 889 C6 DA D 842 -6.139 0.394 44.183 1.00 48.63 C ATOM 890 N6 DA D 842 -7.207 1.140 43.867 1.00 47.71 N ATOM 891 N1 DA D 842 -6.296 -0.908 44.556 1.00 46.23 N ATOM 892 C2 DA D 842 -5.212 -1.636 44.866 1.00 42.47 C ATOM 893 N3 DA D 842 -3.939 -1.257 44.870 1.00 43.16 N ATOM 894 C4 DA D 842 -3.822 0.027 44.493 1.00 44.24 C ATOM 895 P DG D 843 2.155 -0.859 41.739 1.00 72.62 P ATOM 896 OP1 DG D 843 3.573 -1.254 41.952 1.00 69.33 O ATOM 897 OP2 DG D 843 1.716 -0.031 40.582 1.00 54.02 O ATOM 898 O5' DG D 843 1.262 -2.185 41.686 1.00 65.58 O ATOM 899 C5' DG D 843 1.379 -3.262 42.619 1.00 57.73 C ATOM 900 C4' DG D 843 0.297 -4.274 42.274 1.00 57.34 C ATOM 901 O4' DG D 843 -1.019 -3.678 42.466 1.00 54.64 O ATOM 902 C3' DG D 843 0.329 -4.768 40.828 1.00 53.00 C ATOM 903 O3' DG D 843 0.186 -6.193 40.830 1.00 55.47 O ATOM 904 C2' DG D 843 -0.837 -4.031 40.164 1.00 47.15 C ATOM 905 C1' DG D 843 -1.819 -3.892 41.322 1.00 47.78 C ATOM 906 N9 DG D 843 -2.753 -2.775 41.189 1.00 46.37 N ATOM 907 C8 DG D 843 -2.447 -1.474 40.861 1.00 46.37 C ATOM 908 N7 DG D 843 -3.486 -0.683 40.805 1.00 44.65 N ATOM 909 C5 DG D 843 -4.555 -1.517 41.118 1.00 43.32 C ATOM 910 C6 DG D 843 -5.935 -1.215 41.214 1.00 42.47 C ATOM 911 O6 DG D 843 -6.492 -0.115 41.031 1.00 41.71 O ATOM 912 N1 DG D 843 -6.681 -2.348 41.562 1.00 42.78 N ATOM 913 C2 DG D 843 -6.157 -3.608 41.779 1.00 43.93 C ATOM 914 N2 DG D 843 -7.040 -4.574 42.092 1.00 42.43 N ATOM 915 N3 DG D 843 -4.862 -3.899 41.687 1.00 41.14 N ATOM 916 C4 DG D 843 -4.124 -2.808 41.357 1.00 43.42 C ATOM 917 P DC D 844 0.380 -7.042 39.477 1.00 57.55 P ATOM 918 OP1 DC D 844 1.127 -8.273 39.833 1.00 56.71 O ATOM 919 OP2 DC D 844 0.886 -6.144 38.404 1.00 53.74 O ATOM 920 O5' DC D 844 -1.111 -7.431 39.085 1.00 49.27 O ATOM 921 C5' DC D 844 -2.052 -7.453 40.138 1.00 50.22 C ATOM 922 C4' DC D 844 -3.384 -7.988 39.662 1.00 46.40 C ATOM 923 O4' DC D 844 -4.370 -6.938 39.748 1.00 49.71 O ATOM 924 C3' DC D 844 -3.402 -8.519 38.233 1.00 49.20 C ATOM 925 O3' DC D 844 -4.098 -9.765 38.252 1.00 47.56 O ATOM 926 C2' DC D 844 -4.113 -7.422 37.443 1.00 47.73 C ATOM 927 C1' DC D 844 -4.965 -6.726 38.492 1.00 45.58 C ATOM 928 N1 DC D 844 -5.008 -5.268 38.292 1.00 45.49 N ATOM 929 C2 DC D 844 -6.239 -4.635 38.410 1.00 42.13 C ATOM 930 O2 DC D 844 -7.217 -5.342 38.679 1.00 42.92 O ATOM 931 N3 DC D 844 -6.310 -3.293 38.224 1.00 41.56 N ATOM 932 C4 DC D 844 -5.205 -2.606 37.929 1.00 41.57 C ATOM 933 N4 DC D 844 -5.319 -1.282 37.752 1.00 39.30 N ATOM 934 C5 DC D 844 -3.934 -3.248 37.807 1.00 42.50 C ATOM 935 C6 DC D 844 -3.876 -4.570 37.997 1.00 45.31 C ATOM 936 P DT D 845 -4.531 -10.498 36.892 1.00 45.48 P ATOM 937 OP1 DT D 845 -4.687 -11.935 37.250 1.00 49.43 O ATOM 938 OP2 DT D 845 -3.604 -10.093 35.810 1.00 40.83 O ATOM 939 O5' DT D 845 -5.986 -9.890 36.584 1.00 38.78 O ATOM 940 C5' DT D 845 -7.017 -10.035 37.537 1.00 34.94 C ATOM 941 C4' DT D 845 -8.345 -9.670 36.922 1.00 35.47 C ATOM 942 O4' DT D 845 -8.481 -8.229 36.883 1.00 38.49 O ATOM 943 C3' DT D 845 -8.579 -10.165 35.504 0.00 37.20 C ATOM 944 O3' DT D 845 -9.897 -10.629 35.475 1.00 36.65 O ATOM 945 C2' DT D 845 -8.429 -8.916 34.644 1.00 35.88 C ATOM 946 C1' DT D 845 -8.879 -7.814 35.593 1.00 38.03 C ATOM 947 N1 DT D 845 -8.237 -6.484 35.339 1.00 40.24 N ATOM 948 C2 DT D 845 -9.011 -5.342 35.298 1.00 39.14 C ATOM 949 O2 DT D 845 -10.221 -5.348 35.453 1.00 39.51 O ATOM 950 N3 DT D 845 -8.306 -4.183 35.061 1.00 39.72 N ATOM 951 C4 DT D 845 -6.938 -4.063 34.863 1.00 40.28 C ATOM 952 O4 DT D 845 -6.382 -2.987 34.657 1.00 40.48 O ATOM 953 C5 DT D 845 -6.194 -5.293 34.913 1.00 39.01 C ATOM 954 C7 DT D 845 -4.706 -5.275 34.707 1.00 41.59 C ATOM 955 C6 DT D 845 -6.870 -6.423 35.146 1.00 40.28 C ATOM 956 P DC D 846 -10.450 -11.447 34.209 1.00 41.47 P ATOM 957 OP1 DC D 846 -11.388 -12.474 34.697 1.00 36.48 O ATOM 958 OP2 DC D 846 -9.295 -11.860 33.368 1.00 41.04 O ATOM 959 O5' DC D 846 -11.295 -10.354 33.422 1.00 40.81 O ATOM 960 C5' DC D 846 -12.171 -9.502 34.133 1.00 36.60 C ATOM 961 C4' DC D 846 -12.657 -8.475 33.146 1.00 38.79 C ATOM 962 O4' DC D 846 -11.749 -7.349 33.134 1.00 39.76 O ATOM 963 C3' DC D 846 -12.686 -8.985 31.706 1.00 40.69 C ATOM 964 O3' DC D 846 -13.791 -8.401 31.089 0.63 40.42 O ATOM 965 C2' DC D 846 -11.422 -8.394 31.102 1.00 42.02 C ATOM 966 C1' DC D 846 -11.497 -7.032 31.780 1.00 42.95 C ATOM 967 N1 DC D 846 -10.233 -6.268 31.670 1.00 42.82 N ATOM 968 C2 DC D 846 -10.241 -4.867 31.693 1.00 40.45 C ATOM 969 O2 DC D 846 -11.313 -4.257 31.818 1.00 39.56 O ATOM 970 N3 DC D 846 -9.052 -4.226 31.586 1.00 39.60 N ATOM 971 C4 DC D 846 -7.921 -4.924 31.460 1.00 37.00 C ATOM 972 N4 DC D 846 -6.769 -4.257 31.357 1.00 41.06 N ATOM 973 C5 DC D 846 -7.900 -6.342 31.433 1.00 35.73 C ATOM 974 C6 DC D 846 -9.068 -6.969 31.534 1.00 40.05 C ATOM 975 P DT D 847 -14.467 -9.074 29.799 1.00 50.68 P ATOM 976 OP1 DT D 847 -15.342 -10.175 30.282 1.00 47.34 O ATOM 977 OP2 DT D 847 -13.411 -9.391 28.802 1.00 45.26 O ATOM 978 O5' DT D 847 -15.381 -7.882 29.242 1.00 43.02 O ATOM 979 C5' DT D 847 -16.081 -7.076 30.180 1.00 35.06 C ATOM 980 C4' DT D 847 -16.133 -5.651 29.686 1.00 37.08 C ATOM 981 O4' DT D 847 -14.817 -5.052 29.740 0.00 40.13 O ATOM 982 C3' DT D 847 -16.614 -5.514 28.240 1.00 42.01 C ATOM 983 O3' DT D 847 -17.554 -4.418 28.156 1.00 43.75 O ATOM 984 C2' DT D 847 -15.325 -5.287 27.457 1.00 39.20 C ATOM 985 C1' DT D 847 -14.502 -4.508 28.477 1.00 39.15 C ATOM 986 N1 DT D 847 -13.049 -4.668 28.290 1.00 38.95 N ATOM 987 C2 DT D 847 -12.243 -3.561 28.436 1.00 39.19 C ATOM 988 O2 DT D 847 -12.683 -2.454 28.706 1.00 39.35 O ATOM 989 N3 DT D 847 -10.902 -3.815 28.254 1.00 40.23 N ATOM 990 C4 DT D 847 -10.307 -5.038 27.936 1.00 42.65 C ATOM 991 O4 DT D 847 -9.088 -5.177 27.786 1.00 39.26 O ATOM 992 C5 DT D 847 -11.222 -6.151 27.794 1.00 42.42 C ATOM 993 C7 DT D 847 -10.686 -7.518 27.459 1.00 37.14 C ATOM 994 C6 DT D 847 -12.534 -5.913 27.978 1.00 40.22 C ATOM 995 P DC D 848 -18.302 -4.066 26.775 0.64 39.90 P ATOM 996 OP1 DC D 848 -19.692 -3.691 27.101 1.00 42.38 O ATOM 997 OP2 DC D 848 -18.047 -5.118 25.763 1.00 37.32 O ATOM 998 O5' DC D 848 -17.560 -2.748 26.304 1.00 38.20 O ATOM 999 C5' DC D 848 -17.417 -1.675 27.228 1.00 40.19 C ATOM 1000 C4' DC D 848 -16.774 -0.489 26.527 1.00 46.72 C ATOM 1001 O4' DC D 848 -15.326 -0.633 26.533 1.00 46.78 O ATOM 1002 C3' DC D 848 -17.161 -0.323 25.057 1.00 41.46 C ATOM 1003 O3' DC D 848 -17.125 1.055 24.722 0.26 41.42 O ATOM 1004 C2' DC D 848 -16.047 -1.087 24.350 1.00 38.18 C ATOM 1005 C1' DC D 848 -14.875 -0.606 25.195 1.00 38.48 C ATOM 1006 N1 DC D 848 -13.718 -1.485 25.077 1.00 35.56 N ATOM 1007 C2 DC D 848 -12.448 -0.935 25.245 1.00 36.39 C ATOM 1008 O2 DC D 848 -12.337 0.280 25.501 1.00 35.58 O ATOM 1009 N3 DC D 848 -11.389 -1.772 25.122 1.00 36.90 N ATOM 1010 C4 DC D 848 -11.583 -3.070 24.851 1.00 37.44 C ATOM 1011 N4 DC D 848 -10.505 -3.852 24.743 1.00 38.30 N ATOM 1012 C5 DC D 848 -12.880 -3.637 24.675 1.00 34.81 C ATOM 1013 C6 DC D 848 -13.914 -2.806 24.796 1.00 35.95 C ATOM 1014 P DC D 849 -17.743 1.577 23.332 1.00 55.64 P ATOM 1015 OP1 DC D 849 -18.806 2.544 23.688 1.00 51.05 O ATOM 1016 OP2 DC D 849 -18.032 0.414 22.442 1.00 37.08 O ATOM 1017 O5' DC D 849 -16.538 2.381 22.656 1.00 42.11 O ATOM 1018 C5' DC D 849 -15.523 2.980 23.416 1.00 34.71 C ATOM 1019 C4' DC D 849 -14.264 2.957 22.577 1.00 35.03 C ATOM 1020 O4' DC D 849 -13.600 1.692 22.709 1.00 36.15 O ATOM 1021 C3' DC D 849 -14.464 3.127 21.074 1.00 30.71 C ATOM 1022 O3' DC D 849 -13.880 4.364 20.790 0.50 34.01 O ATOM 1023 C2' DC D 849 -13.709 1.975 20.421 0.00 34.18 C ATOM 1024 C1' DC D 849 -12.807 1.557 21.566 1.00 33.42 C ATOM 1025 N1 DC D 849 -12.448 0.154 21.536 1.00 32.60 N ATOM 1026 C2 DC D 849 -11.114 -0.231 21.715 1.00 33.76 C ATOM 1027 O2 DC D 849 -10.237 0.633 21.900 1.00 32.21 O ATOM 1028 N3 DC D 849 -10.823 -1.553 21.679 1.00 33.71 N ATOM 1029 C4 DC D 849 -11.798 -2.443 21.477 1.00 35.20 C ATOM 1030 N4 DC D 849 -11.470 -3.734 21.451 1.00 32.95 N ATOM 1031 C5 DC D 849 -13.159 -2.059 21.290 1.00 36.44 C ATOM 1032 C6 DC D 849 -13.439 -0.753 21.331 1.00 34.58 C ATOM 1033 P DC D 850 -13.828 4.931 19.291 1.00 39.42 P ATOM 1034 OP1 DC D 850 -13.858 6.409 19.425 1.00 30.96 O ATOM 1035 OP2 DC D 850 -14.811 4.220 18.444 1.00 33.22 O ATOM 1036 O5' DC D 850 -12.383 4.486 18.783 1.00 38.42 O ATOM 1037 C5' DC D 850 -11.220 5.085 19.344 1.00 31.90 C ATOM 1038 C4' DC D 850 -10.048 4.358 18.738 1.00 30.97 C ATOM 1039 O4' DC D 850 -10.264 2.957 19.043 1.00 33.53 O ATOM 1040 C3' DC D 850 -9.939 4.434 17.212 1.00 32.78 C ATOM 1041 O3' DC D 850 -8.577 4.684 16.849 1.00 32.72 O ATOM 1042 C2' DC D 850 -10.382 3.033 16.784 1.00 34.90 C ATOM 1043 C1' DC D 850 -9.786 2.235 17.945 1.00 32.53 C ATOM 1044 N1 DC D 850 -10.189 0.801 18.021 1.00 29.11 N ATOM 1045 C2 DC D 850 -9.207 -0.188 18.216 1.00 34.43 C ATOM 1046 O2 DC D 850 -8.016 0.135 18.351 1.00 33.27 O ATOM 1047 N3 DC D 850 -9.581 -1.489 18.271 1.00 35.69 N ATOM 1048 C4 DC D 850 -10.864 -1.815 18.132 1.00 34.06 C ATOM 1049 N4 DC D 850 -11.185 -3.109 18.181 1.00 29.35 N ATOM 1050 C5 DC D 850 -11.865 -0.822 17.923 1.00 35.21 C ATOM 1051 C6 DC D 850 -11.491 0.459 17.876 1.00 30.12 C ATOM 1052 P DG D 851 -8.186 5.261 15.397 1.00 26.46 P ATOM 1053 OP1 DG D 851 -7.728 6.646 15.676 1.00 26.59 O ATOM 1054 OP2 DG D 851 -9.255 4.913 14.427 1.00 28.25 O ATOM 1055 O5' DG D 851 -6.942 4.377 14.926 1.00 30.12 O ATOM 1056 C5' DG D 851 -5.663 4.522 15.541 1.00 32.19 C ATOM 1057 C4' DG D 851 -4.862 3.256 15.322 1.00 29.84 C ATOM 1058 O4' DG D 851 -5.526 2.184 16.032 1.00 36.09 O ATOM 1059 C3' DG D 851 -4.801 2.778 13.884 1.00 33.95 C ATOM 1060 O3' DG D 851 -3.639 3.253 13.265 1.00 35.00 O ATOM 1061 C2' DG D 851 -4.697 1.264 14.006 1.00 37.88 C ATOM 1062 C1' DG D 851 -5.348 0.963 15.345 1.00 35.32 C ATOM 1063 N9 DG D 851 -6.643 0.329 15.190 1.00 32.23 N ATOM 1064 C8 DG D 851 -7.870 0.942 15.126 1.00 33.82 C ATOM 1065 N7 DG D 851 -8.857 0.098 14.986 1.00 36.21 N ATOM 1066 C5 DG D 851 -8.238 -1.149 14.960 1.00 33.89 C ATOM 1067 C6 DG D 851 -8.801 -2.436 14.830 1.00 34.42 C ATOM 1068 O6 DG D 851 -9.998 -2.744 14.705 1.00 36.87 O ATOM 1069 N1 DG D 851 -7.812 -3.418 14.851 1.00 37.25 N ATOM 1070 C2 DG D 851 -6.455 -3.185 14.975 1.00 37.87 C ATOM 1071 N2 DG D 851 -5.655 -4.264 14.968 1.00 35.82 N ATOM 1072 N3 DG D 851 -5.920 -1.978 15.105 1.00 34.90 N ATOM 1073 C4 DG D 851 -6.873 -1.019 15.086 1.00 33.30 C ATOM 1074 P DG D 852 -3.539 3.254 11.665 1.00 38.63 P ATOM 1075 OP1 DG D 852 -2.646 4.381 11.300 1.00 38.28 O ATOM 1076 OP2 DG D 852 -4.905 3.144 11.100 1.00 35.68 O ATOM 1077 O5' DG D 852 -2.854 1.860 11.317 1.00 38.48 O ATOM 1078 C5' DG D 852 -1.808 1.312 12.086 1.00 38.67 C ATOM 1079 C4' DG D 852 -1.629 -0.134 11.652 1.00 39.72 C ATOM 1080 O4' DG D 852 -2.722 -0.956 12.135 1.00 40.80 O ATOM 1081 C3' DG D 852 -1.599 -0.331 10.145 1.00 43.66 C ATOM 1082 O3' DG D 852 -0.589 -1.261 9.842 1.00 51.53 O ATOM 1083 C2' DG D 852 -2.968 -0.903 9.802 1.00 41.67 C ATOM 1084 C1' DG D 852 -3.310 -1.668 11.070 1.00 41.05 C ATOM 1085 N9 DG D 852 -4.749 -1.691 11.258 1.00 39.52 N ATOM 1086 C8 DG D 852 -5.579 -0.602 11.309 1.00 38.81 C ATOM 1087 N7 DG D 852 -6.834 -0.907 11.476 1.00 38.24 N ATOM 1088 C5 DG D 852 -6.839 -2.291 11.528 1.00 37.01 C ATOM 1089 C6 DG D 852 -7.926 -3.181 11.694 1.00 38.22 C ATOM 1090 O6 DG D 852 -9.130 -2.907 11.830 1.00 41.77 O ATOM 1091 N1 DG D 852 -7.498 -4.510 11.691 1.00 39.37 N ATOM 1092 C2 DG D 852 -6.185 -4.917 11.555 1.00 41.58 C ATOM 1093 N2 DG D 852 -5.976 -6.241 11.583 1.00 42.04 N ATOM 1094 N3 DG D 852 -5.151 -4.091 11.404 1.00 40.93 N ATOM 1095 C4 DG D 852 -5.558 -2.794 11.397 1.00 41.64 C ATOM 1096 P DA D 853 -0.175 -1.528 8.314 1.00 65.08 P ATOM 1097 OP1 DA D 853 1.304 -1.715 8.327 1.00 54.10 O ATOM 1098 OP2 DA D 853 -0.852 -0.506 7.467 1.00 54.24 O ATOM 1099 O5' DA D 853 -0.871 -2.919 7.957 1.00 53.40 O ATOM 1100 C5' DA D 853 -0.581 -4.053 8.746 1.00 51.22 C ATOM 1101 C4' DA D 853 -1.335 -5.245 8.198 1.00 53.15 C ATOM 1102 O4' DA D 853 -2.728 -5.204 8.589 1.00 50.36 O ATOM 1103 C3' DA D 853 -1.323 -5.343 6.682 1.00 54.72 C ATOM 1104 O3' DA D 853 -1.107 -6.704 6.386 1.00 64.19 O ATOM 1105 C2' DA D 853 -2.719 -4.884 6.273 1.00 54.60 C ATOM 1106 C1' DA D 853 -3.548 -5.366 7.456 1.00 48.72 C ATOM 1107 N9 DA D 853 -4.731 -4.561 7.693 1.00 44.00 N ATOM 1108 C8 DA D 853 -4.794 -3.203 7.715 1.00 42.33 C ATOM 1109 N7 DA D 853 -5.996 -2.747 7.965 1.00 43.23 N ATOM 1110 C5 DA D 853 -6.770 -3.881 8.121 1.00 40.15 C ATOM 1111 C6 DA D 853 -8.133 -4.073 8.403 1.00 40.28 C ATOM 1112 N6 DA D 853 -9.003 -3.076 8.581 1.00 38.98 N ATOM 1113 N1 DA D 853 -8.576 -5.342 8.495 1.00 43.35 N ATOM 1114 C2 DA D 853 -7.711 -6.348 8.320 1.00 41.74 C ATOM 1115 N3 DA D 853 -6.411 -6.288 8.046 1.00 44.31 N ATOM 1116 C4 DA D 853 -6.001 -5.014 7.959 1.00 44.28 C ATOM 1117 P DG D 854 -0.490 -7.146 4.970 1.00 76.09 P ATOM 1118 OP1 DG D 854 0.597 -8.113 5.264 1.00 67.24 O ATOM 1119 OP2 DG D 854 -0.191 -5.907 4.199 1.00 68.67 O ATOM 1120 O5' DG D 854 -1.716 -7.906 4.265 1.00 65.11 O ATOM 1121 C5' DG D 854 -2.504 -8.804 5.042 1.00 59.39 C ATOM 1122 C4' DG D 854 -3.926 -8.824 4.523 1.00 60.14 C ATOM 1123 O4' DG D 854 -4.705 -7.734 5.071 1.00 57.31 O ATOM 1124 C3' DG D 854 -4.030 -8.682 3.009 1.00 64.31 C ATOM 1125 O3' DG D 854 -4.339 -9.972 2.466 1.00 75.08 O ATOM 1126 C2' DG D 854 -5.149 -7.662 2.792 1.00 55.83 C ATOM 1127 C1' DG D 854 -5.767 -7.512 4.176 1.00 51.43 C ATOM 1128 N9 DG D 854 -6.319 -6.184 4.396 1.00 47.00 N ATOM 1129 C8 DG D 854 -5.662 -4.980 4.302 1.00 47.18 C ATOM 1130 N7 DG D 854 -6.431 -3.955 4.547 1.00 47.27 N ATOM 1131 C5 DG D 854 -7.676 -4.513 4.820 1.00 45.09 C ATOM 1132 C6 DG D 854 -8.912 -3.899 5.158 1.00 42.73 C ATOM 1133 O6 DG D 854 -9.176 -2.692 5.292 1.00 38.26 O ATOM 1134 N1 DG D 854 -9.919 -4.849 5.346 1.00 42.94 N ATOM 1135 C2 DG D 854 -9.754 -6.212 5.226 1.00 43.56 C ATOM 1136 N2 DG D 854 -10.842 -6.968 5.443 1.00 42.75 N ATOM 1137 N3 DG D 854 -8.603 -6.794 4.913 1.00 45.02 N ATOM 1138 C4 DG D 854 -7.616 -5.888 4.726 1.00 45.25 C ATOM 1139 P DG D 855 -4.430 -10.202 0.875 1.00 77.35 P ATOM 1140 OP1 DG D 855 -4.060 -11.611 0.628 1.00 82.44 O ATOM 1141 OP2 DG D 855 -3.673 -9.128 0.186 1.00 68.37 O ATOM 1142 O5' DG D 855 -5.992 -10.028 0.565 1.00 71.41 O ATOM 1143 C5' DG D 855 -6.943 -10.646 1.432 1.00 63.18 C ATOM 1144 C4' DG D 855 -8.313 -10.042 1.204 1.00 62.59 C ATOM 1145 O4' DG D 855 -8.399 -8.732 1.810 1.00 61.45 O ATOM 1146 C3' DG D 855 -8.656 -9.824 -0.263 1.00 66.34 C ATOM 1147 O3' DG D 855 -9.672 -10.752 -0.639 1.00 78.96 O ATOM 1148 C2' DG D 855 -9.143 -8.377 -0.341 1.00 57.89 C ATOM 1149 C1' DG D 855 -9.373 -8.000 1.111 1.00 53.35 C ATOM 1150 N9 DG D 855 -9.142 -6.579 1.321 1.00 48.46 N ATOM 1151 C8 DG D 855 -7.942 -5.918 1.219 1.00 47.74 C ATOM 1152 N7 DG D 855 -8.032 -4.638 1.448 1.00 44.42 N ATOM 1153 C5 DG D 855 -9.382 -4.440 1.705 1.00 43.29 C ATOM 1154 C6 DG D 855 -10.078 -3.246 2.014 1.00 43.63 C ATOM 1155 O6 DG D 855 -9.602 -2.100 2.126 1.00 43.83 O ATOM 1156 N1 DG D 855 -11.446 -3.481 2.208 1.00 40.12 N ATOM 1157 C2 DG D 855 -12.051 -4.714 2.109 1.00 40.59 C ATOM 1158 N2 DG D 855 -13.370 -4.745 2.323 1.00 39.52 N ATOM 1159 N3 DG D 855 -11.409 -5.838 1.816 1.00 44.42 N ATOM 1160 C4 DG D 855 -10.082 -5.625 1.630 1.00 44.89 C ATOM 1161 P DC D 856 -10.295 -10.721 -2.121 1.00 78.74 P ATOM 1162 OP1 DC D 856 -10.926 -12.043 -2.344 1.00 74.31 O ATOM 1163 OP2 DC D 856 -9.258 -10.187 -3.048 1.00 68.95 O ATOM 1164 O5' DC D 856 -11.468 -9.646 -2.016 1.00 64.54 O ATOM 1165 C5' DC D 856 -12.443 -9.813 -1.000 1.00 68.51 C ATOM 1166 C4' DC D 856 -13.651 -8.974 -1.354 1.00 66.27 C ATOM 1167 O4' DC D 856 -13.479 -7.641 -0.805 1.00 64.55 O ATOM 1168 C3' DC D 856 -13.854 -8.836 -2.862 1.00 66.65 C ATOM 1169 O3' DC D 856 -15.230 -9.067 -3.218 1.00 73.62 O ATOM 1170 C2' DC D 856 -13.387 -7.411 -3.150 1.00 64.41 C ATOM 1171 C1' DC D 856 -13.620 -6.677 -1.830 1.00 61.44 C ATOM 1172 N1 DC D 856 -12.638 -5.565 -1.634 1.00 50.48 N ATOM 1173 C2 DC D 856 -13.082 -4.291 -1.245 1.00 47.85 C ATOM 1174 O2 DC D 856 -14.291 -4.086 -1.046 1.00 45.56 O ATOM 1175 N3 DC D 856 -12.152 -3.310 -1.094 1.00 47.67 N ATOM 1176 C4 DC D 856 -10.855 -3.555 -1.316 1.00 44.61 C ATOM 1177 N4 DC D 856 -9.990 -2.552 -1.146 1.00 40.10 N ATOM 1178 C5 DC D 856 -10.394 -4.844 -1.719 1.00 47.58 C ATOM 1179 C6 DC D 856 -11.314 -5.804 -1.867 1.00 47.92 C ATOM 1180 P DG D 857 -15.693 -9.118 -4.763 1.00 83.83 P ATOM 1181 OP1 DG D 857 -16.585 -10.294 -4.892 1.00 83.57 O ATOM 1182 OP2 DG D 857 -14.506 -8.985 -5.654 1.00 68.39 O ATOM 1183 O5' DG D 857 -16.593 -7.805 -4.928 1.00 66.79 O ATOM 1184 C5' DG D 857 -17.613 -7.512 -3.966 1.00 68.48 C ATOM 1185 C4' DG D 857 -18.313 -6.190 -4.258 1.00 69.19 C ATOM 1186 O4' DG D 857 -17.479 -5.052 -3.900 1.00 63.75 O ATOM 1187 C3' DG D 857 -18.677 -5.965 -5.719 1.00 67.26 C ATOM 1188 O3' DG D 857 -19.833 -5.143 -5.774 1.00 61.98 O ATOM 1189 C2' DG D 857 -17.433 -5.264 -6.268 1.00 62.43 C ATOM 1190 C1' DG D 857 -17.022 -4.402 -5.075 1.00 58.95 C ATOM 1191 N9 DG D 857 -15.579 -4.171 -4.973 1.00 56.49 N ATOM 1192 C8 DG D 857 -14.539 -5.041 -5.221 1.00 54.92 C ATOM 1193 N7 DG D 857 -13.357 -4.510 -5.033 1.00 49.69 N ATOM 1194 C5 DG D 857 -13.636 -3.205 -4.634 1.00 48.07 C ATOM 1195 C6 DG D 857 -12.763 -2.140 -4.292 1.00 46.93 C ATOM 1196 O6 DG D 857 -11.516 -2.156 -4.271 1.00 45.87 O ATOM 1197 N1 DG D 857 -13.475 -0.980 -3.950 1.00 39.93 N ATOM 1198 C2 DG D 857 -14.857 -0.876 -3.949 1.00 45.57 C ATOM 1199 N2 DG D 857 -15.398 0.307 -3.613 1.00 41.08 N ATOM 1200 N3 DG D 857 -15.679 -1.867 -4.266 1.00 47.09 N ATOM 1201 C4 DG D 857 -14.997 -2.988 -4.595 1.00 49.88 C TER 1202 DG D 857 ATOM 1203 N LYS B 419 -22.215 12.671 17.206 1.00 38.94 N ATOM 1204 CA LYS B 419 -23.010 12.046 16.149 1.00 41.11 C ATOM 1205 C LYS B 419 -22.520 12.417 14.741 1.00 32.48 C ATOM 1206 O LYS B 419 -22.597 11.593 13.829 1.00 36.82 O ATOM 1207 CB LYS B 419 -24.505 12.392 16.306 1.00 39.52 C ATOM 1208 CG LYS B 419 -25.461 11.406 15.617 1.00 39.94 C ATOM 1209 CD LYS B 419 -26.925 11.782 15.851 1.00 44.98 C ATOM 1210 CE LYS B 419 -27.282 11.772 17.336 1.00 44.53 C ATOM 1211 NZ LYS B 419 -27.170 10.405 17.911 1.00 50.64 N ATOM 1212 N LEU B 420 -22.022 13.645 14.566 1.00 28.93 N ATOM 1213 CA LEU B 420 -21.646 14.153 13.229 1.00 31.03 C ATOM 1214 C LEU B 420 -20.144 14.270 12.931 1.00 29.92 C ATOM 1215 O LEU B 420 -19.356 14.698 13.786 1.00 32.31 O ATOM 1216 CB LEU B 420 -22.309 15.504 12.954 1.00 27.06 C ATOM 1217 CG LEU B 420 -23.818 15.435 12.733 1.00 27.47 C ATOM 1218 CD1 LEU B 420 -24.310 16.755 12.200 1.00 26.30 C ATOM 1219 CD2 LEU B 420 -24.168 14.297 11.790 1.00 27.87 C ATOM 1220 N CYS B 421 -19.760 13.918 11.705 1.00 26.04 N ATOM 1221 CA CYS B 421 -18.354 13.951 11.318 1.00 25.33 C ATOM 1222 C CYS B 421 -17.855 15.389 11.146 1.00 24.20 C ATOM 1223 O CYS B 421 -18.406 16.167 10.371 1.00 26.98 O ATOM 1224 CB CYS B 421 -18.098 13.102 10.058 1.00 24.83 C ATOM 1225 SG CYS B 421 -16.538 13.483 9.151 1.00 22.69 S ATOM 1226 N LEU B 422 -16.808 15.730 11.881 1.00 20.70 N ATOM 1227 CA LEU B 422 -16.240 17.065 11.846 1.00 21.35 C ATOM 1228 C LEU B 422 -15.686 17.494 10.474 1.00 25.79 C ATOM 1229 O LEU B 422 -15.372 18.668 10.268 1.00 27.64 O ATOM 1230 CB LEU B 422 -15.169 17.198 12.924 1.00 20.62 C ATOM 1231 CG LEU B 422 -15.595 17.989 14.160 1.00 23.52 C ATOM 1232 CD1 LEU B 422 -17.017 17.714 14.492 1.00 24.22 C ATOM 1233 CD2 LEU B 422 -14.718 17.646 15.347 1.00 24.37 C ATOM 1234 N VAL B 423 -15.582 16.564 9.529 1.00 25.21 N ATOM 1235 CA VAL B 423 -15.075 16.915 8.199 1.00 22.20 C ATOM 1236 C VAL B 423 -16.169 17.053 7.141 1.00 19.31 C ATOM 1237 O VAL B 423 -16.119 17.964 6.323 1.00 21.42 O ATOM 1238 CB VAL B 423 -13.990 15.916 7.707 1.00 21.59 C ATOM 1239 CG1 VAL B 423 -13.658 16.139 6.242 1.00 17.41 C ATOM 1240 CG2 VAL B 423 -12.749 16.044 8.553 0.82 21.46 C ATOM 1241 N CYS B 424 -17.159 16.165 7.159 1.00 22.74 N ATOM 1242 CA CYS B 424 -18.191 16.150 6.112 1.00 24.29 C ATOM 1243 C CYS B 424 -19.632 16.146 6.648 1.00 26.65 C ATOM 1244 O CYS B 424 -20.585 16.307 5.882 1.00 28.60 O ATOM 1245 CB CYS B 424 -17.976 14.963 5.153 1.00 22.72 C ATOM 1246 SG CYS B 424 -18.447 13.322 5.823 1.00 22.49 S ATOM 1247 N SER B 425 -19.775 15.942 7.957 1.00 28.33 N ATOM 1248 CA SER B 425 -21.075 15.893 8.643 1.00 27.18 C ATOM 1249 C SER B 425 -21.961 14.673 8.368 1.00 30.61 C ATOM 1250 O SER B 425 -23.128 14.664 8.749 1.00 36.05 O ATOM 1251 CB SER B 425 -21.862 17.181 8.429 1.00 27.14 C ATOM 1252 OG SER B 425 -21.070 18.294 8.800 1.00 31.03 O ATOM 1253 N ASP B 426 -21.413 13.642 7.731 1.00 28.05 N ATOM 1254 CA ASP B 426 -22.050 12.329 7.730 1.00 26.59 C ATOM 1255 C ASP B 426 -22.140 11.846 9.183 1.00 30.00 C ATOM 1256 O ASP B 426 -21.557 12.464 10.073 1.00 30.42 O ATOM 1257 CB ASP B 426 -21.207 11.361 6.913 1.00 29.16 C ATOM 1258 CG ASP B 426 -22.021 10.237 6.317 1.00 32.04 C ATOM 1259 OD1 ASP B 426 -23.211 10.108 6.677 1.00 38.02 O ATOM 1260 OD2 ASP B 426 -21.464 9.476 5.500 1.00 30.24 O ATOM 1261 N GLU B 427 -22.857 10.756 9.454 1.00 31.30 N ATOM 1262 CA GLU B 427 -22.943 10.305 10.846 1.00 31.97 C ATOM 1263 C GLU B 427 -21.612 9.710 11.275 1.00 33.05 C ATOM 1264 O GLU B 427 -21.084 8.819 10.605 1.00 32.82 O ATOM 1265 CB GLU B 427 -24.064 9.300 11.070 1.00 31.34 C ATOM 1266 CG GLU B 427 -24.333 9.064 12.534 0.00 35.82 C ATOM 1267 CD GLU B 427 -24.860 7.686 12.788 0.00 39.45 C ATOM 1268 OE1 GLU B 427 -25.370 7.078 11.825 1.00 41.49 O ATOM 1269 OE2 GLU B 427 -24.749 7.214 13.938 1.00 48.50 O ATOM 1270 N ALA B 428 -21.069 10.214 12.383 1.00 32.28 N ATOM 1271 CA ALA B 428 -19.722 9.852 12.827 1.00 29.70 C ATOM 1272 C ALA B 428 -19.681 8.459 13.436 1.00 28.84 C ATOM 1273 O ALA B 428 -20.602 8.063 14.146 1.00 29.17 O ATOM 1274 CB ALA B 428 -19.207 10.870 13.816 1.00 28.05 C ATOM 1275 N SER B 429 -18.603 7.726 13.169 1.00 27.81 N ATOM 1276 CA SER B 429 -18.489 6.339 13.621 1.00 28.14 C ATOM 1277 C SER B 429 -17.497 6.143 14.770 1.00 27.80 C ATOM 1278 O SER B 429 -17.088 5.018 15.064 0.69 30.40 O ATOM 1279 CB SER B 429 -18.098 5.431 12.457 1.00 27.41 C ATOM 1280 OG SER B 429 -16.707 5.493 12.224 1.00 27.18 O ATOM 1281 N GLY B 430 -17.115 7.235 15.419 1.00 26.85 N ATOM 1282 CA GLY B 430 -16.134 7.178 16.479 1.00 22.49 C ATOM 1283 C GLY B 430 -15.147 8.321 16.380 1.00 27.79 C ATOM 1284 O GLY B 430 -15.292 9.218 15.545 1.00 28.25 O ATOM 1285 N CYS B 431 -14.141 8.281 17.248 1.00 32.01 N ATOM 1286 CA CYS B 431 -13.059 9.255 17.280 1.00 26.60 C ATOM 1287 C CYS B 431 -11.865 8.699 16.514 1.00 28.65 C ATOM 1288 O CYS B 431 -11.197 7.781 16.985 1.00 31.61 O ATOM 1289 CB CYS B 431 -12.660 9.504 18.733 1.00 28.30 C ATOM 1290 SG CYS B 431 -11.426 10.796 18.981 1.00 41.57 S ATOM 1291 N HIS B 432 -11.592 9.244 15.333 1.00 26.82 N ATOM 1292 CA HIS B 432 -10.546 8.691 14.482 1.00 26.63 C ATOM 1293 C HIS B 432 -9.397 9.658 14.220 1.00 26.77 C ATOM 1294 O HIS B 432 -9.620 10.793 13.820 1.00 22.86 O ATOM 1295 CB HIS B 432 -11.147 8.214 13.174 1.00 24.65 C ATOM 1296 CG HIS B 432 -12.262 7.235 13.357 1.00 27.28 C ATOM 1297 ND1 HIS B 432 -12.117 6.074 14.082 1.00 29.75 N ATOM 1298 CD2 HIS B 432 -13.539 7.239 12.905 1.00 25.57 C ATOM 1299 CE1 HIS B 432 -13.255 5.402 14.066 1.00 31.05 C ATOM 1300 NE2 HIS B 432 -14.134 6.089 13.358 1.00 28.14 N ATOM 1301 N TYR B 433 -8.173 9.176 14.452 1.00 25.44 N ATOM 1302 CA TYR B 433 -6.949 9.962 14.348 1.00 21.35 C ATOM 1303 C TYR B 433 -7.112 11.311 15.029 1.00 24.56 C ATOM 1304 O TYR B 433 -6.668 12.349 14.523 1.00 24.66 O ATOM 1305 CB TYR B 433 -6.523 10.136 12.895 1.00 22.46 C ATOM 1306 CG TYR B 433 -6.459 8.849 12.116 1.00 23.97 C ATOM 1307 CD1 TYR B 433 -5.645 7.804 12.531 1.00 24.60 C ATOM 1308 CD2 TYR B 433 -7.206 8.680 10.952 1.00 23.11 C ATOM 1309 CE1 TYR B 433 -5.579 6.622 11.822 1.00 24.71 C ATOM 1310 CE2 TYR B 433 -7.144 7.500 10.227 1.00 24.23 C ATOM 1311 CZ TYR B 433 -6.330 6.470 10.672 1.00 25.87 C ATOM 1312 OH TYR B 433 -6.268 5.287 9.967 1.00 28.70 O ATOM 1313 N GLY B 434 -7.780 11.283 16.175 1.00 23.53 N ATOM 1314 CA GLY B 434 -7.900 12.444 17.030 1.00 22.95 C ATOM 1315 C GLY B 434 -9.245 13.140 16.999 1.00 22.59 C ATOM 1316 O GLY B 434 -9.574 13.886 17.904 1.00 26.77 O ATOM 1317 N VAL B 435 -10.032 12.902 15.961 1.00 22.28 N ATOM 1318 CA VAL B 435 -11.187 13.743 15.697 1.00 22.87 C ATOM 1319 C VAL B 435 -12.444 12.919 15.493 1.00 21.93 C ATOM 1320 O VAL B 435 -12.381 11.835 14.930 1.00 27.04 O ATOM 1321 CB VAL B 435 -10.939 14.561 14.406 1.00 26.31 C ATOM 1322 CG1 VAL B 435 -12.005 15.638 14.221 1.00 26.52 C ATOM 1323 CG2 VAL B 435 -9.550 15.177 14.427 1.00 22.46 C ATOM 1324 N LEU B 436 -13.587 13.442 15.920 1.00 24.44 N ATOM 1325 CA LEU B 436 -14.882 12.805 15.634 1.00 26.90 C ATOM 1326 C LEU B 436 -15.158 12.759 14.124 1.00 26.78 C ATOM 1327 O LEU B 436 -15.267 13.797 13.474 1.00 26.47 O ATOM 1328 CB LEU B 436 -16.008 13.555 16.338 1.00 25.00 C ATOM 1329 CG LEU B 436 -17.359 12.853 16.347 1.00 30.63 C ATOM 1330 CD1 LEU B 436 -17.207 11.450 16.935 1.00 28.36 C ATOM 1331 CD2 LEU B 436 -18.403 13.674 17.118 1.00 27.01 C ATOM 1332 N THR B 437 -15.299 11.560 13.574 1.00 23.68 N ATOM 1333 CA THR B 437 -15.186 11.388 12.138 1.00 25.43 C ATOM 1334 C THR B 437 -16.072 10.232 11.662 1.00 28.87 C ATOM 1335 O THR B 437 -16.450 9.378 12.461 1.00 30.70 O ATOM 1336 CB THR B 437 -13.683 11.163 11.787 1.00 29.05 C ATOM 1337 OG1 THR B 437 -13.196 12.240 10.980 1.00 32.53 O ATOM 1338 CG2 THR B 437 -13.439 9.866 11.085 1.00 23.16 C ATOM 1339 N CYS B 438 -16.442 10.231 10.383 1.00 25.70 N ATOM 1340 CA CYS B 438 -17.185 9.120 9.811 1.00 25.29 C ATOM 1341 C CYS B 438 -16.213 8.059 9.338 1.00 25.79 C ATOM 1342 O CYS B 438 -15.028 8.325 9.193 1.00 25.18 O ATOM 1343 CB CYS B 438 -18.054 9.574 8.636 1.00 25.59 C ATOM 1344 SG CYS B 438 -17.169 10.132 7.137 1.00 22.94 S ATOM 1345 N GLY B 439 -16.716 6.860 9.075 1.00 22.82 N ATOM 1346 CA GLY B 439 -15.877 5.812 8.543 1.00 20.23 C ATOM 1347 C GLY B 439 -15.091 6.249 7.319 1.00 26.46 C ATOM 1348 O GLY B 439 -13.866 6.104 7.284 1.00 23.43 O ATOM 1349 N SER B 440 -15.775 6.816 6.328 1.00 25.15 N ATOM 1350 CA SER B 440 -15.120 7.091 5.059 1.00 23.86 C ATOM 1351 C SER B 440 -14.012 8.142 5.155 1.00 22.46 C ATOM 1352 O SER B 440 -13.013 8.047 4.444 1.00 24.82 O ATOM 1353 CB SER B 440 -16.130 7.418 3.952 1.00 26.91 C ATOM 1354 OG SER B 440 -16.802 8.624 4.216 1.00 24.69 O ATOM 1355 N CYS B 441 -14.158 9.121 6.037 1.00 19.88 N ATOM 1356 CA CYS B 441 -13.108 10.140 6.192 1.00 22.44 C ATOM 1357 C CYS B 441 -11.862 9.592 6.907 1.00 24.48 C ATOM 1358 O CYS B 441 -10.721 10.005 6.620 1.00 19.38 O ATOM 1359 CB CYS B 441 -13.629 11.403 6.905 1.00 21.12 C ATOM 1360 SG CYS B 441 -14.642 12.539 5.867 1.00 25.59 S ATOM 1361 N LYS B 442 -12.094 8.670 7.841 1.00 23.57 N ATOM 1362 CA LYS B 442 -11.007 7.969 8.487 1.00 22.08 C ATOM 1363 C LYS B 442 -10.144 7.284 7.437 1.00 21.85 C ATOM 1364 O LYS B 442 -8.926 7.485 7.391 1.00 20.38 O ATOM 1365 CB LYS B 442 -11.529 6.933 9.485 1.00 21.81 C ATOM 1366 CG LYS B 442 -10.473 5.912 9.786 1.00 23.42 C ATOM 1367 CD LYS B 442 -10.718 5.108 11.027 1.00 30.08 C ATOM 1368 CE LYS B 442 -9.550 4.131 11.252 1.00 27.66 C ATOM 1369 NZ LYS B 442 -9.734 3.295 12.468 1.00 31.27 N ATOM 1370 N VAL B 443 -10.784 6.484 6.584 1.00 22.18 N ATOM 1371 CA VAL B 443 -10.045 5.720 5.582 1.00 24.19 C ATOM 1372 C VAL B 443 -9.420 6.643 4.560 1.00 24.54 C ATOM 1373 O VAL B 443 -8.286 6.410 4.130 1.00 28.44 O ATOM 1374 CB VAL B 443 -10.880 4.569 4.897 1.00 24.67 C ATOM 1375 CG1 VAL B 443 -12.346 4.794 5.030 1.00 29.16 C ATOM 1376 CG2 VAL B 443 -10.541 4.447 3.438 1.00 29.48 C ATOM 1377 N PHE B 444 -10.146 7.697 4.189 1.00 23.39 N ATOM 1378 CA PHE B 444 -9.630 8.688 3.242 1.00 21.72 C ATOM 1379 C PHE B 444 -8.354 9.353 3.746 1.00 21.56 C ATOM 1380 O PHE B 444 -7.379 9.494 3.006 1.00 22.63 O ATOM 1381 CB PHE B 444 -10.677 9.757 2.950 1.00 21.72 C ATOM 1382 CG PHE B 444 -10.131 10.965 2.238 1.00 20.64 C ATOM 1383 CD1 PHE B 444 -10.018 10.977 0.859 1.00 22.37 C ATOM 1384 CD2 PHE B 444 -9.739 12.092 2.948 1.00 19.96 C ATOM 1385 CE1 PHE B 444 -9.513 12.088 0.204 1.00 23.92 C ATOM 1386 CE2 PHE B 444 -9.234 13.201 2.305 1.00 18.22 C ATOM 1387 CZ PHE B 444 -9.126 13.205 0.929 1.00 20.90 C ATOM 1388 N PHE B 445 -8.369 9.770 5.003 1.00 19.57 N ATOM 1389 CA PHE B 445 -7.215 10.419 5.584 1.00 19.88 C ATOM 1390 C PHE B 445 -5.992 9.503 5.640 1.00 23.87 C ATOM 1391 O PHE B 445 -4.877 9.912 5.296 1.00 22.58 O ATOM 1392 CB PHE B 445 -7.546 10.900 6.979 1.00 21.02 C ATOM 1393 CG PHE B 445 -6.462 11.708 7.597 1.00 20.92 C ATOM 1394 CD1 PHE B 445 -6.083 12.913 7.033 1.00 24.68 C ATOM 1395 CD2 PHE B 445 -5.827 11.280 8.747 1.00 22.44 C ATOM 1396 CE1 PHE B 445 -5.070 13.681 7.607 1.00 27.34 C ATOM 1397 CE2 PHE B 445 -4.819 12.040 9.331 1.00 24.91 C ATOM 1398 CZ PHE B 445 -4.436 13.239 8.753 1.00 25.01 C ATOM 1399 N LYS B 446 -6.202 8.273 6.096 1.00 22.33 N ATOM 1400 CA LYS B 446 -5.128 7.293 6.139 1.00 22.94 C ATOM 1401 C LYS B 446 -4.502 7.145 4.754 1.00 23.38 C ATOM 1402 O LYS B 446 -3.294 7.288 4.588 1.00 24.80 O ATOM 1403 CB LYS B 446 -5.654 5.960 6.665 1.00 25.31 C ATOM 1404 CG LYS B 446 -4.655 4.833 6.665 1.00 25.58 C ATOM 1405 CD LYS B 446 -3.519 5.078 7.619 1.00 31.32 C ATOM 1406 CE LYS B 446 -2.679 3.810 7.754 1.00 34.08 C ATOM 1407 NZ LYS B 446 -1.624 3.957 8.789 1.00 34.64 N ATOM 1408 N ARG B 447 -5.335 6.913 3.751 1.00 21.13 N ATOM 1409 CA ARG B 447 -4.850 6.801 2.386 1.00 23.79 C ATOM 1410 C ARG B 447 -4.158 8.082 1.887 1.00 27.65 C ATOM 1411 O ARG B 447 -3.137 8.017 1.189 1.00 26.02 O ATOM 1412 CB ARG B 447 -5.989 6.374 1.448 1.00 23.15 C ATOM 1413 CG ARG B 447 -6.457 4.951 1.690 1.00 22.03 C ATOM 1414 CD ARG B 447 -7.773 4.619 0.987 1.00 25.97 C ATOM 1415 NE ARG B 447 -8.069 3.187 1.102 1.00 28.83 N ATOM 1416 CZ ARG B 447 -9.242 2.624 0.827 1.00 29.58 C ATOM 1417 NH1 ARG B 447 -10.261 3.367 0.423 1.00 31.13 N ATOM 1418 NH2 ARG B 447 -9.398 1.313 0.965 1.00 31.88 N ATOM 1419 N ALA B 448 -4.712 9.239 2.253 1.00 26.92 N ATOM 1420 CA ALA B 448 -4.155 10.526 1.840 1.00 24.33 C ATOM 1421 C ALA B 448 -2.727 10.753 2.370 1.00 28.35 C ATOM 1422 O ALA B 448 -1.838 11.180 1.623 1.00 32.82 O ATOM 1423 CB ALA B 448 -5.059 11.644 2.267 1.00 19.85 C ATOM 1424 N VAL B 449 -2.504 10.467 3.651 1.00 26.80 N ATOM 1425 CA VAL B 449 -1.167 10.610 4.218 1.00 30.16 C ATOM 1426 C VAL B 449 -0.187 9.540 3.709 1.00 32.52 C ATOM 1427 O VAL B 449 0.814 9.879 3.077 1.00 35.42 O ATOM 1428 CB VAL B 449 -1.176 10.625 5.757 1.00 27.44 C ATOM 1429 CG1 VAL B 449 0.198 10.970 6.266 1.00 26.12 C ATOM 1430 CG2 VAL B 449 -2.176 11.632 6.264 1.00 25.70 C ATOM 1431 N GLU B 450 -0.478 8.263 3.970 1.00 31.04 N ATOM 1432 CA GLU B 450 0.412 7.170 3.550 1.00 32.67 C ATOM 1433 C GLU B 450 0.709 7.197 2.052 1.00 33.83 C ATOM 1434 O GLU B 450 1.863 7.155 1.648 1.00 41.24 O ATOM 1435 CB GLU B 450 -0.128 5.786 3.944 1.00 29.04 C ATOM 1436 CG GLU B 450 -0.653 5.673 5.362 1.00 28.80 C ATOM 1437 CD GLU B 450 0.423 5.615 6.419 0.00 33.95 C ATOM 1438 OE1 GLU B 450 0.283 4.764 7.309 1.00 39.64 O ATOM 1439 OE2 GLU B 450 1.385 6.413 6.387 1.00 37.21 O ATOM 1440 N GLY B 451 -0.326 7.288 1.231 1.00 34.38 N ATOM 1441 CA GLY B 451 -0.143 7.250 -0.209 1.00 37.51 C ATOM 1442 C GLY B 451 0.563 8.477 -0.753 1.00 39.96 C ATOM 1443 O GLY B 451 0.897 8.535 -1.939 1.00 41.16 O ATOM 1444 N GLN B 452 0.784 9.457 0.118 1.00 37.40 N ATOM 1445 CA GLN B 452 1.422 10.716 -0.256 0.38 40.32 C ATOM 1446 C GLN B 452 0.957 11.208 -1.616 1.00 41.80 C ATOM 1447 O GLN B 452 1.754 11.637 -2.442 1.00 45.10 O ATOM 1448 CB GLN B 452 2.942 10.590 -0.210 1.00 40.58 C ATOM 1449 CG GLN B 452 3.448 10.215 1.163 1.00 39.47 C ATOM 1450 CD GLN B 452 4.823 9.644 1.121 0.00 40.00 C ATOM 1451 OE1 GLN B 452 5.542 9.828 0.151 1.00 35.05 O ATOM 1452 NE2 GLN B 452 5.199 8.934 2.167 1.00 40.95 N ATOM 1453 N HIS B 453 -0.344 11.100 -1.849 1.00 43.66 N ATOM 1454 CA HIS B 453 -0.956 11.761 -2.976 1.00 43.73 C ATOM 1455 C HIS B 453 -0.794 13.239 -2.701 0.00 41.53 C ATOM 1456 O HIS B 453 -0.721 13.670 -1.554 1.00 37.45 O ATOM 1457 CB HIS B 453 -2.445 11.415 -3.058 1.00 41.18 C ATOM 1458 CG HIS B 453 -2.734 9.947 -2.953 1.00 44.52 C ATOM 1459 ND1 HIS B 453 -3.844 9.453 -2.300 1.00 41.22 N ATOM 1460 CD2 HIS B 453 -2.064 8.869 -3.422 1.00 47.43 C ATOM 1461 CE1 HIS B 453 -3.843 8.134 -2.368 1.00 41.86 C ATOM 1462 NE2 HIS B 453 -2.774 7.753 -3.044 1.00 48.16 N ATOM 1463 N ASN B 454 -0.706 14.027 -3.752 1.00 42.34 N ATOM 1464 CA ASN B 454 -0.744 15.462 -3.574 1.00 43.77 C ATOM 1465 C ASN B 454 -1.867 15.933 -4.451 0.00 36.73 C ATOM 1466 O ASN B 454 -1.859 15.742 -5.661 1.00 35.55 O ATOM 1467 CB ASN B 454 0.588 16.108 -3.939 1.00 44.71 C ATOM 1468 CG ASN B 454 1.267 15.411 -5.103 1.00 52.37 C ATOM 1469 OD1 ASN B 454 0.645 14.603 -5.802 1.00 55.99 O ATOM 1470 ND2 ASN B 454 2.546 15.719 -5.321 1.00 48.23 N ATOM 1471 N TYR B 455 -2.872 16.496 -3.814 1.00 32.31 N ATOM 1472 CA TYR B 455 -4.111 16.807 -4.496 1.00 28.97 C ATOM 1473 C TYR B 455 -4.103 18.247 -4.992 1.00 27.81 C ATOM 1474 O TYR B 455 -3.156 18.988 -4.751 1.00 37.82 O ATOM 1475 CB TYR B 455 -5.273 16.594 -3.537 1.00 24.51 C ATOM 1476 CG TYR B 455 -5.457 15.169 -3.058 1.00 24.48 C ATOM 1477 CD1 TYR B 455 -5.687 14.140 -3.959 1.00 24.50 C ATOM 1478 CD2 TYR B 455 -5.445 14.861 -1.700 1.00 21.79 C ATOM 1479 CE1 TYR B 455 -5.883 12.842 -3.529 1.00 24.77 C ATOM 1480 CE2 TYR B 455 -5.649 13.573 -1.258 1.00 23.58 C ATOM 1481 CZ TYR B 455 -5.864 12.559 -2.180 1.00 27.71 C ATOM 1482 OH TYR B 455 -6.071 11.257 -1.759 1.00 29.49 O ATOM 1483 N LEU B 456 -5.167 18.646 -5.669 1.00 22.19 N ATOM 1484 CA LEU B 456 -5.242 19.974 -6.255 1.00 23.78 C ATOM 1485 C LEU B 456 -6.663 20.499 -6.341 1.00 25.84 C ATOM 1486 O LEU B 456 -7.506 19.884 -6.986 1.00 33.68 O ATOM 1487 CB LEU B 456 -4.684 19.918 -7.663 1.00 27.85 C ATOM 1488 CG LEU B 456 -3.234 20.315 -7.778 1.00 29.32 C ATOM 1489 CD1 LEU B 456 -2.875 20.363 -9.238 1.00 34.79 C ATOM 1490 CD2 LEU B 456 -3.107 21.670 -7.133 1.00 31.09 C ATOM 1491 N CYS B 457 -6.948 21.637 -5.722 1.00 22.00 N ATOM 1492 CA CYS B 457 -8.282 22.193 -5.873 1.00 22.82 C ATOM 1493 C CYS B 457 -8.470 22.797 -7.264 1.00 28.37 C ATOM 1494 O CYS B 457 -7.614 23.557 -7.738 1.00 30.77 O ATOM 1495 CB CYS B 457 -8.599 23.224 -4.802 1.00 22.01 C ATOM 1496 SG CYS B 457 -10.358 23.636 -4.770 1.00 20.77 S ATOM 1497 N ALA B 458 -9.588 22.454 -7.911 1.00 26.45 N ATOM 1498 CA ALA B 458 -9.946 23.035 -9.204 1.00 24.46 C ATOM 1499 C ALA B 458 -10.743 24.336 -9.062 1.00 23.38 C ATOM 1500 O ALA B 458 -10.991 25.021 -10.049 1.00 21.42 O ATOM 1501 CB ALA B 458 -10.712 22.042 -10.039 1.00 23.07 C ATOM 1502 N GLY B 459 -11.145 24.671 -7.840 1.00 23.41 N ATOM 1503 CA GLY B 459 -11.894 25.893 -7.598 1.00 28.61 C ATOM 1504 C GLY B 459 -11.056 26.921 -6.864 1.00 30.07 C ATOM 1505 O GLY B 459 -9.890 27.123 -7.201 1.00 34.03 O ATOM 1506 N ASP B 460 -11.672 27.601 -5.901 1.00 31.94 N ATOM 1507 CA ASP B 460 -10.956 28.301 -4.840 1.00 33.62 C ATOM 1508 C ASP B 460 -10.792 27.218 -3.806 1.00 36.19 C ATOM 1509 O ASP B 460 -11.620 26.303 -3.744 1.00 43.00 O ATOM 1510 CB ASP B 460 -11.844 29.381 -4.228 1.00 40.20 C ATOM 1511 CG ASP B 460 -11.320 30.789 -4.454 1.00 45.06 C ATOM 1512 OD1 ASP B 460 -10.120 30.953 -4.768 1.00 41.78 O ATOM 1513 OD2 ASP B 460 -12.125 31.738 -4.295 1.00 48.18 O ATOM 1514 N ASN B 461 -9.783 27.295 -2.958 1.00 30.65 N ATOM 1515 CA ASN B 461 -9.675 26.261 -1.934 1.00 27.82 C ATOM 1516 C ASN B 461 -10.770 26.403 -0.880 1.00 27.27 C ATOM 1517 O ASN B 461 -10.495 26.450 0.316 1.00 27.17 O ATOM 1518 CB ASN B 461 -8.275 26.234 -1.314 1.00 26.81 C ATOM 1519 CG ASN B 461 -7.198 25.843 -2.328 1.00 31.47 C ATOM 1520 OD1 ASN B 461 -6.719 26.685 -3.100 1.00 31.44 O ATOM 1521 ND2 ASN B 461 -6.824 24.559 -2.340 1.00 24.54 N ATOM 1522 N ARG B 462 -12.017 26.456 -1.346 1.00 31.42 N ATOM 1523 CA ARG B 462 -13.180 26.704 -0.498 1.00 31.56 C ATOM 1524 C ARG B 462 -14.278 25.692 -0.754 1.00 30.13 C ATOM 1525 O ARG B 462 -15.421 25.952 -0.392 1.00 30.23 O ATOM 1526 CB ARG B 462 -13.805 28.071 -0.810 1.00 35.40 C ATOM 1527 CG ARG B 462 -13.056 29.303 -0.355 1.00 39.02 C ATOM 1528 CD ARG B 462 -13.956 30.540 -0.501 1.00 41.50 C ATOM 1529 NE ARG B 462 -14.382 30.794 -1.884 1.00 48.74 N ATOM 1530 CZ ARG B 462 -15.650 30.765 -2.317 1.00 53.29 C ATOM 1531 NH1 ARG B 462 -16.657 30.504 -1.475 1.00 45.17 N ATOM 1532 NH2 ARG B 462 -15.919 31.023 -3.598 1.00 46.21 N ATOM 1533 N CYS B 463 -13.960 24.571 -1.400 1.00 26.44 N ATOM 1534 CA CYS B 463 -14.981 23.586 -1.794 1.00 23.09 C ATOM 1535 C CYS B 463 -15.845 23.100 -0.640 1.00 20.83 C ATOM 1536 O CYS B 463 -15.379 23.034 0.486 1.00 25.36 O ATOM 1537 CB CYS B 463 -14.343 22.376 -2.465 1.00 19.22 C ATOM 1538 SG CYS B 463 -13.745 22.679 -4.114 1.00 23.29 S ATOM 1539 N ILE B 464 -17.098 22.750 -0.937 1.00 18.45 N ATOM 1540 CA ILE B 464 -18.036 22.210 0.047 1.00 16.98 C ATOM 1541 C ILE B 464 -17.905 20.697 0.198 1.00 19.82 C ATOM 1542 O ILE B 464 -18.084 19.940 -0.766 1.00 21.41 O ATOM 1543 CB ILE B 464 -19.491 22.584 -0.323 1.00 20.79 C ATOM 1544 CG1 ILE B 464 -19.707 24.084 -0.103 1.00 19.51 C ATOM 1545 CG2 ILE B 464 -20.514 21.761 0.469 1.00 15.61 C ATOM 1546 CD1 ILE B 464 -20.825 24.635 -0.916 1.00 23.08 C ATOM 1547 N ILE B 465 -17.595 20.261 1.414 1.00 20.85 N ATOM 1548 CA ILE B 465 -17.371 18.843 1.705 1.00 20.70 C ATOM 1549 C ILE B 465 -18.512 18.270 2.536 1.00 22.18 C ATOM 1550 O ILE B 465 -18.533 18.406 3.758 1.00 23.49 O ATOM 1551 CB ILE B 465 -16.021 18.634 2.457 1.00 20.02 C ATOM 1552 CG1 ILE B 465 -14.873 19.233 1.636 1.00 18.52 C ATOM 1553 CG2 ILE B 465 -15.773 17.155 2.790 1.00 16.39 C ATOM 1554 CD1 ILE B 465 -14.756 18.657 0.223 1.00 18.92 C ATOM 1555 N ASP B 466 -19.470 17.641 1.867 1.00 22.65 N ATOM 1556 CA ASP B 466 -20.531 16.909 2.551 1.00 25.97 C ATOM 1557 C ASP B 466 -20.652 15.503 1.953 1.00 29.30 C ATOM 1558 O ASP B 466 -19.867 15.131 1.073 1.00 28.16 O ATOM 1559 CB ASP B 466 -21.853 17.661 2.449 1.00 26.42 C ATOM 1560 CG ASP B 466 -22.323 17.810 1.024 1.00 30.33 C ATOM 1561 OD1 ASP B 466 -21.471 17.937 0.122 0.70 24.13 O ATOM 1562 OD2 ASP B 466 -23.554 17.786 0.803 1.00 38.24 O ATOM 1563 N LYS B 467 -21.616 14.722 2.430 1.00 27.68 N ATOM 1564 CA LYS B 467 -21.760 13.340 1.975 1.00 29.19 C ATOM 1565 C LYS B 467 -21.850 13.254 0.447 1.00 29.28 C ATOM 1566 O LYS B 467 -21.298 12.341 -0.158 1.00 30.24 O ATOM 1567 CB LYS B 467 -22.968 12.674 2.658 1.00 35.52 C ATOM 1568 CG LYS B 467 -23.218 11.206 2.301 1.00 34.70 C ATOM 1569 CD LYS B 467 -24.433 10.689 3.071 1.00 47.29 C ATOM 1570 CE LYS B 467 -25.270 9.689 2.254 1.00 54.80 C ATOM 1571 NZ LYS B 467 -26.683 9.557 2.771 1.00 49.52 N ATOM 1572 N ILE B 468 -22.502 14.238 -0.169 1.00 30.64 N ATOM 1573 CA ILE B 468 -22.677 14.291 -1.628 1.00 30.40 C ATOM 1574 C ILE B 468 -21.447 14.772 -2.418 1.00 32.45 C ATOM 1575 O ILE B 468 -21.154 14.241 -3.495 1.00 34.00 O ATOM 1576 CB ILE B 468 -23.878 15.185 -2.001 1.00 33.46 C ATOM 1577 CG1 ILE B 468 -25.179 14.544 -1.531 1.00 33.05 C ATOM 1578 CG2 ILE B 468 -23.938 15.440 -3.491 1.00 27.15 C ATOM 1579 CD1 ILE B 468 -26.209 15.568 -1.180 1.00 36.66 C ATOM 1580 N ARG B 469 -20.722 15.759 -1.893 1.00 26.39 N ATOM 1581 CA ARG B 469 -19.606 16.336 -2.646 1.00 22.96 C ATOM 1582 C ARG B 469 -18.186 15.994 -2.162 1.00 25.14 C ATOM 1583 O ARG B 469 -17.208 16.459 -2.762 1.00 25.14 O ATOM 1584 CB ARG B 469 -19.751 17.850 -2.735 1.00 24.70 C ATOM 1585 CG ARG B 469 -20.929 18.325 -3.570 1.00 24.08 C ATOM 1586 CD ARG B 469 -21.366 19.720 -3.141 1.00 23.00 C ATOM 1587 NE ARG B 469 -22.251 19.686 -1.978 1.00 22.70 N ATOM 1588 CZ ARG B 469 -23.041 20.694 -1.617 1.00 25.00 C ATOM 1589 NH1 ARG B 469 -23.047 21.821 -2.331 1.00 21.57 N ATOM 1590 NH2 ARG B 469 -23.821 20.579 -0.544 1.00 18.31 N ATOM 1591 N ARG B 470 -18.059 15.181 -1.112 1.00 23.29 N ATOM 1592 CA ARG B 470 -16.737 14.875 -0.555 1.00 21.43 C ATOM 1593 C ARG B 470 -15.772 14.201 -1.545 1.00 25.72 C ATOM 1594 O ARG B 470 -14.556 14.400 -1.460 1.00 25.32 O ATOM 1595 CB ARG B 470 -16.859 14.043 0.714 1.00 22.82 C ATOM 1596 CG ARG B 470 -17.782 12.868 0.549 1.00 27.21 C ATOM 1597 CD ARG B 470 -17.362 11.688 1.392 1.00 25.38 C ATOM 1598 NE ARG B 470 -18.146 11.566 2.609 1.00 31.31 N ATOM 1599 CZ ARG B 470 -18.841 10.481 2.930 1.00 28.58 C ATOM 1600 NH1 ARG B 470 -18.835 9.437 2.121 1.00 26.35 N ATOM 1601 NH2 ARG B 470 -19.529 10.441 4.062 1.00 26.34 N ATOM 1602 N LYS B 471 -16.298 13.418 -2.488 1.00 27.12 N ATOM 1603 CA LYS B 471 -15.437 12.786 -3.493 1.00 24.50 C ATOM 1604 C LYS B 471 -14.828 13.813 -4.440 1.00 25.38 C ATOM 1605 O LYS B 471 -13.742 13.590 -4.974 1.00 29.11 O ATOM 1606 CB LYS B 471 -16.189 11.748 -4.340 1.00 26.60 C ATOM 1607 CG LYS B 471 -16.650 10.495 -3.626 1.00 35.33 C ATOM 1608 CD LYS B 471 -17.155 9.476 -4.631 0.00 37.05 C ATOM 1609 CE LYS B 471 -17.857 8.321 -3.951 1.00 41.84 C ATOM 1610 NZ LYS B 471 -17.780 7.078 -4.787 1.00 48.87 N ATOM 1611 N ASN B 472 -15.526 14.925 -4.659 1.00 24.22 N ATOM 1612 CA ASN B 472 -15.132 15.878 -5.694 1.00 23.06 C ATOM 1613 C ASN B 472 -13.780 16.533 -5.479 1.00 21.94 C ATOM 1614 O ASN B 472 -12.966 16.632 -6.399 1.00 23.25 O ATOM 1615 CB ASN B 472 -16.195 16.954 -5.881 1.00 24.14 C ATOM 1616 CG ASN B 472 -17.526 16.385 -6.332 1.00 26.95 C ATOM 1617 OD1 ASN B 472 -17.787 15.190 -6.184 0.44 26.05 O ATOM 1618 ND2 ASN B 472 -18.381 17.242 -6.872 1.00 22.79 N ATOM 1619 N CYS B 473 -13.531 16.993 -4.268 1.00 21.57 N ATOM 1620 CA CYS B 473 -12.281 17.689 -4.034 1.00 21.33 C ATOM 1621 C CYS B 473 -11.526 17.091 -2.860 1.00 19.34 C ATOM 1622 O CYS B 473 -11.683 17.528 -1.726 1.00 20.08 O ATOM 1623 CB CYS B 473 -12.522 19.178 -3.835 1.00 18.18 C ATOM 1624 SG CYS B 473 -11.015 20.121 -3.875 1.00 22.07 S ATOM 1625 N PRO B 474 -10.717 16.066 -3.139 1.00 18.78 N ATOM 1626 CA PRO B 474 -9.857 15.436 -2.137 1.00 19.44 C ATOM 1627 C PRO B 474 -8.959 16.499 -1.518 1.00 19.79 C ATOM 1628 O PRO B 474 -8.649 16.411 -0.337 1.00 19.47 O ATOM 1629 CB PRO B 474 -9.009 14.467 -2.958 1.00 18.75 C ATOM 1630 CG PRO B 474 -9.718 14.278 -4.219 1.00 17.40 C ATOM 1631 CD PRO B 474 -10.580 15.455 -4.469 1.00 17.14 C ATOM 1632 N ALA B 475 -8.547 17.485 -2.314 1.00 18.60 N ATOM 1633 CA ALA B 475 -7.767 18.611 -1.810 1.00 15.31 C ATOM 1634 C ALA B 475 -8.438 19.307 -0.621 1.00 18.58 C ATOM 1635 O ALA B 475 -7.857 19.384 0.459 1.00 18.77 O ATOM 1636 CB ALA B 475 -7.501 19.602 -2.916 1.00 16.57 C ATOM 1637 N CYS B 476 -9.654 19.818 -0.809 1.00 19.05 N ATOM 1638 CA CYS B 476 -10.362 20.486 0.289 1.00 17.69 C ATOM 1639 C CYS B 476 -10.780 19.536 1.405 1.00 18.65 C ATOM 1640 O CYS B 476 -10.867 19.930 2.573 1.00 19.76 O ATOM 1641 CB CYS B 476 -11.572 21.259 -0.225 1.00 19.14 C ATOM 1642 SG CYS B 476 -11.127 22.635 -1.320 1.00 18.10 S ATOM 1643 N ARG B 477 -11.035 18.284 1.057 1.00 17.74 N ATOM 1644 CA ARG B 477 -11.451 17.323 2.056 1.00 16.56 C ATOM 1645 C ARG B 477 -10.278 17.055 2.975 1.00 16.37 C ATOM 1646 O ARG B 477 -10.427 16.994 4.193 1.00 17.25 O ATOM 1647 CB ARG B 477 -11.931 16.030 1.396 1.00 16.96 C ATOM 1648 CG ARG B 477 -12.378 14.979 2.388 1.00 16.52 C ATOM 1649 CD ARG B 477 -12.968 13.794 1.679 1.00 19.64 C ATOM 1650 NE ARG B 477 -13.654 12.874 2.586 1.00 22.56 N ATOM 1651 CZ ARG B 477 -14.077 11.663 2.226 1.00 23.95 C ATOM 1652 NH1 ARG B 477 -13.884 11.242 0.980 1.00 21.59 N ATOM 1653 NH2 ARG B 477 -14.706 10.882 3.098 1.00 20.63 N ATOM 1654 N TYR B 478 -9.100 16.914 2.382 1.00 16.79 N ATOM 1655 CA TYR B 478 -7.878 16.653 3.138 1.00 17.26 C ATOM 1656 C TYR B 478 -7.533 17.840 4.035 1.00 17.69 C ATOM 1657 O TYR B 478 -7.144 17.662 5.195 1.00 19.07 O ATOM 1658 CB TYR B 478 -6.720 16.330 2.187 1.00 16.06 C ATOM 1659 CG TYR B 478 -5.373 16.183 2.853 1.00 16.73 C ATOM 1660 CD1 TYR B 478 -5.116 15.129 3.716 1.00 19.83 C ATOM 1661 CD2 TYR B 478 -4.349 17.083 2.599 1.00 17.68 C ATOM 1662 CE1 TYR B 478 -3.875 14.984 4.321 1.00 21.36 C ATOM 1663 CE2 TYR B 478 -3.111 16.946 3.195 0.00 20.46 C ATOM 1664 CZ TYR B 478 -2.882 15.892 4.051 1.00 21.55 C ATOM 1665 OH TYR B 478 -1.661 15.739 4.661 1.00 28.36 O ATOM 1666 N ARG B 479 -7.680 19.046 3.494 1.00 14.89 N ATOM 1667 CA ARG B 479 -7.447 20.264 4.259 1.00 17.19 C ATOM 1668 C ARG B 479 -8.398 20.364 5.454 1.00 19.02 C ATOM 1669 O ARG B 479 -7.958 20.641 6.565 1.00 21.85 O ATOM 1670 CB ARG B 479 -7.564 21.498 3.367 1.00 18.95 C ATOM 1671 CG ARG B 479 -7.748 22.802 4.134 1.00 20.45 C ATOM 1672 CD ARG B 479 -7.904 24.014 3.184 1.00 24.26 C ATOM 1673 NE ARG B 479 -9.051 23.900 2.283 1.00 21.32 N ATOM 1674 CZ ARG B 479 -10.322 23.934 2.684 1.00 20.41 C ATOM 1675 NH1 ARG B 479 -10.614 24.081 3.970 1.00 19.29 N ATOM 1676 NH2 ARG B 479 -11.304 23.818 1.803 1.00 22.58 N ATOM 1677 N LYS B 480 -9.690 20.118 5.230 1.00 19.43 N ATOM 1678 CA LYS B 480 -10.664 20.084 6.322 1.00 18.71 C ATOM 1679 C LYS B 480 -10.290 19.030 7.374 1.00 22.21 C ATOM 1680 O LYS B 480 -10.475 19.261 8.574 1.00 23.96 O ATOM 1681 CB LYS B 480 -12.094 19.854 5.809 1.00 16.40 C ATOM 1682 CG LYS B 480 -12.671 20.991 4.961 1.00 19.40 C ATOM 1683 CD LYS B 480 -14.202 20.984 4.966 1.00 16.01 C ATOM 1684 CE LYS B 480 -14.722 21.037 6.384 0.00 19.31 C ATOM 1685 NZ LYS B 480 -16.178 20.792 6.415 1.00 19.42 N ATOM 1686 N CYS B 481 -9.769 17.885 6.920 1.00 20.01 N ATOM 1687 CA CYS B 481 -9.224 16.858 7.809 1.00 18.43 C ATOM 1688 C CYS B 481 -8.097 17.413 8.674 1.00 22.24 C ATOM 1689 O CYS B 481 -8.074 17.225 9.891 1.00 22.34 O ATOM 1690 CB CYS B 481 -8.662 15.688 7.002 1.00 21.65 C ATOM 1691 SG CYS B 481 -9.840 14.487 6.368 0.95 18.10 S ATOM 1692 N LEU B 482 -7.138 18.074 8.035 1.00 22.01 N ATOM 1693 CA LEU B 482 -6.026 18.666 8.762 1.00 21.43 C ATOM 1694 C LEU B 482 -6.539 19.721 9.736 1.00 25.88 C ATOM 1695 O LEU B 482 -6.138 19.769 10.899 1.00 27.05 O ATOM 1696 CB LEU B 482 -5.042 19.294 7.784 1.00 21.18 C ATOM 1697 CG LEU B 482 -3.732 18.552 7.524 1.00 20.08 C ATOM 1698 CD1 LEU B 482 -3.921 17.062 7.618 1.00 18.41 C ATOM 1699 CD2 LEU B 482 -3.203 18.949 6.158 1.00 19.73 C ATOM 1700 N GLN B 483 -7.450 20.558 9.263 1.00 25.62 N ATOM 1701 CA GLN B 483 -7.926 21.664 10.071 1.00 24.54 C ATOM 1702 C GLN B 483 -8.680 21.193 11.305 1.00 25.39 C ATOM 1703 O GLN B 483 -8.702 21.870 12.326 1.00 28.49 O ATOM 1704 CB GLN B 483 -8.801 22.594 9.249 1.00 20.85 C ATOM 1705 CG GLN B 483 -8.726 23.996 9.743 1.00 28.20 C ATOM 1706 CD GLN B 483 -8.315 24.956 8.656 1.00 42.11 C ATOM 1707 OE1 GLN B 483 -8.591 24.731 7.460 1.00 38.29 O ATOM 1708 NE2 GLN B 483 -7.652 26.047 9.057 1.00 41.11 N ATOM 1709 N ALA B 484 -9.307 20.030 11.210 1.00 25.85 N ATOM 1710 CA ALA B 484 -10.030 19.477 12.344 1.00 23.17 C ATOM 1711 C ALA B 484 -9.038 18.900 13.356 1.00 28.33 C ATOM 1712 O ALA B 484 -9.419 18.569 14.480 1.00 26.21 O ATOM 1713 CB ALA B 484 -10.992 18.401 11.873 1.00 21.15 C ATOM 1714 N GLY B 485 -7.775 18.772 12.934 1.00 23.79 N ATOM 1715 CA GLY B 485 -6.714 18.233 13.763 1.00 19.63 C ATOM 1716 C GLY B 485 -6.450 16.737 13.642 1.00 22.95 C ATOM 1717 O GLY B 485 -6.016 16.113 14.600 1.00 26.28 O ATOM 1718 N MET B 486 -6.705 16.142 12.484 1.00 22.56 N ATOM 1719 CA MET B 486 -6.400 14.720 12.295 1.00 24.62 C ATOM 1720 C MET B 486 -4.891 14.459 12.228 1.00 28.92 C ATOM 1721 O MET B 486 -4.158 15.126 11.493 1.00 28.51 O ATOM 1722 CB MET B 486 -7.121 14.160 11.061 1.00 21.90 C ATOM 1723 CG MET B 486 -8.637 14.164 11.230 1.00 19.31 C ATOM 1724 SD MET B 486 -9.573 13.422 9.904 1.00 21.64 S ATOM 1725 CE MET B 486 -9.222 11.676 10.108 1.00 20.53 C ATOM 1726 N ASN B 487 -4.433 13.500 13.023 1.00 32.23 N ATOM 1727 CA ASN B 487 -3.021 13.168 13.115 1.00 27.52 C ATOM 1728 C ASN B 487 -2.923 11.667 13.053 1.00 32.45 C ATOM 1729 O ASN B 487 -3.649 10.974 13.768 1.00 33.48 O ATOM 1730 CB ASN B 487 -2.445 13.651 14.441 1.00 28.65 C ATOM 1731 CG ASN B 487 -0.935 13.573 14.475 1.00 40.86 C ATOM 1732 OD1 ASN B 487 -0.330 12.586 14.036 1.00 45.12 O ATOM 1733 ND2 ASN B 487 -0.306 14.629 14.975 1.00 45.76 N ATOM 1734 N LEU B 488 -2.034 11.157 12.208 1.00 34.58 N ATOM 1735 CA LEU B 488 -1.943 9.717 12.006 1.00 33.72 C ATOM 1736 C LEU B 488 -1.545 9.010 13.290 1.00 42.85 C ATOM 1737 O LEU B 488 -2.038 7.915 13.576 1.00 47.50 O ATOM 1738 CB LEU B 488 -0.967 9.379 10.886 1.00 33.57 C ATOM 1739 CG LEU B 488 -1.496 8.334 9.909 1.00 34.32 C ATOM 1740 CD1 LEU B 488 -2.984 8.543 9.602 1.00 32.28 C ATOM 1741 CD2 LEU B 488 -0.686 8.375 8.634 1.00 30.71 C ATOM 1742 N GLU B 489 -0.669 9.639 14.069 1.00 42.15 N ATOM 1743 CA GLU B 489 -0.292 9.089 15.371 1.00 44.39 C ATOM 1744 C GLU B 489 -0.741 9.970 16.537 1.00 45.32 C ATOM 1745 O GLU B 489 0.088 10.549 17.233 1.00 53.99 O ATOM 1746 CB GLU B 489 1.215 8.813 15.440 1.00 48.42 C ATOM 1747 CG GLU B 489 2.099 9.825 14.717 1.00 49.09 C ATOM 1748 CD GLU B 489 3.041 9.160 13.712 1.00 52.34 C ATOM 1749 OE1 GLU B 489 3.012 7.913 13.594 0.75 51.98 O ATOM 1750 OE2 GLU B 489 3.810 9.881 13.036 1.00 52.44 O ATOM 1751 N ALA B 490 -2.056 10.058 16.743 1.00 44.55 N ATOM 1752 CA ALA B 490 -2.632 10.865 17.821 1.00 48.02 C ATOM 1753 C ALA B 490 -2.344 10.278 19.205 1.00 51.97 C ATOM 1754 O ALA B 490 -3.057 9.387 19.675 1.00 51.60 O ATOM 1755 CB ALA B 490 -4.139 11.031 17.616 1.00 35.64 C TER 1756 ALA B 490 HETATM 1757 ZN ZN A 601 -10.077 -17.420 28.560 1.00 35.00 ZN HETATM 1758 ZN ZN A 602 -2.430 -22.649 41.015 1.00 20.10 ZN HETATM 1759 ZN ZN B 601 -16.684 12.423 7.120 1.00 23.26 ZN HETATM 1760 ZN ZN B 602 -11.546 22.338 -3.592 1.00 18.39 ZN HETATM 1761 O HOH A 701 -15.260 -20.908 31.900 1.00 38.65 O HETATM 1762 O HOH A 702 -3.545 -26.226 42.513 1.00 22.46 O HETATM 1763 O HOH A 703 -5.111 -28.336 43.802 1.00 25.89 O HETATM 1764 O HOH A 704 3.239 -21.081 23.899 1.00 37.08 O HETATM 1765 O HOH A 705 -5.212 -21.473 44.242 1.00 18.01 O HETATM 1766 O HOH A 706 3.797 -21.867 41.091 1.00 22.78 O HETATM 1767 O HOH A 707 1.745 -22.997 47.516 1.00 25.88 O HETATM 1768 O HOH A 708 1.002 -23.301 37.834 1.00 26.32 O HETATM 1769 O HOH A 709 -3.961 -28.032 46.679 1.00 33.52 O HETATM 1770 O HOH C 901 -13.070 6.594 1.953 1.00 25.00 O HETATM 1771 O HOH C 902 -18.670 1.158 -0.664 1.00 36.40 O HETATM 1772 O HOH C 903 -8.632 -6.829 40.598 1.00 38.03 O HETATM 1773 O HOH C 904 -5.417 -4.626 25.659 1.00 36.83 O HETATM 1774 O HOH C 905 -13.743 -4.568 13.011 1.00 39.30 O HETATM 1775 O HOH C 906 -12.535 -1.447 9.958 1.00 32.02 O HETATM 1776 O HOH C 907 -9.068 -8.775 19.553 1.00 36.43 O HETATM 1777 O HOH C 908 -20.498 -1.300 0.694 1.00 49.28 O HETATM 1778 O HOH C 909 -10.819 6.508 0.458 1.00 28.24 O HETATM 1779 O HOH C 910 -18.385 -1.442 -0.334 1.00 45.32 O HETATM 1780 O HOH D 901 -11.307 0.177 13.586 1.00 35.60 O HETATM 1781 O HOH D 902 -7.635 -10.508 31.962 1.00 29.83 O HETATM 1782 O HOH D 903 -6.427 2.266 19.365 1.00 27.81 O HETATM 1783 O HOH D 904 -14.077 2.796 16.454 1.00 35.00 O HETATM 1784 O HOH D 905 -3.466 -1.890 14.897 1.00 35.29 O HETATM 1785 O HOH D 906 -7.026 -2.029 0.900 1.00 47.03 O HETATM 1786 O HOH D 907 -13.541 -4.427 32.690 1.00 44.63 O HETATM 1787 O HOH B 701 -19.494 29.370 -1.951 1.00 23.46 O HETATM 1788 O HOH B 702 -8.311 23.138 -0.323 1.00 16.62 O HETATM 1789 O HOH B 703 -13.892 23.982 2.609 1.00 23.25 O HETATM 1790 O HOH B 704 -18.866 7.076 6.614 1.00 30.06 O HETATM 1791 O HOH B 705 -23.282 15.072 4.958 1.00 34.06 O HETATM 1792 O HOH B 706 -4.953 19.979 0.756 1.00 20.41 O HETATM 1793 O HOH B 707 -17.659 20.906 8.328 1.00 25.82 O HETATM 1794 O HOH B 708 -19.982 16.780 15.185 1.00 27.80 O HETATM 1795 O HOH B 709 -2.877 3.811 3.500 1.00 27.25 O HETATM 1796 O HOH B 710 -7.174 9.100 0.134 1.00 25.70 O HETATM 1797 O HOH B 711 -21.769 15.321 16.460 1.00 31.29 O HETATM 1798 O HOH B 712 -12.657 12.285 -1.173 1.00 25.46 O HETATM 1799 O HOH B 713 -8.595 8.781 18.295 1.00 26.32 O HETATM 1800 O HOH B 714 -6.741 27.241 -8.219 1.00 30.68 O HETATM 1801 O HOH B 715 -11.489 20.470 -6.979 1.00 22.05 O HETATM 1802 O HOH B 716 -16.404 19.814 -7.791 1.00 27.62 O HETATM 1803 O HOH B 717 -12.332 13.616 20.013 1.00 27.44 O CONECT 23 1757 CONECT 44 1757 CONECT 142 1757 CONECT 158 1757 CONECT 290 1758 CONECT 332 1758 CONECT 418 1758 CONECT 436 1758 CONECT 1225 1759 CONECT 1246 1759 CONECT 1344 1759 CONECT 1360 1759 CONECT 1496 1760 CONECT 1538 1760 CONECT 1624 1760 CONECT 1642 1760 CONECT 1757 23 44 142 158 CONECT 1758 290 332 418 436 CONECT 1759 1225 1246 1344 1360 CONECT 1760 1496 1538 1624 1642 MASTER 445 0 4 4 4 0 4 6 1799 4 20 22 END
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Related entries of code: 4hn6
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4hn5
RCSB PDB
PDBbind
16aa, >4HN5_3|Chain... *
5cc0
RCSB PDB
PDBbind
16aa, >5CC0_3|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
4hn5
RCSB PDB
PDBbind
TSLP nGRE DNA (5'-D(CGCCTCCGGGAGAGCT)-3')
Entry Information
PDB ID
4hn6
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
Glucocorticoid Receptor DNA Binding Domain, GR DBD (R460D, D462R mutants)
Ligand Name
TSLP nGRE DNA (5'-D(CGCCTCCGGGAGAGCT)-3')
EC.Number
E.C.-.-.-.-
Resolution
2.55(Å)
Affinity (Kd/Ki/IC50)
Kd=0.14uM
Release Year
2012
Protein/NA Sequence
Check fasta file
Primary Reference
(2013) Nat.Struct.Mol.Biol. Vol. 20: pp. 53-58
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P04150
Entrez Gene ID
NCBI Entrez Gene ID:
2908
ASD
Information of known allosteric effects of PDB entries
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