Browse entries in the PDBbind-CN Database
HEADER DNA BINDING PROTEIN/DNA 09-OCT-15 5E69 TITLE GLUCOCORTICOID RECEPTOR DNA BINDING DOMAIN - IL8 NF-KB RESPONSE TITLE 2 ELEMENT COMPLEX COMPND MOL_ID: 1; COMPND 2 MOLECULE: GLUCOCORTICOID RECEPTOR; COMPND 3 CHAIN: A, B; COMPND 4 FRAGMENT: UNP RESIDUES 391-480; COMPND 5 SYNONYM: GR,NUCLEAR RECEPTOR SUBFAMILY 3 GROUP C MEMBER 1; COMPND 6 ENGINEERED: YES; COMPND 7 MOL_ID: 2; COMPND 8 MOLECULE: DNA (5'-D(*GP*AP*GP*GP*AP*AP*AP*TP*TP*CP*CP*AP*CP*GP*AP*T)- COMPND 9 3'); COMPND 10 CHAIN: C; COMPND 11 ENGINEERED: YES; COMPND 12 MOL_ID: 3; COMPND 13 MOLECULE: DNA (5'-D(*AP*TP*CP*GP*TP*GP*GP*AP*AP*TP*TP*TP*CP*CP*TP*C)- COMPND 14 3'); COMPND 15 CHAIN: D; COMPND 16 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: NR3C1, GRL; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL-21 (DE3) PLYSS; SOURCE 9 MOL_ID: 2; SOURCE 10 SYNTHETIC: YES; SOURCE 11 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 12 ORGANISM_TAXID: 9606; SOURCE 13 MOL_ID: 3; SOURCE 14 SYNTHETIC: YES; SOURCE 15 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 16 ORGANISM_TAXID: 9606 KEYWDS DNA BINDING PROTEINS, DNA BINDING PROTEIN-DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR W.H.HUDSON,E.A.RYE,A.G.HERBST,E.A.ORTLUND REVDAT 2 24-OCT-18 5E69 1 JRNL REVDAT 1 08-FEB-17 5E69 0 JRNL AUTH W.H.HUDSON,I.M.S.VERA,J.C.NWACHUKWU,E.R.WEIKUM,A.G.HERBST, JRNL AUTH 2 Q.YANG,D.L.BAIN,K.W.NETTLES,D.J.KOJETIN,E.A.ORTLUND JRNL TITL CRYPTIC GLUCOCORTICOID RECEPTOR-BINDING SITES PERVADE JRNL TITL 2 GENOMIC NF-KAPPA B RESPONSE ELEMENTS. JRNL REF NAT COMMUN V. 9 1337 2018 JRNL REFN ESSN 2041-1723 JRNL PMID 29626214 JRNL DOI 10.1038/S41467-018-03780-1 REMARK 2 REMARK 2 RESOLUTION. 1.85 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX 1.9_1692 REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE, REMARK 3 : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER, REMARK 3 : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY, REMARK 3 : REETAL PAI,RANDY READ,JANE RICHARDSON, REMARK 3 : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI, REMARK 3 : NICHOLAS SAUTER,JACOB SMITH,LAURENT REMARK 3 : STORONI,TOM TERWILLIGER,PETER ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : ML REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.85 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 34.27 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.340 REMARK 3 COMPLETENESS FOR RANGE (%) : 87.9 REMARK 3 NUMBER OF REFLECTIONS : 30348 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.221 REMARK 3 R VALUE (WORKING SET) : 0.220 REMARK 3 FREE R VALUE : 0.242 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 6.520 REMARK 3 FREE R VALUE TEST SET COUNT : 1978 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT (IN BINS). REMARK 3 BIN RESOLUTION RANGE COMPL. NWORK NFREE RWORK RFREE REMARK 3 1 34.2732 - 4.4563 0.81 2012 137 0.1765 0.1876 REMARK 3 2 4.4563 - 3.5383 0.88 2067 148 0.1935 0.2169 REMARK 3 3 3.5383 - 3.0913 0.89 2090 139 0.2184 0.2476 REMARK 3 4 3.0913 - 2.8088 0.91 2107 139 0.2355 0.2324 REMARK 3 5 2.8088 - 2.6076 0.92 2107 155 0.2365 0.2584 REMARK 3 6 2.6076 - 2.4539 0.93 2113 149 0.2402 0.2874 REMARK 3 7 2.4539 - 2.3310 0.94 2158 152 0.2432 0.2897 REMARK 3 8 2.3310 - 2.2296 0.93 2131 148 0.2663 0.2956 REMARK 3 9 2.2296 - 2.1438 0.94 2154 152 0.2598 0.2934 REMARK 3 10 2.1438 - 2.0698 0.92 2083 141 0.2729 0.3419 REMARK 3 11 2.0698 - 2.0051 0.88 2007 145 0.2985 0.2732 REMARK 3 12 2.0051 - 1.9478 0.88 1970 136 0.3139 0.3371 REMARK 3 13 1.9478 - 1.8965 0.81 1853 124 0.3658 0.4195 REMARK 3 14 1.8965 - 1.8502 0.68 1518 113 0.3431 0.3512 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) : 0.230 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 28.870 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 : 0.007 1880 REMARK 3 ANGLE : 0.852 2660 REMARK 3 CHIRALITY : 0.037 288 REMARK 3 PLANARITY : 0.006 228 REMARK 3 DIHEDRAL : 21.940 746 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 NCS DETAILS REMARK 3 NUMBER OF NCS GROUPS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 5E69 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 13-OCT-15. REMARK 100 THE DEPOSITION ID IS D_1000209295. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 12-DEC-12 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : NULL REMARK 200 NUMBER OF CRYSTALS USED : NULL REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 22-ID REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.00 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARMOSAIC 300 MM CCD REMARK 200 INTENSITY-INTEGRATION SOFTWARE : NULL REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 30412 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.850 REMARK 200 RESOLUTION RANGE LOW (A) : 34.270 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 88.4 REMARK 200 DATA REDUNDANCY : 4.400 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 14.0000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.85 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.92 REMARK 200 COMPLETENESS FOR SHELL (%) : 74.7 REMARK 200 DATA REDUNDANCY IN SHELL : 2.30 REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : 2.800 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHENIX REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 55.79 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.78 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.1 M HEPES PH 7.5, 7.5% GLYCEROL, 22% REMARK 280 PEG 20000, 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 19.58250 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 51.63250 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 48.58800 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 51.63250 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 19.58250 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 48.58800 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: 4340 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 12620 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -27.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, C, D, B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 MET A 393 REMARK 465 HIS A 394 REMARK 465 HIS A 395 REMARK 465 HIS A 396 REMARK 465 HIS A 397 REMARK 465 HIS A 398 REMARK 465 HIS A 399 REMARK 465 SER A 400 REMARK 465 SER A 401 REMARK 465 GLY A 402 REMARK 465 VAL A 403 REMARK 465 ASP A 404 REMARK 465 LEU A 405 REMARK 465 GLY A 406 REMARK 465 THR A 407 REMARK 465 GLU A 408 REMARK 465 ASN A 409 REMARK 465 LEU A 410 REMARK 465 TYR A 411 REMARK 465 PHE A 412 REMARK 465 GLN A 413 REMARK 465 SER A 414 REMARK 465 ASN A 415 REMARK 465 ALA A 416 REMARK 465 PRO A 417 REMARK 465 ARG A 491 REMARK 465 LYS A 492 REMARK 465 THR A 493 REMARK 465 LYS A 494 REMARK 465 LYS A 495 REMARK 465 LYS A 496 REMARK 465 ILE A 497 REMARK 465 LYS A 498 REMARK 465 GLY A 499 REMARK 465 ILE A 500 REMARK 465 GLN A 501 REMARK 465 GLN A 502 REMARK 465 ALA A 503 REMARK 465 THR A 504 REMARK 465 THR A 505 REMARK 465 GLY A 506 REMARK 465 MET B 393 REMARK 465 HIS B 394 REMARK 465 HIS B 395 REMARK 465 HIS B 396 REMARK 465 HIS B 397 REMARK 465 HIS B 398 REMARK 465 HIS B 399 REMARK 465 SER B 400 REMARK 465 SER B 401 REMARK 465 GLY B 402 REMARK 465 VAL B 403 REMARK 465 ASP B 404 REMARK 465 LEU B 405 REMARK 465 GLY B 406 REMARK 465 THR B 407 REMARK 465 GLU B 408 REMARK 465 ASN B 409 REMARK 465 LEU B 410 REMARK 465 TYR B 411 REMARK 465 PHE B 412 REMARK 465 GLN B 413 REMARK 465 SER B 414 REMARK 465 ASN B 415 REMARK 465 ALA B 416 REMARK 465 PRO B 417 REMARK 465 ARG B 491 REMARK 465 LYS B 492 REMARK 465 THR B 493 REMARK 465 LYS B 494 REMARK 465 LYS B 495 REMARK 465 LYS B 496 REMARK 465 ILE B 497 REMARK 465 LYS B 498 REMARK 465 GLY B 499 REMARK 465 ILE B 500 REMARK 465 GLN B 501 REMARK 465 GLN B 502 REMARK 465 ALA B 503 REMARK 465 THR B 504 REMARK 465 THR B 505 REMARK 465 GLY B 506 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 O HOH A 733 O HOH B 725 1.96 REMARK 500 O4 DT D 38 O HOH D 101 1.99 REMARK 500 O HOH A 701 O HOH A 702 2.04 REMARK 500 OD1 ASP B 462 O HOH B 701 2.17 REMARK 500 O HOH B 722 O HOH B 726 2.19 REMARK 500 O HOH B 709 O HOH B 712 2.19 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 DG C 20 O4' - C1' - N9 ANGL. DEV. = 2.0 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 LEU A 420 89.28 63.55 REMARK 500 VAL A 423 -64.15 -94.41 REMARK 500 SER A 425 -0.34 71.63 REMARK 500 VAL B 423 -65.43 -97.88 REMARK 500 SER B 425 -0.89 69.37 REMARK 500 REMARK 500 REMARK: NULL REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 601 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 421 SG REMARK 620 2 CYS A 424 SG 113.7 REMARK 620 3 CYS A 438 SG 113.8 106.0 REMARK 620 4 CYS A 441 SG 113.5 109.0 99.8 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 602 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 457 SG REMARK 620 2 CYS A 463 SG 101.6 REMARK 620 3 CYS A 473 SG 113.5 113.6 REMARK 620 4 CYS A 476 SG 111.3 109.3 107.5 REMARK 620 5 HOH A 733 O 75.1 66.3 70.9 173.2 REMARK 620 N 1 2 3 4 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN B 602 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS B 421 SG REMARK 620 2 CYS B 424 SG 116.7 REMARK 620 3 CYS B 438 SG 112.2 104.8 REMARK 620 4 CYS B 441 SG 111.1 108.8 102.3 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN B 601 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS B 457 SG REMARK 620 2 CYS B 463 SG 101.3 REMARK 620 3 CYS B 473 SG 114.1 116.2 REMARK 620 4 CYS B 476 SG 108.5 110.8 105.9 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: 5E6A RELATED DB: PDB REMARK 900 RELATED ID: 5E6B RELATED DB: PDB REMARK 900 RELATED ID: 5E6C RELATED DB: PDB REMARK 900 RELATED ID: 5E6D RELATED DB: PDB DBREF 5E69 A 417 506 UNP P04150 GCR_HUMAN 391 480 DBREF 5E69 C 18 33 PDB 5E69 5E69 18 33 DBREF 5E69 D 34 49 PDB 5E69 5E69 34 49 DBREF 5E69 B 417 506 UNP P04150 GCR_HUMAN 391 480 SEQADV 5E69 MET A 393 UNP P04150 INITIATING METHIONINE SEQADV 5E69 HIS A 394 UNP P04150 EXPRESSION TAG SEQADV 5E69 HIS A 395 UNP P04150 EXPRESSION TAG SEQADV 5E69 HIS A 396 UNP P04150 EXPRESSION TAG SEQADV 5E69 HIS A 397 UNP P04150 EXPRESSION TAG SEQADV 5E69 HIS A 398 UNP P04150 EXPRESSION TAG SEQADV 5E69 HIS A 399 UNP P04150 EXPRESSION TAG SEQADV 5E69 SER A 400 UNP P04150 EXPRESSION TAG SEQADV 5E69 SER A 401 UNP P04150 EXPRESSION TAG SEQADV 5E69 GLY A 402 UNP P04150 EXPRESSION TAG SEQADV 5E69 VAL A 403 UNP P04150 EXPRESSION TAG SEQADV 5E69 ASP A 404 UNP P04150 EXPRESSION TAG SEQADV 5E69 LEU A 405 UNP P04150 EXPRESSION TAG SEQADV 5E69 GLY A 406 UNP P04150 EXPRESSION TAG SEQADV 5E69 THR A 407 UNP P04150 EXPRESSION TAG SEQADV 5E69 GLU A 408 UNP P04150 EXPRESSION TAG SEQADV 5E69 ASN A 409 UNP P04150 EXPRESSION TAG SEQADV 5E69 LEU A 410 UNP P04150 EXPRESSION TAG SEQADV 5E69 TYR A 411 UNP P04150 EXPRESSION TAG SEQADV 5E69 PHE A 412 UNP P04150 EXPRESSION TAG SEQADV 5E69 GLN A 413 UNP P04150 EXPRESSION TAG SEQADV 5E69 SER A 414 UNP P04150 EXPRESSION TAG SEQADV 5E69 ASN A 415 UNP P04150 EXPRESSION TAG SEQADV 5E69 ALA A 416 UNP P04150 EXPRESSION TAG SEQADV 5E69 MET B 393 UNP P04150 INITIATING METHIONINE SEQADV 5E69 HIS B 394 UNP P04150 EXPRESSION TAG SEQADV 5E69 HIS B 395 UNP P04150 EXPRESSION TAG SEQADV 5E69 HIS B 396 UNP P04150 EXPRESSION TAG SEQADV 5E69 HIS B 397 UNP P04150 EXPRESSION TAG SEQADV 5E69 HIS B 398 UNP P04150 EXPRESSION TAG SEQADV 5E69 HIS B 399 UNP P04150 EXPRESSION TAG SEQADV 5E69 SER B 400 UNP P04150 EXPRESSION TAG SEQADV 5E69 SER B 401 UNP P04150 EXPRESSION TAG SEQADV 5E69 GLY B 402 UNP P04150 EXPRESSION TAG SEQADV 5E69 VAL B 403 UNP P04150 EXPRESSION TAG SEQADV 5E69 ASP B 404 UNP P04150 EXPRESSION TAG SEQADV 5E69 LEU B 405 UNP P04150 EXPRESSION TAG SEQADV 5E69 GLY B 406 UNP P04150 EXPRESSION TAG SEQADV 5E69 THR B 407 UNP P04150 EXPRESSION TAG SEQADV 5E69 GLU B 408 UNP P04150 EXPRESSION TAG SEQADV 5E69 ASN B 409 UNP P04150 EXPRESSION TAG SEQADV 5E69 LEU B 410 UNP P04150 EXPRESSION TAG SEQADV 5E69 TYR B 411 UNP P04150 EXPRESSION TAG SEQADV 5E69 PHE B 412 UNP P04150 EXPRESSION TAG SEQADV 5E69 GLN B 413 UNP P04150 EXPRESSION TAG SEQADV 5E69 SER B 414 UNP P04150 EXPRESSION TAG SEQADV 5E69 ASN B 415 UNP P04150 EXPRESSION TAG SEQADV 5E69 ALA B 416 UNP P04150 EXPRESSION TAG SEQRES 1 A 114 MET HIS HIS HIS HIS HIS HIS SER SER GLY VAL ASP LEU SEQRES 2 A 114 GLY THR GLU ASN LEU TYR PHE GLN SER ASN ALA PRO PRO SEQRES 3 A 114 LYS LEU CYS LEU VAL CYS SER ASP GLU ALA SER GLY CYS SEQRES 4 A 114 HIS TYR GLY VAL LEU THR CYS GLY SER CYS LYS VAL PHE SEQRES 5 A 114 PHE LYS ARG ALA VAL GLU GLY GLN HIS ASN TYR LEU CYS SEQRES 6 A 114 ALA GLY ARG ASN ASP CYS ILE ILE ASP LYS ILE ARG ARG SEQRES 7 A 114 LYS ASN CYS PRO ALA CYS ARG TYR ARG LYS CYS LEU GLN SEQRES 8 A 114 ALA GLY MET ASN LEU GLU ALA ARG LYS THR LYS LYS LYS SEQRES 9 A 114 ILE LYS GLY ILE GLN GLN ALA THR THR GLY SEQRES 1 C 16 DG DA DG DG DA DA DA DT DT DC DC DA DC SEQRES 2 C 16 DG DA DT SEQRES 1 D 16 DA DT DC DG DT DG DG DA DA DT DT DT DC SEQRES 2 D 16 DC DT DC SEQRES 1 B 114 MET HIS HIS HIS HIS HIS HIS SER SER GLY VAL ASP LEU SEQRES 2 B 114 GLY THR GLU ASN LEU TYR PHE GLN SER ASN ALA PRO PRO SEQRES 3 B 114 LYS LEU CYS LEU VAL CYS SER ASP GLU ALA SER GLY CYS SEQRES 4 B 114 HIS TYR GLY VAL LEU THR CYS GLY SER CYS LYS VAL PHE SEQRES 5 B 114 PHE LYS ARG ALA VAL GLU GLY GLN HIS ASN TYR LEU CYS SEQRES 6 B 114 ALA GLY ARG ASN ASP CYS ILE ILE ASP LYS ILE ARG ARG SEQRES 7 B 114 LYS ASN CYS PRO ALA CYS ARG TYR ARG LYS CYS LEU GLN SEQRES 8 B 114 ALA GLY MET ASN LEU GLU ALA ARG LYS THR LYS LYS LYS SEQRES 9 B 114 ILE LYS GLY ILE GLN GLN ALA THR THR GLY HET ZN A 601 1 HET ZN A 602 1 HET ZN B 601 1 HET ZN B 602 1 HETNAM ZN ZINC ION FORMUL 5 ZN 4(ZN 2+) FORMUL 9 HOH *96(H2 O) HELIX 1 AA1 CYS A 438 GLY A 451 1 14 HELIX 2 AA2 CYS A 473 GLY A 485 1 13 HELIX 3 AA3 CYS B 438 GLN B 452 1 15 HELIX 4 AA4 ILE B 468 ASN B 472 5 5 HELIX 5 AA5 CYS B 473 ALA B 484 1 12 SHEET 1 AA1 2 GLY A 430 HIS A 432 0 SHEET 2 AA1 2 VAL A 435 THR A 437 -1 O VAL A 435 N HIS A 432 SHEET 1 AA2 2 GLY B 430 HIS B 432 0 SHEET 2 AA2 2 VAL B 435 THR B 437 -1 O VAL B 435 N HIS B 432 LINK SG CYS A 421 ZN ZN A 601 1555 1555 2.30 LINK SG CYS A 424 ZN ZN A 601 1555 1555 2.25 LINK SG CYS A 438 ZN ZN A 601 1555 1555 2.36 LINK SG CYS A 441 ZN ZN A 601 1555 1555 2.36 LINK SG CYS A 457 ZN ZN A 602 1555 1555 2.25 LINK SG CYS A 463 ZN ZN A 602 1555 1555 2.38 LINK SG CYS A 473 ZN ZN A 602 1555 1555 2.29 LINK SG CYS A 476 ZN ZN A 602 1555 1555 2.35 LINK SG CYS B 421 ZN ZN B 602 1555 1555 2.28 LINK SG CYS B 424 ZN ZN B 602 1555 1555 2.24 LINK SG CYS B 438 ZN ZN B 602 1555 1555 2.38 LINK SG CYS B 441 ZN ZN B 602 1555 1555 2.36 LINK SG CYS B 457 ZN ZN B 601 1555 1555 2.31 LINK SG CYS B 463 ZN ZN B 601 1555 1555 2.40 LINK SG CYS B 473 ZN ZN B 601 1555 1555 2.29 LINK SG CYS B 476 ZN ZN B 601 1555 1555 2.33 LINK ZN ZN A 602 O HOH A 733 1555 1555 2.11 SITE 1 AC1 4 CYS A 421 CYS A 424 CYS A 438 CYS A 441 SITE 1 AC2 5 CYS A 457 CYS A 463 CYS A 473 CYS A 476 SITE 2 AC2 5 HOH A 733 SITE 1 AC3 4 CYS B 457 CYS B 463 CYS B 473 CYS B 476 SITE 1 AC4 4 CYS B 421 CYS B 424 CYS B 438 CYS B 441 CRYST1 39.165 97.176 103.265 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 0.025533 0.000000 0.000000 0.00000 SCALE2 0.000000 0.010291 0.000000 0.00000 SCALE3 0.000000 0.000000 0.009684 0.00000 ATOM 1 N PRO A 418 17.457 -20.444 22.417 1.00 69.56 N ATOM 2 CA PRO A 418 18.532 -20.832 21.495 1.00 67.39 C ATOM 3 C PRO A 418 18.749 -19.813 20.375 1.00 67.04 C ATOM 4 O PRO A 418 18.498 -18.621 20.570 1.00 69.02 O ATOM 5 CB PRO A 418 18.037 -22.169 20.915 1.00 68.73 C ATOM 6 CG PRO A 418 16.722 -22.493 21.652 1.00 67.59 C ATOM 7 CD PRO A 418 16.213 -21.181 22.146 1.00 67.66 C ATOM 8 N LYS A 419 19.205 -20.292 19.220 1.00 62.89 N ATOM 9 CA LYS A 419 19.354 -19.469 18.021 1.00 60.59 C ATOM 10 C LYS A 419 19.042 -20.313 16.787 1.00 56.59 C ATOM 11 O LYS A 419 18.509 -21.415 16.925 1.00 61.53 O ATOM 12 CB LYS A 419 20.756 -18.859 17.939 1.00 61.85 C ATOM 13 CG LYS A 419 20.969 -17.689 18.901 1.00 63.13 C ATOM 14 CD LYS A 419 22.280 -16.954 18.682 1.00 64.27 C ATOM 15 CE LYS A 419 23.473 -17.817 19.066 1.00 65.83 C ATOM 16 NZ LYS A 419 24.750 -17.063 18.985 1.00 67.91 N ATOM 17 N LEU A 420 19.370 -19.812 15.595 1.00 53.47 N ATOM 18 CA LEU A 420 19.016 -20.519 14.355 1.00 50.25 C ATOM 19 C LEU A 420 17.501 -20.660 14.113 1.00 49.56 C ATOM 20 O LEU A 420 16.861 -21.591 14.613 1.00 45.17 O ATOM 21 CB LEU A 420 19.684 -21.897 14.291 1.00 51.73 C ATOM 22 CG LEU A 420 21.173 -21.903 13.931 1.00 48.79 C ATOM 23 CD1 LEU A 420 21.503 -23.115 13.067 1.00 50.67 C ATOM 24 CD2 LEU A 420 21.592 -20.605 13.239 1.00 48.06 C ATOM 25 N CYS A 421 16.932 -19.659 13.440 1.00 41.79 N ATOM 26 CA CYS A 421 15.520 -19.652 13.037 1.00 40.30 C ATOM 27 C CYS A 421 15.080 -20.979 12.416 1.00 36.95 C ATOM 28 O CYS A 421 15.732 -21.507 11.521 1.00 40.14 O ATOM 29 CB CYS A 421 15.282 -18.508 12.031 1.00 37.47 C ATOM 30 SG CYS A 421 13.740 -18.557 11.039 1.00 35.02 S ATOM 31 N LEU A 422 13.962 -21.510 12.903 1.00 38.00 N ATOM 32 CA LEU A 422 13.487 -22.829 12.495 1.00 39.13 C ATOM 33 C LEU A 422 12.868 -22.844 11.099 1.00 41.07 C ATOM 34 O LEU A 422 12.535 -23.909 10.570 1.00 40.78 O ATOM 35 CB LEU A 422 12.476 -23.360 13.512 1.00 40.01 C ATOM 36 CG LEU A 422 13.088 -23.764 14.851 1.00 45.59 C ATOM 37 CD1 LEU A 422 12.005 -24.126 15.852 1.00 47.30 C ATOM 38 CD2 LEU A 422 14.055 -24.923 14.658 1.00 48.04 C ATOM 39 N VAL A 423 12.709 -21.668 10.502 1.00 37.78 N ATOM 40 CA VAL A 423 12.202 -21.588 9.140 1.00 37.20 C ATOM 41 C VAL A 423 13.349 -21.522 8.129 1.00 40.04 C ATOM 42 O VAL A 423 13.468 -22.397 7.274 1.00 39.82 O ATOM 43 CB VAL A 423 11.275 -20.372 8.938 1.00 33.87 C ATOM 44 CG1 VAL A 423 10.805 -20.295 7.486 1.00 35.03 C ATOM 45 CG2 VAL A 423 10.077 -20.450 9.877 1.00 35.66 C ATOM 46 N CYS A 424 14.141 -20.452 8.180 1.00 38.47 N ATOM 47 CA CYS A 424 15.240 -20.264 7.224 1.00 38.53 C ATOM 48 C CYS A 424 16.675 -20.564 7.706 1.00 38.88 C ATOM 49 O CYS A 424 17.615 -20.412 6.924 1.00 41.86 O ATOM 50 CB CYS A 424 15.198 -18.835 6.687 1.00 38.30 C ATOM 51 SG CYS A 424 15.682 -17.619 7.900 1.00 37.94 S ATOM 52 N SER A 425 16.843 -20.944 8.975 1.00 39.93 N ATOM 53 CA SER A 425 18.166 -21.239 9.570 1.00 42.66 C ATOM 54 C SER A 425 19.059 -20.010 9.811 1.00 41.73 C ATOM 55 O SER A 425 20.182 -20.149 10.287 1.00 44.33 O ATOM 56 CB SER A 425 18.938 -22.264 8.725 1.00 44.26 C ATOM 57 OG SER A 425 18.392 -23.561 8.880 1.00 48.77 O ATOM 58 N ASP A 426 18.580 -18.819 9.466 1.00 41.47 N ATOM 59 CA ASP A 426 19.279 -17.582 9.821 1.00 42.37 C ATOM 60 C ASP A 426 19.263 -17.418 11.345 1.00 44.42 C ATOM 61 O ASP A 426 18.501 -18.094 12.035 1.00 42.67 O ATOM 62 CB ASP A 426 18.630 -16.375 9.135 1.00 44.83 C ATOM 63 CG ASP A 426 19.493 -15.122 9.191 1.00 49.09 C ATOM 64 OD1 ASP A 426 20.566 -15.151 9.829 1.00 48.81 O ATOM 65 OD2 ASP A 426 19.088 -14.098 8.600 1.00 49.04 O ATOM 66 N GLU A 427 20.133 -16.564 11.876 1.00 46.96 N ATOM 67 CA GLU A 427 20.188 -16.352 13.323 1.00 48.40 C ATOM 68 C GLU A 427 18.849 -15.848 13.866 1.00 45.54 C ATOM 69 O GLU A 427 18.297 -14.865 13.373 1.00 46.35 O ATOM 70 CB GLU A 427 21.302 -15.369 13.689 1.00 49.30 C ATOM 71 CG GLU A 427 21.390 -15.091 15.181 1.00 55.33 C ATOM 72 CD GLU A 427 22.642 -14.327 15.568 1.00 60.01 C ATOM 73 OE1 GLU A 427 23.480 -14.056 14.680 1.00 64.11 O ATOM 74 OE2 GLU A 427 22.788 -14.004 16.766 1.00 62.74 O ATOM 75 N ALA A 428 18.336 -16.531 14.884 1.00 43.12 N ATOM 76 CA ALA A 428 17.026 -16.213 15.442 1.00 43.32 C ATOM 77 C ALA A 428 17.096 -15.032 16.405 1.00 46.63 C ATOM 78 O ALA A 428 18.064 -14.895 17.154 1.00 48.81 O ATOM 79 CB ALA A 428 16.450 -17.426 16.141 1.00 44.63 C ATOM 80 N SER A 429 16.080 -14.173 16.369 1.00 43.17 N ATOM 81 CA SER A 429 16.012 -13.034 17.281 1.00 45.77 C ATOM 82 C SER A 429 15.214 -13.345 18.545 1.00 49.02 C ATOM 83 O SER A 429 15.223 -12.565 19.496 1.00 51.67 O ATOM 84 CB SER A 429 15.409 -11.816 16.575 1.00 47.22 C ATOM 85 OG SER A 429 14.058 -12.042 16.206 1.00 46.70 O ATOM 86 N GLY A 430 14.532 -14.486 18.561 1.00 46.15 N ATOM 87 CA GLY A 430 13.732 -14.868 19.711 1.00 44.85 C ATOM 88 C GLY A 430 12.555 -15.758 19.358 1.00 45.72 C ATOM 89 O GLY A 430 12.502 -16.332 18.269 1.00 42.46 O ATOM 90 N CYS A 431 11.607 -15.876 20.282 1.00 45.13 N ATOM 91 CA CYS A 431 10.426 -16.701 20.057 1.00 45.26 C ATOM 92 C CYS A 431 9.280 -15.839 19.535 1.00 46.17 C ATOM 93 O CYS A 431 8.710 -15.032 20.272 1.00 47.79 O ATOM 94 CB CYS A 431 10.023 -17.418 21.348 1.00 47.01 C ATOM 95 SG CYS A 431 8.706 -18.647 21.172 1.00 57.95 S ATOM 96 N HIS A 432 8.937 -16.023 18.264 1.00 41.21 N ATOM 97 CA HIS A 432 7.922 -15.199 17.622 1.00 39.46 C ATOM 98 C HIS A 432 6.761 -16.049 17.134 1.00 41.52 C ATOM 99 O HIS A 432 6.960 -17.006 16.380 1.00 38.19 O ATOM 100 CB HIS A 432 8.526 -14.415 16.457 1.00 41.37 C ATOM 101 CG HIS A 432 9.677 -13.533 16.849 1.00 41.87 C ATOM 102 ND1 HIS A 432 9.509 -12.432 17.680 1.00 44.74 N ATOM 103 CD2 HIS A 432 10.977 -13.586 16.539 1.00 43.03 C ATOM 104 CE1 HIS A 432 10.684 -11.858 17.847 1.00 45.25 C ATOM 105 NE2 HIS A 432 11.595 -12.514 17.181 1.00 44.21 N ATOM 106 N TYR A 433 5.556 -15.690 17.570 1.00 37.53 N ATOM 107 CA TYR A 433 4.341 -16.422 17.226 1.00 37.80 C ATOM 108 C TYR A 433 4.490 -17.901 17.560 1.00 38.43 C ATOM 109 O TYR A 433 4.030 -18.769 16.815 1.00 37.43 O ATOM 110 CB TYR A 433 3.993 -16.226 15.747 1.00 35.30 C ATOM 111 CG TYR A 433 3.762 -14.773 15.393 1.00 38.38 C ATOM 112 CD1 TYR A 433 2.753 -14.045 16.009 1.00 38.61 C ATOM 113 CD2 TYR A 433 4.560 -14.126 14.460 1.00 36.07 C ATOM 114 CE1 TYR A 433 2.538 -12.719 15.701 1.00 39.21 C ATOM 115 CE2 TYR A 433 4.353 -12.794 14.145 1.00 38.99 C ATOM 116 CZ TYR A 433 3.338 -12.097 14.771 1.00 41.61 C ATOM 117 OH TYR A 433 3.119 -10.772 14.471 1.00 41.93 O ATOM 118 N GLY A 434 5.163 -18.170 18.678 1.00 38.26 N ATOM 119 CA GLY A 434 5.272 -19.511 19.221 1.00 39.92 C ATOM 120 C GLY A 434 6.518 -20.282 18.833 1.00 40.44 C ATOM 121 O GLY A 434 6.791 -21.340 19.395 1.00 43.17 O ATOM 122 N VAL A 435 7.279 -19.759 17.875 1.00 39.95 N ATOM 123 CA VAL A 435 8.401 -20.496 17.300 1.00 38.94 C ATOM 124 C VAL A 435 9.686 -19.664 17.278 1.00 40.32 C ATOM 125 O VAL A 435 9.645 -18.453 17.064 1.00 38.92 O ATOM 126 CB VAL A 435 8.072 -20.958 15.853 1.00 39.48 C ATOM 127 CG1 VAL A 435 9.204 -21.783 15.270 1.00 38.65 C ATOM 128 CG2 VAL A 435 6.776 -21.754 15.828 1.00 38.92 C ATOM 129 N LEU A 436 10.829 -20.312 17.483 1.00 39.01 N ATOM 130 CA LEU A 436 12.100 -19.611 17.383 1.00 40.97 C ATOM 131 C LEU A 436 12.343 -19.234 15.925 1.00 40.49 C ATOM 132 O LEU A 436 12.466 -20.104 15.063 1.00 41.23 O ATOM 133 CB LEU A 436 13.233 -20.494 17.913 1.00 43.45 C ATOM 134 CG LEU A 436 14.649 -19.924 17.991 1.00 50.48 C ATOM 135 CD1 LEU A 436 14.734 -18.835 19.049 1.00 49.35 C ATOM 136 CD2 LEU A 436 15.644 -21.035 18.277 1.00 53.33 C ATOM 137 N THR A 437 12.446 -17.933 15.660 1.00 37.92 N ATOM 138 CA THR A 437 12.556 -17.419 14.295 1.00 37.34 C ATOM 139 C THR A 437 13.388 -16.147 14.242 1.00 37.65 C ATOM 140 O THR A 437 13.626 -15.502 15.261 1.00 40.35 O ATOM 141 CB THR A 437 11.171 -17.093 13.657 1.00 37.96 C ATOM 142 OG1 THR A 437 10.464 -16.161 14.482 1.00 43.30 O ATOM 143 CG2 THR A 437 10.326 -18.342 13.462 1.00 41.34 C ATOM 144 N CYS A 438 13.823 -15.790 13.040 1.00 36.15 N ATOM 145 CA CYS A 438 14.500 -14.522 12.825 1.00 39.16 C ATOM 146 C CYS A 438 13.469 -13.412 12.664 1.00 39.08 C ATOM 147 O CYS A 438 12.262 -13.669 12.627 1.00 36.80 O ATOM 148 CB CYS A 438 15.402 -14.590 11.589 1.00 39.25 C ATOM 149 SG CYS A 438 14.510 -14.865 10.032 1.00 37.70 S ATOM 150 N GLY A 439 13.951 -12.182 12.538 1.00 41.25 N ATOM 151 CA GLY A 439 13.075 -11.035 12.410 1.00 41.56 C ATOM 152 C GLY A 439 12.300 -11.020 11.106 1.00 37.62 C ATOM 153 O GLY A 439 11.124 -10.660 11.084 1.00 36.99 O ATOM 154 N SER A 440 12.949 -11.411 10.013 1.00 36.05 N ATOM 155 CA SER A 440 12.308 -11.323 8.704 1.00 35.98 C ATOM 156 C SER A 440 11.207 -12.374 8.546 1.00 35.75 C ATOM 157 O SER A 440 10.196 -12.128 7.890 1.00 35.16 O ATOM 158 CB SER A 440 13.341 -11.459 7.580 1.00 38.38 C ATOM 159 OG SER A 440 13.791 -12.793 7.433 1.00 41.83 O ATOM 160 N CYS A 441 11.397 -13.542 9.151 1.00 33.21 N ATOM 161 CA CYS A 441 10.387 -14.588 9.066 1.00 34.33 C ATOM 162 C CYS A 441 9.202 -14.257 9.984 1.00 34.82 C ATOM 163 O CYS A 441 8.067 -14.648 9.715 1.00 32.42 O ATOM 164 CB CYS A 441 10.996 -15.955 9.404 1.00 32.80 C ATOM 165 SG CYS A 441 12.063 -16.654 8.078 1.00 35.26 S ATOM 166 N LYS A 442 9.466 -13.509 11.052 1.00 32.41 N ATOM 167 CA LYS A 442 8.398 -13.014 11.921 1.00 32.94 C ATOM 168 C LYS A 442 7.411 -12.123 11.164 1.00 32.76 C ATOM 169 O LYS A 442 6.198 -12.341 11.220 1.00 33.69 O ATOM 170 CB LYS A 442 8.984 -12.238 13.104 1.00 34.92 C ATOM 171 CG LYS A 442 7.943 -11.498 13.939 1.00 38.38 C ATOM 172 CD LYS A 442 8.598 -10.552 14.941 1.00 41.83 C ATOM 173 CE LYS A 442 8.869 -9.184 14.322 1.00 48.33 C ATOM 174 NZ LYS A 442 9.627 -8.267 15.231 1.00 48.87 N ATOM 175 N VAL A 443 7.930 -11.120 10.458 1.00 33.41 N ATOM 176 CA VAL A 443 7.067 -10.177 9.751 1.00 31.58 C ATOM 177 C VAL A 443 6.531 -10.769 8.450 1.00 33.98 C ATOM 178 O VAL A 443 5.470 -10.363 7.972 1.00 33.18 O ATOM 179 CB VAL A 443 7.794 -8.846 9.442 1.00 35.55 C ATOM 180 CG1 VAL A 443 8.217 -8.160 10.736 1.00 38.60 C ATOM 181 CG2 VAL A 443 8.993 -9.070 8.524 1.00 38.09 C ATOM 182 N PHE A 444 7.260 -11.723 7.876 1.00 33.87 N ATOM 183 CA PHE A 444 6.753 -12.445 6.716 1.00 32.27 C ATOM 184 C PHE A 444 5.479 -13.197 7.073 1.00 32.08 C ATOM 185 O PHE A 444 4.480 -13.125 6.358 1.00 34.35 O ATOM 186 CB PHE A 444 7.786 -13.435 6.168 1.00 31.53 C ATOM 187 CG PHE A 444 7.218 -14.375 5.138 1.00 33.48 C ATOM 188 CD1 PHE A 444 7.116 -13.988 3.817 1.00 33.71 C ATOM 189 CD2 PHE A 444 6.756 -15.634 5.499 1.00 32.70 C ATOM 190 CE1 PHE A 444 6.575 -14.836 2.867 1.00 36.77 C ATOM 191 CE2 PHE A 444 6.213 -16.490 4.548 1.00 32.76 C ATOM 192 CZ PHE A 444 6.125 -16.087 3.233 1.00 34.25 C ATOM 193 N PHE A 445 5.536 -13.943 8.170 1.00 29.29 N ATOM 194 CA PHE A 445 4.404 -14.751 8.605 1.00 33.18 C ATOM 195 C PHE A 445 3.189 -13.881 8.909 1.00 33.98 C ATOM 196 O PHE A 445 2.078 -14.194 8.491 1.00 35.11 O ATOM 197 CB PHE A 445 4.768 -15.584 9.837 1.00 30.82 C ATOM 198 CG PHE A 445 3.635 -16.434 10.340 1.00 34.98 C ATOM 199 CD1 PHE A 445 3.243 -17.569 9.644 1.00 35.65 C ATOM 200 CD2 PHE A 445 2.946 -16.089 11.488 1.00 34.82 C ATOM 201 CE1 PHE A 445 2.192 -18.350 10.097 1.00 36.36 C ATOM 202 CE2 PHE A 445 1.897 -16.867 11.947 1.00 37.38 C ATOM 203 CZ PHE A 445 1.521 -17.999 11.250 1.00 36.48 C ATOM 204 N LYS A 446 3.411 -12.785 9.629 1.00 34.25 N ATOM 205 CA LYS A 446 2.339 -11.843 9.944 1.00 37.74 C ATOM 206 C LYS A 446 1.664 -11.333 8.668 1.00 38.38 C ATOM 207 O LYS A 446 0.437 -11.261 8.595 1.00 41.33 O ATOM 208 CB LYS A 446 2.880 -10.669 10.767 1.00 38.73 C ATOM 209 CG LYS A 446 1.820 -9.641 11.165 1.00 42.07 C ATOM 210 CD LYS A 446 0.817 -10.234 12.142 1.00 44.06 C ATOM 211 CE LYS A 446 -0.346 -9.286 12.398 1.00 48.62 C ATOM 212 NZ LYS A 446 0.092 -7.951 12.884 1.00 50.02 N ATOM 213 N ARG A 447 2.470 -10.994 7.665 1.00 37.73 N ATOM 214 CA ARG A 447 1.951 -10.544 6.374 1.00 41.10 C ATOM 215 C ARG A 447 1.144 -11.641 5.690 1.00 42.82 C ATOM 216 O ARG A 447 0.034 -11.405 5.213 1.00 41.61 O ATOM 217 CB ARG A 447 3.089 -10.103 5.439 1.00 42.48 C ATOM 218 CG ARG A 447 3.638 -8.702 5.685 1.00 46.23 C ATOM 219 CD ARG A 447 4.478 -8.220 4.495 1.00 45.24 C ATOM 220 NE ARG A 447 5.614 -9.098 4.215 1.00 45.08 N ATOM 221 CZ ARG A 447 6.811 -8.977 4.784 1.00 44.53 C ATOM 222 NH1 ARG A 447 7.031 -8.007 5.662 1.00 43.21 N ATOM 223 NH2 ARG A 447 7.791 -9.819 4.473 1.00 41.26 N ATOM 224 N ALA A 448 1.720 -12.840 5.648 1.00 37.64 N ATOM 225 CA ALA A 448 1.146 -13.956 4.899 1.00 38.83 C ATOM 226 C ALA A 448 -0.129 -14.502 5.532 1.00 41.56 C ATOM 227 O ALA A 448 -1.052 -14.919 4.831 1.00 43.13 O ATOM 228 CB ALA A 448 2.174 -15.071 4.761 1.00 34.99 C ATOM 229 N VAL A 449 -0.170 -14.504 6.860 1.00 37.19 N ATOM 230 CA VAL A 449 -1.269 -15.118 7.592 1.00 39.06 C ATOM 231 C VAL A 449 -2.516 -14.225 7.637 1.00 46.20 C ATOM 232 O VAL A 449 -3.633 -14.723 7.777 1.00 47.96 O ATOM 233 CB VAL A 449 -0.821 -15.496 9.030 1.00 39.98 C ATOM 234 CG1 VAL A 449 -0.852 -14.288 9.959 1.00 38.70 C ATOM 235 CG2 VAL A 449 -1.664 -16.631 9.580 1.00 44.14 C ATOM 236 N GLU A 450 -2.333 -12.910 7.544 1.00 47.13 N ATOM 237 CA GLU A 450 -3.477 -12.008 7.443 1.00 49.35 C ATOM 238 C GLU A 450 -3.791 -11.689 5.994 1.00 48.69 C ATOM 239 O GLU A 450 -4.851 -11.142 5.681 1.00 53.05 O ATOM 240 CB GLU A 450 -3.222 -10.719 8.217 1.00 49.82 C ATOM 241 CG GLU A 450 -2.888 -10.940 9.678 1.00 51.66 C ATOM 242 CD GLU A 450 -3.031 -9.674 10.495 1.00 58.37 C ATOM 243 OE1 GLU A 450 -2.566 -8.611 10.027 1.00 60.07 O ATOM 244 OE2 GLU A 450 -3.591 -9.742 11.611 1.00 60.44 O ATOM 245 N GLY A 451 -2.873 -12.056 5.110 1.00 50.98 N ATOM 246 CA GLY A 451 -3.036 -11.778 3.702 1.00 56.18 C ATOM 247 C GLY A 451 -3.787 -12.911 3.037 1.00 57.92 C ATOM 248 O GLY A 451 -4.519 -13.664 3.693 1.00 56.31 O ATOM 249 N GLN A 452 -3.631 -13.010 1.726 1.00 61.99 N ATOM 250 CA GLN A 452 -4.287 -14.050 0.954 1.00 63.15 C ATOM 251 C GLN A 452 -3.520 -15.368 1.033 1.00 59.72 C ATOM 252 O GLN A 452 -4.113 -16.449 1.011 1.00 60.19 O ATOM 253 CB GLN A 452 -4.427 -13.606 -0.493 1.00 64.18 C ATOM 254 CG GLN A 452 -4.525 -12.096 -0.673 1.00 68.17 C ATOM 255 CD GLN A 452 -5.916 -11.553 -0.380 1.00 71.59 C ATOM 256 OE1 GLN A 452 -6.513 -11.861 0.653 1.00 70.96 O ATOM 257 NE2 GLN A 452 -6.436 -10.732 -1.291 1.00 72.43 N ATOM 258 N HIS A 453 -2.193 -15.252 1.084 1.00 60.24 N ATOM 259 CA HIS A 453 -1.261 -16.360 0.846 1.00 57.59 C ATOM 260 C HIS A 453 -1.699 -17.197 -0.359 1.00 58.20 C ATOM 261 O HIS A 453 -1.815 -18.425 -0.297 1.00 58.94 O ATOM 262 CB HIS A 453 -1.017 -17.223 2.101 1.00 54.43 C ATOM 263 CG HIS A 453 -2.260 -17.738 2.790 1.00 52.12 C ATOM 264 ND1 HIS A 453 -2.707 -17.188 3.970 1.00 50.76 N ATOM 265 CD2 HIS A 453 -3.064 -18.772 2.501 1.00 52.66 C ATOM 266 CE1 HIS A 453 -3.782 -17.860 4.363 1.00 47.76 C ATOM 267 NE2 HIS A 453 -4.028 -18.814 3.508 1.00 51.05 N ATOM 268 N ASN A 454 -1.910 -16.492 -1.468 1.00 59.41 N ATOM 269 CA ASN A 454 -2.216 -17.083 -2.775 1.00 61.62 C ATOM 270 C ASN A 454 -1.145 -18.026 -3.298 1.00 57.93 C ATOM 271 O ASN A 454 -1.359 -18.759 -4.267 1.00 58.06 O ATOM 272 CB ASN A 454 -2.366 -15.986 -3.828 1.00 62.51 C ATOM 273 CG ASN A 454 -2.983 -14.717 -3.280 1.00 66.27 C ATOM 274 OD1 ASN A 454 -4.202 -14.582 -3.204 1.00 70.16 O ATOM 275 ND2 ASN A 454 -2.135 -13.789 -2.861 1.00 66.38 N ATOM 276 N TYR A 455 0.007 -17.978 -2.643 1.00 53.69 N ATOM 277 CA TYR A 455 1.292 -18.280 -3.246 1.00 49.20 C ATOM 278 C TYR A 455 1.300 -19.584 -4.013 1.00 47.51 C ATOM 279 O TYR A 455 0.731 -20.587 -3.587 1.00 48.77 O ATOM 280 CB TYR A 455 2.370 -18.316 -2.166 1.00 48.53 C ATOM 281 CG TYR A 455 2.358 -17.138 -1.227 1.00 48.30 C ATOM 282 CD1 TYR A 455 2.328 -15.837 -1.710 1.00 49.81 C ATOM 283 CD2 TYR A 455 2.367 -17.330 0.150 1.00 49.26 C ATOM 284 CE1 TYR A 455 2.315 -14.757 -0.847 1.00 51.45 C ATOM 285 CE2 TYR A 455 2.353 -16.259 1.019 1.00 48.68 C ATOM 286 CZ TYR A 455 2.328 -14.976 0.512 1.00 52.16 C ATOM 287 OH TYR A 455 2.316 -13.901 1.366 1.00 55.63 O ATOM 288 N LEU A 456 1.907 -19.532 -5.187 1.00 41.95 N ATOM 289 CA LEU A 456 2.114 -20.717 -5.993 1.00 41.07 C ATOM 290 C LEU A 456 3.598 -21.039 -6.058 1.00 41.47 C ATOM 291 O LEU A 456 4.421 -20.166 -6.341 1.00 41.18 O ATOM 292 CB LEU A 456 1.559 -20.521 -7.404 1.00 43.96 C ATOM 293 CG LEU A 456 0.054 -20.265 -7.500 1.00 48.68 C ATOM 294 CD1 LEU A 456 -0.367 -19.985 -8.939 1.00 47.52 C ATOM 295 CD2 LEU A 456 -0.727 -21.439 -6.934 1.00 46.41 C ATOM 296 N CYS A 457 3.935 -22.295 -5.796 1.00 36.79 N ATOM 297 CA CYS A 457 5.299 -22.762 -5.952 1.00 37.82 C ATOM 298 C CYS A 457 5.580 -23.065 -7.427 1.00 37.87 C ATOM 299 O CYS A 457 4.756 -23.678 -8.107 1.00 38.63 O ATOM 300 CB CYS A 457 5.530 -24.001 -5.085 1.00 35.55 C ATOM 301 SG CYS A 457 7.199 -24.669 -5.165 1.00 36.05 S ATOM 302 N ALA A 458 6.731 -22.622 -7.925 1.00 36.78 N ATOM 303 CA ALA A 458 7.126 -22.896 -9.308 1.00 37.31 C ATOM 304 C ALA A 458 7.890 -24.209 -9.402 1.00 36.47 C ATOM 305 O ALA A 458 8.195 -24.691 -10.494 1.00 36.66 O ATOM 306 CB ALA A 458 7.969 -21.757 -9.859 1.00 38.28 C ATOM 307 N GLY A 459 8.213 -24.757 -8.236 1.00 36.28 N ATOM 308 CA GLY A 459 8.922 -26.015 -8.101 1.00 37.73 C ATOM 309 C GLY A 459 8.011 -27.172 -7.739 1.00 40.06 C ATOM 310 O GLY A 459 6.886 -27.276 -8.229 1.00 40.54 O ATOM 311 N ARG A 460 8.550 -28.080 -6.933 1.00 39.24 N ATOM 312 CA ARG A 460 7.854 -29.266 -6.420 1.00 40.28 C ATOM 313 C ARG A 460 7.307 -29.132 -4.987 1.00 40.20 C ATOM 314 O ARG A 460 7.047 -30.141 -4.332 1.00 42.65 O ATOM 315 CB ARG A 460 8.773 -30.477 -6.539 1.00 41.41 C ATOM 316 CG ARG A 460 9.169 -30.725 -7.987 1.00 45.78 C ATOM 317 CD ARG A 460 9.923 -32.021 -8.178 1.00 49.23 C ATOM 318 NE ARG A 460 10.550 -32.066 -9.495 1.00 53.41 N ATOM 319 CZ ARG A 460 11.402 -33.008 -9.887 1.00 52.75 C ATOM 320 NH1 ARG A 460 11.728 -33.994 -9.062 1.00 52.59 N ATOM 321 NH2 ARG A 460 11.927 -32.964 -11.104 1.00 54.73 N ATOM 322 N ASN A 461 7.254 -27.900 -4.480 1.00 37.13 N ATOM 323 CA ASN A 461 6.870 -27.569 -3.098 1.00 40.21 C ATOM 324 C ASN A 461 7.838 -28.104 -2.048 1.00 39.08 C ATOM 325 O ASN A 461 7.469 -28.263 -0.888 1.00 39.01 O ATOM 326 CB ASN A 461 5.464 -28.100 -2.766 1.00 41.29 C ATOM 327 CG ASN A 461 4.363 -27.392 -3.533 1.00 41.96 C ATOM 328 OD1 ASN A 461 3.893 -27.883 -4.557 1.00 44.03 O ATOM 329 ND2 ASN A 461 3.932 -26.238 -3.029 1.00 41.61 N ATOM 330 N ASP A 462 9.049 -28.441 -2.478 1.00 38.92 N ATOM 331 CA ASP A 462 10.180 -28.734 -1.597 1.00 37.01 C ATOM 332 C ASP A 462 11.284 -27.660 -1.589 1.00 39.02 C ATOM 333 O ASP A 462 12.409 -27.966 -1.202 1.00 40.57 O ATOM 334 CB ASP A 462 10.780 -30.103 -1.916 1.00 44.35 C ATOM 335 CG ASP A 462 11.082 -30.279 -3.371 1.00 42.23 C ATOM 336 OD1 ASP A 462 11.021 -29.282 -4.122 1.00 42.33 O ATOM 337 OD2 ASP A 462 11.387 -31.425 -3.761 1.00 53.15 O ATOM 338 N CYS A 463 11.017 -26.468 -2.124 1.00 37.36 N ATOM 339 CA CYS A 463 12.063 -25.446 -2.312 1.00 39.52 C ATOM 340 C CYS A 463 12.921 -25.223 -1.067 1.00 39.23 C ATOM 341 O CYS A 463 12.420 -25.237 0.057 1.00 39.62 O ATOM 342 CB CYS A 463 11.449 -24.101 -2.732 1.00 35.35 C ATOM 343 SG CYS A 463 10.653 -24.068 -4.366 1.00 37.22 S ATOM 344 N ILE A 464 14.225 -25.063 -1.278 1.00 36.34 N ATOM 345 CA ILE A 464 15.153 -24.789 -0.186 1.00 37.79 C ATOM 346 C ILE A 464 14.950 -23.374 0.331 1.00 38.29 C ATOM 347 O ILE A 464 15.063 -22.410 -0.422 1.00 38.64 O ATOM 348 CB ILE A 464 16.622 -24.960 -0.629 1.00 41.53 C ATOM 349 CG1 ILE A 464 16.873 -26.394 -1.099 1.00 42.92 C ATOM 350 CG2 ILE A 464 17.578 -24.580 0.503 1.00 40.10 C ATOM 351 CD1 ILE A 464 18.197 -26.578 -1.815 1.00 47.30 C ATOM 352 N ILE A 465 14.657 -23.250 1.618 1.00 37.47 N ATOM 353 CA ILE A 465 14.461 -21.937 2.213 1.00 37.18 C ATOM 354 C ILE A 465 15.606 -21.640 3.173 1.00 38.01 C ATOM 355 O ILE A 465 15.675 -22.206 4.261 1.00 38.92 O ATOM 356 CB ILE A 465 13.113 -21.853 2.960 1.00 38.40 C ATOM 357 CG1 ILE A 465 11.951 -22.187 2.016 1.00 37.43 C ATOM 358 CG2 ILE A 465 12.929 -20.482 3.601 1.00 39.45 C ATOM 359 CD1 ILE A 465 11.769 -21.203 0.881 1.00 36.29 C ATOM 360 N ASP A 466 16.499 -20.745 2.766 1.00 38.39 N ATOM 361 CA ASP A 466 17.585 -20.293 3.630 1.00 41.71 C ATOM 362 C ASP A 466 17.736 -18.788 3.447 1.00 42.63 C ATOM 363 O ASP A 466 16.943 -18.171 2.736 1.00 42.39 O ATOM 364 CB ASP A 466 18.897 -21.042 3.333 1.00 40.28 C ATOM 365 CG ASP A 466 19.330 -20.941 1.876 1.00 43.61 C ATOM 366 OD1 ASP A 466 18.745 -20.142 1.114 1.00 44.93 O ATOM 367 OD2 ASP A 466 20.277 -21.663 1.488 1.00 46.38 O ATOM 368 N LYS A 467 18.741 -18.196 4.085 1.00 43.72 N ATOM 369 CA LYS A 467 18.896 -16.744 4.046 1.00 46.93 C ATOM 370 C LYS A 467 19.020 -16.222 2.617 1.00 44.96 C ATOM 371 O LYS A 467 18.536 -15.140 2.306 1.00 49.21 O ATOM 372 CB LYS A 467 20.109 -16.308 4.874 1.00 47.73 C ATOM 373 CG LYS A 467 20.317 -14.802 4.906 1.00 49.71 C ATOM 374 CD LYS A 467 21.302 -14.388 5.981 1.00 51.37 C ATOM 375 CE LYS A 467 21.772 -12.964 5.740 1.00 58.84 C ATOM 376 NZ LYS A 467 20.641 -12.020 5.479 1.00 62.48 N ATOM 377 N ILE A 468 19.652 -17.000 1.746 1.00 44.75 N ATOM 378 CA ILE A 468 19.837 -16.598 0.357 1.00 43.04 C ATOM 379 C ILE A 468 18.577 -16.809 -0.491 1.00 45.72 C ATOM 380 O ILE A 468 18.227 -15.965 -1.318 1.00 45.71 O ATOM 381 CB ILE A 468 21.011 -17.368 -0.290 1.00 43.10 C ATOM 382 CG1 ILE A 468 22.292 -17.180 0.527 1.00 44.79 C ATOM 383 CG2 ILE A 468 21.223 -16.913 -1.727 1.00 45.81 C ATOM 384 CD1 ILE A 468 23.512 -17.842 -0.086 1.00 48.82 C ATOM 385 N ARG A 469 17.910 -17.943 -0.297 1.00 44.02 N ATOM 386 CA ARG A 469 16.789 -18.329 -1.155 1.00 39.28 C ATOM 387 C ARG A 469 15.364 -18.089 -0.622 1.00 38.54 C ATOM 388 O ARG A 469 14.393 -18.390 -1.318 1.00 39.15 O ATOM 389 CB ARG A 469 16.947 -19.806 -1.526 1.00 36.97 C ATOM 390 CG ARG A 469 18.051 -20.047 -2.554 1.00 39.46 C ATOM 391 CD ARG A 469 18.463 -21.508 -2.628 1.00 36.61 C ATOM 392 NE ARG A 469 19.445 -21.850 -1.603 1.00 41.29 N ATOM 393 CZ ARG A 469 20.187 -22.954 -1.623 1.00 39.91 C ATOM 394 NH1 ARG A 469 20.055 -23.824 -2.615 1.00 41.79 N ATOM 395 NH2 ARG A 469 21.060 -23.187 -0.653 1.00 45.81 N ATOM 396 N ARG A 470 15.220 -17.556 0.588 1.00 38.66 N ATOM 397 CA ARG A 470 13.890 -17.468 1.204 1.00 38.84 C ATOM 398 C ARG A 470 12.935 -16.523 0.466 1.00 38.65 C ATOM 399 O ARG A 470 11.717 -16.671 0.565 1.00 38.77 O ATOM 400 CB ARG A 470 14.002 -17.043 2.672 1.00 38.56 C ATOM 401 CG ARG A 470 14.555 -15.652 2.888 1.00 38.71 C ATOM 402 CD ARG A 470 14.869 -15.422 4.358 1.00 41.27 C ATOM 403 NE ARG A 470 15.470 -14.113 4.576 1.00 41.92 N ATOM 404 CZ ARG A 470 16.210 -13.793 5.631 1.00 42.87 C ATOM 405 NH1 ARG A 470 16.446 -14.688 6.581 1.00 40.33 N ATOM 406 NH2 ARG A 470 16.716 -12.572 5.732 1.00 45.27 N ATOM 407 N LYS A 471 13.481 -15.565 -0.276 1.00 35.27 N ATOM 408 CA LYS A 471 12.654 -14.631 -1.038 1.00 37.69 C ATOM 409 C LYS A 471 12.051 -15.269 -2.290 1.00 40.40 C ATOM 410 O LYS A 471 11.054 -14.783 -2.819 1.00 39.62 O ATOM 411 CB LYS A 471 13.466 -13.399 -1.450 1.00 42.56 C ATOM 412 CG LYS A 471 13.994 -12.557 -0.295 1.00 44.22 C ATOM 413 CD LYS A 471 14.850 -11.409 -0.825 1.00 49.18 C ATOM 414 CE LYS A 471 15.542 -10.651 0.301 1.00 49.73 C ATOM 415 NZ LYS A 471 16.411 -11.536 1.131 1.00 51.55 N ATOM 416 N ASN A 472 12.666 -16.348 -2.768 1.00 38.38 N ATOM 417 CA ASN A 472 12.247 -16.973 -4.020 1.00 37.70 C ATOM 418 C ASN A 472 10.846 -17.581 -3.973 1.00 38.34 C ATOM 419 O ASN A 472 10.070 -17.448 -4.921 1.00 36.22 O ATOM 420 CB ASN A 472 13.240 -18.065 -4.430 1.00 35.90 C ATOM 421 CG ASN A 472 14.618 -17.520 -4.752 1.00 40.86 C ATOM 422 OD1 ASN A 472 15.073 -16.539 -4.161 1.00 42.12 O ATOM 423 ND2 ASN A 472 15.295 -18.163 -5.694 1.00 42.67 N ATOM 424 N CYS A 473 10.527 -18.274 -2.886 1.00 35.74 N ATOM 425 CA CYS A 473 9.263 -18.993 -2.839 1.00 37.26 C ATOM 426 C CYS A 473 8.491 -18.757 -1.551 1.00 32.11 C ATOM 427 O CYS A 473 8.676 -19.473 -0.572 1.00 32.70 O ATOM 428 CB CYS A 473 9.493 -20.493 -3.034 1.00 34.26 C ATOM 429 SG CYS A 473 7.963 -21.399 -3.386 1.00 33.77 S ATOM 430 N PRO A 474 7.624 -17.736 -1.547 1.00 33.98 N ATOM 431 CA PRO A 474 6.758 -17.491 -0.389 1.00 31.80 C ATOM 432 C PRO A 474 5.847 -18.679 -0.071 1.00 32.63 C ATOM 433 O PRO A 474 5.528 -18.889 1.095 1.00 31.02 O ATOM 434 CB PRO A 474 5.939 -16.263 -0.808 1.00 36.36 C ATOM 435 CG PRO A 474 6.138 -16.128 -2.297 1.00 38.51 C ATOM 436 CD PRO A 474 7.494 -16.688 -2.573 1.00 33.73 C ATOM 437 N ALA A 475 5.443 -19.447 -1.080 1.00 31.57 N ATOM 438 CA ALA A 475 4.631 -20.636 -0.834 1.00 34.55 C ATOM 439 C ALA A 475 5.347 -21.608 0.100 1.00 30.70 C ATOM 440 O ALA A 475 4.787 -22.053 1.098 1.00 29.57 O ATOM 441 CB ALA A 475 4.278 -21.327 -2.148 1.00 34.95 C ATOM 442 N CYS A 476 6.589 -21.932 -0.227 1.00 29.55 N ATOM 443 CA CYS A 476 7.346 -22.888 0.569 1.00 27.89 C ATOM 444 C CYS A 476 7.773 -22.278 1.896 1.00 29.61 C ATOM 445 O CYS A 476 7.868 -22.972 2.904 1.00 29.26 O ATOM 446 CB CYS A 476 8.563 -23.390 -0.208 1.00 29.75 C ATOM 447 SG CYS A 476 8.144 -24.617 -1.486 1.00 31.91 S ATOM 448 N ARG A 477 8.035 -20.978 1.899 1.00 29.26 N ATOM 449 CA ARG A 477 8.387 -20.312 3.147 1.00 29.90 C ATOM 450 C ARG A 477 7.210 -20.343 4.115 1.00 29.06 C ATOM 451 O ARG A 477 7.380 -20.641 5.294 1.00 31.62 O ATOM 452 CB ARG A 477 8.823 -18.870 2.900 1.00 31.26 C ATOM 453 CG ARG A 477 9.444 -18.205 4.124 1.00 32.50 C ATOM 454 CD ARG A 477 9.852 -16.779 3.812 1.00 32.69 C ATOM 455 NE ARG A 477 10.647 -16.177 4.878 1.00 34.20 N ATOM 456 CZ ARG A 477 11.144 -14.946 4.820 1.00 35.36 C ATOM 457 NH1 ARG A 477 10.921 -14.199 3.746 1.00 34.87 N ATOM 458 NH2 ARG A 477 11.862 -14.461 5.827 1.00 34.29 N ATOM 459 N TYR A 478 6.017 -20.039 3.613 1.00 30.08 N ATOM 460 CA TYR A 478 4.822 -20.036 4.454 1.00 30.25 C ATOM 461 C TYR A 478 4.504 -21.443 4.949 1.00 29.62 C ATOM 462 O TYR A 478 4.124 -21.626 6.098 1.00 29.78 O ATOM 463 CB TYR A 478 3.626 -19.453 3.695 1.00 29.94 C ATOM 464 CG TYR A 478 2.349 -19.389 4.507 1.00 33.20 C ATOM 465 CD1 TYR A 478 2.244 -18.556 5.615 1.00 32.87 C ATOM 466 CD2 TYR A 478 1.248 -20.159 4.162 1.00 36.97 C ATOM 467 CE1 TYR A 478 1.069 -18.492 6.360 1.00 35.28 C ATOM 468 CE2 TYR A 478 0.071 -20.105 4.898 1.00 38.30 C ATOM 469 CZ TYR A 478 -0.015 -19.270 5.992 1.00 38.45 C ATOM 470 OH TYR A 478 -1.187 -19.225 6.716 1.00 39.43 O ATOM 471 N ARG A 479 4.668 -22.435 4.079 1.00 28.84 N ATOM 472 CA ARG A 479 4.472 -23.830 4.467 1.00 29.39 C ATOM 473 C ARG A 479 5.416 -24.222 5.608 1.00 29.95 C ATOM 474 O ARG A 479 5.014 -24.912 6.547 1.00 30.15 O ATOM 475 CB ARG A 479 4.678 -24.761 3.265 1.00 30.14 C ATOM 476 CG ARG A 479 4.640 -26.245 3.619 1.00 32.38 C ATOM 477 CD ARG A 479 4.937 -27.132 2.409 1.00 40.07 C ATOM 478 NE ARG A 479 6.126 -26.698 1.675 1.00 37.34 N ATOM 479 CZ ARG A 479 7.376 -26.957 2.051 1.00 40.80 C ATOM 480 NH1 ARG A 479 7.610 -27.652 3.159 1.00 36.37 N ATOM 481 NH2 ARG A 479 8.394 -26.517 1.323 1.00 39.51 N ATOM 482 N LYS A 480 6.668 -23.775 5.527 1.00 29.67 N ATOM 483 CA LYS A 480 7.642 -24.071 6.575 1.00 30.48 C ATOM 484 C LYS A 480 7.291 -23.364 7.881 1.00 31.21 C ATOM 485 O LYS A 480 7.506 -23.915 8.958 1.00 33.32 O ATOM 486 CB LYS A 480 9.055 -23.683 6.138 1.00 30.81 C ATOM 487 CG LYS A 480 9.647 -24.615 5.094 1.00 37.52 C ATOM 488 CD LYS A 480 11.143 -24.398 4.942 1.00 38.76 C ATOM 489 CE LYS A 480 11.896 -24.942 6.150 1.00 42.90 C ATOM 490 NZ LYS A 480 13.375 -24.785 6.013 1.00 44.03 N ATOM 491 N CYS A 481 6.759 -22.148 7.783 1.00 30.44 N ATOM 492 CA CYS A 481 6.271 -21.432 8.963 1.00 30.57 C ATOM 493 C CYS A 481 5.204 -22.243 9.690 1.00 30.92 C ATOM 494 O CYS A 481 5.261 -22.408 10.907 1.00 32.99 O ATOM 495 CB CYS A 481 5.696 -20.067 8.580 1.00 32.62 C ATOM 496 SG CYS A 481 6.904 -18.833 8.057 1.00 34.20 S ATOM 497 N LEU A 482 4.233 -22.747 8.932 1.00 29.94 N ATOM 498 CA LEU A 482 3.135 -23.519 9.503 1.00 30.61 C ATOM 499 C LEU A 482 3.617 -24.842 10.083 1.00 30.93 C ATOM 500 O LEU A 482 3.185 -25.243 11.157 1.00 32.75 O ATOM 501 CB LEU A 482 2.050 -23.785 8.458 1.00 28.18 C ATOM 502 CG LEU A 482 1.262 -22.588 7.925 1.00 31.03 C ATOM 503 CD1 LEU A 482 0.274 -23.052 6.868 1.00 31.28 C ATOM 504 CD2 LEU A 482 0.546 -21.853 9.051 1.00 33.90 C ATOM 505 N GLN A 483 4.509 -25.518 9.368 1.00 31.74 N ATOM 506 CA GLN A 483 5.008 -26.807 9.819 1.00 34.86 C ATOM 507 C GLN A 483 5.805 -26.643 11.119 1.00 38.35 C ATOM 508 O GLN A 483 5.771 -27.508 11.994 1.00 41.34 O ATOM 509 CB GLN A 483 5.856 -27.467 8.727 1.00 40.17 C ATOM 510 CG GLN A 483 5.858 -28.988 8.805 1.00 47.71 C ATOM 511 CD GLN A 483 5.584 -29.651 7.466 1.00 52.42 C ATOM 512 OE1 GLN A 483 6.050 -29.193 6.417 1.00 54.18 O ATOM 513 NE2 GLN A 483 4.814 -30.736 7.495 1.00 51.52 N ATOM 514 N ALA A 484 6.490 -25.512 11.256 1.00 34.80 N ATOM 515 CA ALA A 484 7.247 -25.222 12.467 1.00 34.93 C ATOM 516 C ALA A 484 6.316 -24.880 13.630 1.00 40.48 C ATOM 517 O ALA A 484 6.736 -24.886 14.789 1.00 38.78 O ATOM 518 CB ALA A 484 8.229 -24.088 12.219 1.00 34.51 C ATOM 519 N GLY A 485 5.055 -24.582 13.317 1.00 35.95 N ATOM 520 CA GLY A 485 4.055 -24.326 14.341 1.00 35.28 C ATOM 521 C GLY A 485 3.698 -22.874 14.618 1.00 36.29 C ATOM 522 O GLY A 485 3.062 -22.578 15.629 1.00 36.08 O ATOM 523 N MET A 486 4.092 -21.962 13.734 1.00 34.05 N ATOM 524 CA MET A 486 3.783 -20.547 13.935 1.00 33.81 C ATOM 525 C MET A 486 2.278 -20.292 13.910 1.00 36.00 C ATOM 526 O MET A 486 1.552 -20.848 13.084 1.00 31.57 O ATOM 527 CB MET A 486 4.476 -19.684 12.878 1.00 34.59 C ATOM 528 CG MET A 486 5.996 -19.737 12.928 1.00 37.09 C ATOM 529 SD MET A 486 6.758 -18.575 11.779 1.00 35.09 S ATOM 530 CE MET A 486 6.531 -17.035 12.658 1.00 34.44 C ATOM 531 N ASN A 487 1.809 -19.468 14.839 1.00 35.89 N ATOM 532 CA ASN A 487 0.398 -19.111 14.900 1.00 37.46 C ATOM 533 C ASN A 487 0.209 -17.749 15.555 1.00 41.19 C ATOM 534 O ASN A 487 0.963 -17.375 16.452 1.00 38.19 O ATOM 535 CB ASN A 487 -0.398 -20.185 15.650 1.00 38.59 C ATOM 536 CG ASN A 487 -0.006 -20.294 17.111 1.00 44.21 C ATOM 537 OD1 ASN A 487 -0.750 -19.871 17.994 1.00 48.83 O ATOM 538 ND2 ASN A 487 1.165 -20.869 17.375 1.00 42.13 N ATOM 539 N LEU A 488 -0.808 -17.018 15.112 1.00 42.44 N ATOM 540 CA LEU A 488 -1.034 -15.653 15.577 1.00 47.18 C ATOM 541 C LEU A 488 -1.434 -15.562 17.044 1.00 47.81 C ATOM 542 O LEU A 488 -1.061 -14.614 17.734 1.00 53.06 O ATOM 543 CB LEU A 488 -2.108 -14.973 14.728 1.00 44.83 C ATOM 544 CG LEU A 488 -1.640 -14.303 13.440 1.00 45.96 C ATOM 545 CD1 LEU A 488 -2.614 -13.208 13.033 1.00 51.01 C ATOM 546 CD2 LEU A 488 -0.233 -13.747 13.593 1.00 47.19 C ATOM 547 N GLU A 489 -2.189 -16.545 17.520 1.00 49.59 N ATOM 548 CA GLU A 489 -2.776 -16.463 18.853 1.00 54.33 C ATOM 549 C GLU A 489 -1.831 -16.933 19.957 1.00 54.40 C ATOM 550 O GLU A 489 -2.196 -16.934 21.132 1.00 57.45 O ATOM 551 CB GLU A 489 -4.077 -17.267 18.905 1.00 56.06 C ATOM 552 CG GLU A 489 -5.131 -16.789 17.913 1.00 57.35 C ATOM 553 CD GLU A 489 -5.514 -15.334 18.114 1.00 60.56 C ATOM 554 OE1 GLU A 489 -6.341 -15.054 19.007 1.00 66.80 O ATOM 555 OE2 GLU A 489 -4.989 -14.471 17.379 1.00 61.13 O ATOM 556 N ALA A 490 -0.619 -17.326 19.580 1.00 52.94 N ATOM 557 CA ALA A 490 0.376 -17.764 20.555 1.00 54.55 C ATOM 558 C ALA A 490 0.766 -16.622 21.489 1.00 58.65 C ATOM 559 O ALA A 490 0.566 -15.449 21.166 1.00 59.55 O ATOM 560 CB ALA A 490 1.604 -18.314 19.850 1.00 50.54 C TER 561 ALA A 490 ATOM 562 O5' DG C 18 17.316 -6.176 27.941 1.00 72.61 O ATOM 563 C5' DG C 18 17.716 -7.289 28.733 1.00 72.29 C ATOM 564 C4' DG C 18 16.516 -8.136 29.118 1.00 70.82 C ATOM 565 O4' DG C 18 15.624 -7.357 29.945 1.00 69.23 O ATOM 566 C3' DG C 18 15.670 -8.608 27.949 1.00 68.34 C ATOM 567 O3' DG C 18 16.167 -9.854 27.474 1.00 70.09 O ATOM 568 C2' DG C 18 14.283 -8.765 28.572 1.00 65.41 C ATOM 569 C1' DG C 18 14.278 -7.707 29.677 1.00 65.22 C ATOM 570 N9 DG C 18 13.543 -6.490 29.337 1.00 62.17 N ATOM 571 C8 DG C 18 14.077 -5.267 29.009 1.00 62.48 C ATOM 572 N7 DG C 18 13.178 -4.356 28.764 1.00 61.12 N ATOM 573 C5 DG C 18 11.968 -5.014 28.945 1.00 59.99 C ATOM 574 C6 DG C 18 10.643 -4.536 28.819 1.00 58.79 C ATOM 575 O6 DG C 18 10.265 -3.398 28.511 1.00 59.09 O ATOM 576 N1 DG C 18 9.706 -5.532 29.088 1.00 58.76 N ATOM 577 C2 DG C 18 10.013 -6.825 29.437 1.00 59.34 C ATOM 578 N2 DG C 18 8.974 -7.643 29.660 1.00 59.61 N ATOM 579 N3 DG C 18 11.252 -7.287 29.560 1.00 59.08 N ATOM 580 C4 DG C 18 12.176 -6.329 29.300 1.00 59.66 C ATOM 581 P DA C 19 15.978 -10.269 25.934 1.00 70.36 P ATOM 582 OP1 DA C 19 16.764 -11.504 25.717 1.00 71.62 O ATOM 583 OP2 DA C 19 16.228 -9.071 25.100 1.00 66.50 O ATOM 584 O5' DA C 19 14.422 -10.613 25.817 1.00 62.42 O ATOM 585 C5' DA C 19 13.884 -11.738 26.499 1.00 58.22 C ATOM 586 C4' DA C 19 12.372 -11.705 26.446 1.00 57.94 C ATOM 587 O4' DA C 19 11.916 -10.482 27.054 1.00 57.39 O ATOM 588 C3' DA C 19 11.788 -11.701 25.042 1.00 55.42 C ATOM 589 O3' DA C 19 11.530 -13.040 24.630 1.00 53.61 O ATOM 590 C2' DA C 19 10.486 -10.913 25.202 1.00 55.52 C ATOM 591 C1' DA C 19 10.734 -10.036 26.428 1.00 55.50 C ATOM 592 N9 DA C 19 10.885 -8.620 26.116 1.00 56.11 N ATOM 593 C8 DA C 19 12.050 -7.949 25.864 1.00 57.58 C ATOM 594 N7 DA C 19 11.881 -6.670 25.624 1.00 56.01 N ATOM 595 C5 DA C 19 10.512 -6.491 25.729 1.00 54.47 C ATOM 596 C6 DA C 19 9.691 -5.358 25.592 1.00 54.59 C ATOM 597 N6 DA C 19 10.160 -4.141 25.296 1.00 55.42 N ATOM 598 N1 DA C 19 8.362 -5.525 25.757 1.00 54.00 N ATOM 599 C2 DA C 19 7.895 -6.744 26.049 1.00 54.24 C ATOM 600 N3 DA C 19 8.568 -7.881 26.208 1.00 53.02 N ATOM 601 C4 DA C 19 9.884 -7.683 26.033 1.00 54.90 C ATOM 602 P DG C 20 11.398 -13.410 23.070 1.00 55.18 P ATOM 603 OP1 DG C 20 11.189 -14.872 22.999 1.00 54.66 O ATOM 604 OP2 DG C 20 12.525 -12.794 22.336 1.00 51.30 O ATOM 605 O5' DG C 20 10.063 -12.661 22.601 1.00 49.57 O ATOM 606 C5' DG C 20 8.799 -13.027 23.138 1.00 48.14 C ATOM 607 C4' DG C 20 7.724 -12.077 22.641 1.00 51.47 C ATOM 608 O4' DG C 20 8.032 -10.718 23.074 1.00 48.00 O ATOM 609 C3' DG C 20 7.589 -12.011 21.114 1.00 45.66 C ATOM 610 O3' DG C 20 6.224 -12.002 20.747 1.00 47.66 O ATOM 611 C2' DG C 20 8.258 -10.688 20.766 1.00 47.14 C ATOM 612 C1' DG C 20 7.886 -9.853 21.976 1.00 49.08 C ATOM 613 N9 DG C 20 8.740 -8.679 22.139 1.00 51.38 N ATOM 614 C8 DG C 20 10.116 -8.643 22.134 1.00 51.16 C ATOM 615 N7 DG C 20 10.603 -7.439 22.265 1.00 51.25 N ATOM 616 C5 DG C 20 9.479 -6.625 22.346 1.00 51.21 C ATOM 617 C6 DG C 20 9.376 -5.219 22.489 1.00 52.08 C ATOM 618 O6 DG C 20 10.290 -4.387 22.586 1.00 53.51 O ATOM 619 N1 DG C 20 8.047 -4.800 22.532 1.00 51.11 N ATOM 620 C2 DG C 20 6.957 -5.634 22.439 1.00 51.70 C ATOM 621 N2 DG C 20 5.753 -5.049 22.496 1.00 50.18 N ATOM 622 N3 DG C 20 7.041 -6.951 22.301 1.00 50.80 N ATOM 623 C4 DG C 20 8.327 -7.374 22.261 1.00 49.78 C ATOM 624 P DG C 21 5.791 -12.223 19.213 1.00 44.25 P ATOM 625 OP1 DG C 21 5.080 -13.516 19.163 1.00 43.68 O ATOM 626 OP2 DG C 21 6.950 -11.977 18.321 1.00 44.62 O ATOM 627 O5' DG C 21 4.749 -11.049 18.939 1.00 43.33 O ATOM 628 C5' DG C 21 3.668 -10.840 19.832 1.00 45.23 C ATOM 629 C4' DG C 21 3.007 -9.501 19.566 1.00 47.32 C ATOM 630 O4' DG C 21 3.899 -8.427 19.972 1.00 44.30 O ATOM 631 C3' DG C 21 2.655 -9.238 18.105 1.00 47.82 C ATOM 632 O3' DG C 21 1.400 -8.592 18.025 1.00 46.28 O ATOM 633 C2' DG C 21 3.792 -8.337 17.619 1.00 47.48 C ATOM 634 C1' DG C 21 4.161 -7.566 18.881 1.00 47.31 C ATOM 635 N9 DG C 21 5.571 -7.182 18.937 1.00 49.72 N ATOM 636 C8 DG C 21 6.657 -8.026 18.919 1.00 47.65 C ATOM 637 N7 DG C 21 7.800 -7.404 18.989 1.00 46.49 N ATOM 638 C5 DG C 21 7.454 -6.062 19.062 1.00 49.28 C ATOM 639 C6 DG C 21 8.277 -4.913 19.159 1.00 48.74 C ATOM 640 O6 DG C 21 9.512 -4.856 19.196 1.00 48.47 O ATOM 641 N1 DG C 21 7.526 -3.744 19.209 1.00 47.29 N ATOM 642 C2 DG C 21 6.154 -3.690 19.173 1.00 48.60 C ATOM 643 N2 DG C 21 5.606 -2.468 19.233 1.00 47.87 N ATOM 644 N3 DG C 21 5.370 -4.759 19.085 1.00 48.67 N ATOM 645 C4 DG C 21 6.086 -5.906 19.033 1.00 47.98 C ATOM 646 P DA C 22 0.666 -8.411 16.610 1.00 49.70 P ATOM 647 OP1 DA C 22 -0.779 -8.248 16.893 1.00 50.75 O ATOM 648 OP2 DA C 22 1.124 -9.487 15.702 1.00 47.57 O ATOM 649 O5' DA C 22 1.221 -7.013 16.078 1.00 51.33 O ATOM 650 C5' DA C 22 1.040 -5.852 16.870 1.00 54.46 C ATOM 651 C4' DA C 22 1.704 -4.645 16.239 1.00 53.16 C ATOM 652 O4' DA C 22 3.122 -4.636 16.549 1.00 51.80 O ATOM 653 C3' DA C 22 1.605 -4.559 14.708 1.00 55.42 C ATOM 654 O3' DA C 22 1.243 -3.240 14.352 1.00 61.64 O ATOM 655 C2' DA C 22 3.032 -4.870 14.260 1.00 53.56 C ATOM 656 C1' DA C 22 3.808 -4.234 15.395 1.00 51.60 C ATOM 657 N9 DA C 22 5.199 -4.656 15.482 1.00 48.93 N ATOM 658 C8 DA C 22 5.696 -5.918 15.317 1.00 48.13 C ATOM 659 N7 DA C 22 7.002 -5.992 15.444 1.00 50.46 N ATOM 660 C5 DA C 22 7.384 -4.684 15.708 1.00 50.30 C ATOM 661 C6 DA C 22 8.641 -4.088 15.942 1.00 49.48 C ATOM 662 N6 DA C 22 9.790 -4.771 15.950 1.00 49.41 N ATOM 663 N1 DA C 22 8.669 -2.757 16.172 1.00 49.81 N ATOM 664 C2 DA C 22 7.518 -2.077 16.166 1.00 49.44 C ATOM 665 N3 DA C 22 6.281 -2.526 15.957 1.00 51.42 N ATOM 666 C4 DA C 22 6.285 -3.850 15.733 1.00 49.79 C ATOM 667 P DA C 23 0.591 -2.906 12.922 1.00 63.50 P ATOM 668 OP1 DA C 23 -0.870 -3.111 13.042 1.00 63.31 O ATOM 669 OP2 DA C 23 1.353 -3.612 11.864 1.00 58.89 O ATOM 670 O5' DA C 23 0.873 -1.342 12.764 1.00 62.75 O ATOM 671 C5' DA C 23 0.808 -0.501 13.910 1.00 61.38 C ATOM 672 C4' DA C 23 1.879 0.572 13.861 1.00 63.48 C ATOM 673 O4' DA C 23 3.181 -0.017 14.117 1.00 60.07 O ATOM 674 C3' DA C 23 1.994 1.308 12.530 1.00 64.69 C ATOM 675 O3' DA C 23 2.205 2.690 12.771 1.00 69.64 O ATOM 676 C2' DA C 23 3.207 0.653 11.866 1.00 61.62 C ATOM 677 C1' DA C 23 4.072 0.294 13.066 1.00 59.71 C ATOM 678 N9 DA C 23 4.931 -0.869 12.842 1.00 56.15 N ATOM 679 C8 DA C 23 4.531 -2.131 12.498 1.00 54.30 C ATOM 680 N7 DA C 23 5.520 -2.985 12.376 1.00 51.44 N ATOM 681 C5 DA C 23 6.646 -2.235 12.663 1.00 50.90 C ATOM 682 C6 DA C 23 8.016 -2.561 12.705 1.00 50.56 C ATOM 683 N6 DA C 23 8.490 -3.784 12.445 1.00 48.67 N ATOM 684 N1 DA C 23 8.883 -1.577 13.027 1.00 51.55 N ATOM 685 C2 DA C 23 8.404 -0.354 13.287 1.00 51.45 C ATOM 686 N3 DA C 23 7.140 0.071 13.277 1.00 53.58 N ATOM 687 C4 DA C 23 6.303 -0.928 12.956 1.00 53.06 C ATOM 688 P DA C 24 2.202 3.739 11.556 1.00 73.27 P ATOM 689 OP1 DA C 24 1.578 4.986 12.051 1.00 78.25 O ATOM 690 OP2 DA C 24 1.642 3.058 10.366 1.00 72.60 O ATOM 691 O5' DA C 24 3.756 4.011 11.300 1.00 69.25 O ATOM 692 C5' DA C 24 4.619 4.237 12.406 1.00 68.47 C ATOM 693 C4' DA C 24 6.047 4.466 11.947 1.00 69.09 C ATOM 694 O4' DA C 24 6.736 3.195 11.819 1.00 66.04 O ATOM 695 C3' DA C 24 6.188 5.172 10.604 1.00 70.35 C ATOM 696 O3' DA C 24 7.236 6.123 10.681 1.00 72.77 O ATOM 697 C2' DA C 24 6.517 4.032 9.635 1.00 66.24 C ATOM 698 C1' DA C 24 7.290 3.068 10.526 1.00 63.77 C ATOM 699 N9 DA C 24 7.173 1.667 10.119 1.00 57.23 N ATOM 700 C8 DA C 24 6.035 1.013 9.735 1.00 56.46 C ATOM 701 N7 DA C 24 6.226 -0.250 9.435 1.00 54.27 N ATOM 702 C5 DA C 24 7.582 -0.441 9.644 1.00 53.40 C ATOM 703 C6 DA C 24 8.417 -1.570 9.504 1.00 52.22 C ATOM 704 N6 DA C 24 7.976 -2.766 9.102 1.00 49.54 N ATOM 705 N1 DA C 24 9.725 -1.420 9.794 1.00 50.36 N ATOM 706 C2 DA C 24 10.164 -0.221 10.193 1.00 52.17 C ATOM 707 N3 DA C 24 9.479 0.910 10.362 1.00 53.74 N ATOM 708 C4 DA C 24 8.181 0.730 10.067 1.00 54.53 C ATOM 709 P DT C 25 7.556 7.086 9.436 1.00 78.08 P ATOM 710 OP1 DT C 25 7.981 8.391 9.990 1.00 81.76 O ATOM 711 OP2 DT C 25 6.419 7.023 8.489 1.00 76.26 O ATOM 712 O5' DT C 25 8.815 6.385 8.747 1.00 72.52 O ATOM 713 C5' DT C 25 9.899 5.942 9.553 1.00 69.47 C ATOM 714 C4' DT C 25 10.838 5.063 8.753 1.00 67.78 C ATOM 715 O4' DT C 25 10.272 3.748 8.615 1.00 62.29 O ATOM 716 C3' DT C 25 11.118 5.552 7.331 1.00 70.01 C ATOM 717 O3' DT C 25 12.453 6.038 7.247 1.00 72.45 O ATOM 718 C2' DT C 25 10.894 4.313 6.437 1.00 65.86 C ATOM 719 C1' DT C 25 10.778 3.172 7.443 1.00 62.04 C ATOM 720 N1 DT C 25 9.850 2.082 7.019 1.00 57.65 N ATOM 721 C2 DT C 25 10.330 0.797 6.904 1.00 54.91 C ATOM 722 O2 DT C 25 11.489 0.495 7.124 1.00 51.20 O ATOM 723 N3 DT C 25 9.398 -0.129 6.519 1.00 51.55 N ATOM 724 C4 DT C 25 8.063 0.093 6.244 1.00 52.37 C ATOM 725 O4 DT C 25 7.304 -0.810 5.905 1.00 51.74 O ATOM 726 C5 DT C 25 7.622 1.462 6.386 1.00 54.77 C ATOM 727 C7 DT C 25 6.193 1.826 6.115 1.00 53.91 C ATOM 728 C6 DT C 25 8.526 2.379 6.764 1.00 56.30 C ATOM 729 P DT C 26 12.980 6.747 5.905 1.00 74.10 P ATOM 730 OP1 DT C 26 13.964 7.778 6.306 1.00 74.69 O ATOM 731 OP2 DT C 26 11.803 7.124 5.089 1.00 72.13 O ATOM 732 O5' DT C 26 13.755 5.573 5.149 1.00 71.77 O ATOM 733 C5' DT C 26 14.655 4.747 5.876 1.00 71.22 C ATOM 734 C4' DT C 26 15.048 3.531 5.060 1.00 70.66 C ATOM 735 O4' DT C 26 13.950 2.585 5.028 1.00 66.30 O ATOM 736 C3' DT C 26 15.410 3.824 3.602 1.00 72.87 C ATOM 737 O3' DT C 26 16.672 3.253 3.302 1.00 76.67 O ATOM 738 C2' DT C 26 14.280 3.169 2.798 1.00 68.49 C ATOM 739 C1' DT C 26 13.836 2.054 3.731 1.00 66.03 C ATOM 740 N1 DT C 26 12.422 1.620 3.523 1.00 62.24 N ATOM 741 C2 DT C 26 12.135 0.275 3.462 1.00 57.10 C ATOM 742 O2 DT C 26 12.981 -0.594 3.567 1.00 55.41 O ATOM 743 N3 DT C 26 10.812 -0.019 3.275 1.00 54.66 N ATOM 744 C4 DT C 26 9.767 0.875 3.145 1.00 54.45 C ATOM 745 O4 DT C 26 8.609 0.509 2.980 1.00 52.43 O ATOM 746 C5 DT C 26 10.134 2.270 3.216 1.00 57.73 C ATOM 747 C7 DT C 26 9.084 3.335 3.087 1.00 56.13 C ATOM 748 C6 DT C 26 11.430 2.572 3.400 1.00 59.75 C ATOM 749 P DC C 27 17.450 3.660 1.958 1.00 78.47 P ATOM 750 OP1 DC C 27 18.876 3.836 2.313 1.00 77.86 O ATOM 751 OP2 DC C 27 16.706 4.759 1.300 1.00 74.84 O ATOM 752 O5' DC C 27 17.309 2.358 1.043 1.00 78.31 O ATOM 753 C5' DC C 27 17.574 1.075 1.599 1.00 77.06 C ATOM 754 C4' DC C 27 16.962 -0.016 0.744 1.00 72.89 C ATOM 755 O4' DC C 27 15.539 -0.058 0.958 1.00 68.67 O ATOM 756 C3' DC C 27 17.153 0.170 -0.763 1.00 72.59 C ATOM 757 O3' DC C 27 18.068 -0.797 -1.256 1.00 75.76 O ATOM 758 C2' DC C 27 15.747 -0.015 -1.364 1.00 68.67 C ATOM 759 C1' DC C 27 14.939 -0.571 -0.197 1.00 67.04 C ATOM 760 N1 DC C 27 13.511 -0.156 -0.212 1.00 63.04 N ATOM 761 C2 DC C 27 12.511 -1.130 -0.291 1.00 59.74 C ATOM 762 O2 DC C 27 12.835 -2.323 -0.342 1.00 57.25 O ATOM 763 N3 DC C 27 11.213 -0.737 -0.306 1.00 58.41 N ATOM 764 C4 DC C 27 10.907 0.560 -0.248 1.00 58.28 C ATOM 765 N4 DC C 27 9.613 0.899 -0.266 1.00 57.25 N ATOM 766 C5 DC C 27 11.914 1.567 -0.168 1.00 59.44 C ATOM 767 C6 DC C 27 13.190 1.167 -0.154 1.00 60.86 C ATOM 768 P DC C 28 18.550 -0.752 -2.788 1.00 77.79 P ATOM 769 OP1 DC C 28 19.893 -1.370 -2.847 1.00 75.18 O ATOM 770 OP2 DC C 28 18.341 0.623 -3.297 1.00 75.45 O ATOM 771 O5' DC C 28 17.512 -1.707 -3.535 1.00 73.28 O ATOM 772 C5' DC C 28 17.249 -2.996 -3.010 1.00 73.72 C ATOM 773 C4' DC C 28 16.096 -3.650 -3.743 1.00 72.08 C ATOM 774 O4' DC C 28 14.843 -3.066 -3.311 1.00 69.03 O ATOM 775 C3' DC C 28 16.137 -3.505 -5.267 1.00 72.43 C ATOM 776 O3' DC C 28 16.043 -4.780 -5.863 1.00 81.84 O ATOM 777 C2' DC C 28 14.910 -2.644 -5.588 1.00 68.76 C ATOM 778 C1' DC C 28 13.993 -2.962 -4.422 1.00 66.12 C ATOM 779 N1 DC C 28 12.987 -1.902 -4.157 1.00 62.63 N ATOM 780 C2 DC C 28 11.633 -2.239 -4.066 1.00 59.49 C ATOM 781 O2 DC C 28 11.296 -3.423 -4.197 1.00 59.01 O ATOM 782 N3 DC C 28 10.727 -1.258 -3.831 1.00 57.97 N ATOM 783 C4 DC C 28 11.133 0.006 -3.694 1.00 58.73 C ATOM 784 N4 DC C 28 10.204 0.938 -3.462 1.00 59.24 N ATOM 785 C5 DC C 28 12.508 0.369 -3.787 1.00 61.50 C ATOM 786 C6 DC C 28 13.392 -0.607 -4.020 1.00 62.88 C ATOM 787 P DA C 29 16.493 -5.008 -7.388 1.00 75.96 P ATOM 788 OP1 DA C 29 17.829 -5.639 -7.365 1.00 77.95 O ATOM 789 OP2 DA C 29 16.267 -3.763 -8.155 1.00 71.97 O ATOM 790 O5' DA C 29 15.439 -6.076 -7.919 1.00 71.42 O ATOM 791 C5' DA C 29 14.921 -7.045 -7.029 1.00 67.21 C ATOM 792 C4' DA C 29 13.547 -7.507 -7.478 1.00 63.75 C ATOM 793 O4' DA C 29 12.541 -6.552 -7.052 1.00 62.50 O ATOM 794 C3' DA C 29 13.376 -7.669 -8.984 1.00 59.79 C ATOM 795 O3' DA C 29 12.604 -8.824 -9.243 1.00 58.90 O ATOM 796 C2' DA C 29 12.646 -6.388 -9.402 1.00 59.14 C ATOM 797 C1' DA C 29 11.816 -6.067 -8.164 1.00 60.06 C ATOM 798 N9 DA C 29 11.591 -4.637 -7.959 1.00 58.70 N ATOM 799 C8 DA C 29 12.537 -3.650 -7.945 1.00 60.20 C ATOM 800 N7 DA C 29 12.050 -2.452 -7.720 1.00 59.15 N ATOM 801 C5 DA C 29 10.692 -2.668 -7.569 1.00 57.73 C ATOM 802 C6 DA C 29 9.614 -1.797 -7.309 1.00 56.54 C ATOM 803 N6 DA C 29 9.755 -0.478 -7.151 1.00 56.59 N ATOM 804 N1 DA C 29 8.381 -2.337 -7.220 1.00 55.98 N ATOM 805 C2 DA C 29 8.242 -3.659 -7.381 1.00 57.12 C ATOM 806 N3 DA C 29 9.178 -4.577 -7.627 1.00 57.75 N ATOM 807 C4 DA C 29 10.391 -4.011 -7.710 1.00 57.69 C ATOM 808 P DC C 30 12.468 -9.392 -10.737 1.00 58.67 P ATOM 809 OP1 DC C 30 12.349 -10.867 -10.639 1.00 54.61 O ATOM 810 OP2 DC C 30 13.539 -8.785 -11.558 1.00 55.75 O ATOM 811 O5' DC C 30 11.064 -8.806 -11.221 1.00 55.96 O ATOM 812 C5' DC C 30 9.924 -8.985 -10.398 1.00 56.25 C ATOM 813 C4' DC C 30 8.809 -8.042 -10.799 1.00 55.51 C ATOM 814 O4' DC C 30 9.129 -6.699 -10.395 1.00 57.35 O ATOM 815 C3' DC C 30 8.535 -7.967 -12.301 1.00 54.16 C ATOM 816 O3' DC C 30 7.303 -8.604 -12.583 1.00 53.12 O ATOM 817 C2' DC C 30 8.486 -6.454 -12.611 1.00 56.10 C ATOM 818 C1' DC C 30 8.407 -5.833 -11.223 1.00 57.07 C ATOM 819 N1 DC C 30 9.000 -4.465 -11.118 1.00 56.99 N ATOM 820 C2 DC C 30 8.171 -3.379 -10.817 1.00 56.72 C ATOM 821 O2 DC C 30 6.960 -3.574 -10.658 1.00 56.84 O ATOM 822 N3 DC C 30 8.718 -2.143 -10.712 1.00 56.00 N ATOM 823 C4 DC C 30 10.028 -1.975 -10.891 1.00 55.83 C ATOM 824 N4 DC C 30 10.520 -0.737 -10.777 1.00 55.77 N ATOM 825 C5 DC C 30 10.893 -3.069 -11.194 1.00 55.44 C ATOM 826 C6 DC C 30 10.342 -4.286 -11.295 1.00 57.21 C ATOM 827 P DG C 31 6.919 -8.995 -14.090 1.00 54.38 P ATOM 828 OP1 DG C 31 5.978 -10.139 -14.017 1.00 51.39 O ATOM 829 OP2 DG C 31 8.181 -9.121 -14.853 1.00 51.12 O ATOM 830 O5' DG C 31 6.127 -7.705 -14.618 1.00 53.85 O ATOM 831 C5' DG C 31 5.060 -7.172 -13.835 1.00 56.80 C ATOM 832 C4' DG C 31 4.661 -5.782 -14.307 1.00 61.82 C ATOM 833 O4' DG C 31 5.616 -4.794 -13.835 1.00 60.80 O ATOM 834 C3' DG C 31 4.573 -5.595 -15.830 1.00 65.09 C ATOM 835 O3' DG C 31 3.322 -5.010 -16.157 1.00 70.90 O ATOM 836 C2' DG C 31 5.727 -4.635 -16.133 1.00 62.24 C ATOM 837 C1' DG C 31 5.775 -3.836 -14.846 1.00 61.46 C ATOM 838 N9 DG C 31 7.025 -3.110 -14.641 1.00 59.63 N ATOM 839 C8 DG C 31 8.300 -3.564 -14.880 1.00 57.29 C ATOM 840 N7 DG C 31 9.223 -2.681 -14.610 1.00 57.54 N ATOM 841 C5 DG C 31 8.513 -1.570 -14.167 1.00 58.34 C ATOM 842 C6 DG C 31 8.975 -0.302 -13.734 1.00 56.96 C ATOM 843 O6 DG C 31 10.144 0.103 -13.653 1.00 55.67 O ATOM 844 N1 DG C 31 7.920 0.535 -13.374 1.00 58.13 N ATOM 845 C2 DG C 31 6.589 0.190 -13.426 1.00 59.22 C ATOM 846 N2 DG C 31 5.714 1.131 -13.038 1.00 60.63 N ATOM 847 N3 DG C 31 6.144 -0.993 -13.830 1.00 58.29 N ATOM 848 C4 DG C 31 7.159 -1.819 -14.184 1.00 58.36 C ATOM 849 P DA C 32 2.725 -5.109 -17.646 1.00 76.63 P ATOM 850 OP1 DA C 32 1.774 -6.243 -17.660 1.00 74.14 O ATOM 851 OP2 DA C 32 3.845 -5.086 -18.615 1.00 76.33 O ATOM 852 O5' DA C 32 1.913 -3.737 -17.803 1.00 76.85 O ATOM 853 C5' DA C 32 1.115 -3.261 -16.720 1.00 74.06 C ATOM 854 C4' DA C 32 1.052 -1.742 -16.710 1.00 76.08 C ATOM 855 O4' DA C 32 2.312 -1.199 -16.234 1.00 72.79 O ATOM 856 C3' DA C 32 0.786 -1.094 -18.070 1.00 78.38 C ATOM 857 O3' DA C 32 -0.238 -0.119 -17.950 1.00 83.34 O ATOM 858 C2' DA C 32 2.127 -0.461 -18.444 1.00 73.07 C ATOM 859 C1' DA C 32 2.730 -0.155 -17.082 1.00 70.90 C ATOM 860 N9 DA C 32 4.190 -0.129 -17.095 1.00 63.67 N ATOM 861 C8 DA C 32 5.026 -1.147 -17.462 1.00 63.39 C ATOM 862 N7 DA C 32 6.299 -0.845 -17.378 1.00 60.89 N ATOM 863 C5 DA C 32 6.301 0.463 -16.922 1.00 60.41 C ATOM 864 C6 DA C 32 7.344 1.363 -16.627 1.00 60.04 C ATOM 865 N6 DA C 32 8.640 1.055 -16.754 1.00 58.63 N ATOM 866 N1 DA C 32 7.004 2.596 -16.195 1.00 61.30 N ATOM 867 C2 DA C 32 5.705 2.900 -16.068 1.00 61.48 C ATOM 868 N3 DA C 32 4.638 2.140 -16.315 1.00 62.88 N ATOM 869 C4 DA C 32 5.009 0.922 -16.743 1.00 62.53 C ATOM 870 P DT C 33 -0.903 0.522 -19.265 1.00 90.47 P ATOM 871 OP1 DT C 33 -2.306 0.855 -18.928 1.00 90.79 O ATOM 872 OP2 DT C 33 -0.613 -0.373 -20.409 1.00 86.96 O ATOM 873 O5' DT C 33 -0.080 1.877 -19.483 1.00 82.90 O ATOM 874 C5' DT C 33 0.008 2.829 -18.428 1.00 80.20 C ATOM 875 C4' DT C 33 0.932 3.974 -18.805 1.00 76.56 C ATOM 876 O4' DT C 33 2.311 3.572 -18.626 1.00 72.96 O ATOM 877 C3' DT C 33 0.810 4.459 -20.256 1.00 76.32 C ATOM 878 O3' DT C 33 0.493 5.844 -20.280 1.00 76.95 O ATOM 879 C2' DT C 33 2.193 4.184 -20.864 1.00 71.53 C ATOM 880 C1' DT C 33 3.085 4.168 -19.633 1.00 69.57 C ATOM 881 N1 DT C 33 4.332 3.371 -19.809 1.00 64.49 N ATOM 882 C2 DT C 33 5.542 3.936 -19.480 1.00 62.54 C ATOM 883 O2 DT C 33 5.654 5.067 -19.045 1.00 61.94 O ATOM 884 N3 DT C 33 6.626 3.123 -19.677 1.00 59.93 N ATOM 885 C4 DT C 33 6.621 1.828 -20.161 1.00 59.97 C ATOM 886 O4 DT C 33 7.651 1.177 -20.302 1.00 61.25 O ATOM 887 C5 DT C 33 5.319 1.295 -20.488 1.00 60.80 C ATOM 888 C7 DT C 33 5.187 -0.100 -21.023 1.00 61.50 C ATOM 889 C6 DT C 33 4.250 2.083 -20.299 1.00 63.09 C TER 890 DT C 33 ATOM 891 O5' DA D 34 16.294 7.711 -17.492 1.00 84.76 O ATOM 892 C5' DA D 34 15.972 8.789 -18.367 1.00 87.28 C ATOM 893 C4' DA D 34 14.476 9.042 -18.379 1.00 89.67 C ATOM 894 O4' DA D 34 13.809 7.981 -19.123 1.00 80.23 O ATOM 895 C3' DA D 34 13.828 9.062 -16.992 1.00 96.86 C ATOM 896 O3' DA D 34 12.956 10.190 -16.849 1.00116.98 O ATOM 897 C2' DA D 34 13.044 7.756 -16.951 1.00 87.28 C ATOM 898 C1' DA D 34 12.669 7.578 -18.407 1.00 77.54 C ATOM 899 N9 DA D 34 12.346 6.195 -18.740 1.00 70.10 N ATOM 900 C8 DA D 34 13.223 5.166 -18.946 1.00 68.52 C ATOM 901 N7 DA D 34 12.641 4.019 -19.208 1.00 65.97 N ATOM 902 C5 DA D 34 11.288 4.314 -19.163 1.00 64.56 C ATOM 903 C6 DA D 34 10.135 3.525 -19.355 1.00 62.70 C ATOM 904 N6 DA D 34 10.175 2.220 -19.646 1.00 62.87 N ATOM 905 N1 DA D 34 8.935 4.132 -19.238 1.00 61.03 N ATOM 906 C2 DA D 34 8.898 5.438 -18.949 1.00 63.55 C ATOM 907 N3 DA D 34 9.911 6.281 -18.746 1.00 66.31 N ATOM 908 C4 DA D 34 11.089 5.649 -18.870 1.00 66.44 C ATOM 909 P DT D 35 13.271 11.343 -15.768 1.00136.08 P ATOM 910 OP1 DT D 35 12.382 12.488 -16.067 1.00122.48 O ATOM 911 OP2 DT D 35 14.738 11.538 -15.752 1.00119.24 O ATOM 912 O5' DT D 35 12.855 10.722 -14.344 1.00109.16 O ATOM 913 C5' DT D 35 11.950 9.620 -14.248 1.00100.12 C ATOM 914 C4' DT D 35 10.517 10.047 -14.498 1.00 97.70 C ATOM 915 O4' DT D 35 9.899 9.101 -15.409 1.00 90.64 O ATOM 916 C3' DT D 35 9.635 10.014 -13.264 1.00 95.45 C ATOM 917 O3' DT D 35 8.480 10.826 -13.456 1.00 97.48 O ATOM 918 C2' DT D 35 9.269 8.541 -13.205 1.00 88.61 C ATOM 919 C1' DT D 35 9.042 8.233 -14.683 1.00 84.97 C ATOM 920 N1 DT D 35 9.362 6.821 -15.047 1.00 74.60 N ATOM 921 C2 DT D 35 8.350 5.984 -15.453 1.00 70.96 C ATOM 922 O2 DT D 35 7.188 6.337 -15.546 1.00 71.28 O ATOM 923 N3 DT D 35 8.749 4.709 -15.756 1.00 67.81 N ATOM 924 C4 DT D 35 10.033 4.198 -15.690 1.00 67.07 C ATOM 925 O4 DT D 35 10.292 3.035 -15.983 1.00 64.35 O ATOM 926 C5 DT D 35 11.046 5.128 -15.251 1.00 69.33 C ATOM 927 C7 DT D 35 12.476 4.688 -15.138 1.00 67.03 C ATOM 928 C6 DT D 35 10.665 6.378 -14.950 1.00 73.79 C ATOM 929 P DC D 36 7.579 11.258 -12.195 1.00 98.24 P ATOM 930 OP1 DC D 36 6.554 12.209 -12.682 1.00 98.86 O ATOM 931 OP2 DC D 36 8.501 11.662 -11.111 1.00 98.24 O ATOM 932 O5' DC D 36 6.850 9.901 -11.747 1.00 92.20 O ATOM 933 C5' DC D 36 5.891 9.288 -12.609 1.00 88.83 C ATOM 934 C4' DC D 36 5.430 7.945 -12.060 1.00 84.81 C ATOM 935 O4' DC D 36 6.269 6.870 -12.566 1.00 80.97 O ATOM 936 C3' DC D 36 5.446 7.807 -10.530 1.00 83.57 C ATOM 937 O3' DC D 36 4.215 7.260 -10.104 1.00 84.79 O ATOM 938 C2' DC D 36 6.591 6.821 -10.286 1.00 79.63 C ATOM 939 C1' DC D 36 6.461 5.952 -11.521 1.00 76.35 C ATOM 940 N1 DC D 36 7.654 5.101 -11.812 1.00 71.61 N ATOM 941 C2 DC D 36 7.469 3.820 -12.346 1.00 66.36 C ATOM 942 O2 DC D 36 6.319 3.425 -12.575 1.00 65.21 O ATOM 943 N3 DC D 36 8.555 3.051 -12.602 1.00 63.59 N ATOM 944 C4 DC D 36 9.778 3.514 -12.341 1.00 65.48 C ATOM 945 N4 DC D 36 10.819 2.718 -12.610 1.00 63.45 N ATOM 946 C5 DC D 36 9.988 4.815 -11.791 1.00 69.25 C ATOM 947 C6 DC D 36 8.907 5.565 -11.541 1.00 71.68 C ATOM 948 P DG D 37 3.524 7.748 -8.740 1.00 87.33 P ATOM 949 OP1 DG D 37 2.911 9.071 -8.997 1.00 87.87 O ATOM 950 OP2 DG D 37 4.508 7.582 -7.647 1.00 82.14 O ATOM 951 O5' DG D 37 2.358 6.679 -8.520 1.00 82.59 O ATOM 952 C5' DG D 37 1.597 6.228 -9.633 1.00 82.07 C ATOM 953 C4' DG D 37 1.332 4.738 -9.532 1.00 81.87 C ATOM 954 O4' DG D 37 2.502 4.001 -9.975 1.00 78.12 O ATOM 955 C3' DG D 37 1.015 4.241 -8.123 1.00 81.30 C ATOM 956 O3' DG D 37 -0.076 3.334 -8.166 1.00 82.89 O ATOM 957 C2' DG D 37 2.311 3.557 -7.680 1.00 77.05 C ATOM 958 C1' DG D 37 2.870 3.048 -9.001 1.00 74.56 C ATOM 959 N9 DG D 37 4.327 2.923 -9.009 1.00 68.93 N ATOM 960 C8 DG D 37 5.242 3.892 -8.672 1.00 69.40 C ATOM 961 N7 DG D 37 6.481 3.498 -8.780 1.00 66.47 N ATOM 962 C5 DG D 37 6.384 2.184 -9.220 1.00 63.42 C ATOM 963 C6 DG D 37 7.401 1.243 -9.515 1.00 60.81 C ATOM 964 O6 DG D 37 8.629 1.391 -9.443 1.00 60.18 O ATOM 965 N1 DG D 37 6.870 0.024 -9.930 1.00 58.69 N ATOM 966 C2 DG D 37 5.528 -0.251 -10.046 1.00 60.99 C ATOM 967 N2 DG D 37 5.209 -1.485 -10.463 1.00 58.62 N ATOM 968 N3 DG D 37 4.564 0.622 -9.773 1.00 62.09 N ATOM 969 C4 DG D 37 5.064 1.815 -9.367 1.00 63.71 C ATOM 970 P DT D 38 -0.860 2.946 -6.819 1.00 87.52 P ATOM 971 OP1 DT D 38 -2.310 2.988 -7.115 1.00 88.55 O ATOM 972 OP2 DT D 38 -0.303 3.755 -5.711 1.00 84.95 O ATOM 973 O5' DT D 38 -0.438 1.429 -6.573 1.00 81.90 O ATOM 974 C5' DT D 38 -0.468 0.512 -7.652 1.00 79.06 C ATOM 975 C4' DT D 38 0.329 -0.732 -7.317 1.00 78.09 C ATOM 976 O4' DT D 38 1.742 -0.484 -7.503 1.00 74.31 O ATOM 977 C3' DT D 38 0.168 -1.232 -5.877 1.00 76.61 C ATOM 978 O3' DT D 38 -0.325 -2.555 -5.894 1.00 79.14 O ATOM 979 C2' DT D 38 1.587 -1.158 -5.289 1.00 71.88 C ATOM 980 C1' DT D 38 2.449 -1.219 -6.540 1.00 69.16 C ATOM 981 N1 DT D 38 3.806 -0.616 -6.380 1.00 65.12 N ATOM 982 C2 DT D 38 4.916 -1.370 -6.695 1.00 61.96 C ATOM 983 O2 DT D 38 4.853 -2.519 -7.093 1.00 61.21 O ATOM 984 N3 DT D 38 6.110 -0.729 -6.524 1.00 59.40 N ATOM 985 C4 DT D 38 6.311 0.559 -6.082 1.00 60.30 C ATOM 986 O4 DT D 38 7.433 1.038 -5.964 1.00 59.30 O ATOM 987 C5 DT D 38 5.106 1.301 -5.767 1.00 62.67 C ATOM 988 C7 DT D 38 5.196 2.716 -5.276 1.00 62.49 C ATOM 989 C6 DT D 38 3.925 0.684 -5.932 1.00 64.37 C ATOM 990 P DG D 39 -1.155 -3.129 -4.646 1.00 85.26 P ATOM 991 OP1 DG D 39 -2.367 -3.783 -5.191 1.00 86.27 O ATOM 992 OP2 DG D 39 -1.274 -2.053 -3.636 1.00 82.98 O ATOM 993 O5' DG D 39 -0.189 -4.252 -4.051 1.00 78.65 O ATOM 994 C5' DG D 39 0.479 -5.134 -4.938 1.00 76.94 C ATOM 995 C4' DG D 39 1.810 -5.568 -4.361 1.00 72.49 C ATOM 996 O4' DG D 39 2.769 -4.495 -4.472 1.00 69.15 O ATOM 997 C3' DG D 39 1.777 -5.951 -2.878 1.00 69.93 C ATOM 998 O3' DG D 39 2.031 -7.342 -2.747 1.00 69.27 O ATOM 999 C2' DG D 39 2.888 -5.097 -2.237 1.00 66.44 C ATOM 1000 C1' DG D 39 3.702 -4.651 -3.442 1.00 64.60 C ATOM 1001 N9 DG D 39 4.404 -3.387 -3.243 1.00 61.63 N ATOM 1002 C8 DG D 39 3.861 -2.188 -2.850 1.00 61.04 C ATOM 1003 N7 DG D 39 4.738 -1.227 -2.756 1.00 59.75 N ATOM 1004 C5 DG D 39 5.940 -1.828 -3.109 1.00 57.36 C ATOM 1005 C6 DG D 39 7.242 -1.283 -3.191 1.00 56.32 C ATOM 1006 O6 DG D 39 7.604 -0.121 -2.960 1.00 58.17 O ATOM 1007 N1 DG D 39 8.177 -2.237 -3.586 1.00 55.67 N ATOM 1008 C2 DG D 39 7.888 -3.550 -3.870 1.00 56.41 C ATOM 1009 N2 DG D 39 8.921 -4.321 -4.236 1.00 54.27 N ATOM 1010 N3 DG D 39 6.671 -4.073 -3.797 1.00 57.24 N ATOM 1011 C4 DG D 39 5.750 -3.156 -3.412 1.00 58.25 C ATOM 1012 P DG D 40 1.950 -8.068 -1.316 1.00 70.14 P ATOM 1013 OP1 DG D 40 1.068 -9.245 -1.480 1.00 69.87 O ATOM 1014 OP2 DG D 40 1.651 -7.071 -0.263 1.00 70.70 O ATOM 1015 O5' DG D 40 3.443 -8.583 -1.089 1.00 66.21 O ATOM 1016 C5' DG D 40 4.151 -9.174 -2.170 1.00 59.00 C ATOM 1017 C4' DG D 40 5.639 -9.184 -1.892 1.00 54.74 C ATOM 1018 O4' DG D 40 6.164 -7.838 -2.012 1.00 55.51 O ATOM 1019 C3' DG D 40 6.029 -9.682 -0.500 1.00 52.84 C ATOM 1020 O3' DG D 40 7.095 -10.608 -0.611 1.00 48.95 O ATOM 1021 C2' DG D 40 6.449 -8.408 0.240 1.00 51.99 C ATOM 1022 C1' DG D 40 6.965 -7.535 -0.896 1.00 52.09 C ATOM 1023 N9 DG D 40 6.854 -6.100 -0.632 1.00 52.51 N ATOM 1024 C8 DG D 40 5.711 -5.398 -0.336 1.00 54.77 C ATOM 1025 N7 DG D 40 5.916 -4.123 -0.154 1.00 53.19 N ATOM 1026 C5 DG D 40 7.283 -3.967 -0.342 1.00 52.21 C ATOM 1027 C6 DG D 40 8.088 -2.804 -0.273 1.00 52.27 C ATOM 1028 O6 DG D 40 7.739 -1.642 -0.022 1.00 52.60 O ATOM 1029 N1 DG D 40 9.426 -3.088 -0.531 1.00 52.25 N ATOM 1030 C2 DG D 40 9.923 -4.337 -0.821 1.00 50.95 C ATOM 1031 N2 DG D 40 11.242 -4.415 -1.043 1.00 52.47 N ATOM 1032 N3 DG D 40 9.181 -5.433 -0.888 1.00 50.12 N ATOM 1033 C4 DG D 40 7.875 -5.175 -0.638 1.00 52.18 C ATOM 1034 P DA D 41 7.625 -11.401 0.682 1.00 49.24 P ATOM 1035 OP1 DA D 41 8.012 -12.755 0.225 1.00 47.14 O ATOM 1036 OP2 DA D 41 6.669 -11.222 1.801 1.00 46.35 O ATOM 1037 O5' DA D 41 8.957 -10.626 1.065 1.00 45.86 O ATOM 1038 C5' DA D 41 9.973 -10.470 0.095 1.00 46.35 C ATOM 1039 C4' DA D 41 11.149 -9.749 0.697 1.00 45.71 C ATOM 1040 O4' DA D 41 10.851 -8.336 0.757 1.00 47.07 O ATOM 1041 C3' DA D 41 11.491 -10.192 2.116 1.00 43.73 C ATOM 1042 O3' DA D 41 12.864 -10.507 2.194 1.00 41.02 O ATOM 1043 C2' DA D 41 11.115 -8.992 2.998 1.00 43.78 C ATOM 1044 C1' DA D 41 11.165 -7.820 2.025 1.00 46.84 C ATOM 1045 N9 DA D 41 10.192 -6.771 2.321 1.00 48.83 N ATOM 1046 C8 DA D 41 8.839 -6.917 2.451 1.00 47.55 C ATOM 1047 N7 DA D 41 8.206 -5.796 2.702 1.00 47.99 N ATOM 1048 C5 DA D 41 9.213 -4.845 2.729 1.00 48.43 C ATOM 1049 C6 DA D 41 9.198 -3.454 2.946 1.00 48.12 C ATOM 1050 N6 DA D 41 8.083 -2.760 3.189 1.00 47.31 N ATOM 1051 N1 DA D 41 10.378 -2.803 2.905 1.00 48.79 N ATOM 1052 C2 DA D 41 11.493 -3.501 2.663 1.00 49.29 C ATOM 1053 N3 DA D 41 11.632 -4.806 2.442 1.00 47.75 N ATOM 1054 C4 DA D 41 10.443 -5.427 2.490 1.00 47.78 C ATOM 1055 P DA D 42 13.458 -11.222 3.500 1.00 40.56 P ATOM 1056 OP1 DA D 42 14.633 -12.021 3.080 1.00 42.63 O ATOM 1057 OP2 DA D 42 12.340 -11.883 4.216 1.00 37.81 O ATOM 1058 O5' DA D 42 13.964 -9.995 4.386 1.00 41.71 O ATOM 1059 C5' DA D 42 14.830 -9.028 3.811 1.00 42.99 C ATOM 1060 C4' DA D 42 15.119 -7.910 4.793 1.00 44.10 C ATOM 1061 O4' DA D 42 14.036 -6.942 4.767 1.00 44.00 O ATOM 1062 C3' DA D 42 15.262 -8.345 6.253 1.00 45.24 C ATOM 1063 O3' DA D 42 16.324 -7.627 6.838 1.00 50.61 O ATOM 1064 C2' DA D 42 13.921 -7.935 6.860 1.00 45.41 C ATOM 1065 C1' DA D 42 13.648 -6.658 6.088 1.00 46.64 C ATOM 1066 N9 DA D 42 12.248 -6.252 6.088 1.00 46.88 N ATOM 1067 C8 DA D 42 11.150 -7.064 6.020 1.00 45.49 C ATOM 1068 N7 DA D 42 10.011 -6.413 6.036 1.00 46.22 N ATOM 1069 C5 DA D 42 10.390 -5.083 6.121 1.00 46.94 C ATOM 1070 C6 DA D 42 9.648 -3.887 6.180 1.00 47.55 C ATOM 1071 N6 DA D 42 8.312 -3.849 6.156 1.00 45.84 N ATOM 1072 N1 DA D 42 10.335 -2.729 6.259 1.00 47.30 N ATOM 1073 C2 DA D 42 11.672 -2.771 6.280 1.00 47.73 C ATOM 1074 N3 DA D 42 12.477 -3.831 6.233 1.00 47.44 N ATOM 1075 C4 DA D 42 11.764 -4.967 6.153 1.00 47.94 C ATOM 1076 P DT D 43 16.984 -8.089 8.226 1.00 51.74 P ATOM 1077 OP1 DT D 43 18.178 -8.894 7.878 1.00 52.80 O ATOM 1078 OP2 DT D 43 15.957 -8.668 9.121 1.00 50.79 O ATOM 1079 O5' DT D 43 17.464 -6.701 8.853 1.00 53.14 O ATOM 1080 C5' DT D 43 17.944 -5.680 7.983 1.00 52.37 C ATOM 1081 C4' DT D 43 17.512 -4.308 8.461 1.00 53.71 C ATOM 1082 O4' DT D 43 16.079 -4.149 8.292 1.00 50.84 O ATOM 1083 C3' DT D 43 17.812 -4.015 9.932 1.00 52.61 C ATOM 1084 O3' DT D 43 18.482 -2.771 10.040 1.00 57.91 O ATOM 1085 C2' DT D 43 16.427 -3.977 10.587 1.00 52.33 C ATOM 1086 C1' DT D 43 15.548 -3.524 9.434 1.00 51.21 C ATOM 1087 N1 DT D 43 14.113 -3.925 9.576 1.00 49.27 N ATOM 1088 C2 DT D 43 13.136 -2.957 9.516 1.00 49.84 C ATOM 1089 O2 DT D 43 13.377 -1.775 9.352 1.00 52.06 O ATOM 1090 N3 DT D 43 11.856 -3.423 9.652 1.00 47.39 N ATOM 1091 C4 DT D 43 11.460 -4.732 9.843 1.00 48.23 C ATOM 1092 O4 DT D 43 10.279 -5.050 9.955 1.00 44.85 O ATOM 1093 C5 DT D 43 12.532 -5.700 9.901 1.00 48.22 C ATOM 1094 C7 DT D 43 12.223 -7.155 10.103 1.00 45.69 C ATOM 1095 C6 DT D 43 13.793 -5.255 9.766 1.00 49.52 C ATOM 1096 P DT D 44 19.048 -2.267 11.456 1.00 56.64 P ATOM 1097 OP1 DT D 44 20.346 -1.607 11.189 1.00 60.78 O ATOM 1098 OP2 DT D 44 18.989 -3.392 12.415 1.00 53.28 O ATOM 1099 O5' DT D 44 17.984 -1.161 11.907 1.00 55.64 O ATOM 1100 C5' DT D 44 17.600 -0.143 10.992 1.00 54.84 C ATOM 1101 C4' DT D 44 16.495 0.720 11.571 1.00 55.06 C ATOM 1102 O4' DT D 44 15.232 0.008 11.517 1.00 52.88 O ATOM 1103 C3' DT D 44 16.689 1.139 13.030 1.00 58.30 C ATOM 1104 O3' DT D 44 16.374 2.522 13.167 1.00 61.80 O ATOM 1105 C2' DT D 44 15.698 0.247 13.788 1.00 55.11 C ATOM 1106 C1' DT D 44 14.584 0.109 12.763 1.00 54.17 C ATOM 1107 N1 DT D 44 13.721 -1.101 12.942 1.00 50.79 N ATOM 1108 C2 DT D 44 12.354 -0.955 12.918 1.00 50.98 C ATOM 1109 O2 DT D 44 11.802 0.120 12.777 1.00 51.16 O ATOM 1110 N3 DT D 44 11.649 -2.119 13.072 1.00 49.51 N ATOM 1111 C4 DT D 44 12.162 -3.390 13.240 1.00 49.12 C ATOM 1112 O4 DT D 44 11.443 -4.376 13.371 1.00 48.95 O ATOM 1113 C5 DT D 44 13.605 -3.477 13.253 1.00 51.51 C ATOM 1114 C7 DT D 44 14.279 -4.806 13.430 1.00 48.59 C ATOM 1115 C6 DT D 44 14.308 -2.341 13.101 1.00 51.22 C ATOM 1116 P DT D 45 16.699 3.310 14.529 1.00 63.60 P ATOM 1117 OP1 DT D 45 17.255 4.629 14.156 1.00 61.21 O ATOM 1118 OP2 DT D 45 17.462 2.409 15.423 1.00 58.56 O ATOM 1119 O5' DT D 45 15.257 3.544 15.172 1.00 56.70 O ATOM 1120 C5' DT D 45 14.245 4.185 14.410 1.00 54.43 C ATOM 1121 C4' DT D 45 12.896 4.031 15.082 1.00 54.53 C ATOM 1122 O4' DT D 45 12.457 2.658 14.971 1.00 52.11 O ATOM 1123 C3' DT D 45 12.879 4.374 16.578 1.00 52.89 C ATOM 1124 O3' DT D 45 11.928 5.398 16.826 1.00 55.59 O ATOM 1125 C2' DT D 45 12.496 3.057 17.269 1.00 50.35 C ATOM 1126 C1' DT D 45 11.796 2.294 16.154 1.00 52.36 C ATOM 1127 N1 DT D 45 11.885 0.817 16.302 1.00 49.96 N ATOM 1128 C2 DT D 45 10.738 0.066 16.224 1.00 49.37 C ATOM 1129 O2 DT D 45 9.638 0.550 16.034 1.00 48.67 O ATOM 1130 N3 DT D 45 10.926 -1.283 16.371 1.00 49.08 N ATOM 1131 C4 DT D 45 12.123 -1.941 16.586 1.00 51.61 C ATOM 1132 O4 DT D 45 12.191 -3.161 16.707 1.00 49.72 O ATOM 1133 C5 DT D 45 13.290 -1.091 16.662 1.00 52.29 C ATOM 1134 C7 DT D 45 14.647 -1.688 16.895 1.00 51.38 C ATOM 1135 C6 DT D 45 13.116 0.231 16.517 1.00 50.94 C ATOM 1136 P DC D 46 11.757 6.016 18.302 1.00 55.11 P ATOM 1137 OP1 DC D 46 11.512 7.466 18.131 1.00 53.13 O ATOM 1138 OP2 DC D 46 12.880 5.554 19.149 1.00 50.42 O ATOM 1139 O5' DC D 46 10.421 5.325 18.839 1.00 52.48 O ATOM 1140 C5' DC D 46 9.230 5.399 18.066 1.00 52.24 C ATOM 1141 C4' DC D 46 8.172 4.461 18.614 1.00 52.25 C ATOM 1142 O4' DC D 46 8.568 3.083 18.379 1.00 51.16 O ATOM 1143 C3' DC D 46 7.918 4.580 20.127 1.00 50.87 C ATOM 1144 O3' DC D 46 6.521 4.714 20.376 1.00 52.17 O ATOM 1145 C2' DC D 46 8.459 3.262 20.684 1.00 51.62 C ATOM 1146 C1' DC D 46 8.218 2.331 19.510 1.00 52.51 C ATOM 1147 N1 DC D 46 9.035 1.087 19.555 1.00 50.79 N ATOM 1148 C2 DC D 46 8.401 -0.153 19.428 1.00 49.65 C ATOM 1149 O2 DC D 46 7.176 -0.186 19.264 1.00 49.94 O ATOM 1150 N3 DC D 46 9.150 -1.282 19.485 1.00 47.99 N ATOM 1151 C4 DC D 46 10.468 -1.201 19.663 1.00 50.01 C ATOM 1152 N4 DC D 46 11.164 -2.342 19.713 1.00 49.69 N ATOM 1153 C5 DC D 46 11.132 0.055 19.802 1.00 49.79 C ATOM 1154 C6 DC D 46 10.383 1.162 19.746 1.00 50.23 C ATOM 1155 P DC D 47 5.982 5.145 21.830 1.00 49.52 P ATOM 1156 OP1 DC D 47 5.058 6.280 21.618 1.00 50.60 O ATOM 1157 OP2 DC D 47 7.135 5.276 22.749 1.00 49.79 O ATOM 1158 O5' DC D 47 5.121 3.886 22.313 1.00 50.85 O ATOM 1159 C5' DC D 47 3.886 3.580 21.669 1.00 54.23 C ATOM 1160 C4' DC D 47 3.498 2.129 21.898 1.00 53.63 C ATOM 1161 O4' DC D 47 4.534 1.269 21.384 1.00 52.11 O ATOM 1162 C3' DC D 47 3.351 1.722 23.353 1.00 53.27 C ATOM 1163 O3' DC D 47 2.025 1.998 23.804 1.00 56.45 O ATOM 1164 C2' DC D 47 3.620 0.215 23.312 1.00 55.42 C ATOM 1165 C1' DC D 47 4.502 0.035 22.072 1.00 52.83 C ATOM 1166 N1 DC D 47 5.902 -0.382 22.386 1.00 53.24 N ATOM 1167 C2 DC D 47 6.182 -1.733 22.619 1.00 52.37 C ATOM 1168 O2 DC D 47 5.262 -2.555 22.565 1.00 52.79 O ATOM 1169 N3 DC D 47 7.456 -2.103 22.895 1.00 51.93 N ATOM 1170 C4 DC D 47 8.422 -1.185 22.943 1.00 52.32 C ATOM 1171 N4 DC D 47 9.663 -1.600 23.222 1.00 50.95 N ATOM 1172 C5 DC D 47 8.158 0.198 22.710 1.00 52.42 C ATOM 1173 C6 DC D 47 6.896 0.551 22.437 1.00 52.50 C ATOM 1174 P DT D 48 1.664 1.947 25.371 1.00 57.77 P ATOM 1175 OP1 DT D 48 0.324 2.552 25.541 1.00 57.56 O ATOM 1176 OP2 DT D 48 2.819 2.475 26.132 1.00 53.19 O ATOM 1177 O5' DT D 48 1.555 0.387 25.697 1.00 58.58 O ATOM 1178 C5' DT D 48 0.628 -0.426 24.992 1.00 59.42 C ATOM 1179 C4' DT D 48 0.811 -1.882 25.368 1.00 61.34 C ATOM 1180 O4' DT D 48 2.155 -2.307 25.021 1.00 57.73 O ATOM 1181 C3' DT D 48 0.634 -2.180 26.857 1.00 62.56 C ATOM 1182 O3' DT D 48 -0.186 -3.322 27.031 1.00 65.74 O ATOM 1183 C2' DT D 48 2.059 -2.424 27.353 1.00 62.11 C ATOM 1184 C1' DT D 48 2.736 -2.982 26.112 1.00 59.56 C ATOM 1185 N1 DT D 48 4.206 -2.741 26.085 1.00 57.80 N ATOM 1186 C2 DT D 48 5.067 -3.814 26.028 1.00 56.93 C ATOM 1187 O2 DT D 48 4.691 -4.971 25.991 1.00 56.21 O ATOM 1188 N3 DT D 48 6.396 -3.481 26.012 1.00 54.94 N ATOM 1189 C4 DT D 48 6.939 -2.209 26.050 1.00 55.76 C ATOM 1190 O4 DT D 48 8.150 -2.011 26.032 1.00 55.05 O ATOM 1191 C5 DT D 48 5.980 -1.131 26.112 1.00 55.37 C ATOM 1192 C7 DT D 48 6.448 0.293 26.159 1.00 55.59 C ATOM 1193 C6 DT D 48 4.677 -1.446 26.130 1.00 55.24 C ATOM 1194 P DC D 49 -0.736 -3.701 28.491 1.00 71.39 P ATOM 1195 OP1 DC D 49 -2.053 -4.355 28.309 1.00 71.57 O ATOM 1196 OP2 DC D 49 -0.619 -2.495 29.341 1.00 67.35 O ATOM 1197 O5' DC D 49 0.316 -4.782 29.027 1.00 68.70 O ATOM 1198 C5' DC D 49 0.546 -5.974 28.283 1.00 69.12 C ATOM 1199 C4' DC D 49 1.676 -6.787 28.890 1.00 69.36 C ATOM 1200 O4' DC D 49 2.951 -6.196 28.539 1.00 67.58 O ATOM 1201 C3' DC D 49 1.654 -6.888 30.419 1.00 71.31 C ATOM 1202 O3' DC D 49 1.667 -8.254 30.812 1.00 76.54 O ATOM 1203 C2' DC D 49 2.930 -6.159 30.860 1.00 69.89 C ATOM 1204 C1' DC D 49 3.817 -6.313 29.637 1.00 67.97 C ATOM 1205 N1 DC D 49 4.869 -5.265 29.524 1.00 62.87 N ATOM 1206 C2 DC D 49 6.210 -5.640 29.385 1.00 62.38 C ATOM 1207 O2 DC D 49 6.501 -6.842 29.358 1.00 63.21 O ATOM 1208 N3 DC D 49 7.154 -4.673 29.283 1.00 61.46 N ATOM 1209 C4 DC D 49 6.800 -3.388 29.315 1.00 60.37 C ATOM 1210 N4 DC D 49 7.767 -2.470 29.212 1.00 60.00 N ATOM 1211 C5 DC D 49 5.439 -2.986 29.457 1.00 61.45 C ATOM 1212 C6 DC D 49 4.516 -3.948 29.557 1.00 62.96 C TER 1213 DC D 49 ATOM 1214 N PRO B 418 -3.410 -14.348 -30.473 1.00 68.90 N ATOM 1215 CA PRO B 418 -3.244 -15.742 -30.049 1.00 67.68 C ATOM 1216 C PRO B 418 -1.782 -16.152 -29.880 1.00 66.85 C ATOM 1217 O PRO B 418 -1.520 -17.251 -29.389 1.00 67.07 O ATOM 1218 CB PRO B 418 -3.907 -16.538 -31.184 1.00 65.96 C ATOM 1219 CG PRO B 418 -3.962 -15.579 -32.360 1.00 65.88 C ATOM 1220 CD PRO B 418 -4.174 -14.237 -31.727 1.00 66.14 C ATOM 1221 N LYS B 419 -0.846 -15.294 -30.277 1.00 63.23 N ATOM 1222 CA LYS B 419 0.576 -15.619 -30.158 1.00 62.28 C ATOM 1223 C LYS B 419 1.086 -15.414 -28.732 1.00 61.32 C ATOM 1224 O LYS B 419 0.738 -14.435 -28.070 1.00 60.55 O ATOM 1225 CB LYS B 419 1.409 -14.788 -31.142 1.00 63.35 C ATOM 1226 CG LYS B 419 0.819 -13.432 -31.495 1.00 65.39 C ATOM 1227 CD LYS B 419 1.683 -12.726 -32.533 1.00 65.35 C ATOM 1228 CE LYS B 419 1.825 -13.564 -33.799 1.00 67.82 C ATOM 1229 NZ LYS B 419 2.596 -12.855 -34.861 1.00 66.94 N ATOM 1230 N LEU B 420 1.917 -16.345 -28.269 1.00 60.12 N ATOM 1231 CA LEU B 420 2.327 -16.380 -26.868 1.00 56.81 C ATOM 1232 C LEU B 420 3.818 -16.121 -26.663 1.00 53.30 C ATOM 1233 O LEU B 420 4.642 -16.457 -27.515 1.00 54.37 O ATOM 1234 CB LEU B 420 1.961 -17.733 -26.257 1.00 56.42 C ATOM 1235 CG LEU B 420 0.509 -18.183 -26.414 1.00 58.26 C ATOM 1236 CD1 LEU B 420 0.317 -19.563 -25.806 1.00 58.31 C ATOM 1237 CD2 LEU B 420 -0.437 -17.176 -25.780 1.00 56.11 C ATOM 1238 N CYS B 421 4.148 -15.523 -25.520 1.00 52.06 N ATOM 1239 CA CYS B 421 5.535 -15.348 -25.098 1.00 49.19 C ATOM 1240 C CYS B 421 6.210 -16.708 -24.967 1.00 48.61 C ATOM 1241 O CYS B 421 5.688 -17.604 -24.305 1.00 49.58 O ATOM 1242 CB CYS B 421 5.596 -14.584 -23.769 1.00 49.16 C ATOM 1243 SG CYS B 421 7.236 -14.421 -23.019 1.00 46.40 S ATOM 1244 N LEU B 422 7.368 -16.864 -25.601 1.00 46.21 N ATOM 1245 CA LEU B 422 8.072 -18.141 -25.587 1.00 47.94 C ATOM 1246 C LEU B 422 8.723 -18.436 -24.239 1.00 47.51 C ATOM 1247 O LEU B 422 9.231 -19.532 -24.016 1.00 47.72 O ATOM 1248 CB LEU B 422 9.125 -18.180 -26.696 1.00 46.15 C ATOM 1249 CG LEU B 422 8.530 -18.355 -28.095 1.00 51.77 C ATOM 1250 CD1 LEU B 422 9.612 -18.354 -29.164 1.00 53.03 C ATOM 1251 CD2 LEU B 422 7.708 -19.635 -28.158 1.00 50.48 C ATOM 1252 N VAL B 423 8.704 -17.459 -23.340 1.00 46.77 N ATOM 1253 CA VAL B 423 9.266 -17.651 -22.011 1.00 46.61 C ATOM 1254 C VAL B 423 8.179 -17.994 -20.987 1.00 46.74 C ATOM 1255 O VAL B 423 8.188 -19.085 -20.414 1.00 48.21 O ATOM 1256 CB VAL B 423 10.041 -16.405 -21.539 1.00 43.39 C ATOM 1257 CG1 VAL B 423 10.613 -16.633 -20.151 1.00 45.36 C ATOM 1258 CG2 VAL B 423 11.153 -16.073 -22.518 1.00 46.27 C ATOM 1259 N CYS B 424 7.275 -17.051 -20.731 1.00 44.43 N ATOM 1260 CA CYS B 424 6.234 -17.233 -19.714 1.00 47.93 C ATOM 1261 C CYS B 424 4.833 -17.613 -20.224 1.00 47.94 C ATOM 1262 O CYS B 424 3.902 -17.721 -19.422 1.00 47.60 O ATOM 1263 CB CYS B 424 6.115 -15.966 -18.872 1.00 44.40 C ATOM 1264 SG CYS B 424 5.277 -14.628 -19.716 1.00 48.70 S ATOM 1265 N SER B 425 4.677 -17.768 -21.539 1.00 48.48 N ATOM 1266 CA SER B 425 3.401 -18.164 -22.162 1.00 49.17 C ATOM 1267 C SER B 425 2.293 -17.102 -22.101 1.00 50.60 C ATOM 1268 O SER B 425 1.185 -17.335 -22.585 1.00 51.51 O ATOM 1269 CB SER B 425 2.885 -19.473 -21.555 1.00 50.94 C ATOM 1270 OG SER B 425 3.722 -20.557 -21.917 1.00 51.22 O ATOM 1271 N ASP B 426 2.574 -15.957 -21.490 1.00 48.96 N ATOM 1272 CA ASP B 426 1.655 -14.821 -21.539 1.00 50.74 C ATOM 1273 C ASP B 426 1.608 -14.315 -22.983 1.00 53.16 C ATOM 1274 O ASP B 426 2.497 -14.633 -23.771 1.00 53.03 O ATOM 1275 CB ASP B 426 2.104 -13.720 -20.577 1.00 52.22 C ATOM 1276 CG ASP B 426 0.984 -12.775 -20.197 1.00 55.81 C ATOM 1277 OD1 ASP B 426 -0.113 -12.872 -20.786 1.00 59.65 O ATOM 1278 OD2 ASP B 426 1.203 -11.932 -19.300 1.00 58.94 O ATOM 1279 N GLU B 427 0.579 -13.558 -23.352 1.00 56.06 N ATOM 1280 CA GLU B 427 0.453 -13.151 -24.754 1.00 57.66 C ATOM 1281 C GLU B 427 1.586 -12.196 -25.153 1.00 54.53 C ATOM 1282 O GLU B 427 1.956 -11.287 -24.403 1.00 56.37 O ATOM 1283 CB GLU B 427 -0.925 -12.528 -25.028 1.00 59.51 C ATOM 1284 CG GLU B 427 -1.049 -11.037 -24.772 1.00 62.02 C ATOM 1285 CD GLU B 427 -2.394 -10.489 -25.212 1.00 69.13 C ATOM 1286 OE1 GLU B 427 -3.397 -11.232 -25.129 1.00 69.10 O ATOM 1287 OE2 GLU B 427 -2.447 -9.320 -25.652 1.00 71.40 O ATOM 1288 N ALA B 428 2.146 -12.434 -26.334 1.00 54.65 N ATOM 1289 CA ALA B 428 3.349 -11.738 -26.780 1.00 54.98 C ATOM 1290 C ALA B 428 3.038 -10.387 -27.418 1.00 56.44 C ATOM 1291 O ALA B 428 2.022 -10.228 -28.093 1.00 57.71 O ATOM 1292 CB ALA B 428 4.121 -12.609 -27.751 1.00 53.16 C ATOM 1293 N SER B 429 3.916 -9.415 -27.187 1.00 55.78 N ATOM 1294 CA SER B 429 3.742 -8.075 -27.738 1.00 56.90 C ATOM 1295 C SER B 429 4.528 -7.857 -29.032 1.00 56.53 C ATOM 1296 O SER B 429 4.423 -6.802 -29.656 1.00 59.34 O ATOM 1297 CB SER B 429 4.157 -7.028 -26.704 1.00 55.16 C ATOM 1298 OG SER B 429 5.546 -7.115 -26.430 1.00 56.42 O ATOM 1299 N GLY B 430 5.315 -8.850 -29.431 1.00 55.47 N ATOM 1300 CA GLY B 430 6.123 -8.735 -30.631 1.00 53.20 C ATOM 1301 C GLY B 430 7.423 -9.506 -30.523 1.00 52.94 C ATOM 1302 O GLY B 430 7.609 -10.293 -29.595 1.00 54.65 O ATOM 1303 N CYS B 431 8.326 -9.279 -31.472 1.00 53.43 N ATOM 1304 CA CYS B 431 9.622 -9.946 -31.461 1.00 52.47 C ATOM 1305 C CYS B 431 10.672 -9.069 -30.789 1.00 54.74 C ATOM 1306 O CYS B 431 11.091 -8.049 -31.340 1.00 54.49 O ATOM 1307 CB CYS B 431 10.058 -10.296 -32.885 1.00 54.06 C ATOM 1308 SG CYS B 431 11.622 -11.200 -32.981 1.00 66.11 S ATOM 1309 N HIS B 432 11.114 -9.486 -29.607 1.00 49.81 N ATOM 1310 CA HIS B 432 12.047 -8.688 -28.823 1.00 50.28 C ATOM 1311 C HIS B 432 13.351 -9.436 -28.575 1.00 50.37 C ATOM 1312 O HIS B 432 13.349 -10.549 -28.047 1.00 48.92 O ATOM 1313 CB HIS B 432 11.408 -8.281 -27.495 1.00 50.54 C ATOM 1314 CG HIS B 432 10.124 -7.535 -27.654 1.00 51.71 C ATOM 1315 ND1 HIS B 432 10.047 -6.295 -28.245 1.00 52.06 N ATOM 1316 CD2 HIS B 432 8.852 -7.856 -27.294 1.00 52.43 C ATOM 1317 CE1 HIS B 432 8.791 -5.880 -28.248 1.00 52.90 C ATOM 1318 NE2 HIS B 432 8.050 -6.813 -27.674 1.00 54.07 N ATOM 1319 N TYR B 433 14.455 -8.808 -28.968 1.00 48.89 N ATOM 1320 CA TYR B 433 15.793 -9.379 -28.838 1.00 50.23 C ATOM 1321 C TYR B 433 15.897 -10.743 -29.517 1.00 51.02 C ATOM 1322 O TYR B 433 16.624 -11.625 -29.056 1.00 50.29 O ATOM 1323 CB TYR B 433 16.190 -9.479 -27.363 1.00 48.06 C ATOM 1324 CG TYR B 433 16.088 -8.157 -26.637 1.00 50.61 C ATOM 1325 CD1 TYR B 433 16.860 -7.070 -27.027 1.00 49.74 C ATOM 1326 CD2 TYR B 433 15.214 -7.991 -25.571 1.00 47.31 C ATOM 1327 CE1 TYR B 433 16.768 -5.857 -26.373 1.00 51.05 C ATOM 1328 CE2 TYR B 433 15.115 -6.781 -24.910 1.00 48.24 C ATOM 1329 CZ TYR B 433 15.895 -5.718 -25.315 1.00 50.74 C ATOM 1330 OH TYR B 433 15.799 -4.512 -24.661 1.00 53.93 O ATOM 1331 N GLY B 434 15.162 -10.904 -30.614 1.00 50.53 N ATOM 1332 CA GLY B 434 15.268 -12.089 -31.446 1.00 53.51 C ATOM 1333 C GLY B 434 14.206 -13.142 -31.197 1.00 53.02 C ATOM 1334 O GLY B 434 14.098 -14.109 -31.949 1.00 55.33 O ATOM 1335 N VAL B 435 13.416 -12.959 -30.144 1.00 53.72 N ATOM 1336 CA VAL B 435 12.458 -13.977 -29.723 1.00 52.17 C ATOM 1337 C VAL B 435 11.076 -13.376 -29.485 1.00 49.13 C ATOM 1338 O VAL B 435 10.959 -12.258 -28.988 1.00 49.68 O ATOM 1339 CB VAL B 435 12.943 -14.688 -28.431 1.00 51.37 C ATOM 1340 CG1 VAL B 435 11.936 -15.726 -27.961 1.00 50.48 C ATOM 1341 CG2 VAL B 435 14.300 -15.334 -28.659 1.00 51.50 C ATOM 1342 N LEU B 436 10.029 -14.119 -29.834 1.00 50.33 N ATOM 1343 CA LEU B 436 8.673 -13.675 -29.549 1.00 49.85 C ATOM 1344 C LEU B 436 8.437 -13.717 -28.037 1.00 52.04 C ATOM 1345 O LEU B 436 8.500 -14.782 -27.421 1.00 50.05 O ATOM 1346 CB LEU B 436 7.666 -14.563 -30.281 1.00 51.95 C ATOM 1347 CG LEU B 436 6.188 -14.181 -30.274 1.00 54.30 C ATOM 1348 CD1 LEU B 436 5.969 -12.886 -31.039 1.00 56.93 C ATOM 1349 CD2 LEU B 436 5.349 -15.305 -30.863 1.00 57.84 C ATOM 1350 N THR B 437 8.138 -12.560 -27.448 1.00 49.45 N ATOM 1351 CA THR B 437 8.044 -12.428 -25.993 1.00 49.29 C ATOM 1352 C THR B 437 7.024 -11.374 -25.588 1.00 51.43 C ATOM 1353 O THR B 437 6.607 -10.553 -26.404 1.00 49.83 O ATOM 1354 CB THR B 437 9.402 -12.038 -25.338 1.00 49.08 C ATOM 1355 OG1 THR B 437 9.840 -10.770 -25.840 1.00 52.84 O ATOM 1356 CG2 THR B 437 10.480 -13.086 -25.586 1.00 47.44 C ATOM 1357 N CYS B 438 6.627 -11.404 -24.319 1.00 46.79 N ATOM 1358 CA CYS B 438 5.765 -10.370 -23.764 1.00 47.29 C ATOM 1359 C CYS B 438 6.603 -9.170 -23.343 1.00 45.42 C ATOM 1360 O CYS B 438 7.830 -9.193 -23.441 1.00 46.86 O ATOM 1361 CB CYS B 438 4.964 -10.903 -22.572 1.00 48.88 C ATOM 1362 SG CYS B 438 5.953 -11.315 -21.109 1.00 48.50 S ATOM 1363 N GLY B 439 5.937 -8.127 -22.860 1.00 46.03 N ATOM 1364 CA GLY B 439 6.618 -6.914 -22.450 1.00 45.69 C ATOM 1365 C GLY B 439 7.460 -7.089 -21.201 1.00 46.25 C ATOM 1366 O GLY B 439 8.590 -6.602 -21.134 1.00 46.05 O ATOM 1367 N SER B 440 6.914 -7.784 -20.208 1.00 46.03 N ATOM 1368 CA SER B 440 7.609 -7.966 -18.938 1.00 45.54 C ATOM 1369 C SER B 440 8.875 -8.805 -19.105 1.00 42.33 C ATOM 1370 O SER B 440 9.910 -8.488 -18.526 1.00 41.85 O ATOM 1371 CB SER B 440 6.685 -8.612 -17.902 1.00 48.55 C ATOM 1372 OG SER B 440 6.424 -9.967 -18.221 1.00 49.28 O ATOM 1373 N CYS B 441 8.797 -9.867 -19.902 1.00 41.84 N ATOM 1374 CA CYS B 441 9.960 -10.725 -20.117 1.00 41.85 C ATOM 1375 C CYS B 441 11.048 -10.003 -20.917 1.00 41.65 C ATOM 1376 O CYS B 441 12.237 -10.245 -20.719 1.00 39.67 O ATOM 1377 CB CYS B 441 9.551 -12.031 -20.814 1.00 43.43 C ATOM 1378 SG CYS B 441 8.755 -13.260 -19.706 1.00 44.02 S ATOM 1379 N LYS B 442 10.644 -9.105 -21.809 1.00 41.15 N ATOM 1380 CA LYS B 442 11.611 -8.324 -22.574 1.00 43.12 C ATOM 1381 C LYS B 442 12.381 -7.381 -21.654 1.00 41.15 C ATOM 1382 O LYS B 442 13.604 -7.275 -21.738 1.00 43.73 O ATOM 1383 CB LYS B 442 10.908 -7.536 -23.686 1.00 46.08 C ATOM 1384 CG LYS B 442 11.429 -6.120 -23.868 1.00 47.69 C ATOM 1385 CD LYS B 442 10.481 -5.268 -24.691 1.00 50.61 C ATOM 1386 CE LYS B 442 10.735 -3.789 -24.437 1.00 53.16 C ATOM 1387 NZ LYS B 442 12.171 -3.430 -24.624 1.00 57.90 N ATOM 1388 N VAL B 443 11.652 -6.705 -20.770 1.00 41.23 N ATOM 1389 CA VAL B 443 12.244 -5.781 -19.810 1.00 43.34 C ATOM 1390 C VAL B 443 13.113 -6.526 -18.795 1.00 43.88 C ATOM 1391 O VAL B 443 14.198 -6.064 -18.431 1.00 44.04 O ATOM 1392 CB VAL B 443 11.147 -4.977 -19.076 1.00 45.60 C ATOM 1393 CG1 VAL B 443 11.737 -4.158 -17.949 1.00 48.88 C ATOM 1394 CG2 VAL B 443 10.407 -4.079 -20.055 1.00 48.29 C ATOM 1395 N PHE B 444 12.634 -7.684 -18.350 1.00 40.15 N ATOM 1396 CA PHE B 444 13.392 -8.530 -17.431 1.00 40.44 C ATOM 1397 C PHE B 444 14.742 -8.942 -18.015 1.00 41.39 C ATOM 1398 O PHE B 444 15.771 -8.861 -17.343 1.00 41.90 O ATOM 1399 CB PHE B 444 12.588 -9.781 -17.065 1.00 41.31 C ATOM 1400 CG PHE B 444 13.382 -10.805 -16.306 1.00 39.94 C ATOM 1401 CD1 PHE B 444 13.526 -10.708 -14.930 1.00 42.54 C ATOM 1402 CD2 PHE B 444 13.990 -11.862 -16.968 1.00 38.34 C ATOM 1403 CE1 PHE B 444 14.261 -11.645 -14.227 1.00 42.18 C ATOM 1404 CE2 PHE B 444 14.729 -12.802 -16.271 1.00 40.60 C ATOM 1405 CZ PHE B 444 14.865 -12.696 -14.902 1.00 38.43 C ATOM 1406 N PHE B 445 14.729 -9.394 -19.265 1.00 41.12 N ATOM 1407 CA PHE B 445 15.949 -9.852 -19.922 1.00 44.22 C ATOM 1408 C PHE B 445 16.974 -8.730 -20.059 1.00 44.59 C ATOM 1409 O PHE B 445 18.152 -8.919 -19.757 1.00 45.18 O ATOM 1410 CB PHE B 445 15.638 -10.437 -21.298 1.00 41.77 C ATOM 1411 CG PHE B 445 16.859 -10.859 -22.062 1.00 46.13 C ATOM 1412 CD1 PHE B 445 17.550 -12.006 -21.707 1.00 45.66 C ATOM 1413 CD2 PHE B 445 17.321 -10.109 -23.132 1.00 45.64 C ATOM 1414 CE1 PHE B 445 18.677 -12.399 -22.406 1.00 46.55 C ATOM 1415 CE2 PHE B 445 18.449 -10.497 -23.834 1.00 48.66 C ATOM 1416 CZ PHE B 445 19.127 -11.642 -23.471 1.00 46.85 C ATOM 1417 N LYS B 446 16.517 -7.570 -20.520 1.00 44.30 N ATOM 1418 CA LYS B 446 17.376 -6.398 -20.658 1.00 48.17 C ATOM 1419 C LYS B 446 18.053 -6.052 -19.328 1.00 49.32 C ATOM 1420 O LYS B 446 19.268 -5.875 -19.270 1.00 50.59 O ATOM 1421 CB LYS B 446 16.565 -5.207 -21.175 1.00 49.62 C ATOM 1422 CG LYS B 446 17.330 -3.890 -21.245 1.00 53.18 C ATOM 1423 CD LYS B 446 18.387 -3.904 -22.340 1.00 55.06 C ATOM 1424 CE LYS B 446 19.046 -2.538 -22.480 1.00 54.49 C ATOM 1425 NZ LYS B 446 20.118 -2.538 -23.509 1.00 57.70 N ATOM 1426 N ARG B 447 17.264 -5.983 -18.260 1.00 47.06 N ATOM 1427 CA ARG B 447 17.791 -5.679 -16.932 1.00 48.81 C ATOM 1428 C ARG B 447 18.734 -6.767 -16.423 1.00 51.80 C ATOM 1429 O ARG B 447 19.691 -6.481 -15.704 1.00 53.03 O ATOM 1430 CB ARG B 447 16.644 -5.481 -15.939 1.00 47.83 C ATOM 1431 CG ARG B 447 16.013 -4.099 -15.997 1.00 51.04 C ATOM 1432 CD ARG B 447 14.647 -4.081 -15.334 1.00 50.42 C ATOM 1433 NE ARG B 447 14.031 -2.759 -15.404 1.00 52.03 N ATOM 1434 CZ ARG B 447 12.774 -2.500 -15.058 1.00 52.86 C ATOM 1435 NH1 ARG B 447 11.987 -3.477 -14.626 1.00 51.78 N ATOM 1436 NH2 ARG B 447 12.300 -1.265 -15.151 1.00 53.03 N ATOM 1437 N ALA B 448 18.461 -8.012 -16.798 1.00 48.66 N ATOM 1438 CA ALA B 448 19.285 -9.135 -16.361 1.00 50.79 C ATOM 1439 C ALA B 448 20.678 -9.079 -16.984 1.00 53.12 C ATOM 1440 O ALA B 448 21.681 -9.302 -16.305 1.00 55.76 O ATOM 1441 CB ALA B 448 18.605 -10.455 -16.700 1.00 45.90 C ATOM 1442 N VAL B 449 20.734 -8.775 -18.278 1.00 53.16 N ATOM 1443 CA VAL B 449 22.005 -8.709 -18.993 1.00 53.86 C ATOM 1444 C VAL B 449 22.793 -7.460 -18.610 1.00 55.96 C ATOM 1445 O VAL B 449 23.993 -7.527 -18.342 1.00 58.76 O ATOM 1446 CB VAL B 449 21.796 -8.727 -20.518 1.00 54.99 C ATOM 1447 CG1 VAL B 449 23.125 -8.569 -21.239 1.00 56.91 C ATOM 1448 CG2 VAL B 449 21.110 -10.016 -20.943 1.00 52.59 C ATOM 1449 N GLU B 450 22.108 -6.323 -18.576 1.00 58.04 N ATOM 1450 CA GLU B 450 22.740 -5.055 -18.232 1.00 60.09 C ATOM 1451 C GLU B 450 23.360 -5.070 -16.823 1.00 58.88 C ATOM 1452 O GLU B 450 24.316 -4.345 -16.568 1.00 61.63 O ATOM 1453 CB GLU B 450 21.724 -3.904 -18.348 1.00 60.07 C ATOM 1454 CG GLU B 450 21.288 -3.567 -19.779 1.00 61.10 C ATOM 1455 CD GLU B 450 22.238 -2.612 -20.483 1.00 66.94 C ATOM 1456 OE1 GLU B 450 22.582 -1.569 -19.885 1.00 70.78 O ATOM 1457 OE2 GLU B 450 22.639 -2.903 -21.633 1.00 68.35 O ATOM 1458 N GLY B 451 22.802 -5.870 -15.912 1.00 59.18 N ATOM 1459 CA GLY B 451 23.181 -5.832 -14.506 1.00 59.82 C ATOM 1460 C GLY B 451 24.025 -7.007 -14.082 1.00 61.72 C ATOM 1461 O GLY B 451 24.602 -7.027 -12.973 1.00 61.09 O ATOM 1462 N GLN B 452 24.102 -7.977 -14.985 1.00 61.98 N ATOM 1463 CA GLN B 452 24.921 -9.147 -14.781 1.00 63.80 C ATOM 1464 C GLN B 452 24.675 -9.770 -13.408 1.00 63.87 C ATOM 1465 O GLN B 452 25.539 -9.786 -12.529 1.00 65.75 O ATOM 1466 CB GLN B 452 26.367 -8.727 -15.064 1.00 65.07 C ATOM 1467 CG GLN B 452 27.479 -9.785 -15.249 1.00 66.88 C ATOM 1468 CD GLN B 452 27.098 -11.050 -16.099 1.00 69.44 C ATOM 1469 OE1 GLN B 452 28.040 -11.767 -16.522 1.00 73.44 O ATOM 1470 NE2 GLN B 452 25.797 -11.508 -16.008 1.00 69.54 N ATOM 1471 N HIS B 453 23.423 -10.219 -13.284 1.00 64.45 N ATOM 1472 CA HIS B 453 22.793 -10.672 -12.061 1.00 60.41 C ATOM 1473 C HIS B 453 23.185 -12.087 -11.690 1.00 60.44 C ATOM 1474 O HIS B 453 23.296 -12.966 -12.547 1.00 60.85 O ATOM 1475 CB HIS B 453 21.262 -10.603 -12.191 1.00 59.13 C ATOM 1476 CG HIS B 453 20.696 -9.208 -12.125 1.00 58.74 C ATOM 1477 ND1 HIS B 453 20.793 -8.319 -13.180 1.00 60.46 N ATOM 1478 CD2 HIS B 453 20.055 -8.551 -11.139 1.00 60.02 C ATOM 1479 CE1 HIS B 453 20.229 -7.178 -12.838 1.00 59.60 C ATOM 1480 NE2 HIS B 453 19.771 -7.280 -11.605 1.00 63.22 N ATOM 1481 N ASN B 454 23.420 -12.287 -10.401 1.00 62.66 N ATOM 1482 CA ASN B 454 23.597 -13.619 -9.874 1.00 61.54 C ATOM 1483 C ASN B 454 22.248 -14.109 -9.368 1.00 57.21 C ATOM 1484 O ASN B 454 21.708 -13.604 -8.383 1.00 58.88 O ATOM 1485 CB ASN B 454 24.661 -13.632 -8.771 1.00 61.92 C ATOM 1486 CG ASN B 454 24.293 -12.756 -7.586 1.00 67.76 C ATOM 1487 OD1 ASN B 454 23.907 -11.598 -7.746 1.00 71.37 O ATOM 1488 ND2 ASN B 454 24.398 -13.316 -6.385 1.00 65.99 N ATOM 1489 N TYR B 455 21.690 -15.083 -10.069 1.00 53.03 N ATOM 1490 CA TYR B 455 20.411 -15.637 -9.673 1.00 46.78 C ATOM 1491 C TYR B 455 20.623 -17.049 -9.157 1.00 44.81 C ATOM 1492 O TYR B 455 21.476 -17.782 -9.661 1.00 44.91 O ATOM 1493 CB TYR B 455 19.425 -15.634 -10.839 1.00 46.97 C ATOM 1494 CG TYR B 455 18.967 -14.267 -11.303 1.00 46.72 C ATOM 1495 CD1 TYR B 455 18.671 -13.259 -10.392 1.00 48.32 C ATOM 1496 CD2 TYR B 455 18.821 -13.989 -12.656 1.00 45.96 C ATOM 1497 CE1 TYR B 455 18.245 -12.012 -10.820 1.00 48.42 C ATOM 1498 CE2 TYR B 455 18.397 -12.749 -13.092 1.00 45.80 C ATOM 1499 CZ TYR B 455 18.110 -11.765 -12.172 1.00 47.46 C ATOM 1500 OH TYR B 455 17.691 -10.530 -12.612 1.00 51.54 O ATOM 1501 N LEU B 456 19.848 -17.429 -8.151 1.00 40.44 N ATOM 1502 CA LEU B 456 19.937 -18.773 -7.609 1.00 38.31 C ATOM 1503 C LEU B 456 18.554 -19.400 -7.507 1.00 34.97 C ATOM 1504 O LEU B 456 17.657 -18.849 -6.872 1.00 35.26 O ATOM 1505 CB LEU B 456 20.624 -18.753 -6.242 1.00 39.96 C ATOM 1506 CG LEU B 456 20.744 -20.087 -5.504 1.00 38.39 C ATOM 1507 CD1 LEU B 456 21.471 -21.113 -6.364 1.00 38.91 C ATOM 1508 CD2 LEU B 456 21.461 -19.895 -4.174 1.00 38.34 C ATOM 1509 N CYS B 457 18.390 -20.549 -8.151 1.00 32.20 N ATOM 1510 CA CYS B 457 17.159 -21.322 -8.057 1.00 31.15 C ATOM 1511 C CYS B 457 17.073 -22.026 -6.700 1.00 32.15 C ATOM 1512 O CYS B 457 18.041 -22.639 -6.260 1.00 32.32 O ATOM 1513 CB CYS B 457 17.096 -22.341 -9.200 1.00 29.90 C ATOM 1514 SG CYS B 457 15.604 -23.359 -9.252 1.00 30.77 S ATOM 1515 N ALA B 458 15.920 -21.930 -6.042 1.00 30.19 N ATOM 1516 CA ALA B 458 15.684 -22.622 -4.776 1.00 32.41 C ATOM 1517 C ALA B 458 15.210 -24.045 -5.039 1.00 32.64 C ATOM 1518 O ALA B 458 14.992 -24.834 -4.118 1.00 36.45 O ATOM 1519 CB ALA B 458 14.663 -21.866 -3.936 1.00 33.32 C ATOM 1520 N GLY B 459 15.030 -24.333 -6.320 1.00 36.54 N ATOM 1521 CA GLY B 459 14.582 -25.615 -6.827 1.00 34.92 C ATOM 1522 C GLY B 459 15.685 -26.482 -7.413 1.00 36.34 C ATOM 1523 O GLY B 459 16.757 -26.649 -6.829 1.00 37.27 O ATOM 1524 N ARG B 460 15.320 -27.154 -8.503 1.00 34.92 N ATOM 1525 CA ARG B 460 16.182 -28.004 -9.328 1.00 33.19 C ATOM 1526 C ARG B 460 16.686 -27.392 -10.661 1.00 34.44 C ATOM 1527 O ARG B 460 17.112 -28.135 -11.546 1.00 36.70 O ATOM 1528 CB ARG B 460 15.452 -29.319 -9.584 1.00 34.83 C ATOM 1529 CG ARG B 460 15.185 -30.077 -8.283 1.00 38.75 C ATOM 1530 CD ARG B 460 14.133 -31.160 -8.441 1.00 43.06 C ATOM 1531 NE ARG B 460 13.987 -31.940 -7.215 1.00 41.66 N ATOM 1532 CZ ARG B 460 13.247 -31.568 -6.176 1.00 44.30 C ATOM 1533 NH1 ARG B 460 12.586 -30.419 -6.207 1.00 41.93 N ATOM 1534 NH2 ARG B 460 13.171 -32.341 -5.101 1.00 44.19 N ATOM 1535 N ASN B 461 16.528 -26.078 -10.838 1.00 32.78 N ATOM 1536 CA ASN B 461 16.754 -25.378 -12.120 1.00 34.14 C ATOM 1537 C ASN B 461 15.764 -25.838 -13.197 1.00 36.26 C ATOM 1538 O ASN B 461 16.042 -25.713 -14.391 1.00 37.03 O ATOM 1539 CB ASN B 461 18.185 -25.599 -12.660 1.00 33.12 C ATOM 1540 CG ASN B 461 19.222 -24.649 -12.063 1.00 34.20 C ATOM 1541 OD1 ASN B 461 18.897 -23.582 -11.545 1.00 33.35 O ATOM 1542 ND2 ASN B 461 20.493 -25.033 -12.168 1.00 32.62 N ATOM 1543 N ASP B 462 14.659 -26.446 -12.770 1.00 38.46 N ATOM 1544 CA ASP B 462 13.547 -26.846 -13.645 1.00 37.60 C ATOM 1545 C ASP B 462 12.228 -26.048 -13.508 1.00 39.47 C ATOM 1546 O ASP B 462 11.188 -26.533 -13.934 1.00 42.80 O ATOM 1547 CB ASP B 462 13.261 -28.348 -13.494 1.00 43.66 C ATOM 1548 CG ASP B 462 12.801 -28.736 -12.104 1.00 45.21 C ATOM 1549 OD1 ASP B 462 12.587 -27.846 -11.253 1.00 49.16 O ATOM 1550 OD2 ASP B 462 12.632 -29.953 -11.869 1.00 51.12 O ATOM 1551 N CYS B 463 12.232 -24.913 -12.817 1.00 37.15 N ATOM 1552 CA CYS B 463 10.978 -24.258 -12.421 1.00 38.38 C ATOM 1553 C CYS B 463 9.979 -23.972 -13.559 1.00 40.46 C ATOM 1554 O CYS B 463 10.359 -23.680 -14.697 1.00 39.51 O ATOM 1555 CB CYS B 463 11.286 -22.950 -11.680 1.00 35.33 C ATOM 1556 SG CYS B 463 12.053 -23.162 -10.030 1.00 35.00 S ATOM 1557 N ILE B 464 8.693 -24.099 -13.239 1.00 38.47 N ATOM 1558 CA ILE B 464 7.623 -23.684 -14.142 1.00 37.99 C ATOM 1559 C ILE B 464 7.592 -22.165 -14.242 1.00 38.65 C ATOM 1560 O ILE B 464 7.520 -21.470 -13.229 1.00 41.14 O ATOM 1561 CB ILE B 464 6.237 -24.176 -13.667 1.00 41.06 C ATOM 1562 CG1 ILE B 464 6.176 -25.705 -13.655 1.00 41.44 C ATOM 1563 CG2 ILE B 464 5.130 -23.591 -14.544 1.00 42.54 C ATOM 1564 CD1 ILE B 464 5.972 -26.313 -15.020 1.00 46.92 C ATOM 1565 N ILE B 465 7.660 -21.647 -15.461 1.00 39.20 N ATOM 1566 CA ILE B 465 7.569 -20.208 -15.668 1.00 41.77 C ATOM 1567 C ILE B 465 6.295 -19.871 -16.433 1.00 42.29 C ATOM 1568 O ILE B 465 6.168 -20.194 -17.609 1.00 44.07 O ATOM 1569 CB ILE B 465 8.796 -19.659 -16.431 1.00 42.11 C ATOM 1570 CG1 ILE B 465 10.086 -19.976 -15.668 1.00 42.62 C ATOM 1571 CG2 ILE B 465 8.670 -18.158 -16.647 1.00 40.06 C ATOM 1572 CD1 ILE B 465 10.155 -19.350 -14.278 1.00 40.12 C ATOM 1573 N ASP B 466 5.347 -19.240 -15.745 1.00 45.97 N ATOM 1574 CA ASP B 466 4.144 -18.718 -16.382 1.00 47.66 C ATOM 1575 C ASP B 466 3.849 -17.329 -15.832 1.00 46.80 C ATOM 1576 O ASP B 466 4.632 -16.801 -15.041 1.00 47.01 O ATOM 1577 CB ASP B 466 2.949 -19.662 -16.181 1.00 47.53 C ATOM 1578 CG ASP B 466 2.682 -19.995 -14.716 1.00 51.94 C ATOM 1579 OD1 ASP B 466 2.893 -19.137 -13.829 1.00 53.11 O ATOM 1580 OD2 ASP B 466 2.249 -21.138 -14.450 1.00 53.27 O ATOM 1581 N LYS B 467 2.727 -16.746 -16.248 1.00 48.90 N ATOM 1582 CA LYS B 467 2.365 -15.388 -15.840 1.00 48.88 C ATOM 1583 C LYS B 467 2.438 -15.172 -14.329 1.00 51.36 C ATOM 1584 O LYS B 467 2.930 -14.131 -13.871 1.00 52.25 O ATOM 1585 CB LYS B 467 0.962 -15.039 -16.345 1.00 53.21 C ATOM 1586 CG LYS B 467 0.538 -13.612 -16.032 1.00 56.11 C ATOM 1587 CD LYS B 467 -0.667 -13.201 -16.849 1.00 57.80 C ATOM 1588 CE LYS B 467 -1.297 -11.924 -16.321 1.00 62.26 C ATOM 1589 NZ LYS B 467 -0.273 -10.864 -16.141 1.00 61.41 N ATOM 1590 N ILE B 468 1.988 -16.161 -13.560 1.00 51.57 N ATOM 1591 CA ILE B 468 2.036 -16.063 -12.102 1.00 51.45 C ATOM 1592 C ILE B 468 3.429 -16.353 -11.532 1.00 51.22 C ATOM 1593 O ILE B 468 3.974 -15.574 -10.748 1.00 53.09 O ATOM 1594 CB ILE B 468 1.055 -17.034 -11.450 1.00 52.53 C ATOM 1595 CG1 ILE B 468 -0.253 -17.087 -12.242 1.00 57.54 C ATOM 1596 CG2 ILE B 468 0.814 -16.656 -10.002 1.00 54.61 C ATOM 1597 CD1 ILE B 468 -0.638 -18.448 -12.742 1.00 57.25 C ATOM 1598 N ARG B 469 4.034 -17.438 -11.995 1.00 48.09 N ATOM 1599 CA ARG B 469 5.216 -17.989 -11.352 1.00 45.13 C ATOM 1600 C ARG B 469 6.528 -17.366 -11.813 1.00 45.61 C ATOM 1601 O ARG B 469 7.578 -17.641 -11.232 1.00 44.31 O ATOM 1602 CB ARG B 469 5.255 -19.497 -11.590 1.00 46.06 C ATOM 1603 CG ARG B 469 4.145 -20.267 -10.887 1.00 45.79 C ATOM 1604 CD ARG B 469 4.052 -21.682 -11.452 1.00 46.24 C ATOM 1605 NE ARG B 469 3.201 -22.547 -10.640 1.00 46.09 N ATOM 1606 CZ ARG B 469 1.898 -22.723 -10.840 1.00 47.87 C ATOM 1607 NH1 ARG B 469 1.280 -22.096 -11.832 1.00 46.88 N ATOM 1608 NH2 ARG B 469 1.210 -23.526 -10.041 1.00 49.70 N ATOM 1609 N ARG B 470 6.478 -16.538 -12.853 1.00 46.50 N ATOM 1610 CA ARG B 470 7.702 -15.991 -13.431 1.00 45.02 C ATOM 1611 C ARG B 470 8.433 -15.075 -12.454 1.00 44.08 C ATOM 1612 O ARG B 470 9.642 -14.880 -12.570 1.00 44.82 O ATOM 1613 CB ARG B 470 7.399 -15.240 -14.732 1.00 44.51 C ATOM 1614 CG ARG B 470 6.550 -13.993 -14.562 1.00 44.29 C ATOM 1615 CD ARG B 470 6.093 -13.457 -15.914 1.00 46.31 C ATOM 1616 NE ARG B 470 5.384 -12.190 -15.776 1.00 45.41 N ATOM 1617 CZ ARG B 470 4.498 -11.729 -16.652 1.00 49.19 C ATOM 1618 NH1 ARG B 470 4.203 -12.433 -17.735 1.00 48.10 N ATOM 1619 NH2 ARG B 470 3.904 -10.564 -16.440 1.00 48.71 N ATOM 1620 N LYS B 471 7.704 -14.525 -11.488 1.00 41.79 N ATOM 1621 CA LYS B 471 8.310 -13.677 -10.467 1.00 44.79 C ATOM 1622 C LYS B 471 9.085 -14.498 -9.434 1.00 44.82 C ATOM 1623 O LYS B 471 9.947 -13.971 -8.731 1.00 45.66 O ATOM 1624 CB LYS B 471 7.240 -12.839 -9.760 1.00 47.96 C ATOM 1625 CG LYS B 471 6.561 -11.804 -10.646 1.00 51.92 C ATOM 1626 CD LYS B 471 5.571 -10.965 -9.847 1.00 56.26 C ATOM 1627 CE LYS B 471 4.837 -9.966 -10.734 1.00 58.86 C ATOM 1628 NZ LYS B 471 4.061 -10.633 -11.820 1.00 55.94 N ATOM 1629 N ASN B 472 8.774 -15.787 -9.341 1.00 42.97 N ATOM 1630 CA ASN B 472 9.370 -16.635 -8.310 1.00 41.89 C ATOM 1631 C ASN B 472 10.837 -16.945 -8.549 1.00 41.58 C ATOM 1632 O ASN B 472 11.652 -16.874 -7.628 1.00 44.36 O ATOM 1633 CB ASN B 472 8.598 -17.946 -8.189 1.00 40.45 C ATOM 1634 CG ASN B 472 7.247 -17.762 -7.541 1.00 46.46 C ATOM 1635 OD1 ASN B 472 6.675 -16.672 -7.571 1.00 45.93 O ATOM 1636 ND2 ASN B 472 6.729 -18.828 -6.945 1.00 45.64 N ATOM 1637 N CYS B 473 11.176 -17.301 -9.782 1.00 37.82 N ATOM 1638 CA CYS B 473 12.538 -17.715 -10.070 1.00 37.40 C ATOM 1639 C CYS B 473 13.143 -16.972 -11.249 1.00 36.88 C ATOM 1640 O CYS B 473 13.026 -17.411 -12.392 1.00 34.37 O ATOM 1641 CB CYS B 473 12.597 -19.217 -10.331 1.00 40.33 C ATOM 1642 SG CYS B 473 14.273 -19.866 -10.203 1.00 35.00 S ATOM 1643 N PRO B 474 13.795 -15.836 -10.970 1.00 38.33 N ATOM 1644 CA PRO B 474 14.528 -15.116 -12.015 1.00 38.60 C ATOM 1645 C PRO B 474 15.621 -15.983 -12.634 1.00 37.28 C ATOM 1646 O PRO B 474 15.949 -15.795 -13.801 1.00 34.93 O ATOM 1647 CB PRO B 474 15.123 -13.909 -11.271 1.00 41.07 C ATOM 1648 CG PRO B 474 14.973 -14.213 -9.810 1.00 44.00 C ATOM 1649 CD PRO B 474 13.770 -15.094 -9.699 1.00 39.51 C ATOM 1650 N ALA B 475 16.161 -16.928 -11.866 1.00 35.85 N ATOM 1651 CA ALA B 475 17.194 -17.825 -12.376 1.00 37.21 C ATOM 1652 C ALA B 475 16.690 -18.649 -13.553 1.00 36.74 C ATOM 1653 O ALA B 475 17.303 -18.662 -14.620 1.00 37.61 O ATOM 1654 CB ALA B 475 17.697 -18.743 -11.271 1.00 36.45 C ATOM 1655 N CYS B 476 15.574 -19.339 -13.353 1.00 34.29 N ATOM 1656 CA CYS B 476 15.011 -20.177 -14.404 1.00 32.65 C ATOM 1657 C CYS B 476 14.405 -19.327 -15.521 1.00 35.34 C ATOM 1658 O CYS B 476 14.427 -19.721 -16.686 1.00 37.17 O ATOM 1659 CB CYS B 476 13.968 -21.134 -13.822 1.00 36.11 C ATOM 1660 SG CYS B 476 14.700 -22.451 -12.789 1.00 34.15 S ATOM 1661 N ARG B 477 13.883 -18.157 -15.169 1.00 33.70 N ATOM 1662 CA ARG B 477 13.322 -17.253 -16.171 1.00 35.50 C ATOM 1663 C ARG B 477 14.418 -16.771 -17.117 1.00 35.91 C ATOM 1664 O ARG B 477 14.252 -16.788 -18.339 1.00 38.30 O ATOM 1665 CB ARG B 477 12.634 -16.060 -15.505 1.00 35.65 C ATOM 1666 CG ARG B 477 11.818 -15.199 -16.458 1.00 36.23 C ATOM 1667 CD ARG B 477 11.221 -14.012 -15.730 1.00 38.35 C ATOM 1668 NE ARG B 477 10.279 -13.264 -16.558 1.00 41.37 N ATOM 1669 CZ ARG B 477 9.655 -12.161 -16.158 1.00 41.70 C ATOM 1670 NH1 ARG B 477 9.877 -11.678 -14.942 1.00 41.05 N ATOM 1671 NH2 ARG B 477 8.810 -11.539 -16.970 1.00 43.73 N ATOM 1672 N TYR B 478 15.541 -16.358 -16.541 1.00 35.67 N ATOM 1673 CA TYR B 478 16.695 -15.904 -17.314 1.00 37.37 C ATOM 1674 C TYR B 478 17.269 -17.023 -18.182 1.00 38.71 C ATOM 1675 O TYR B 478 17.601 -16.806 -19.345 1.00 39.87 O ATOM 1676 CB TYR B 478 17.768 -15.354 -16.375 1.00 39.26 C ATOM 1677 CG TYR B 478 18.962 -14.746 -17.073 1.00 43.12 C ATOM 1678 CD1 TYR B 478 18.800 -13.889 -18.154 1.00 42.81 C ATOM 1679 CD2 TYR B 478 20.252 -15.014 -16.636 1.00 48.58 C ATOM 1680 CE1 TYR B 478 19.894 -13.325 -18.790 1.00 45.39 C ATOM 1681 CE2 TYR B 478 21.351 -14.456 -17.266 1.00 49.11 C ATOM 1682 CZ TYR B 478 21.166 -13.612 -18.340 1.00 49.47 C ATOM 1683 OH TYR B 478 22.259 -13.057 -18.964 1.00 53.40 O ATOM 1684 N ARG B 479 17.382 -18.217 -17.609 1.00 38.53 N ATOM 1685 CA ARG B 479 17.834 -19.395 -18.345 1.00 39.39 C ATOM 1686 C ARG B 479 16.943 -19.663 -19.557 1.00 41.29 C ATOM 1687 O ARG B 479 17.436 -19.955 -20.649 1.00 41.63 O ATOM 1688 CB ARG B 479 17.858 -20.620 -17.424 1.00 41.94 C ATOM 1689 CG ARG B 479 18.219 -21.923 -18.118 1.00 44.81 C ATOM 1690 CD ARG B 479 18.144 -23.105 -17.156 1.00 44.13 C ATOM 1691 NE ARG B 479 16.891 -23.126 -16.404 1.00 43.95 N ATOM 1692 CZ ARG B 479 15.737 -23.587 -16.880 1.00 46.66 C ATOM 1693 NH1 ARG B 479 15.667 -24.072 -18.114 1.00 46.50 N ATOM 1694 NH2 ARG B 479 14.649 -23.563 -16.122 1.00 43.63 N ATOM 1695 N LYS B 480 15.632 -19.552 -19.364 1.00 39.64 N ATOM 1696 CA LYS B 480 14.685 -19.773 -20.452 1.00 41.30 C ATOM 1697 C LYS B 480 14.816 -18.709 -21.538 1.00 43.89 C ATOM 1698 O LYS B 480 14.686 -19.014 -22.723 1.00 41.64 O ATOM 1699 CB LYS B 480 13.250 -19.808 -19.924 1.00 40.82 C ATOM 1700 CG LYS B 480 12.863 -21.144 -19.316 1.00 45.13 C ATOM 1701 CD LYS B 480 11.392 -21.182 -18.951 1.00 49.70 C ATOM 1702 CE LYS B 480 11.051 -22.445 -18.173 1.00 49.52 C ATOM 1703 NZ LYS B 480 11.145 -23.665 -19.024 1.00 51.73 N ATOM 1704 N CYS B 481 15.068 -17.467 -21.129 1.00 42.84 N ATOM 1705 CA CYS B 481 15.332 -16.389 -22.081 1.00 43.70 C ATOM 1706 C CYS B 481 16.505 -16.752 -22.985 1.00 45.29 C ATOM 1707 O CYS B 481 16.421 -16.627 -24.207 1.00 46.87 O ATOM 1708 CB CYS B 481 15.628 -15.072 -21.356 1.00 42.18 C ATOM 1709 SG CYS B 481 14.205 -14.257 -20.582 1.00 45.30 S ATOM 1710 N LEU B 482 17.592 -17.213 -22.371 1.00 42.31 N ATOM 1711 CA LEU B 482 18.813 -17.546 -23.097 1.00 45.05 C ATOM 1712 C LEU B 482 18.623 -18.751 -24.011 1.00 48.74 C ATOM 1713 O LEU B 482 19.068 -18.744 -25.159 1.00 49.92 O ATOM 1714 CB LEU B 482 19.960 -17.810 -22.117 1.00 44.50 C ATOM 1715 CG LEU B 482 20.437 -16.608 -21.299 1.00 44.47 C ATOM 1716 CD1 LEU B 482 21.528 -17.020 -20.325 1.00 46.93 C ATOM 1717 CD2 LEU B 482 20.928 -15.492 -22.215 1.00 45.35 C ATOM 1718 N GLN B 483 17.956 -19.781 -23.502 1.00 45.77 N ATOM 1719 CA GLN B 483 17.746 -21.004 -24.267 1.00 46.83 C ATOM 1720 C GLN B 483 16.771 -20.797 -25.426 1.00 49.40 C ATOM 1721 O GLN B 483 16.812 -21.527 -26.417 1.00 51.30 O ATOM 1722 CB GLN B 483 17.253 -22.123 -23.348 1.00 46.76 C ATOM 1723 CG GLN B 483 18.319 -22.621 -22.383 1.00 49.34 C ATOM 1724 CD GLN B 483 17.771 -23.569 -21.332 1.00 51.41 C ATOM 1725 OE1 GLN B 483 16.558 -23.685 -21.152 1.00 53.57 O ATOM 1726 NE2 GLN B 483 18.667 -24.255 -20.633 1.00 50.49 N ATOM 1727 N ALA B 484 15.903 -19.797 -25.304 1.00 49.29 N ATOM 1728 CA ALA B 484 14.980 -19.458 -26.384 1.00 47.81 C ATOM 1729 C ALA B 484 15.681 -18.639 -27.466 1.00 49.45 C ATOM 1730 O ALA B 484 15.143 -18.452 -28.556 1.00 53.34 O ATOM 1731 CB ALA B 484 13.779 -18.703 -25.844 1.00 47.98 C ATOM 1732 N GLY B 485 16.881 -18.154 -27.163 1.00 49.58 N ATOM 1733 CA GLY B 485 17.680 -17.435 -28.140 1.00 51.32 C ATOM 1734 C GLY B 485 17.749 -15.923 -27.996 1.00 53.12 C ATOM 1735 O GLY B 485 18.267 -15.244 -28.884 1.00 50.94 O ATOM 1736 N MET B 486 17.240 -15.386 -26.890 1.00 49.59 N ATOM 1737 CA MET B 486 17.268 -13.939 -26.681 1.00 50.46 C ATOM 1738 C MET B 486 18.699 -13.409 -26.614 1.00 52.36 C ATOM 1739 O MET B 486 19.549 -13.961 -25.916 1.00 52.11 O ATOM 1740 CB MET B 486 16.504 -13.554 -25.409 1.00 45.82 C ATOM 1741 CG MET B 486 15.005 -13.791 -25.497 1.00 46.69 C ATOM 1742 SD MET B 486 14.060 -13.121 -24.112 1.00 49.52 S ATOM 1743 CE MET B 486 14.120 -11.367 -24.466 1.00 45.70 C ATOM 1744 N ASN B 487 18.956 -12.344 -27.366 1.00 54.22 N ATOM 1745 CA ASN B 487 20.263 -11.698 -27.380 1.00 56.34 C ATOM 1746 C ASN B 487 20.116 -10.206 -27.657 1.00 59.14 C ATOM 1747 O ASN B 487 19.285 -9.803 -28.470 1.00 57.82 O ATOM 1748 CB ASN B 487 21.170 -12.349 -28.427 1.00 58.97 C ATOM 1749 CG ASN B 487 22.548 -11.720 -28.480 1.00 62.72 C ATOM 1750 OD1 ASN B 487 22.998 -11.096 -27.519 1.00 66.51 O ATOM 1751 ND2 ASN B 487 23.225 -11.881 -29.609 1.00 66.14 N ATOM 1752 N LEU B 488 20.933 -9.392 -26.993 1.00 61.44 N ATOM 1753 CA LEU B 488 20.826 -7.938 -27.108 1.00 63.21 C ATOM 1754 C LEU B 488 21.194 -7.427 -28.500 1.00 67.05 C ATOM 1755 O LEU B 488 20.682 -6.398 -28.944 1.00 67.91 O ATOM 1756 CB LEU B 488 21.709 -7.252 -26.061 1.00 62.38 C ATOM 1757 CG LEU B 488 21.198 -7.235 -24.620 1.00 60.02 C ATOM 1758 CD1 LEU B 488 21.935 -6.184 -23.804 1.00 60.57 C ATOM 1759 CD2 LEU B 488 19.696 -6.994 -24.580 1.00 58.12 C ATOM 1760 N GLU B 489 22.077 -8.151 -29.184 1.00 68.17 N ATOM 1761 CA GLU B 489 22.621 -7.695 -30.463 1.00 69.95 C ATOM 1762 C GLU B 489 21.850 -8.219 -31.669 1.00 70.56 C ATOM 1763 O GLU B 489 22.255 -7.998 -32.811 1.00 73.99 O ATOM 1764 CB GLU B 489 24.094 -8.094 -30.584 1.00 69.55 C ATOM 1765 CG GLU B 489 25.000 -7.413 -29.568 1.00 70.45 C ATOM 1766 CD GLU B 489 24.929 -5.893 -29.635 1.00 75.64 C ATOM 1767 OE1 GLU B 489 24.851 -5.335 -30.753 1.00 76.12 O ATOM 1768 OE2 GLU B 489 24.958 -5.255 -28.560 1.00 76.55 O ATOM 1769 N ALA B 490 20.746 -8.915 -31.411 1.00 70.24 N ATOM 1770 CA ALA B 490 19.928 -9.495 -32.475 1.00 71.12 C ATOM 1771 C ALA B 490 19.434 -8.439 -33.461 1.00 74.32 C ATOM 1772 O ALA B 490 19.356 -7.255 -33.133 1.00 76.74 O ATOM 1773 CB ALA B 490 18.749 -10.247 -31.878 1.00 64.08 C TER 1774 ALA B 490 HETATM 1775 ZN ZN A 601 14.031 -17.058 9.314 1.00 34.69 ZN HETATM 1776 ZN ZN A 602 8.439 -23.631 -3.596 1.00 33.23 ZN HETATM 1777 ZN ZN B 601 14.150 -22.123 -10.553 1.00 34.23 ZN HETATM 1778 ZN ZN B 602 6.781 -13.539 -20.966 1.00 42.97 ZN HETATM 1779 O HOH A 701 17.670 -13.581 0.961 1.00 64.85 O HETATM 1780 O HOH A 702 16.476 -14.459 -0.445 1.00 52.23 O HETATM 1781 O HOH A 703 11.204 -26.770 1.592 1.00 39.80 O HETATM 1782 O HOH A 704 18.799 -12.861 11.939 1.00 56.21 O HETATM 1783 O HOH A 705 2.153 -27.152 -6.288 1.00 44.47 O HETATM 1784 O HOH A 706 13.242 -9.707 15.487 1.00 46.89 O HETATM 1785 O HOH A 707 -1.156 -9.114 5.282 1.00 58.15 O HETATM 1786 O HOH A 708 -5.200 -21.107 3.865 1.00 45.93 O HETATM 1787 O HOH A 709 5.215 -25.741 -0.588 1.00 33.99 O HETATM 1788 O HOH A 710 10.430 -10.629 5.753 1.00 38.07 O HETATM 1789 O HOH A 711 10.834 -26.852 -5.169 1.00 38.74 O HETATM 1790 O HOH A 712 14.654 -25.264 3.393 1.00 41.34 O HETATM 1791 O HOH A 713 1.581 -6.273 11.405 1.00 51.73 O HETATM 1792 O HOH A 714 2.134 -22.642 1.146 1.00 34.71 O HETATM 1793 O HOH A 715 4.216 -8.080 8.871 1.00 41.90 O HETATM 1794 O HOH A 716 10.928 -22.766 18.742 1.00 45.10 O HETATM 1795 O HOH A 717 9.051 -26.077 15.758 1.00 46.42 O HETATM 1796 O HOH A 718 20.208 -19.501 6.494 1.00 43.81 O HETATM 1797 O HOH A 719 17.336 -23.777 5.878 1.00 48.19 O HETATM 1798 O HOH A 720 7.623 -30.397 0.997 1.00 45.08 O HETATM 1799 O HOH A 721 9.019 -27.264 -11.491 1.00 41.97 O HETATM 1800 O HOH A 722 5.490 -18.827 -4.004 1.00 38.60 O HETATM 1801 O HOH A 723 16.642 -11.159 13.057 1.00 46.57 O HETATM 1802 O HOH A 724 9.533 -26.071 9.187 1.00 42.38 O HETATM 1803 O HOH A 725 4.451 -12.435 3.442 1.00 40.90 O HETATM 1804 O HOH A 726 -5.938 -11.613 11.801 1.00 65.98 O HETATM 1805 O HOH A 727 5.190 -8.808 13.497 1.00 43.12 O HETATM 1806 O HOH A 728 14.629 -34.308 -10.849 1.00 50.23 O HETATM 1807 O HOH A 729 -2.327 -21.710 -3.848 1.00 51.89 O HETATM 1808 O HOH A 730 5.930 -30.643 3.579 1.00 52.72 O HETATM 1809 O HOH A 731 0.660 -20.633 -0.384 1.00 69.00 O HETATM 1810 O HOH A 732 -3.858 -18.702 15.729 1.00 45.67 O HETATM 1811 O HOH A 733 8.916 -22.653 -5.400 1.00 66.93 O HETATM 1812 O HOH A 734 2.223 -28.294 12.393 1.00 50.19 O HETATM 1813 O HOH A 735 22.348 -18.643 7.599 1.00 46.76 O HETATM 1814 O HOH A 736 8.157 -29.874 -12.115 1.00 68.12 O HETATM 1815 O HOH A 737 11.137 -22.077 -6.801 1.00 44.29 O HETATM 1816 O HOH A 738 1.582 -6.897 8.326 1.00 48.53 O HETATM 1817 O HOH C 101 14.023 -7.447 -13.416 1.00 48.01 O HETATM 1818 O HOH C 102 9.603 -7.488 -15.805 1.00 48.75 O HETATM 1819 O HOH C 103 11.452 -1.328 27.896 1.00 63.93 O HETATM 1820 O HOH C 104 11.528 -11.728 -8.306 1.00 52.63 O HETATM 1821 O HOH C 105 7.885 -2.704 -18.402 1.00 59.37 O HETATM 1822 O HOH C 106 11.803 -5.705 17.945 1.00 63.98 O HETATM 1823 O HOH C 107 6.283 -5.450 11.310 1.00 48.14 O HETATM 1824 O HOH C 108 13.696 -4.783 24.371 1.00 66.88 O HETATM 1825 O HOH C 109 4.541 -2.318 8.250 1.00 56.51 O HETATM 1826 O HOH C 110 -3.058 -9.985 16.205 1.00 68.01 O HETATM 1827 O HOH C 111 2.578 -4.503 20.197 1.00 51.57 O HETATM 1828 O HOH C 112 4.509 -7.266 11.495 1.00 45.09 O HETATM 1829 O HOH D 101 8.221 2.496 -4.864 1.00 62.72 O HETATM 1830 O HOH D 102 11.192 2.195 11.730 1.00 53.83 O HETATM 1831 O HOH D 103 11.361 -6.788 14.054 1.00 49.70 O HETATM 1832 O HOH D 104 2.711 -2.948 21.895 1.00 54.34 O HETATM 1833 O HOH D 105 15.576 -8.318 11.805 1.00 54.03 O HETATM 1834 O HOH D 106 13.741 -2.669 20.611 1.00 51.42 O HETATM 1835 O HOH D 107 9.601 -14.801 1.175 1.00 36.75 O HETATM 1836 O HOH D 108 3.046 -7.198 2.151 1.00 67.85 O HETATM 1837 O HOH D 109 9.042 -12.712 -2.436 1.00 51.49 O HETATM 1838 O HOH D 110 14.246 -5.815 1.351 1.00 51.02 O HETATM 1839 O HOH D 111 9.474 8.036 15.810 1.00 59.34 O HETATM 1840 O HOH D 112 4.778 1.426 17.922 1.00 56.35 O HETATM 1841 O HOH D 113 9.559 -10.945 -3.785 1.00 63.52 O HETATM 1842 O HOH B 701 13.269 -26.126 -10.124 1.00 37.99 O HETATM 1843 O HOH B 702 2.643 -10.116 -19.212 1.00 60.75 O HETATM 1844 O HOH B 703 13.280 -24.577 -19.487 1.00 49.89 O HETATM 1845 O HOH B 704 12.599 -3.618 -27.047 1.00 52.66 O HETATM 1846 O HOH B 705 12.393 -24.775 -16.375 1.00 42.36 O HETATM 1847 O HOH B 706 12.298 -28.305 -7.695 1.00 38.58 O HETATM 1848 O HOH B 707 20.150 -16.483 -26.397 1.00 60.74 O HETATM 1849 O HOH B 708 11.274 -12.757 -12.616 1.00 43.56 O HETATM 1850 O HOH B 709 8.408 -21.736 -20.074 1.00 46.03 O HETATM 1851 O HOH B 710 12.080 -6.161 -14.658 1.00 48.46 O HETATM 1852 O HOH B 711 16.913 -30.233 -13.219 1.00 39.18 O HETATM 1853 O HOH B 712 9.588 -23.191 -21.204 1.00 56.70 O HETATM 1854 O HOH B 713 10.608 -16.205 -31.533 1.00 58.33 O HETATM 1855 O HOH B 714 1.308 -17.953 -18.474 1.00 54.19 O HETATM 1856 O HOH B 715 15.491 -27.147 -16.712 1.00 43.92 O HETATM 1857 O HOH B 716 3.246 -7.464 -23.326 1.00 58.90 O HETATM 1858 O HOH B 717 20.295 -21.538 -10.190 1.00 33.39 O HETATM 1859 O HOH B 718 20.094 -18.251 -14.746 1.00 42.08 O HETATM 1860 O HOH B 719 17.869 -22.152 -13.785 1.00 38.51 O HETATM 1861 O HOH B 720 22.877 -9.949 -24.892 1.00 61.55 O HETATM 1862 O HOH B 721 16.120 -8.784 -14.475 1.00 45.05 O HETATM 1863 O HOH B 722 9.280 -25.472 -17.748 1.00 49.59 O HETATM 1864 O HOH B 723 7.450 -23.074 -17.998 1.00 49.15 O HETATM 1865 O HOH B 724 13.600 -20.396 -7.049 1.00 32.81 O HETATM 1866 O HOH B 725 8.687 -20.970 -6.370 1.00 37.48 O HETATM 1867 O HOH B 726 9.380 -27.049 -16.235 1.00 53.59 O HETATM 1868 O HOH B 727 1.732 -23.229 -16.497 1.00 59.96 O HETATM 1869 O HOH B 728 16.101 -17.112 -8.900 1.00 38.75 O HETATM 1870 O HOH B 729 17.951 -15.453 -6.918 1.00 53.11 O HETATM 1871 O HOH B 730 14.230 -3.208 -19.367 1.00 53.88 O HETATM 1872 O HOH B 731 14.706 -32.142 -12.283 1.00 44.99 O HETATM 1873 O HOH B 732 21.613 -16.732 -13.432 1.00 49.79 O HETATM 1874 O HOH B 733 20.539 -21.135 -14.041 1.00 45.08 O CONECT 30 1775 CONECT 51 1775 CONECT 149 1775 CONECT 165 1775 CONECT 301 1776 CONECT 343 1776 CONECT 429 1776 CONECT 447 1776 CONECT 1243 1778 CONECT 1264 1778 CONECT 1362 1778 CONECT 1378 1778 CONECT 1514 1777 CONECT 1556 1777 CONECT 1642 1777 CONECT 1660 1777 CONECT 1775 30 51 149 165 CONECT 1776 301 343 429 447 CONECT 1776 1811 CONECT 1777 1514 1556 1642 1660 CONECT 1778 1243 1264 1362 1378 CONECT 1811 1776 MASTER 414 0 4 5 4 0 5 6 1870 4 22 22 END
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Related entries of code: 5e69
Entries with 90% protein sequence similarity cutoff in PDBbind
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Complexes with the same small molecule ligand
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Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5e69
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
Glucocorticoid receptor DNA binding domain
Ligand Name
IL8 NF-kappa B response element DNA
EC.Number
E.C.-.-.-.-
Resolution
1.85(Å)
Affinity (Kd/Ki/IC50)
Kd=17uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) Nat Commun Vol. 9: pp. 1337-1337
Links to External Databases
RCSB PDB
The mother database
PDBsum
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Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P04150
Entrez Gene ID
NCBI Entrez Gene ID:
2908
ASD
Information of known allosteric effects of PDB entries
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