Browse entries in the PDBbind-CN Database
HEADER TRANSCRIPTION/DNA 09-JUN-16 5KE6 TITLE MOUSE KLF4 ZNF1-3 AND TPG/CPA SEQUENCE DNA COMPLEX STRUCTURE COMPND MOL_ID: 1; COMPND 2 MOLECULE: KRUEPPEL-LIKE FACTOR 4; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: UNP RESIDUES 396-483; COMPND 5 SYNONYM: EPITHELIAL ZINC FINGER PROTEIN EZF,GUT-ENRICHED KRUEPPEL- COMPND 6 LIKE FACTOR; COMPND 7 ENGINEERED: YES; COMPND 8 MOL_ID: 2; COMPND 9 MOLECULE: DNA (5'-D(*GP*AP*GP*GP*TP*GP*TP*GP*GP*C)-3'); COMPND 10 CHAIN: B; COMPND 11 ENGINEERED: YES; COMPND 12 MOL_ID: 3; COMPND 13 MOLECULE: DNA (5'-D(*GP*CP*CP*AP*CP*AP*CP*CP*TP*C)-3'); COMPND 14 CHAIN: C; COMPND 15 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; SOURCE 3 ORGANISM_COMMON: MOUSE; SOURCE 4 ORGANISM_TAXID: 10090; SOURCE 5 GENE: KLF4, EZF, GKLF, ZIE; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3) CODON PLUS; SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PGEX-6P-1; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PXC1248; SOURCE 11 MOL_ID: 2; SOURCE 12 SYNTHETIC: YES; SOURCE 13 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; SOURCE 14 ORGANISM_TAXID: 32630; SOURCE 15 MOL_ID: 3; SOURCE 16 SYNTHETIC: YES; SOURCE 17 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; SOURCE 18 ORGANISM_TAXID: 32630 KEYWDS KLF4, ZINC FINGER, KRUPPEL-LIKE FACTORS, TRANSCRIPTION-DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR H.HASHIMOTO,X.CHENG REVDAT 5 25-DEC-19 5KE6 1 REMARK REVDAT 4 20-SEP-17 5KE6 1 REMARK REVDAT 3 14-DEC-16 5KE6 1 JRNL REVDAT 2 21-SEP-16 5KE6 1 JRNL REVDAT 1 14-SEP-16 5KE6 0 JRNL AUTH H.HASHIMOTO,D.WANG,A.N.STEVES,P.JIN,R.M.BLUMENTHAL,X.ZHANG, JRNL AUTH 2 X.CHENG JRNL TITL DISTINCTIVE KLF4 MUTANTS DETERMINE PREFERENCE FOR DNA JRNL TITL 2 METHYLATION STATUS. JRNL REF NUCLEIC ACIDS RES. V. 44 10177 2016 JRNL REFN ESSN 1362-4962 JRNL PMID 27596594 JRNL DOI 10.1093/NAR/GKW774 REMARK 2 REMARK 2 RESOLUTION. 1.99 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX (DEV_2400: ???) 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) : 1.99 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 34.68 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.440 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.8 REMARK 3 NUMBER OF REFLECTIONS : 12416 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.200 REMARK 3 R VALUE (WORKING SET) : 0.198 REMARK 3 FREE R VALUE : 0.234 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.010 REMARK 3 FREE R VALUE TEST SET COUNT : 622 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 34.6833 - 3.1582 0.99 3094 164 0.1700 0.2026 REMARK 3 2 3.1582 - 2.5070 1.00 2948 155 0.2250 0.2772 REMARK 3 3 2.5070 - 2.1902 1.00 2885 152 0.2289 0.2536 REMARK 3 4 2.1902 - 1.9899 1.00 2867 151 0.2654 0.2958 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) : 0.220 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 23.840 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 : 0.008 1195 REMARK 3 ANGLE : 0.874 1674 REMARK 3 CHIRALITY : 0.040 170 REMARK 3 PLANARITY : 0.005 145 REMARK 3 DIHEDRAL : 25.440 614 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : 5 REMARK 3 TLS GROUP : 1 REMARK 3 SELECTION: (CHAIN A AND RESID 399:427) REMARK 3 ORIGIN FOR THE GROUP (A): -26.3160 -36.8602 262.8873 REMARK 3 T TENSOR REMARK 3 T11: 0.3371 T22: 0.4586 REMARK 3 T33: 0.3708 T12: -0.1100 REMARK 3 T13: -0.0790 T23: 0.0769 REMARK 3 L TENSOR REMARK 3 L11: 3.0543 L22: 6.8262 REMARK 3 L33: 8.6627 L12: -4.3790 REMARK 3 L13: -2.8146 L23: 2.3430 REMARK 3 S TENSOR REMARK 3 S11: -0.1346 S12: 0.6547 S13: 0.6351 REMARK 3 S21: -0.1078 S22: 0.0060 S23: -0.6810 REMARK 3 S31: -0.1979 S32: 0.6544 S33: 0.0887 REMARK 3 TLS GROUP : 2 REMARK 3 SELECTION: (CHAIN A AND RESID 428:457) REMARK 3 ORIGIN FOR THE GROUP (A): -41.7697 -49.4253 272.1995 REMARK 3 T TENSOR REMARK 3 T11: 0.2627 T22: 0.3127 REMARK 3 T33: 0.2322 T12: -0.0184 REMARK 3 T13: -0.0338 T23: 0.0989 REMARK 3 L TENSOR REMARK 3 L11: 3.8014 L22: 6.0494 REMARK 3 L33: 7.0540 L12: 1.3026 REMARK 3 L13: -2.9944 L23: -1.4023 REMARK 3 S TENSOR REMARK 3 S11: -0.0343 S12: -0.3633 S13: -0.2872 REMARK 3 S21: 0.3537 S22: 0.1849 S23: 0.3576 REMARK 3 S31: -0.0120 S32: -0.3007 S33: -0.2129 REMARK 3 TLS GROUP : 3 REMARK 3 SELECTION: (CHAIN A AND RESID 458:483) REMARK 3 ORIGIN FOR THE GROUP (A): -27.6379 -63.4492 283.0868 REMARK 3 T TENSOR REMARK 3 T11: 0.4399 T22: 0.3971 REMARK 3 T33: 0.5015 T12: 0.1176 REMARK 3 T13: 0.0594 T23: 0.0717 REMARK 3 L TENSOR REMARK 3 L11: 3.8323 L22: 6.5886 REMARK 3 L33: 5.3338 L12: -2.0739 REMARK 3 L13: 1.5319 L23: -4.5413 REMARK 3 S TENSOR REMARK 3 S11: -0.3637 S12: -0.3973 S13: -1.0016 REMARK 3 S21: 0.5515 S22: 0.6965 S23: 0.9446 REMARK 3 S31: 0.0634 S32: -0.0862 S33: -0.2926 REMARK 3 TLS GROUP : 4 REMARK 3 SELECTION: (CHAIN B AND RESID 1:10) REMARK 3 ORIGIN FOR THE GROUP (A): -26.4226 -49.4529 271.3599 REMARK 3 T TENSOR REMARK 3 T11: 0.3103 T22: 0.3580 REMARK 3 T33: 0.2026 T12: 0.0417 REMARK 3 T13: -0.0488 T23: 0.0361 REMARK 3 L TENSOR REMARK 3 L11: 1.9133 L22: 2.1940 REMARK 3 L33: 4.0823 L12: 0.0410 REMARK 3 L13: -0.1055 L23: 1.8838 REMARK 3 S TENSOR REMARK 3 S11: -0.1080 S12: 0.0175 S13: 0.0797 REMARK 3 S21: 0.2341 S22: 0.2808 S23: -0.1027 REMARK 3 S31: 0.2191 S32: 0.2818 S33: -0.1714 REMARK 3 TLS GROUP : 5 REMARK 3 SELECTION: (CHAIN C AND RESID 1:10) REMARK 3 ORIGIN FOR THE GROUP (A): -26.0895 -50.9288 272.2980 REMARK 3 T TENSOR REMARK 3 T11: 0.3100 T22: 0.3606 REMARK 3 T33: 0.2425 T12: -0.0262 REMARK 3 T13: -0.0209 T23: 0.0057 REMARK 3 L TENSOR REMARK 3 L11: 3.7654 L22: 5.4861 REMARK 3 L33: 3.8610 L12: 0.3119 REMARK 3 L13: 2.2678 L23: 3.4050 REMARK 3 S TENSOR REMARK 3 S11: 0.0157 S12: 0.2396 S13: -0.2281 REMARK 3 S21: 0.5605 S22: 0.3569 S23: -0.3489 REMARK 3 S31: 0.3820 S32: 0.3890 S33: -0.3613 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 5KE6 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 10-JUN-16. REMARK 100 THE DEPOSITION ID IS D_1000221910. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 08-MAR-14 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 8.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 22-BM REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.000 REMARK 200 MONOCHROMATOR : SI (111) REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARMOSAIC 300 MM CCD REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XDS REMARK 200 DATA SCALING SOFTWARE : XSCALE REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 12435 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.990 REMARK 200 RESOLUTION RANGE LOW (A) : 34.678 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : -3.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.9 REMARK 200 DATA REDUNDANCY : 7.000 REMARK 200 R MERGE (I) : 0.07300 REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 16.5800 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.99 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.04 REMARK 200 COMPLETENESS FOR SHELL (%) : NULL REMARK 200 DATA REDUNDANCY IN SHELL : 7.20 REMARK 200 R MERGE FOR SHELL (I) : 0.98200 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : 2.320 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER REMARK 200 STARTING MODEL: 4M9E REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 50.68 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.49 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.1M TRIS-HCL PH8.5 , 0.25M NACL AND REMARK 280 20% POLYETHYLENE GLYCOL 8000, VAPOR DIFFUSION, HANGING DROP, REMARK 280 TEMPERATURE 289K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 43 21 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z+1/2 REMARK 290 3555 -Y+1/2,X+1/2,Z+3/4 REMARK 290 4555 Y+1/2,-X+1/2,Z+1/4 REMARK 290 5555 -X+1/2,Y+1/2,-Z+3/4 REMARK 290 6555 X+1/2,-Y+1/2,-Z+1/4 REMARK 290 7555 Y,X,-Z REMARK 290 8555 -Y,-X,-Z+1/2 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 65.27000 REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 25.43500 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 25.43500 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 97.90500 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 25.43500 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 25.43500 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 32.63500 REMARK 290 SMTRY1 5 -1.000000 0.000000 0.000000 25.43500 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 25.43500 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 97.90500 REMARK 290 SMTRY1 6 1.000000 0.000000 0.000000 25.43500 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 25.43500 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 32.63500 REMARK 290 SMTRY1 7 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 7 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 8 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 65.27000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TRIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TRIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 2910 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 8540 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -15.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B, C REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLY A 391 REMARK 465 PRO A 392 REMARK 465 LEU A 393 REMARK 465 GLY A 394 REMARK 465 SER A 395 REMARK 465 ARG A 396 REMARK 465 THR A 397 REMARK 465 ALA A 398 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 638 O HOH A 648 2.12 REMARK 500 O HOH A 649 O HOH B 118 2.16 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 DT B 5 O4' - C1' - N1 ANGL. DEV. = 3.7 DEGREES 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 503 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 402 SG REMARK 620 2 CYS A 407 SG 115.3 REMARK 620 3 HIS A 420 NE2 110.7 103.4 REMARK 620 4 HIS A 424 NE2 111.6 114.8 99.5 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 502 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 432 SG REMARK 620 2 CYS A 437 SG 120.1 REMARK 620 3 HIS A 450 NE2 115.5 97.7 REMARK 620 4 HIS A 454 NE2 109.7 115.2 95.6 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 ZN A 501 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 462 SG REMARK 620 2 CYS A 465 SG 113.8 REMARK 620 3 HIS A 478 NE2 121.8 98.9 REMARK 620 4 HIS A 482 NE2 111.7 115.9 92.9 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 501 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue ZN A 502 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue ZN A 503 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 5KEA RELATED DB: PDB REMARK 900 RELATED ID: 5KE9 RELATED DB: PDB REMARK 900 RELATED ID: 5KEB RELATED DB: PDB REMARK 900 RELATED ID: 5K5I RELATED DB: PDB REMARK 900 RELATED ID: 5K5J RELATED DB: PDB REMARK 900 RELATED ID: 5K5L RELATED DB: PDB DBREF 5KE6 A 396 483 UNP Q60793 KLF4_MOUSE 396 483 DBREF 5KE6 B 1 10 PDB 5KE6 5KE6 1 10 DBREF 5KE6 C 1 10 PDB 5KE6 5KE6 1 10 SEQADV 5KE6 GLY A 391 UNP Q60793 EXPRESSION TAG SEQADV 5KE6 PRO A 392 UNP Q60793 EXPRESSION TAG SEQADV 5KE6 LEU A 393 UNP Q60793 EXPRESSION TAG SEQADV 5KE6 GLY A 394 UNP Q60793 EXPRESSION TAG SEQADV 5KE6 SER A 395 UNP Q60793 EXPRESSION TAG SEQRES 1 A 93 GLY PRO LEU GLY SER ARG THR ALA THR HIS THR CYS ASP SEQRES 2 A 93 TYR ALA GLY CYS GLY LYS THR TYR THR LYS SER SER HIS SEQRES 3 A 93 LEU LYS ALA HIS LEU ARG THR HIS THR GLY GLU LYS PRO SEQRES 4 A 93 TYR HIS CYS ASP TRP ASP GLY CYS GLY TRP LYS PHE ALA SEQRES 5 A 93 ARG SER ASP GLU LEU THR ARG HIS TYR ARG LYS HIS THR SEQRES 6 A 93 GLY HIS ARG PRO PHE GLN CYS GLN LYS CYS ASP ARG ALA SEQRES 7 A 93 PHE SER ARG SER ASP HIS LEU ALA LEU HIS MET LYS ARG SEQRES 8 A 93 HIS PHE SEQRES 1 B 10 DG DA DG DG DT DG DT DG DG DC SEQRES 1 C 10 DG DC DC DA DC DA DC DC DT DC HET ZN A 501 1 HET ZN A 502 1 HET ZN A 503 1 HETNAM ZN ZINC ION FORMUL 4 ZN 3(ZN 2+) FORMUL 7 HOH *81(H2 O) HELIX 1 AA1 LYS A 413 GLY A 426 1 14 HELIX 2 AA2 ARG A 443 GLY A 456 1 14 HELIX 3 AA3 ARG A 471 ARG A 481 1 11 SHEET 1 AA1 2 HIS A 400 THR A 401 0 SHEET 2 AA1 2 THR A 410 TYR A 411 -1 O TYR A 411 N HIS A 400 SHEET 1 AA2 2 TYR A 430 HIS A 431 0 SHEET 2 AA2 2 LYS A 440 PHE A 441 -1 O PHE A 441 N TYR A 430 SHEET 1 AA3 2 PHE A 460 GLN A 461 0 SHEET 2 AA3 2 ALA A 468 PHE A 469 -1 O PHE A 469 N PHE A 460 LINK SG CYS A 402 ZN ZN A 503 1555 1555 2.27 LINK SG CYS A 407 ZN ZN A 503 1555 1555 2.38 LINK NE2 HIS A 420 ZN ZN A 503 1555 1555 2.08 LINK NE2 HIS A 424 ZN ZN A 503 1555 1555 2.04 LINK SG CYS A 432 ZN ZN A 502 1555 1555 2.28 LINK SG CYS A 437 ZN ZN A 502 1555 1555 2.29 LINK NE2 HIS A 450 ZN ZN A 502 1555 1555 2.04 LINK NE2 HIS A 454 ZN ZN A 502 1555 1555 2.11 LINK SG CYS A 462 ZN ZN A 501 1555 1555 2.25 LINK SG CYS A 465 ZN ZN A 501 1555 1555 2.30 LINK NE2 HIS A 478 ZN ZN A 501 1555 1555 2.06 LINK NE2 HIS A 482 ZN ZN A 501 1555 1555 2.03 SITE 1 AC1 4 CYS A 462 CYS A 465 HIS A 478 HIS A 482 SITE 1 AC2 4 CYS A 432 CYS A 437 HIS A 450 HIS A 454 SITE 1 AC3 4 CYS A 402 CYS A 407 HIS A 420 HIS A 424 CRYST1 50.870 50.870 130.540 90.00 90.00 90.00 P 43 21 2 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 0.019658 0.000000 0.000000 0.00000 SCALE2 0.000000 0.019658 0.000000 0.00000 SCALE3 0.000000 0.000000 0.007660 0.00000 ATOM 1 N THR A 399 -16.005 -37.690 256.338 1.00 81.71 N ANISOU 1 N THR A 399 7128 13219 10699 -1253 1497 1785 N ATOM 2 CA THR A 399 -17.016 -38.692 256.653 1.00 77.19 C ANISOU 2 CA THR A 399 7027 12599 9702 -909 1170 1645 C ATOM 3 C THR A 399 -18.353 -38.005 256.913 1.00 72.20 C ANISOU 3 C THR A 399 6810 11573 9049 -1073 966 1667 C ATOM 4 O THR A 399 -18.628 -36.947 256.348 1.00 74.13 O ANISOU 4 O THR A 399 7164 11604 9399 -1292 1169 1897 O ATOM 5 CB THR A 399 -16.613 -39.551 257.878 1.00 79.81 C ANISOU 5 CB THR A 399 7178 13115 10030 -690 818 1299 C ATOM 6 OG1 THR A 399 -16.689 -38.765 259.077 1.00 79.80 O ANISOU 6 OG1 THR A 399 7008 12938 10376 -955 497 1097 O ATOM 7 CG2 THR A 399 -15.195 -40.089 257.705 1.00 86.00 C ANISOU 7 CG2 THR A 399 7457 14355 10866 -492 991 1250 C ATOM 8 HA THR A 399 -17.124 -39.284 255.892 1.00 92.65 H ATOM 9 HB THR A 399 -17.217 -40.306 257.951 1.00 95.80 H ATOM 10 HG1 THR A 399 -16.470 -39.231 259.740 1.00 95.79 H ATOM 11 HG21 THR A 399 -14.948 -40.626 258.475 1.00103.23 H ATOM 12 HG22 THR A 399 -15.144 -40.639 256.908 1.00103.23 H ATOM 13 HG23 THR A 399 -14.569 -39.353 257.621 1.00103.23 H ATOM 14 N HIS A 400 -19.174 -38.596 257.783 1.00 59.08 N ANISOU 14 N HIS A 400 5399 9808 7240 -936 607 1435 N ATOM 15 CA HIS A 400 -20.570 -38.190 257.952 1.00 53.64 C ANISOU 15 CA HIS A 400 5104 8817 6458 -1000 428 1434 C ATOM 16 C HIS A 400 -20.674 -37.269 259.164 1.00 49.89 C ANISOU 16 C HIS A 400 4523 8103 6330 -1257 179 1314 C ATOM 17 O HIS A 400 -20.815 -37.727 260.301 1.00 46.80 O ANISOU 17 O HIS A 400 4156 7671 5954 -1160 -101 1068 O ATOM 18 CB HIS A 400 -21.468 -39.413 258.103 1.00 49.29 C ANISOU 18 CB HIS A 400 4896 8269 5561 -732 274 1245 C ATOM 19 CG HIS A 400 -21.287 -40.435 257.023 1.00 50.95 C ANISOU 19 CG HIS A 400 5241 8699 5419 -467 480 1290 C ATOM 20 ND1 HIS A 400 -21.988 -40.396 255.835 1.00 52.10 N ANISOU 20 ND1 HIS A 400 5642 8861 5292 -383 592 1412 N ATOM 21 CD2 HIS A 400 -20.483 -41.523 256.950 1.00 52.70 C ANISOU 21 CD2 HIS A 400 5413 9137 5475 -212 582 1214 C ATOM 22 CE1 HIS A 400 -21.628 -41.419 255.080 1.00 53.19 C ANISOU 22 CE1 HIS A 400 5892 9194 5126 -122 747 1397 C ATOM 23 NE2 HIS A 400 -20.714 -42.117 255.731 1.00 54.02 N ANISOU 23 NE2 HIS A 400 5825 9409 5289 -17 766 1294 N ATOM 24 H HIS A 400 -18.941 -39.246 258.296 1.00 70.92 H ATOM 25 HA HIS A 400 -20.857 -37.695 257.169 1.00 64.39 H ATOM 26 HB2 HIS A 400 -21.274 -39.841 258.951 1.00 59.17 H ATOM 27 HB3 HIS A 400 -22.394 -39.124 258.085 1.00 59.17 H ATOM 28 HD2 HIS A 400 -19.887 -41.814 257.602 1.00 63.27 H ATOM 29 HE1 HIS A 400 -21.957 -41.612 254.232 1.00 63.86 H ATOM 30 HE2 HIS A 400 -20.327 -42.828 255.440 1.00 64.85 H ATOM 31 N THR A 401 -20.644 -35.969 258.910 1.00 49.12 N ANISOU 31 N THR A 401 4387 7804 6470 -1549 307 1494 N ATOM 32 CA THR A 401 -20.655 -34.971 259.965 1.00 51.32 C ANISOU 32 CA THR A 401 4593 7819 7088 -1822 101 1381 C ATOM 33 C THR A 401 -22.043 -34.377 260.139 1.00 48.22 C ANISOU 33 C THR A 401 4638 7115 6569 -1803 -34 1447 C ATOM 34 O THR A 401 -22.770 -34.166 259.164 1.00 43.51 O ANISOU 34 O THR A 401 4320 6481 5732 -1697 134 1663 O ATOM 35 CB THR A 401 -19.670 -33.855 259.656 1.00 58.08 C ANISOU 35 CB THR A 401 5143 8586 8339 -2210 377 1503 C ATOM 36 OG1 THR A 401 -18.431 -34.435 259.235 1.00 62.55 O ANISOU 36 OG1 THR A 401 5256 9513 8999 -2196 585 1478 O ATOM 37 CG2 THR A 401 -19.454 -32.988 260.900 1.00 58.85 C ANISOU 37 CG2 THR A 401 5094 8447 8819 -2508 101 1268 C ATOM 38 H THR A 401 -20.615 -35.634 258.119 1.00 58.97 H ATOM 39 HA THR A 401 -20.394 -35.386 260.802 1.00 61.62 H ATOM 40 HB THR A 401 -20.024 -33.295 258.947 1.00 69.72 H ATOM 41 HG1 THR A 401 -17.875 -33.829 259.060 1.00 75.09 H ATOM 42 HG21 THR A 401 -18.825 -32.276 260.703 1.00 70.65 H ATOM 43 HG22 THR A 401 -20.295 -32.597 261.182 1.00 70.65 H ATOM 44 HG23 THR A 401 -19.100 -33.530 261.623 1.00 70.65 H ATOM 45 N CYS A 402 -22.395 -34.101 261.390 1.00 42.12 N ANISOU 45 N CYS A 402 3924 6149 5931 -1850 -346 1248 N ATOM 46 CA CYS A 402 -23.640 -33.420 261.705 1.00 40.21 C ANISOU 46 CA CYS A 402 4053 5615 5612 -1827 -470 1300 C ATOM 47 C CYS A 402 -23.459 -31.929 261.484 1.00 46.11 C ANISOU 47 C CYS A 402 4878 6056 6585 -2112 -312 1488 C ATOM 48 O CYS A 402 -22.508 -31.327 261.994 1.00 46.48 O ANISOU 48 O CYS A 402 4682 5991 6988 -2413 -317 1389 O ATOM 49 CB CYS A 402 -24.059 -33.688 263.152 1.00 37.79 C ANISOU 49 CB CYS A 402 3835 5186 5338 -1725 -811 1036 C ATOM 50 SG CYS A 402 -25.595 -32.848 263.621 1.00 35.87 S ANISOU 50 SG CYS A 402 4014 4610 5006 -1656 -940 1098 S ATOM 51 H CYS A 402 -21.923 -34.302 262.080 1.00 50.41 H ATOM 52 HA CYS A 402 -24.342 -33.736 261.116 1.00 48.12 H ATOM 53 HB2 CYS A 402 -24.193 -34.642 263.269 1.00 45.21 H ATOM 54 HB3 CYS A 402 -23.357 -33.378 263.745 1.00 45.21 H ATOM 55 N ASP A 403 -24.380 -31.331 260.732 1.00 47.74 N ANISOU 55 N ASP A 403 5440 6124 6575 -2000 -168 1729 N ATOM 56 CA ASP A 403 -24.273 -29.935 260.343 1.00 52.10 C ANISOU 56 CA ASP A 403 6211 6329 7254 -2197 88 1968 C ATOM 57 C ASP A 403 -25.311 -29.058 261.035 1.00 50.09 C ANISOU 57 C ASP A 403 6340 5742 6949 -2122 -100 1972 C ATOM 58 O ASP A 403 -25.600 -27.962 260.560 1.00 52.52 O ANISOU 58 O ASP A 403 7004 5749 7201 -2129 126 2215 O ATOM 59 CB ASP A 403 -24.384 -29.824 258.823 1.00 57.51 C ANISOU 59 CB ASP A 403 7096 7101 7656 -2020 472 2292 C ATOM 60 CG ASP A 403 -23.236 -30.529 258.107 1.00 62.69 C ANISOU 60 CG ASP A 403 7400 8038 8380 -2102 738 2331 C ATOM 61 OD1 ASP A 403 -22.066 -30.325 258.500 1.00 66.06 O ANISOU 61 OD1 ASP A 403 7458 8429 9215 -2465 845 2241 O ATOM 62 OD2 ASP A 403 -23.505 -31.303 257.165 1.00 63.69 O ANISOU 62 OD2 ASP A 403 7596 8449 8153 -1790 822 2418 O ATOM 63 H ASP A 403 -25.084 -31.722 260.432 1.00 57.31 H ATOM 64 HA ASP A 403 -23.396 -29.608 260.598 1.00 62.54 H ATOM 65 HB2 ASP A 403 -25.215 -30.232 258.534 1.00 69.04 H ATOM 66 HB3 ASP A 403 -24.366 -28.888 258.571 1.00 69.04 H ATOM 67 N TYR A 404 -25.862 -29.508 262.157 1.00 45.58 N ANISOU 67 N TYR A 404 5752 5192 6373 -2011 -467 1724 N ATOM 68 CA TYR A 404 -26.871 -28.748 262.885 1.00 48.29 C ANISOU 68 CA TYR A 404 6448 5247 6653 -1889 -641 1720 C ATOM 69 C TYR A 404 -26.191 -27.894 263.951 1.00 52.97 C ANISOU 69 C TYR A 404 7051 5477 7596 -2198 -759 1578 C ATOM 70 O TYR A 404 -25.471 -28.425 264.804 1.00 55.11 O ANISOU 70 O TYR A 404 7027 5844 8069 -2312 -978 1300 O ATOM 71 CB TYR A 404 -27.890 -29.694 263.523 1.00 46.46 C ANISOU 71 CB TYR A 404 6217 5209 6227 -1592 -905 1533 C ATOM 72 CG TYR A 404 -29.112 -29.005 264.085 1.00 47.29 C ANISOU 72 CG TYR A 404 6661 5104 6204 -1377 -1030 1563 C ATOM 73 CD1 TYR A 404 -30.209 -28.741 263.280 1.00 48.88 C ANISOU 73 CD1 TYR A 404 7050 5418 6104 -1086 -955 1723 C ATOM 74 CD2 TYR A 404 -29.174 -28.625 265.420 1.00 47.68 C ANISOU 74 CD2 TYR A 404 6841 4876 6399 -1404 -1238 1414 C ATOM 75 CE1 TYR A 404 -31.331 -28.113 263.779 1.00 49.98 C ANISOU 75 CE1 TYR A 404 7457 5422 6111 -835 -1061 1746 C ATOM 76 CE2 TYR A 404 -30.299 -27.993 265.933 1.00 47.77 C ANISOU 76 CE2 TYR A 404 7176 4702 6271 -1163 -1321 1459 C ATOM 77 CZ TYR A 404 -31.374 -27.738 265.103 1.00 49.60 C ANISOU 77 CZ TYR A 404 7548 5073 6224 -883 -1220 1632 C ATOM 78 OH TYR A 404 -32.505 -27.110 265.580 1.00 50.99 O ANISOU 78 OH TYR A 404 8004 5125 6246 -589 -1294 1674 O ATOM 79 H TYR A 404 -25.666 -30.261 262.521 1.00 54.72 H ATOM 80 HA TYR A 404 -27.338 -28.159 262.272 1.00 57.97 H ATOM 81 HB2 TYR A 404 -28.191 -30.325 262.852 1.00 55.78 H ATOM 82 HB3 TYR A 404 -27.460 -30.170 264.251 1.00 55.78 H ATOM 83 HD1 TYR A 404 -30.186 -28.989 262.383 1.00 58.68 H ATOM 84 HD2 TYR A 404 -28.449 -28.794 265.979 1.00 57.24 H ATOM 85 HE1 TYR A 404 -32.056 -27.941 263.222 1.00 60.00 H ATOM 86 HE2 TYR A 404 -30.327 -27.740 266.827 1.00 57.35 H ATOM 87 HH TYR A 404 -32.412 -26.931 266.395 1.00 61.22 H ATOM 88 N ALA A 405 -26.409 -26.580 263.892 1.00 57.79 N ANISOU 88 N ALA A 405 8034 5671 8251 -2297 -620 1743 N ATOM 89 CA ALA A 405 -25.999 -25.647 264.947 1.00 60.62 C ANISOU 89 CA ALA A 405 8515 5611 8906 -2572 -763 1574 C ATOM 90 C ALA A 405 -24.603 -25.967 265.471 1.00 64.60 C ANISOU 90 C ALA A 405 8513 6221 9812 -2953 -883 1262 C ATOM 91 O ALA A 405 -24.372 -26.078 266.678 1.00 65.32 O ANISOU 91 O ALA A 405 8506 6301 10013 -2929 -1232 922 O ATOM 92 CB ALA A 405 -27.008 -25.644 266.095 1.00 57.73 C ANISOU 92 CB ALA A 405 8419 5139 8377 -2261 -1111 1438 C ATOM 93 H ALA A 405 -26.804 -26.193 263.233 1.00 69.37 H ATOM 94 HA ALA A 405 -25.974 -24.751 264.576 1.00 72.77 H ATOM 95 HB1 ALA A 405 -26.710 -25.019 266.775 1.00 69.30 H ATOM 96 HB2 ALA A 405 -27.874 -25.373 265.753 1.00 69.30 H ATOM 97 HB3 ALA A 405 -27.063 -26.538 266.468 1.00 69.30 H ATOM 98 N GLY A 406 -23.666 -26.138 264.542 1.00 70.99 N ANISOU 98 N GLY A 406 8986 7202 10783 -3200 -566 1344 N ATOM 99 CA GLY A 406 -22.280 -26.386 264.909 1.00 73.03 C ANISOU 99 CA GLY A 406 8686 7668 11396 -3473 -604 995 C ATOM 100 C GLY A 406 -22.064 -27.583 265.810 1.00 70.12 C ANISOU 100 C GLY A 406 7983 7685 10974 -3249 -1055 688 C ATOM 101 O GLY A 406 -21.099 -27.602 266.581 1.00 72.51 O ANISOU 101 O GLY A 406 7934 8117 11501 -3351 -1243 294 O ATOM 102 H GLY A 406 -23.809 -26.114 263.695 1.00 85.21 H ATOM 103 HA2 GLY A 406 -21.761 -26.522 264.101 1.00 87.67 H ATOM 104 HA3 GLY A 406 -21.929 -25.603 265.362 1.00 87.67 H ATOM 105 N CYS A 407 -22.932 -28.593 265.730 1.00 59.13 N ANISOU 105 N CYS A 407 6731 6511 9225 -2855 -1172 802 N ATOM 106 CA CYS A 407 -22.765 -29.785 266.556 1.00 55.84 C ANISOU 106 CA CYS A 407 6121 6409 8688 -2554 -1493 526 C ATOM 107 C CYS A 407 -21.403 -30.427 266.316 1.00 57.03 C ANISOU 107 C CYS A 407 5698 6949 9022 -2667 -1465 356 C ATOM 108 O CYS A 407 -20.569 -30.513 267.224 1.00 60.26 O ANISOU 108 O CYS A 407 5813 7481 9602 -2674 -1757 -5 O ATOM 109 CB CYS A 407 -23.890 -30.777 266.260 1.00 41.71 C ANISOU 109 CB CYS A 407 4584 4771 6494 -2151 -1446 673 C ATOM 110 SG CYS A 407 -23.665 -32.412 267.008 1.00 39.18 S ANISOU 110 SG CYS A 407 4137 4780 5969 -1763 -1653 409 S ATOM 111 H CYS A 407 -23.618 -28.612 265.212 1.00 70.98 H ATOM 112 HA CYS A 407 -22.821 -29.534 267.491 1.00 67.04 H ATOM 113 HB2 CYS A 407 -24.722 -30.411 266.596 1.00 49.92 H ATOM 114 HB3 CYS A 407 -23.951 -30.899 265.300 1.00 49.92 H ATOM 115 N GLY A 408 -21.165 -30.895 265.095 1.00 60.74 N ANISOU 115 N GLY A 408 6009 7655 9414 -2683 -1118 589 N ATOM 116 CA GLY A 408 -19.878 -31.431 264.722 1.00 66.45 C ANISOU 116 CA GLY A 408 6179 8761 10307 -2776 -1013 478 C ATOM 117 C GLY A 408 -19.696 -32.918 264.938 1.00 66.11 C ANISOU 117 C GLY A 408 6017 9126 9976 -2334 -1161 341 C ATOM 118 O GLY A 408 -18.729 -33.484 264.414 1.00 70.56 O ANISOU 118 O GLY A 408 6167 10053 10591 -2317 -1013 315 O ATOM 119 H GLY A 408 -21.746 -30.910 264.461 1.00 72.92 H ATOM 120 HA2 GLY A 408 -19.724 -31.248 263.782 1.00 79.76 H ATOM 121 HA3 GLY A 408 -19.190 -30.973 265.231 1.00 79.76 H ATOM 122 N LYS A 409 -20.570 -33.571 265.701 1.00 59.04 N ANISOU 122 N LYS A 409 5494 8161 8778 -1963 -1400 256 N ATOM 123 CA LYS A 409 -20.451 -35.010 265.886 1.00 54.62 C ANISOU 123 CA LYS A 409 4947 7895 7911 -1529 -1454 148 C ATOM 124 C LYS A 409 -20.333 -35.702 264.536 1.00 53.38 C ANISOU 124 C LYS A 409 4716 7977 7591 -1491 -1097 382 C ATOM 125 O LYS A 409 -21.037 -35.361 263.581 1.00 51.45 O ANISOU 125 O LYS A 409 4671 7604 7275 -1622 -857 651 O ATOM 126 CB LYS A 409 -21.657 -35.548 266.652 1.00 51.05 C ANISOU 126 CB LYS A 409 5015 7221 7163 -1208 -1583 114 C ATOM 127 CG LYS A 409 -21.535 -35.417 268.158 1.00 53.77 C ANISOU 127 CG LYS A 409 5471 7442 7518 -998 -1952 -178 C ATOM 128 CD LYS A 409 -22.652 -36.167 268.867 1.00 53.67 C ANISOU 128 CD LYS A 409 5990 7218 7184 -629 -1953 -185 C ATOM 129 CE LYS A 409 -22.306 -36.443 270.325 1.00 60.54 C ANISOU 129 CE LYS A 409 7025 8047 7929 -224 -2266 -478 C ATOM 130 NZ LYS A 409 -23.357 -37.271 270.981 1.00 61.40 N ANISOU 130 NZ LYS A 409 7700 7911 7719 148 -2139 -453 N ATOM 131 H LYS A 409 -21.231 -33.208 266.115 1.00 70.88 H ATOM 132 HA LYS A 409 -19.652 -35.203 266.400 1.00 65.57 H ATOM 133 HB2 LYS A 409 -22.447 -35.058 266.375 1.00 61.29 H ATOM 134 HB3 LYS A 409 -21.765 -36.489 266.444 1.00 61.29 H ATOM 135 HG2 LYS A 409 -20.687 -35.790 268.445 1.00 64.55 H ATOM 136 HG3 LYS A 409 -21.591 -34.480 268.405 1.00 64.55 H ATOM 137 HD2 LYS A 409 -23.461 -35.632 268.844 1.00 64.43 H ATOM 138 HD3 LYS A 409 -22.799 -37.017 268.424 1.00 64.43 H ATOM 139 HE2 LYS A 409 -21.466 -36.926 270.369 1.00 72.67 H ATOM 140 HE3 LYS A 409 -22.237 -35.603 270.804 1.00 72.67 H ATOM 141 HZ1 LYS A 409 -23.138 -37.423 271.830 1.00 73.71 H ATOM 142 HZ2 LYS A 409 -24.139 -36.847 270.955 1.00 73.71 H ATOM 143 HZ3 LYS A 409 -23.437 -38.051 270.559 1.00 73.71 H ATOM 144 N THR A 410 -19.426 -36.674 264.455 1.00 54.19 N ANISOU 144 N THR A 410 4555 8444 7591 -1248 -1075 267 N ATOM 145 CA THR A 410 -19.150 -37.384 263.215 1.00 52.76 C ANISOU 145 CA THR A 410 4302 8512 7233 -1161 -742 462 C ATOM 146 C THR A 410 -19.383 -38.874 263.402 1.00 47.75 C ANISOU 146 C THR A 410 3956 7999 6190 -691 -754 369 C ATOM 147 O THR A 410 -19.128 -39.431 264.474 1.00 46.64 O ANISOU 147 O THR A 410 3874 7903 5945 -379 -984 128 O ATOM 148 CB THR A 410 -17.712 -37.167 262.745 1.00 57.50 C ANISOU 148 CB THR A 410 4297 9455 8094 -1305 -591 444 C ATOM 149 OG1 THR A 410 -16.814 -37.511 263.809 1.00 60.67 O ANISOU 149 OG1 THR A 410 4361 10119 8572 -1089 -906 93 O ATOM 150 CG2 THR A 410 -17.504 -35.732 262.337 1.00 60.88 C ANISOU 150 CG2 THR A 410 4511 9686 8937 -1835 -420 578 C ATOM 151 H THR A 410 -18.950 -36.942 265.119 1.00 65.05 H ATOM 152 HA THR A 410 -19.750 -37.066 262.522 1.00 63.34 H ATOM 153 HB THR A 410 -17.535 -37.733 261.978 1.00 69.02 H ATOM 154 HG1 THR A 410 -16.019 -37.396 263.562 1.00 72.83 H ATOM 155 HG21 THR A 410 -16.590 -35.602 262.040 1.00 73.09 H ATOM 156 HG22 THR A 410 -18.107 -35.503 261.612 1.00 73.09 H ATOM 157 HG23 THR A 410 -17.678 -35.145 263.089 1.00 73.09 H ATOM 158 N TYR A 411 -19.839 -39.520 262.331 1.00 42.31 N ANISOU 158 N TYR A 411 3486 7346 5242 -614 -487 548 N ATOM 159 CA TYR A 411 -20.198 -40.925 262.372 1.00 42.04 C ANISOU 159 CA TYR A 411 3817 7332 4825 -241 -426 461 C ATOM 160 C TYR A 411 -19.565 -41.646 261.194 1.00 45.38 C ANISOU 160 C TYR A 411 4149 8045 5047 -89 -147 583 C ATOM 161 O TYR A 411 -19.109 -41.022 260.231 1.00 45.74 O ANISOU 161 O TYR A 411 3917 8235 5227 -285 37 781 O ATOM 162 CB TYR A 411 -21.723 -41.094 262.377 1.00 37.52 C ANISOU 162 CB TYR A 411 3710 6435 4113 -307 -414 467 C ATOM 163 CG TYR A 411 -22.330 -40.498 263.625 1.00 34.76 C ANISOU 163 CG TYR A 411 3491 5802 3916 -371 -651 353 C ATOM 164 CD1 TYR A 411 -22.409 -41.239 264.798 1.00 38.46 C ANISOU 164 CD1 TYR A 411 4232 6141 4240 -63 -744 156 C ATOM 165 CD2 TYR A 411 -22.765 -39.180 263.653 1.00 35.79 C ANISOU 165 CD2 TYR A 411 3528 5773 4296 -679 -754 456 C ATOM 166 CE1 TYR A 411 -22.934 -40.697 265.959 1.00 34.81 C ANISOU 166 CE1 TYR A 411 3933 5414 3880 -60 -941 63 C ATOM 167 CE2 TYR A 411 -23.291 -38.628 264.810 1.00 34.59 C ANISOU 167 CE2 TYR A 411 3528 5357 4256 -695 -968 353 C ATOM 168 CZ TYR A 411 -23.374 -39.395 265.958 1.00 34.56 C ANISOU 168 CZ TYR A 411 3778 5248 4107 -383 -1066 156 C ATOM 169 OH TYR A 411 -23.891 -38.850 267.108 1.00 34.15 O ANISOU 169 OH TYR A 411 3922 4925 4127 -343 -1256 66 O ATOM 170 H TYR A 411 -19.949 -39.156 261.559 1.00 50.80 H ATOM 171 HA TYR A 411 -19.849 -41.318 263.188 1.00 50.48 H ATOM 172 HB2 TYR A 411 -22.099 -40.640 261.607 1.00 45.06 H ATOM 173 HB3 TYR A 411 -21.942 -42.038 262.352 1.00 45.06 H ATOM 174 HD1 TYR A 411 -22.112 -42.120 264.800 1.00 46.18 H ATOM 175 HD2 TYR A 411 -22.711 -38.662 262.882 1.00 42.97 H ATOM 176 HE1 TYR A 411 -22.989 -41.210 266.733 1.00 41.80 H ATOM 177 HE2 TYR A 411 -23.589 -37.747 264.814 1.00 41.53 H ATOM 178 HH TYR A 411 -23.878 -39.418 267.727 1.00 41.00 H ATOM 179 N THR A 412 -19.526 -42.976 261.292 1.00 49.14 N ANISOU 179 N THR A 412 4923 8569 5179 293 -73 473 N ATOM 180 CA THR A 412 -18.927 -43.797 260.247 1.00 53.53 C ANISOU 180 CA THR A 412 5479 9382 5477 521 189 567 C ATOM 181 C THR A 412 -19.915 -44.174 259.154 1.00 50.55 C ANISOU 181 C THR A 412 5477 8861 4868 439 367 658 C ATOM 182 O THR A 412 -19.488 -44.480 258.041 1.00 52.26 O ANISOU 182 O THR A 412 5666 9280 4909 549 586 793 O ATOM 183 CB THR A 412 -18.337 -45.081 260.837 1.00 54.40 C ANISOU 183 CB THR A 412 5796 9601 5271 1038 208 397 C ATOM 184 OG1 THR A 412 -19.393 -45.892 261.367 1.00 54.09 O ANISOU 184 OG1 THR A 412 6371 9182 5000 1143 224 260 O ATOM 185 CG2 THR A 412 -17.330 -44.758 261.932 1.00 59.02 C ANISOU 185 CG2 THR A 412 5984 10414 6025 1227 -39 241 C ATOM 186 H THR A 412 -19.840 -43.425 261.955 1.00 58.99 H ATOM 187 HA THR A 412 -18.203 -43.299 259.835 1.00 64.26 H ATOM 188 HB THR A 412 -17.878 -45.572 260.137 1.00 65.30 H ATOM 189 HG1 THR A 412 -19.077 -46.599 261.693 1.00 64.94 H ATOM 190 HG21 THR A 412 -16.964 -45.579 262.297 1.00 70.85 H ATOM 191 HG22 THR A 412 -16.606 -44.224 261.569 1.00 70.85 H ATOM 192 HG23 THR A 412 -17.762 -44.261 262.644 1.00 70.85 H ATOM 193 N LYS A 413 -21.213 -44.193 259.456 1.00 45.94 N ANISOU 193 N LYS A 413 5227 7960 4267 280 273 555 N ATOM 194 CA LYS A 413 -22.265 -44.479 258.490 1.00 45.21 C ANISOU 194 CA LYS A 413 5416 7773 3990 180 359 546 C ATOM 195 C LYS A 413 -23.253 -43.325 258.481 1.00 42.51 C ANISOU 195 C LYS A 413 4995 7293 3863 -135 206 602 C ATOM 196 O LYS A 413 -23.486 -42.685 259.513 1.00 37.66 O ANISOU 196 O LYS A 413 4305 6515 3490 -265 41 566 O ATOM 197 CB LYS A 413 -23.050 -45.762 258.818 1.00 46.45 C ANISOU 197 CB LYS A 413 6046 7688 3913 286 429 286 C ATOM 198 CG LYS A 413 -22.279 -47.051 258.740 1.00 50.41 C ANISOU 198 CG LYS A 413 6805 8246 4103 656 628 217 C ATOM 199 CD LYS A 413 -23.079 -48.199 259.356 1.00 52.09 C ANISOU 199 CD LYS A 413 7556 8083 4153 706 755 -46 C ATOM 200 CE LYS A 413 -24.318 -48.538 258.534 1.00 53.62 C ANISOU 200 CE LYS A 413 7957 8131 4285 428 806 -226 C ATOM 201 NZ LYS A 413 -24.911 -49.830 258.985 1.00 55.75 N ANISOU 201 NZ LYS A 413 8769 8012 4400 448 1047 -506 N ATOM 202 H LYS A 413 -21.516 -44.036 260.245 1.00 55.15 H ATOM 203 HA LYS A 413 -21.880 -44.567 257.603 1.00 54.28 H ATOM 204 HB2 LYS A 413 -23.393 -45.685 259.722 1.00 55.76 H ATOM 205 HB3 LYS A 413 -23.792 -45.831 258.197 1.00 55.76 H ATOM 206 HG2 LYS A 413 -22.102 -47.265 257.811 1.00 60.52 H ATOM 207 HG3 LYS A 413 -21.447 -46.959 259.230 1.00 60.52 H ATOM 208 HD2 LYS A 413 -22.519 -48.990 259.399 1.00 62.54 H ATOM 209 HD3 LYS A 413 -23.367 -47.945 260.247 1.00 62.54 H ATOM 210 HE2 LYS A 413 -24.981 -47.839 258.648 1.00 64.37 H ATOM 211 HE3 LYS A 413 -24.072 -48.622 257.600 1.00 64.37 H ATOM 212 HZ1 LYS A 413 -25.633 -50.019 258.500 1.00 66.92 H ATOM 213 HZ2 LYS A 413 -24.318 -50.487 258.889 1.00 66.92 H ATOM 214 HZ3 LYS A 413 -25.145 -49.775 259.842 1.00 66.92 H ATOM 215 N SER A 414 -23.837 -43.069 257.305 1.00 43.69 N ANISOU 215 N SER A 414 5203 7523 3877 -188 251 681 N ATOM 216 CA SER A 414 -24.889 -42.062 257.212 1.00 44.06 C ANISOU 216 CA SER A 414 5234 7470 4037 -380 103 716 C ATOM 217 C SER A 414 -26.100 -42.469 258.030 1.00 39.89 C ANISOU 217 C SER A 414 4876 6725 3555 -481 -32 441 C ATOM 218 O SER A 414 -26.803 -41.610 258.571 1.00 40.99 O ANISOU 218 O SER A 414 4957 6738 3878 -620 -176 454 O ATOM 219 CB SER A 414 -25.298 -41.835 255.750 1.00 49.13 C ANISOU 219 CB SER A 414 5960 8284 4422 -286 159 816 C ATOM 220 OG SER A 414 -25.962 -42.971 255.230 1.00 50.96 O ANISOU 220 OG SER A 414 6420 8565 4376 -184 144 545 O ATOM 221 H SER A 414 -23.645 -43.458 256.562 1.00 52.46 H ATOM 222 HA SER A 414 -24.556 -41.222 257.565 1.00 52.90 H ATOM 223 HB2 SER A 414 -25.894 -41.072 255.704 1.00 58.98 H ATOM 224 HB3 SER A 414 -24.502 -41.666 255.223 1.00 58.98 H ATOM 225 HG SER A 414 -26.181 -42.835 254.430 1.00 61.17 H ATOM 226 N SER A 415 -26.353 -43.769 258.146 1.00 36.97 N ANISOU 226 N SER A 415 4740 6281 3027 -413 60 195 N ATOM 227 CA SER A 415 -27.501 -44.223 258.918 1.00 39.04 C ANISOU 227 CA SER A 415 5164 6298 3372 -553 37 -77 C ATOM 228 C SER A 415 -27.353 -43.842 260.393 1.00 35.12 C ANISOU 228 C SER A 415 4670 5570 3103 -567 -9 -41 C ATOM 229 O SER A 415 -28.338 -43.499 261.064 1.00 32.26 O ANISOU 229 O SER A 415 4329 5031 2898 -704 -71 -137 O ATOM 230 CB SER A 415 -27.656 -45.732 258.745 1.00 45.23 C ANISOU 230 CB SER A 415 6265 6970 3951 -503 238 -345 C ATOM 231 OG SER A 415 -28.628 -46.226 259.636 1.00 49.44 O ANISOU 231 OG SER A 415 6974 7196 4614 -668 327 -598 O ATOM 232 H SER A 415 -25.883 -44.397 257.794 1.00 44.39 H ATOM 233 HA SER A 415 -28.302 -43.796 258.576 1.00 46.88 H ATOM 234 HB2 SER A 415 -27.935 -45.920 257.835 1.00 54.31 H ATOM 235 HB3 SER A 415 -26.807 -46.162 258.930 1.00 54.31 H ATOM 236 HG SER A 415 -28.712 -47.057 259.538 1.00 59.35 H ATOM 237 N HIS A 416 -26.124 -43.885 260.912 1.00 32.21 N ANISOU 237 N HIS A 416 4266 5232 2740 -387 7 76 N ATOM 238 CA HIS A 416 -25.885 -43.415 262.273 1.00 33.64 C ANISOU 238 CA HIS A 416 4440 5243 3100 -338 -108 86 C ATOM 239 C HIS A 416 -26.128 -41.918 262.379 1.00 31.62 C ANISOU 239 C HIS A 416 3931 4993 3091 -536 -314 236 C ATOM 240 O HIS A 416 -26.707 -41.442 263.360 1.00 29.93 O ANISOU 240 O HIS A 416 3796 4561 3015 -579 -418 190 O ATOM 241 CB HIS A 416 -24.458 -43.735 262.711 1.00 36.17 C ANISOU 241 CB HIS A 416 4693 5696 3356 -59 -114 120 C ATOM 242 CG HIS A 416 -24.151 -45.198 262.757 1.00 39.05 C ANISOU 242 CG HIS A 416 5404 6013 3421 239 107 -8 C ATOM 243 ND1 HIS A 416 -22.865 -45.681 262.875 1.00 42.00 N ANISOU 243 ND1 HIS A 416 5721 6597 3639 590 131 11 N ATOM 244 CD2 HIS A 416 -24.961 -46.282 262.715 1.00 39.56 C ANISOU 244 CD2 HIS A 416 5893 5826 3312 246 342 -175 C ATOM 245 CE1 HIS A 416 -22.896 -47.002 262.889 1.00 43.15 C ANISOU 245 CE1 HIS A 416 6314 6605 3477 855 374 -103 C ATOM 246 NE2 HIS A 416 -24.154 -47.392 262.795 1.00 41.89 N ANISOU 246 NE2 HIS A 416 6469 6130 3318 617 525 -223 N ATOM 247 H HIS A 416 -25.425 -44.176 260.504 1.00 38.68 H ATOM 248 HA HIS A 416 -26.496 -43.865 262.878 1.00 40.40 H ATOM 249 HB2 HIS A 416 -23.840 -43.323 262.087 1.00 43.44 H ATOM 250 HB3 HIS A 416 -24.315 -43.375 263.600 1.00 43.44 H ATOM 251 HD2 HIS A 416 -25.888 -46.277 262.638 1.00 47.50 H ATOM 252 HE1 HIS A 416 -22.157 -47.562 262.959 1.00 51.81 H ATOM 253 HE2 HIS A 416 -24.425 -48.208 262.787 1.00 50.30 H ATOM 254 N LEU A 417 -25.669 -41.156 261.390 1.00 34.16 N ANISOU 254 N LEU A 417 4005 5524 3449 -628 -330 432 N ATOM 255 CA LEU A 417 -25.909 -39.718 261.402 1.00 34.65 C ANISOU 255 CA LEU A 417 3924 5526 3713 -805 -457 593 C ATOM 256 C LEU A 417 -27.397 -39.419 261.348 1.00 32.89 C ANISOU 256 C LEU A 417 3839 5193 3464 -872 -522 533 C ATOM 257 O LEU A 417 -27.894 -38.563 262.091 1.00 30.56 O ANISOU 257 O LEU A 417 3571 4717 3323 -936 -647 558 O ATOM 258 CB LEU A 417 -25.180 -39.047 260.234 1.00 35.98 C ANISOU 258 CB LEU A 417 3898 5888 3887 -867 -345 835 C ATOM 259 CG LEU A 417 -25.361 -37.529 260.081 1.00 37.30 C ANISOU 259 CG LEU A 417 4013 5931 4227 -1039 -378 1041 C ATOM 260 CD1 LEU A 417 -25.079 -36.783 261.369 1.00 33.64 C ANISOU 260 CD1 LEU A 417 3483 5245 4053 -1173 -549 987 C ATOM 261 CD2 LEU A 417 -24.460 -36.990 258.966 1.00 40.50 C ANISOU 261 CD2 LEU A 417 4277 6470 4640 -1091 -140 1298 C ATOM 262 H LEU A 417 -25.223 -41.441 260.712 1.00 41.02 H ATOM 263 HA LEU A 417 -25.559 -39.346 262.227 1.00 41.60 H ATOM 264 HB2 LEU A 417 -24.230 -39.213 260.336 1.00 43.21 H ATOM 265 HB3 LEU A 417 -25.489 -39.456 259.411 1.00 43.21 H ATOM 266 HG LEU A 417 -26.280 -37.349 259.831 1.00 44.78 H ATOM 267 HD11 LEU A 417 -25.207 -35.834 261.218 1.00 40.23 H ATOM 268 HD12 LEU A 417 -25.690 -37.095 262.054 1.00 40.23 H ATOM 269 HD13 LEU A 417 -24.163 -36.956 261.639 1.00 40.23 H ATOM 270 HD21 LEU A 417 -24.592 -36.032 258.889 1.00 48.62 H ATOM 271 HD22 LEU A 417 -23.535 -37.180 259.188 1.00 48.62 H ATOM 272 HD23 LEU A 417 -24.696 -37.425 258.132 1.00 48.62 H ATOM 273 N LYS A 418 -28.132 -40.110 260.472 1.00 35.72 N ANISOU 273 N LYS A 418 4267 5681 3622 -840 -452 421 N ATOM 274 CA LYS A 418 -29.567 -39.872 260.384 1.00 35.53 C ANISOU 274 CA LYS A 418 4271 5644 3585 -887 -538 294 C ATOM 275 C LYS A 418 -30.225 -40.050 261.750 1.00 31.60 C ANISOU 275 C LYS A 418 3873 4880 3253 -940 -547 137 C ATOM 276 O LYS A 418 -31.009 -39.204 262.191 1.00 30.42 O ANISOU 276 O LYS A 418 3701 4649 3210 -962 -652 167 O ATOM 277 CB LYS A 418 -30.203 -40.802 259.354 1.00 36.35 C ANISOU 277 CB LYS A 418 4395 5948 3470 -862 -491 75 C ATOM 278 CG LYS A 418 -31.701 -40.557 259.167 1.00 39.16 C ANISOU 278 CG LYS A 418 4660 6395 3822 -899 -621 -130 C ATOM 279 CD LYS A 418 -32.266 -41.289 257.960 1.00 43.51 C ANISOU 279 CD LYS A 418 5168 7222 4140 -859 -658 -391 C ATOM 280 CE LYS A 418 -33.646 -40.752 257.594 1.00 46.55 C ANISOU 280 CE LYS A 418 5360 7835 4492 -811 -869 -583 C ATOM 281 NZ LYS A 418 -34.262 -41.467 256.445 1.00 48.73 N ANISOU 281 NZ LYS A 418 5549 8427 4539 -759 -980 -937 N ATOM 282 H LYS A 418 -27.829 -40.706 259.931 1.00 42.89 H ATOM 283 HA LYS A 418 -29.718 -38.958 260.096 1.00 42.67 H ATOM 284 HB2 LYS A 418 -29.769 -40.666 258.497 1.00 43.65 H ATOM 285 HB3 LYS A 418 -30.084 -41.720 259.643 1.00 43.65 H ATOM 286 HG2 LYS A 418 -32.173 -40.869 259.955 1.00 47.01 H ATOM 287 HG3 LYS A 418 -31.853 -39.608 259.042 1.00 47.01 H ATOM 288 HD2 LYS A 418 -31.676 -41.159 257.200 1.00 52.24 H ATOM 289 HD3 LYS A 418 -32.350 -42.233 258.165 1.00 52.24 H ATOM 290 HE2 LYS A 418 -34.235 -40.850 258.358 1.00 55.89 H ATOM 291 HE3 LYS A 418 -33.566 -39.815 257.355 1.00 55.89 H ATOM 292 HZ1 LYS A 418 -35.063 -41.122 256.266 1.00 58.50 H ATOM 293 HZ2 LYS A 418 -33.746 -41.387 255.724 1.00 58.50 H ATOM 294 HZ3 LYS A 418 -34.356 -42.330 256.639 1.00 58.50 H ATOM 295 N ALA A 419 -29.909 -41.155 262.431 1.00 30.35 N ANISOU 295 N ALA A 419 3882 4567 3081 -906 -399 -13 N ATOM 296 CA ALA A 419 -30.450 -41.378 263.771 1.00 29.83 C ANISOU 296 CA ALA A 419 4002 4199 3132 -894 -328 -130 C ATOM 297 C ALA A 419 -30.028 -40.274 264.740 1.00 29.30 C ANISOU 297 C ALA A 419 3937 3994 3204 -820 -506 37 C ATOM 298 O ALA A 419 -30.839 -39.818 265.556 1.00 29.77 O ANISOU 298 O ALA A 419 4081 3865 3364 -817 -530 12 O ATOM 299 CB ALA A 419 -30.010 -42.751 264.288 1.00 29.98 C ANISOU 299 CB ALA A 419 4313 4038 3038 -780 -85 -277 C ATOM 300 H ALA A 419 -29.392 -41.779 262.145 1.00 36.44 H ATOM 301 HA ALA A 419 -31.419 -41.375 263.722 1.00 35.82 H ATOM 302 HB1 ALA A 419 -30.376 -42.886 265.176 1.00 36.00 H ATOM 303 HB2 ALA A 419 -30.342 -43.435 263.686 1.00 36.00 H ATOM 304 HB3 ALA A 419 -29.041 -42.780 264.320 1.00 36.00 H ATOM 305 N HIS A 420 -28.763 -39.832 264.679 1.00 26.51 N ANISOU 305 N HIS A 420 3474 3730 2868 -767 -623 181 N ATOM 306 CA HIS A 420 -28.329 -38.772 265.593 1.00 27.22 C ANISOU 306 CA HIS A 420 3549 3679 3116 -745 -821 266 C ATOM 307 C HIS A 420 -29.085 -37.478 265.341 1.00 26.59 C ANISOU 307 C HIS A 420 3411 3553 3140 -874 -929 402 C ATOM 308 O HIS A 420 -29.352 -36.724 266.284 1.00 26.25 O ANISOU 308 O HIS A 420 3486 3290 3197 -840 -1052 414 O ATOM 309 CB HIS A 420 -26.827 -38.498 265.466 1.00 31.63 C ANISOU 309 CB HIS A 420 3892 4388 3738 -739 -919 333 C ATOM 310 CG HIS A 420 -26.417 -37.167 266.028 1.00 39.16 C ANISOU 310 CG HIS A 420 4745 5223 4910 -848 -1131 396 C ATOM 311 ND1 HIS A 420 -26.274 -36.938 267.380 1.00 40.39 N ANISOU 311 ND1 HIS A 420 5044 5182 5123 -709 -1319 263 N ATOM 312 CD2 HIS A 420 -26.153 -35.984 265.419 1.00 42.33 C ANISOU 312 CD2 HIS A 420 4978 5632 5473 -1078 -1159 564 C ATOM 313 CE1 HIS A 420 -25.924 -35.680 267.577 1.00 43.15 C ANISOU 313 CE1 HIS A 420 5280 5433 5681 -887 -1492 311 C ATOM 314 NE2 HIS A 420 -25.846 -35.078 266.403 1.00 46.35 N ANISOU 314 NE2 HIS A 420 5510 5935 6168 -1133 -1366 504 N ATOM 315 H HIS A 420 -28.159 -40.118 264.138 1.00 31.67 H ATOM 316 HA HIS A 420 -28.507 -39.050 266.505 1.00 32.69 H ATOM 317 HB2 HIS A 420 -26.340 -39.186 265.945 1.00 37.98 H ATOM 318 HB3 HIS A 420 -26.583 -38.513 264.527 1.00 37.98 H ATOM 319 HD1 HIS A 420 -26.388 -37.526 267.998 1.00 48.50 H ATOM 320 HD2 HIS A 420 -26.171 -35.820 264.504 1.00 50.82 H ATOM 321 HE1 HIS A 420 -25.762 -35.283 268.403 1.00 51.80 H ATOM 322 N LEU A 421 -29.420 -37.194 264.080 1.00 27.04 N ANISOU 322 N LEU A 421 3341 3808 3125 -957 -885 507 N ATOM 323 CA LEU A 421 -30.113 -35.948 263.760 1.00 30.80 C ANISOU 323 CA LEU A 421 3829 4251 3624 -981 -967 658 C ATOM 324 C LEU A 421 -31.470 -35.860 264.450 1.00 28.57 C ANISOU 324 C LEU A 421 3654 3855 3347 -900 -1001 547 C ATOM 325 O LEU A 421 -31.963 -34.755 264.694 1.00 30.88 O ANISOU 325 O LEU A 421 4031 4031 3671 -850 -1094 663 O ATOM 326 CB LEU A 421 -30.263 -35.814 262.236 1.00 32.62 C ANISOU 326 CB LEU A 421 3968 4745 3679 -961 -900 772 C ATOM 327 CG LEU A 421 -28.977 -35.416 261.486 1.00 33.94 C ANISOU 327 CG LEU A 421 4055 4973 3866 -1036 -800 984 C ATOM 328 CD1 LEU A 421 -29.115 -35.547 259.974 1.00 35.22 C ANISOU 328 CD1 LEU A 421 4209 5399 3776 -924 -687 1084 C ATOM 329 CD2 LEU A 421 -28.583 -33.999 261.808 1.00 36.28 C ANISOU 329 CD2 LEU A 421 4419 5028 4339 -1145 -822 1182 C ATOM 330 H LEU A 421 -29.259 -37.698 263.402 1.00 32.31 H ATOM 331 HA LEU A 421 -29.575 -35.204 264.071 1.00 36.99 H ATOM 332 HB2 LEU A 421 -30.558 -36.666 261.878 1.00 39.17 H ATOM 333 HB3 LEU A 421 -30.931 -35.135 262.050 1.00 39.17 H ATOM 334 HG LEU A 421 -28.256 -35.998 261.771 1.00 40.75 H ATOM 335 HD11 LEU A 421 -28.279 -35.284 259.557 1.00 42.30 H ATOM 336 HD12 LEU A 421 -29.319 -36.470 259.755 1.00 42.30 H ATOM 337 HD13 LEU A 421 -29.832 -34.968 259.671 1.00 42.30 H ATOM 338 HD21 LEU A 421 -27.772 -33.780 261.322 1.00 43.57 H ATOM 339 HD22 LEU A 421 -29.300 -33.404 261.542 1.00 43.57 H ATOM 340 HD23 LEU A 421 -28.427 -33.924 262.763 1.00 43.57 H ATOM 341 N ARG A 422 -32.077 -36.999 264.780 1.00 26.77 N ANISOU 341 N ARG A 422 3444 3634 3095 -888 -881 324 N ATOM 342 CA ARG A 422 -33.339 -36.994 265.520 1.00 30.70 C ANISOU 342 CA ARG A 422 4001 4017 3648 -839 -833 201 C ATOM 343 C ARG A 422 -33.199 -36.353 266.896 1.00 30.51 C ANISOU 343 C ARG A 422 4208 3665 3720 -730 -896 276 C ATOM 344 O ARG A 422 -34.176 -35.805 267.424 1.00 32.42 O ANISOU 344 O ARG A 422 4510 3812 3995 -640 -898 279 O ATOM 345 CB ARG A 422 -33.864 -38.425 265.646 1.00 30.08 C ANISOU 345 CB ARG A 422 3926 3930 3572 -915 -593 -68 C ATOM 346 CG ARG A 422 -34.000 -39.097 264.315 1.00 32.09 C ANISOU 346 CG ARG A 422 3982 4493 3718 -1022 -566 -203 C ATOM 347 CD ARG A 422 -34.819 -40.347 264.366 1.00 33.93 C ANISOU 347 CD ARG A 422 4193 4697 4000 -1171 -320 -530 C ATOM 348 NE ARG A 422 -34.890 -40.925 263.032 1.00 37.58 N ANISOU 348 NE ARG A 422 4481 5464 4332 -1260 -358 -697 N ATOM 349 CZ ARG A 422 -34.340 -42.079 262.659 1.00 39.98 C ANISOU 349 CZ ARG A 422 4915 5729 4546 -1334 -196 -828 C ATOM 350 NH1 ARG A 422 -33.685 -42.848 263.523 1.00 39.24 N ANISOU 350 NH1 ARG A 422 5138 5309 4464 -1306 41 -812 N ATOM 351 NH2 ARG A 422 -34.470 -42.473 261.403 1.00 41.47 N ANISOU 351 NH2 ARG A 422 4961 6208 4586 -1377 -276 -989 N ATOM 352 H ARG A 422 -31.782 -37.783 264.589 1.00 32.16 H ATOM 353 HA ARG A 422 -33.992 -36.481 265.019 1.00 36.87 H ATOM 354 HB2 ARG A 422 -33.247 -38.944 266.185 1.00 36.12 H ATOM 355 HB3 ARG A 422 -34.739 -38.406 266.065 1.00 36.12 H ATOM 356 HG2 ARG A 422 -34.428 -38.485 263.696 1.00 38.54 H ATOM 357 HG3 ARG A 422 -33.117 -39.332 263.990 1.00 38.54 H ATOM 358 HD2 ARG A 422 -34.401 -40.988 264.961 1.00 40.74 H ATOM 359 HD3 ARG A 422 -35.718 -40.137 264.663 1.00 40.74 H ATOM 360 HE ARG A 422 -35.324 -40.484 262.435 1.00 45.12 H ATOM 361 HH11 ARG A 422 -33.593 -42.596 264.340 1.00 47.12 H ATOM 362 HH12 ARG A 422 -33.342 -43.593 263.262 1.00 47.12 H ATOM 363 HH21 ARG A 422 -34.900 -41.985 260.841 1.00 49.79 H ATOM 364 HH22 ARG A 422 -34.131 -43.222 261.151 1.00 49.79 H ATOM 365 N THR A 423 -32.009 -36.402 267.503 1.00 32.38 N ANISOU 365 N THR A 423 4567 3753 3983 -695 -966 309 N ATOM 366 CA THR A 423 -31.828 -35.680 268.757 1.00 32.69 C ANISOU 366 CA THR A 423 4837 3504 4082 -560 -1100 341 C ATOM 367 C THR A 423 -31.983 -34.182 268.570 1.00 32.89 C ANISOU 367 C THR A 423 4865 3468 4164 -600 -1276 512 C ATOM 368 O THR A 423 -32.284 -33.481 269.537 1.00 33.31 O ANISOU 368 O THR A 423 5148 3267 4241 -471 -1369 529 O ATOM 369 CB THR A 423 -30.455 -35.947 269.390 1.00 37.34 C ANISOU 369 CB THR A 423 5491 4023 4675 -481 -1222 277 C ATOM 370 OG1 THR A 423 -29.429 -35.331 268.599 1.00 39.64 O ANISOU 370 OG1 THR A 423 5529 4476 5056 -668 -1359 371 O ATOM 371 CG2 THR A 423 -30.192 -37.437 269.545 1.00 38.81 C ANISOU 371 CG2 THR A 423 5766 4245 4734 -356 -1022 135 C ATOM 372 H THR A 423 -31.319 -36.830 267.220 1.00 38.88 H ATOM 373 HA THR A 423 -32.507 -35.973 269.386 1.00 39.26 H ATOM 374 HB THR A 423 -30.441 -35.553 270.277 1.00 44.84 H ATOM 375 HG1 THR A 423 -29.439 -35.646 267.820 1.00 47.59 H ATOM 376 HG21 THR A 423 -29.320 -37.580 269.946 1.00 46.60 H ATOM 377 HG22 THR A 423 -30.870 -37.836 270.112 1.00 46.60 H ATOM 378 HG23 THR A 423 -30.214 -37.869 268.676 1.00 46.60 H ATOM 379 N HIS A 424 -31.776 -33.668 267.354 1.00 29.79 N ANISOU 379 N HIS A 424 4296 3264 3760 -737 -1291 651 N ATOM 380 CA HIS A 424 -31.962 -32.243 267.111 1.00 36.32 C ANISOU 380 CA HIS A 424 5229 3972 4598 -741 -1378 840 C ATOM 381 C HIS A 424 -33.381 -31.925 266.644 1.00 37.42 C ANISOU 381 C HIS A 424 5380 4245 4595 -568 -1332 889 C ATOM 382 O HIS A 424 -33.905 -30.849 266.961 1.00 40.53 O ANISOU 382 O HIS A 424 5981 4465 4953 -430 -1393 1006 O ATOM 383 CB HIS A 424 -30.951 -31.726 266.067 1.00 40.12 C ANISOU 383 CB HIS A 424 5597 4527 5120 -931 -1347 999 C ATOM 384 CG HIS A 424 -29.510 -31.871 266.469 1.00 45.17 C ANISOU 384 CG HIS A 424 6120 5100 5944 -1115 -1406 923 C ATOM 385 ND1 HIS A 424 -28.960 -31.196 267.538 1.00 47.97 N ANISOU 385 ND1 HIS A 424 6589 5175 6461 -1172 -1581 841 N ATOM 386 CD2 HIS A 424 -28.498 -32.588 265.921 1.00 47.23 C ANISOU 386 CD2 HIS A 424 6126 5578 6243 -1228 -1334 887 C ATOM 387 CE1 HIS A 424 -27.679 -31.506 267.642 1.00 49.97 C ANISOU 387 CE1 HIS A 424 6606 5517 6863 -1319 -1638 723 C ATOM 388 NE2 HIS A 424 -27.372 -32.346 266.671 1.00 50.89 N ANISOU 388 NE2 HIS A 424 6494 5936 6906 -1345 -1471 770 N ATOM 389 H HIS A 424 -31.531 -34.119 266.664 1.00 35.78 H ATOM 390 HA HIS A 424 -31.807 -31.761 267.938 1.00 43.61 H ATOM 391 HB2 HIS A 424 -31.078 -32.221 265.242 1.00 48.17 H ATOM 392 HB3 HIS A 424 -31.120 -30.784 265.912 1.00 48.17 H ATOM 393 HD1 HIS A 424 -29.386 -30.663 268.062 1.00 57.59 H ATOM 394 HD2 HIS A 424 -28.556 -33.146 265.179 1.00 56.71 H ATOM 395 HE1 HIS A 424 -27.092 -31.183 268.287 1.00 59.99 H ATOM 396 N THR A 425 -34.014 -32.837 265.902 1.00 39.56 N ANISOU 396 N THR A 425 5424 4835 4773 -551 -1240 769 N ATOM 397 CA THR A 425 -35.321 -32.584 265.304 1.00 40.59 C ANISOU 397 CA THR A 425 5448 5214 4761 -368 -1247 742 C ATOM 398 C THR A 425 -36.489 -33.031 266.177 1.00 40.68 C ANISOU 398 C THR A 425 5396 5221 4841 -280 -1173 548 C ATOM 399 O THR A 425 -37.613 -32.562 265.961 1.00 41.77 O ANISOU 399 O THR A 425 5432 5548 4891 -80 -1208 523 O ATOM 400 CB THR A 425 -35.440 -33.292 263.946 1.00 41.44 C ANISOU 400 CB THR A 425 5300 5718 4728 -394 -1225 642 C ATOM 401 OG1 THR A 425 -35.336 -34.714 264.120 1.00 40.91 O ANISOU 401 OG1 THR A 425 5082 5708 4752 -575 -1108 393 O ATOM 402 CG2 THR A 425 -34.361 -32.841 263.003 1.00 41.01 C ANISOU 402 CG2 THR A 425 5325 5674 4581 -436 -1219 866 C ATOM 403 H THR A 425 -33.700 -33.619 265.729 1.00 47.50 H ATOM 404 HA THR A 425 -35.414 -31.631 265.151 1.00 48.74 H ATOM 405 HB THR A 425 -36.299 -33.080 263.548 1.00 49.76 H ATOM 406 HG1 THR A 425 -35.401 -35.100 263.376 1.00 49.11 H ATOM 407 HG21 THR A 425 -34.452 -33.298 262.152 1.00 49.24 H ATOM 408 HG22 THR A 425 -34.428 -31.884 262.856 1.00 49.24 H ATOM 409 HG23 THR A 425 -33.489 -33.042 263.377 1.00 49.24 H ATOM 410 N GLY A 426 -36.261 -33.928 267.138 1.00 38.38 N ANISOU 410 N GLY A 426 5170 4727 4684 -385 -1039 412 N ATOM 411 CA GLY A 426 -37.351 -34.528 267.891 1.00 37.64 C ANISOU 411 CA GLY A 426 5022 4602 4679 -344 -845 224 C ATOM 412 C GLY A 426 -38.146 -35.567 267.134 1.00 37.46 C ANISOU 412 C GLY A 426 4635 4905 4693 -497 -701 -56 C ATOM 413 O GLY A 426 -39.182 -36.023 267.625 1.00 38.17 O ANISOU 413 O GLY A 426 4590 5006 4907 -521 -490 -249 O ATOM 414 H GLY A 426 -35.480 -34.203 267.370 1.00 46.08 H ATOM 415 HA2 GLY A 426 -36.990 -34.948 268.687 1.00 45.20 H ATOM 416 HA3 GLY A 426 -37.962 -33.829 268.172 1.00 45.20 H ATOM 417 N GLU A 427 -37.697 -35.949 265.948 1.00 34.98 N ANISOU 417 N GLU A 427 4153 4852 4287 -610 -790 -107 N ATOM 418 CA GLU A 427 -38.375 -36.979 265.184 1.00 36.89 C ANISOU 418 CA GLU A 427 4068 5395 4555 -777 -695 -436 C ATOM 419 C GLU A 427 -38.269 -38.320 265.903 1.00 34.99 C ANISOU 419 C GLU A 427 3941 4879 4476 -1005 -356 -636 C ATOM 420 O GLU A 427 -37.183 -38.709 266.350 1.00 29.68 O ANISOU 420 O GLU A 427 3577 3928 3772 -1013 -281 -513 O ATOM 421 CB GLU A 427 -37.760 -37.062 263.788 1.00 39.23 C ANISOU 421 CB GLU A 427 4271 5979 4655 -782 -870 -415 C ATOM 422 CG GLU A 427 -38.590 -37.795 262.803 1.00 44.27 C ANISOU 422 CG GLU A 427 4553 7016 5252 -868 -902 -780 C ATOM 423 CD GLU A 427 -39.739 -36.954 262.261 1.00 47.99 C ANISOU 423 CD GLU A 427 4727 7897 5608 -610 -1131 -869 C ATOM 424 OE1 GLU A 427 -40.892 -37.425 262.330 1.00 49.38 O ANISOU 424 OE1 GLU A 427 4533 8302 5928 -704 -1084 -1245 O ATOM 425 OE2 GLU A 427 -39.483 -35.830 261.770 1.00 48.45 O ANISOU 425 OE2 GLU A 427 4928 8046 5434 -301 -1331 -578 O ATOM 426 H GLU A 427 -36.999 -35.626 265.563 1.00 42.01 H ATOM 427 HA GLU A 427 -39.314 -36.750 265.094 1.00 44.30 H ATOM 428 HB2 GLU A 427 -37.628 -36.162 263.451 1.00 47.10 H ATOM 429 HB3 GLU A 427 -36.905 -37.517 263.851 1.00 47.10 H ATOM 430 HG2 GLU A 427 -38.033 -38.061 262.055 1.00 53.15 H ATOM 431 HG3 GLU A 427 -38.968 -38.580 263.230 1.00 53.15 H ATOM 432 N LYS A 428 -39.399 -39.030 266.006 1.00 31.59 N ANISOU 432 N LYS A 428 5414 3418 3172 88 236 367 N ATOM 433 CA LYS A 428 -39.481 -40.315 266.712 1.00 32.80 C ANISOU 433 CA LYS A 428 5274 3798 3390 22 65 363 C ATOM 434 C LYS A 428 -40.284 -41.283 265.854 1.00 31.36 C ANISOU 434 C LYS A 428 4860 3765 3289 89 -138 527 C ATOM 435 O LYS A 428 -41.501 -41.433 266.025 1.00 31.36 O ANISOU 435 O LYS A 428 4693 3870 3352 258 -169 702 O ATOM 436 CB LYS A 428 -40.114 -40.149 268.098 1.00 36.59 C ANISOU 436 CB LYS A 428 5738 4307 3855 122 186 383 C ATOM 437 CG LYS A 428 -39.279 -39.323 269.055 1.00 39.40 C ANISOU 437 CG LYS A 428 6359 4545 4068 -36 359 178 C ATOM 438 CD LYS A 428 -39.878 -39.274 270.447 1.00 43.09 C ANISOU 438 CD LYS A 428 6861 5047 4464 29 491 179 C ATOM 439 CE LYS A 428 -38.983 -38.499 271.410 1.00 49.50 C ANISOU 439 CE LYS A 428 7978 5767 5061 -215 628 -60 C ATOM 440 NZ LYS A 428 -39.531 -38.496 272.808 1.00 55.52 N ANISOU 440 NZ LYS A 428 8840 6567 5689 -185 770 -78 N ATOM 441 H LYS A 428 -40.149 -38.781 265.666 1.00 37.94 H ATOM 442 HA LYS A 428 -38.588 -40.676 266.826 1.00 39.38 H ATOM 443 HB2 LYS A 428 -40.973 -39.710 267.999 1.00 43.93 H ATOM 444 HB3 LYS A 428 -40.237 -41.027 268.493 1.00 43.93 H ATOM 445 HG2 LYS A 428 -38.393 -39.714 269.122 1.00 47.31 H ATOM 446 HG3 LYS A 428 -39.218 -38.415 268.720 1.00 47.31 H ATOM 447 HD2 LYS A 428 -40.740 -38.831 270.409 1.00 51.73 H ATOM 448 HD3 LYS A 428 -39.979 -40.178 270.785 1.00 51.73 H ATOM 449 HE2 LYS A 428 -38.105 -38.910 271.430 1.00 59.42 H ATOM 450 HE3 LYS A 428 -38.914 -37.579 271.111 1.00 59.42 H ATOM 451 HZ1 LYS A 428 -38.990 -38.038 273.346 1.00 66.66 H ATOM 452 HZ2 LYS A 428 -40.337 -38.118 272.818 1.00 66.66 H ATOM 453 HZ3 LYS A 428 -39.600 -39.331 273.109 1.00 66.66 H ATOM 454 N PRO A 429 -39.634 -41.951 264.898 1.00 31.93 N ANISOU 454 N PRO A 429 4921 3855 3357 -66 -261 467 N ATOM 455 CA PRO A 429 -40.388 -42.724 263.901 1.00 30.28 C ANISOU 455 CA PRO A 429 4589 3758 3158 -69 -444 589 C ATOM 456 C PRO A 429 -40.938 -44.056 264.380 1.00 29.07 C ANISOU 456 C PRO A 429 4182 3762 3101 -131 -571 630 C ATOM 457 O PRO A 429 -41.707 -44.671 263.632 1.00 30.80 O ANISOU 457 O PRO A 429 4297 4091 3314 -186 -727 721 O ATOM 458 CB PRO A 429 -39.353 -42.965 262.788 1.00 31.21 C ANISOU 458 CB PRO A 429 4869 3783 3206 -245 -451 462 C ATOM 459 CG PRO A 429 -38.234 -42.035 263.060 1.00 31.82 C ANISOU 459 CG PRO A 429 5128 3705 3257 -292 -262 324 C ATOM 460 CD PRO A 429 -38.208 -41.859 264.538 1.00 31.33 C ANISOU 460 CD PRO A 429 4976 3682 3248 -254 -202 288 C ATOM 461 HA PRO A 429 -41.116 -42.190 263.547 1.00 36.36 H ATOM 462 HB2 PRO A 429 -39.047 -43.885 262.822 1.00 37.48 H ATOM 463 HB3 PRO A 429 -39.754 -42.772 261.926 1.00 37.48 H ATOM 464 HG2 PRO A 429 -37.403 -42.425 262.748 1.00 38.21 H ATOM 465 HG3 PRO A 429 -38.401 -41.187 262.619 1.00 38.21 H ATOM 466 HD2 PRO A 429 -37.705 -42.575 264.956 1.00 37.63 H ATOM 467 HD3 PRO A 429 -37.854 -40.987 264.770 1.00 37.63 H ATOM 468 N TYR A 430 -40.555 -44.548 265.553 1.00 24.83 N ANISOU 468 N TYR A 430 3565 3242 2627 -157 -517 571 N ATOM 469 CA TYR A 430 -40.896 -45.906 265.971 1.00 27.08 C ANISOU 469 CA TYR A 430 3673 3617 2999 -236 -596 609 C ATOM 470 C TYR A 430 -41.951 -45.836 267.076 1.00 26.19 C ANISOU 470 C TYR A 430 3407 3611 2933 -118 -543 737 C ATOM 471 O TYR A 430 -41.637 -45.494 268.218 1.00 27.09 O ANISOU 471 O TYR A 430 3569 3709 3013 -59 -428 706 O ATOM 472 CB TYR A 430 -39.639 -46.659 266.409 1.00 25.79 C ANISOU 472 CB TYR A 430 3535 3395 2869 -326 -566 500 C ATOM 473 CG TYR A 430 -38.594 -46.666 265.305 1.00 26.48 C ANISOU 473 CG TYR A 430 3750 3372 2939 -419 -548 379 C ATOM 474 CD1 TYR A 430 -38.607 -47.640 264.318 1.00 26.37 C ANISOU 474 CD1 TYR A 430 3776 3296 2946 -531 -580 350 C ATOM 475 CD2 TYR A 430 -37.620 -45.673 265.237 1.00 26.88 C ANISOU 475 CD2 TYR A 430 3909 3365 2937 -427 -462 278 C ATOM 476 CE1 TYR A 430 -37.671 -47.631 263.304 1.00 29.72 C ANISOU 476 CE1 TYR A 430 4350 3602 3341 -609 -503 234 C ATOM 477 CE2 TYR A 430 -36.686 -45.663 264.241 1.00 28.17 C ANISOU 477 CE2 TYR A 430 4174 3433 3097 -518 -398 175 C ATOM 478 CZ TYR A 430 -36.713 -46.636 263.267 1.00 29.17 C ANISOU 478 CZ TYR A 430 4344 3495 3243 -589 -407 158 C ATOM 479 OH TYR A 430 -35.774 -46.624 262.268 1.00 31.44 O ANISOU 479 OH TYR A 430 4763 3668 3514 -674 -284 48 O ATOM 480 H TYR A 430 -40.091 -44.112 266.132 1.00 29.82 H ATOM 481 HA TYR A 430 -41.281 -46.381 265.218 1.00 32.52 H ATOM 482 HB2 TYR A 430 -39.257 -46.223 267.187 1.00 30.98 H ATOM 483 HB3 TYR A 430 -39.870 -47.578 266.617 1.00 30.98 H ATOM 484 HD1 TYR A 430 -39.255 -48.307 264.339 1.00 31.67 H ATOM 485 HD2 TYR A 430 -37.598 -45.010 265.888 1.00 32.28 H ATOM 486 HE1 TYR A 430 -37.685 -48.292 262.649 1.00 35.69 H ATOM 487 HE2 TYR A 430 -36.041 -44.994 264.214 1.00 33.83 H ATOM 488 HH TYR A 430 -35.897 -47.274 261.750 1.00 37.75 H ATOM 489 N HIS A 431 -43.192 -46.172 266.717 1.00 26.04 N ANISOU 489 N HIS A 431 3198 3720 2975 -110 -624 879 N ATOM 490 CA HIS A 431 -44.367 -45.994 267.565 1.00 30.53 C ANISOU 490 CA HIS A 431 3569 4411 3619 24 -536 1033 C ATOM 491 C HIS A 431 -44.819 -47.316 268.182 1.00 29.39 C ANISOU 491 C HIS A 431 3259 4345 3563 -122 -549 1077 C ATOM 492 O HIS A 431 -45.090 -48.280 267.459 1.00 30.81 O ANISOU 492 O HIS A 431 3355 4570 3782 -324 -689 1080 O ATOM 493 CB HIS A 431 -45.514 -45.413 266.737 1.00 29.66 C ANISOU 493 CB HIS A 431 3276 4445 3548 142 -619 1211 C ATOM 494 CG HIS A 431 -45.192 -44.113 266.065 1.00 32.11 C ANISOU 494 CG HIS A 431 3783 4647 3772 316 -583 1221 C ATOM 495 ND1 HIS A 431 -46.086 -43.462 265.239 1.00 36.32 N ANISOU 495 ND1 HIS A 431 4187 5299 4314 483 -669 1428 N ATOM 496 CD2 HIS A 431 -44.069 -43.353 266.078 1.00 31.96 C ANISOU 496 CD2 HIS A 431 4079 4412 3652 336 -465 1068 C ATOM 497 CE1 HIS A 431 -45.532 -42.351 264.782 1.00 36.26 C ANISOU 497 CE1 HIS A 431 4459 5109 4211 624 -577 1410 C ATOM 498 NE2 HIS A 431 -44.311 -42.260 265.280 1.00 32.64 N ANISOU 498 NE2 HIS A 431 4275 4440 3689 511 -442 1174 N ATOM 499 H HIS A 431 -43.382 -46.520 265.954 1.00 31.27 H ATOM 500 HA HIS A 431 -44.158 -45.374 268.281 1.00 36.66 H ATOM 501 HB2 HIS A 431 -45.753 -46.051 266.047 1.00 35.62 H ATOM 502 HB3 HIS A 431 -46.274 -45.263 267.321 1.00 35.62 H ATOM 503 HD1 HIS A 431 -46.880 -43.734 265.055 1.00 43.61 H ATOM 504 HD2 HIS A 431 -43.287 -43.531 266.549 1.00 38.38 H ATOM 505 HE1 HIS A 431 -45.935 -41.737 264.211 1.00 43.54 H ATOM 506 N CYS A 432 -44.945 -47.350 269.509 1.00 28.66 N ANISOU 506 N CYS A 432 3161 4254 3477 -44 -380 1110 N ATOM 507 CA CYS A 432 -45.578 -48.483 270.171 1.00 29.53 C ANISOU 507 CA CYS A 432 3121 4431 3670 -159 -337 1198 C ATOM 508 C CYS A 432 -47.031 -48.637 269.728 1.00 32.02 C ANISOU 508 C CYS A 432 3105 4939 4120 -199 -375 1353 C ATOM 509 O CYS A 432 -47.791 -47.664 269.712 1.00 33.12 O ANISOU 509 O CYS A 432 3091 5187 4305 5 -305 1467 O ATOM 510 CB CYS A 432 -45.522 -48.307 271.687 1.00 32.42 C ANISOU 510 CB CYS A 432 3576 4776 3965 -51 -124 1224 C ATOM 511 SG CYS A 432 -46.224 -49.704 272.533 1.00 33.19 S ANISOU 511 SG CYS A 432 3550 4917 4142 -197 -25 1352 S ATOM 512 H CYS A 432 -44.674 -46.732 270.042 1.00 34.42 H ATOM 513 HA CYS A 432 -45.101 -49.296 269.941 1.00 35.47 H ATOM 514 HB2 CYS A 432 -44.598 -48.216 271.965 1.00 38.93 H ATOM 515 HB3 CYS A 432 -46.027 -47.516 271.936 1.00 38.93 H ATOM 516 N ASP A 433 -47.427 -49.870 269.389 1.00 34.02 N ANISOU 516 N ASP A 433 3241 5236 4447 -468 -470 1370 N ATOM 517 CA ASP A 433 -48.801 -50.175 268.992 1.00 41.25 C ANISOU 517 CA ASP A 433 3792 6392 5491 -604 -542 1512 C ATOM 518 C ASP A 433 -49.593 -50.852 270.098 1.00 39.50 C ANISOU 518 C ASP A 433 3394 6229 5385 -678 -335 1622 C ATOM 519 O ASP A 433 -50.701 -51.331 269.847 1.00 43.10 O ANISOU 519 O ASP A 433 3513 6893 5970 -874 -381 1731 O ATOM 520 CB ASP A 433 -48.834 -51.077 267.751 1.00 54.11 C ANISOU 520 CB ASP A 433 5423 8045 7093 -957 -788 1430 C ATOM 521 CG ASP A 433 -48.115 -50.478 266.556 1.00 67.03 C ANISOU 521 CG ASP A 433 7253 9629 8586 -919 -974 1328 C ATOM 522 OD1 ASP A 433 -48.130 -49.236 266.398 1.00 71.42 O ANISOU 522 OD1 ASP A 433 7780 10248 9109 -638 -982 1401 O ATOM 523 OD2 ASP A 433 -47.539 -51.262 265.765 1.00 71.54 O ANISOU 523 OD2 ASP A 433 8041 10068 9074 -1173 -1072 1176 O ATOM 524 H ASP A 433 -46.907 -50.555 269.382 1.00 40.85 H ATOM 525 HA ASP A 433 -49.252 -49.346 268.768 1.00 49.53 H ATOM 526 HB2 ASP A 433 -48.406 -51.921 267.965 1.00 64.96 H ATOM 527 HB3 ASP A 433 -49.758 -51.229 267.498 1.00 64.96 H ATOM 528 N TRP A 434 -49.044 -50.932 271.303 1.00 38.08 N ANISOU 528 N TRP A 434 3433 5890 5143 -561 -116 1601 N ATOM 529 CA TRP A 434 -49.759 -51.544 272.413 1.00 40.56 C ANISOU 529 CA TRP A 434 3643 6239 5530 -623 124 1718 C ATOM 530 C TRP A 434 -51.014 -50.742 272.714 1.00 44.68 C ANISOU 530 C TRP A 434 3800 6993 6184 -450 287 1882 C ATOM 531 O TRP A 434 -50.970 -49.514 272.799 1.00 46.03 O ANISOU 531 O TRP A 434 3994 7177 6319 -141 364 1896 O ATOM 532 CB TRP A 434 -48.849 -51.598 273.640 1.00 37.18 C ANISOU 532 CB TRP A 434 3566 5624 4936 -495 298 1683 C ATOM 533 CG TRP A 434 -49.284 -52.575 274.716 1.00 39.63 C ANISOU 533 CG TRP A 434 3904 5894 5261 -618 526 1797 C ATOM 534 CD1 TRP A 434 -50.062 -52.308 275.806 1.00 42.25 C ANISOU 534 CD1 TRP A 434 4159 6306 5588 -523 824 1915 C ATOM 535 CD2 TRP A 434 -48.942 -53.963 274.800 1.00 39.97 C ANISOU 535 CD2 TRP A 434 4109 5766 5313 -847 521 1812 C ATOM 536 NE1 TRP A 434 -50.233 -53.446 276.559 1.00 43.24 N ANISOU 536 NE1 TRP A 434 4384 6341 5705 -700 988 2010 N ATOM 537 CE2 TRP A 434 -49.554 -54.475 275.964 1.00 42.41 C ANISOU 537 CE2 TRP A 434 4432 6067 5614 -891 805 1958 C ATOM 538 CE3 TRP A 434 -48.181 -54.826 274.002 1.00 38.58 C ANISOU 538 CE3 TRP A 434 4099 5406 5152 -1004 353 1723 C ATOM 539 CZ2 TRP A 434 -49.433 -55.807 276.348 1.00 44.37 C ANISOU 539 CZ2 TRP A 434 4865 6125 5870 -1086 908 2035 C ATOM 540 CZ3 TRP A 434 -48.056 -56.153 274.390 1.00 39.74 C ANISOU 540 CZ3 TRP A 434 4431 5345 5324 -1175 478 1792 C ATOM 541 CH2 TRP A 434 -48.681 -56.628 275.552 1.00 43.38 C ANISOU 541 CH2 TRP A 434 4910 5795 5776 -1214 744 1956 C ATOM 542 H TRP A 434 -48.261 -50.640 271.503 1.00 45.72 H ATOM 543 HA TRP A 434 -50.017 -52.449 272.177 1.00 48.70 H ATOM 544 HB2 TRP A 434 -47.959 -51.855 273.353 1.00 44.64 H ATOM 545 HB3 TRP A 434 -48.819 -50.715 274.041 1.00 44.64 H ATOM 546 HD1 TRP A 434 -50.427 -51.476 276.007 1.00 50.73 H ATOM 547 HE1 TRP A 434 -50.690 -53.501 277.285 1.00 51.92 H ATOM 548 HE3 TRP A 434 -47.765 -54.515 273.230 1.00 46.32 H ATOM 549 HZ2 TRP A 434 -49.843 -56.127 277.119 1.00 53.28 H ATOM 550 HZ3 TRP A 434 -47.554 -56.737 273.869 1.00 47.72 H ATOM 551 HH2 TRP A 434 -48.582 -57.522 275.787 1.00 52.08 H ATOM 552 N ASP A 435 -52.135 -51.437 272.865 1.00 51.33 N ANISOU 552 N ASP A 435 4302 8004 7195 -651 373 2013 N ATOM 553 CA ASP A 435 -53.405 -50.773 273.135 1.00 55.76 C ANISOU 553 CA ASP A 435 4420 8826 7939 -477 557 2209 C ATOM 554 C ASP A 435 -53.264 -49.756 274.265 1.00 55.03 C ANISOU 554 C ASP A 435 4525 8619 7764 -89 914 2230 C ATOM 555 O ASP A 435 -52.815 -50.088 275.364 1.00 54.99 O ANISOU 555 O ASP A 435 4842 8438 7613 -103 1137 2176 O ATOM 556 CB ASP A 435 -54.460 -51.822 273.489 1.00 61.00 C ANISOU 556 CB ASP A 435 4748 9647 8783 -796 689 2330 C ATOM 557 CG ASP A 435 -55.870 -51.270 273.443 1.00 67.46 C ANISOU 557 CG ASP A 435 5100 10735 9798 -640 768 2471 C ATOM 558 OD1 ASP A 435 -56.094 -50.267 272.727 1.00 69.07 O ANISOU 558 OD1 ASP A 435 5129 11077 10037 -376 616 2541 O ATOM 559 OD2 ASP A 435 -56.755 -51.843 274.113 1.00 71.65 O ANISOU 559 OD2 ASP A 435 5471 11313 10439 -771 986 2512 O ATOM 560 H ASP A 435 -52.188 -52.293 272.816 1.00 61.62 H ATOM 561 HA ASP A 435 -53.697 -50.304 272.338 1.00 66.94 H ATOM 562 HB2 ASP A 435 -54.404 -52.554 272.855 1.00 73.23 H ATOM 563 HB3 ASP A 435 -54.294 -52.147 274.388 1.00 73.23 H ATOM 564 N GLY A 436 -53.636 -48.507 273.985 1.00 51.83 N ANISOU 564 N GLY A 436 3967 8299 7426 254 976 2313 N ATOM 565 CA GLY A 436 -53.639 -47.472 274.995 1.00 51.91 C ANISOU 565 CA GLY A 436 4186 8173 7365 609 1376 2318 C ATOM 566 C GLY A 436 -52.333 -46.728 275.177 1.00 50.15 C ANISOU 566 C GLY A 436 4523 7668 6865 732 1354 2104 C ATOM 567 O GLY A 436 -52.323 -45.696 275.863 1.00 50.75 O ANISOU 567 O GLY A 436 4821 7606 6854 1007 1680 2077 O ATOM 568 H GLY A 436 -53.891 -48.239 273.208 1.00 62.22 H ATOM 569 HA2 GLY A 436 -54.322 -46.820 274.771 1.00 62.32 H ATOM 570 HA3 GLY A 436 -53.875 -47.869 275.848 1.00 62.32 H ATOM 571 N CYS A 437 -51.235 -47.211 274.596 1.00 48.08 N ANISOU 571 N CYS A 437 4496 7309 6462 520 1014 1945 N ATOM 572 CA CYS A 437 -49.920 -46.605 274.767 1.00 45.61 C ANISOU 572 CA CYS A 437 4655 6775 5900 570 968 1742 C ATOM 573 C CYS A 437 -49.580 -45.718 273.573 1.00 45.27 C ANISOU 573 C CYS A 437 4626 6698 5878 693 772 1703 C ATOM 574 O CYS A 437 -49.771 -46.106 272.413 1.00 46.23 O ANISOU 574 O CYS A 437 4514 6941 6108 586 485 1758 O ATOM 575 CB CYS A 437 -48.854 -47.691 274.943 1.00 43.16 C ANISOU 575 CB CYS A 437 4571 6383 5443 301 763 1625 C ATOM 576 SG CYS A 437 -47.198 -47.084 275.333 1.00 40.67 S ANISOU 576 SG CYS A 437 4741 5886 4827 310 687 1404 S ATOM 577 H CYS A 437 -51.229 -47.905 274.088 1.00 57.72 H ATOM 578 HA CYS A 437 -49.925 -46.052 275.564 1.00 54.76 H ATOM 579 HB2 CYS A 437 -49.128 -48.277 275.666 1.00 51.82 H ATOM 580 HB3 CYS A 437 -48.793 -48.198 274.119 1.00 51.82 H ATOM 581 N GLY A 438 -49.067 -44.527 273.863 1.00 43.34 N ANISOU 581 N GLY A 438 4701 6270 5496 887 944 1600 N ATOM 582 CA GLY A 438 -48.716 -43.589 272.819 1.00 42.69 C ANISOU 582 CA GLY A 438 4704 6103 5414 1015 826 1573 C ATOM 583 C GLY A 438 -47.241 -43.251 272.788 1.00 38.75 C ANISOU 583 C GLY A 438 4626 5408 4690 879 728 1328 C ATOM 584 O GLY A 438 -46.849 -42.215 272.243 1.00 38.08 O ANISOU 584 O GLY A 438 4739 5172 4557 992 761 1271 O ATOM 585 H GLY A 438 -48.914 -44.242 274.660 1.00 52.03 H ATOM 586 HA2 GLY A 438 -48.961 -43.963 271.958 1.00 51.26 H ATOM 587 HA3 GLY A 438 -49.214 -42.767 272.947 1.00 51.26 H ATOM 588 N TRP A 439 -46.413 -44.119 273.358 1.00 33.67 N ANISOU 588 N TRP A 439 4104 4771 3917 639 614 1206 N ATOM 589 CA TRP A 439 -44.981 -43.881 273.348 1.00 32.42 C ANISOU 589 CA TRP A 439 4250 4497 3572 493 494 1001 C ATOM 590 C TRP A 439 -44.396 -44.070 271.951 1.00 29.45 C ANISOU 590 C TRP A 439 3808 4114 3266 404 222 966 C ATOM 591 O TRP A 439 -44.805 -44.956 271.190 1.00 27.48 O ANISOU 591 O TRP A 439 3320 3972 3150 334 43 1060 O ATOM 592 CB TRP A 439 -44.288 -44.805 274.356 1.00 35.63 C ANISOU 592 CB TRP A 439 4746 4959 3833 310 430 947 C ATOM 593 CG TRP A 439 -44.292 -44.238 275.740 1.00 41.31 C ANISOU 593 CG TRP A 439 5731 5638 4328 331 683 883 C ATOM 594 CD1 TRP A 439 -45.254 -44.406 276.696 1.00 44.86 C ANISOU 594 CD1 TRP A 439 6162 6124 4760 415 943 988 C ATOM 595 CD2 TRP A 439 -43.293 -43.394 276.319 1.00 43.94 C ANISOU 595 CD2 TRP A 439 6415 5888 4391 224 721 683 C ATOM 596 NE1 TRP A 439 -44.911 -43.722 277.837 1.00 46.71 N ANISOU 596 NE1 TRP A 439 6763 6285 4699 379 1151 856 N ATOM 597 CE2 TRP A 439 -43.711 -43.091 277.631 1.00 47.37 C ANISOU 597 CE2 TRP A 439 7079 6304 4615 239 999 661 C ATOM 598 CE3 TRP A 439 -42.083 -42.865 275.857 1.00 45.26 C ANISOU 598 CE3 TRP A 439 6728 6005 4465 78 561 511 C ATOM 599 CZ2 TRP A 439 -42.961 -42.286 278.488 1.00 50.36 C ANISOU 599 CZ2 TRP A 439 7859 6619 4656 82 1091 455 C ATOM 600 CZ3 TRP A 439 -41.339 -42.071 276.706 1.00 48.09 C ANISOU 600 CZ3 TRP A 439 7426 6319 4527 -86 642 319 C ATOM 601 CH2 TRP A 439 -41.781 -41.786 278.009 1.00 49.53 C ANISOU 601 CH2 TRP A 439 7864 6487 4467 -97 891 283 C ATOM 602 H TRP A 439 -46.653 -44.845 273.751 1.00 40.43 H ATOM 603 HA TRP A 439 -44.813 -42.965 273.619 1.00 38.94 H ATOM 604 HB2 TRP A 439 -44.752 -45.656 274.377 1.00 42.79 H ATOM 605 HB3 TRP A 439 -43.365 -44.935 274.085 1.00 42.79 H ATOM 606 HD1 TRP A 439 -46.029 -44.909 276.589 1.00 53.86 H ATOM 607 HE1 TRP A 439 -45.373 -43.693 278.562 1.00 56.08 H ATOM 608 HE3 TRP A 439 -41.783 -43.050 274.996 1.00 54.34 H ATOM 609 HZ2 TRP A 439 -43.250 -42.098 279.351 1.00 60.46 H ATOM 610 HZ3 TRP A 439 -40.534 -41.713 276.409 1.00 57.74 H ATOM 611 HH2 TRP A 439 -41.260 -41.246 278.558 1.00 59.46 H ATOM 612 N LYS A 440 -43.439 -43.207 271.621 1.00 28.77 N ANISOU 612 N LYS A 440 3970 3892 3070 374 220 815 N ATOM 613 CA LYS A 440 -42.674 -43.262 270.388 1.00 28.62 C ANISOU 613 CA LYS A 440 3967 3834 3072 274 26 750 C ATOM 614 C LYS A 440 -41.194 -43.097 270.717 1.00 29.39 C ANISOU 614 C LYS A 440 4266 3870 3031 92 -9 553 C ATOM 615 O LYS A 440 -40.827 -42.571 271.771 1.00 31.52 O ANISOU 615 O LYS A 440 4715 4111 3150 46 113 454 O ATOM 616 CB LYS A 440 -43.128 -42.162 269.414 1.00 30.64 C ANISOU 616 CB LYS A 440 4292 3990 3361 443 93 815 C ATOM 617 CG LYS A 440 -44.643 -42.116 269.233 1.00 33.93 C ANISOU 617 CG LYS A 440 4451 4521 3919 670 137 1056 C ATOM 618 CD LYS A 440 -45.070 -40.937 268.399 1.00 38.36 C ANISOU 618 CD LYS A 440 5092 4981 4500 908 219 1178 C ATOM 619 CE LYS A 440 -46.581 -40.825 268.399 1.00 43.99 C ANISOU 619 CE LYS A 440 5478 5856 5379 1184 282 1462 C ATOM 620 NZ LYS A 440 -47.042 -39.721 267.525 1.00 47.34 N ANISOU 620 NZ LYS A 440 5948 6206 5834 1479 336 1656 N ATOM 621 H LYS A 440 -43.207 -42.550 272.125 1.00 34.55 H ATOM 622 HA LYS A 440 -42.803 -44.124 269.964 1.00 34.37 H ATOM 623 HB2 LYS A 440 -42.841 -41.300 269.754 1.00 36.80 H ATOM 624 HB3 LYS A 440 -42.728 -42.325 268.545 1.00 36.80 H ATOM 625 HG2 LYS A 440 -44.936 -42.926 268.786 1.00 40.74 H ATOM 626 HG3 LYS A 440 -45.067 -42.042 270.102 1.00 40.74 H ATOM 627 HD2 LYS A 440 -44.700 -40.123 268.773 1.00 46.06 H ATOM 628 HD3 LYS A 440 -44.769 -41.059 267.485 1.00 46.06 H ATOM 629 HE2 LYS A 440 -46.963 -41.654 268.071 1.00 52.81 H ATOM 630 HE3 LYS A 440 -46.889 -40.647 269.302 1.00 52.81 H ATOM 631 HZ1 LYS A 440 -47.931 -39.673 267.539 1.00 56.84 H ATOM 632 HZ2 LYS A 440 -46.706 -38.948 267.808 1.00 56.84 H ATOM 633 HZ3 LYS A 440 -46.774 -39.864 266.688 1.00 56.84 H ATOM 634 N PHE A 441 -40.338 -43.521 269.789 1.00 30.37 N ANISOU 634 N PHE A 441 4357 3987 3193 -30 -168 492 N ATOM 635 CA PHE A 441 -38.906 -43.574 270.045 1.00 29.53 C ANISOU 635 CA PHE A 441 4319 3890 3012 -203 -226 345 C ATOM 636 C PHE A 441 -38.127 -43.199 268.794 1.00 28.49 C ANISOU 636 C PHE A 441 4254 3661 2911 -282 -248 256 C ATOM 637 O PHE A 441 -38.602 -43.361 267.663 1.00 26.77 O ANISOU 637 O PHE A 441 4013 3397 2763 -228 -284 320 O ATOM 638 CB PHE A 441 -38.500 -44.973 270.525 1.00 27.83 C ANISOU 638 CB PHE A 441 3922 3803 2847 -254 -364 408 C ATOM 639 CG PHE A 441 -39.201 -45.389 271.759 1.00 26.52 C ANISOU 639 CG PHE A 441 3728 3724 2624 -197 -324 510 C ATOM 640 CD1 PHE A 441 -40.405 -46.068 271.697 1.00 26.11 C ANISOU 640 CD1 PHE A 441 3550 3689 2682 -111 -296 654 C ATOM 641 CD2 PHE A 441 -38.668 -45.082 273.002 1.00 30.05 C ANISOU 641 CD2 PHE A 441 4284 4255 2880 -266 -308 460 C ATOM 642 CE1 PHE A 441 -41.062 -46.442 272.860 1.00 29.30 C ANISOU 642 CE1 PHE A 441 3939 4162 3031 -71 -208 753 C ATOM 643 CE2 PHE A 441 -39.317 -45.453 274.159 1.00 30.65 C ANISOU 643 CE2 PHE A 441 4386 4403 2857 -222 -241 557 C ATOM 644 CZ PHE A 441 -40.517 -46.129 274.088 1.00 30.38 C ANISOU 644 CZ PHE A 441 4229 4356 2960 -111 -168 707 C ATOM 645 H PHE A 441 -40.564 -43.784 269.002 1.00 36.47 H ATOM 646 HA PHE A 441 -38.683 -42.937 270.743 1.00 35.47 H ATOM 647 HB2 PHE A 441 -38.709 -45.617 269.831 1.00 33.42 H ATOM 648 HB3 PHE A 441 -37.547 -44.979 270.706 1.00 33.42 H ATOM 649 HD1 PHE A 441 -40.775 -46.276 270.870 1.00 31.36 H ATOM 650 HD2 PHE A 441 -37.862 -44.622 273.054 1.00 36.09 H ATOM 651 HE1 PHE A 441 -41.869 -46.901 272.811 1.00 35.19 H ATOM 652 HE2 PHE A 441 -38.949 -45.243 274.987 1.00 36.81 H ATOM 653 HZ PHE A 441 -40.954 -46.383 274.869 1.00 36.49 H ATOM 654 N ALA A 442 -36.905 -42.715 269.013 1.00 28.15 N ANISOU 654 N ALA A 442 4290 3611 2796 -444 -229 108 N ATOM 655 CA ALA A 442 -36.044 -42.328 267.906 1.00 29.74 C ANISOU 655 CA ALA A 442 4555 3717 3027 -551 -197 13 C ATOM 656 C ALA A 442 -35.334 -43.520 267.273 1.00 26.72 C ANISOU 656 C ALA A 442 3975 3402 2775 -588 -298 32 C ATOM 657 O ALA A 442 -34.879 -43.419 266.124 1.00 26.88 O ANISOU 657 O ALA A 442 4055 3326 2833 -640 -241 -19 O ATOM 658 CB ALA A 442 -35.023 -41.291 268.390 1.00 33.98 C ANISOU 658 CB ALA A 442 5232 4230 3450 -761 -107 -163 C ATOM 659 H ALA A 442 -36.555 -42.602 269.790 1.00 33.81 H ATOM 660 HA ALA A 442 -36.588 -41.910 267.220 1.00 35.71 H ATOM 661 HB1 ALA A 442 -34.453 -41.039 267.647 1.00 40.81 H ATOM 662 HB2 ALA A 442 -35.497 -40.513 268.723 1.00 40.81 H ATOM 663 HB3 ALA A 442 -34.489 -41.682 269.099 1.00 40.81 H ATOM 664 N ARG A 443 -35.238 -44.648 267.980 1.00 23.39 N ANISOU 664 N ARG A 443 3359 3112 2417 -548 -404 113 N ATOM 665 CA ARG A 443 -34.554 -45.836 267.477 1.00 22.84 C ANISOU 665 CA ARG A 443 3131 3054 2493 -536 -437 149 C ATOM 666 C ARG A 443 -35.449 -47.061 267.612 1.00 24.29 C ANISOU 666 C ARG A 443 3257 3225 2749 -431 -488 283 C ATOM 667 O ARG A 443 -36.181 -47.203 268.599 1.00 24.98 O ANISOU 667 O ARG A 443 3319 3388 2786 -376 -531 373 O ATOM 668 CB ARG A 443 -33.228 -46.070 268.226 1.00 24.46 C ANISOU 668 CB ARG A 443 3137 3425 2734 -590 -492 146 C ATOM 669 CG ARG A 443 -32.178 -45.020 267.931 1.00 24.83 C ANISOU 669 CG ARG A 443 3190 3498 2746 -770 -430 -4 C ATOM 670 CD ARG A 443 -30.995 -45.061 268.893 1.00 30.21 C ANISOU 670 CD ARG A 443 3618 4441 3420 -874 -548 8 C ATOM 671 NE ARG A 443 -30.502 -46.422 269.164 1.00 29.87 N ANISOU 671 NE ARG A 443 3297 4516 3536 -701 -630 190 N ATOM 672 CZ ARG A 443 -29.226 -46.743 269.360 1.00 31.19 C ANISOU 672 CZ ARG A 443 3142 4890 3818 -711 -687 254 C ATOM 673 NH1 ARG A 443 -28.886 -48.005 269.614 1.00 31.76 N ANISOU 673 NH1 ARG A 443 2992 5025 4050 -479 -726 467 N ATOM 674 NH2 ARG A 443 -28.283 -45.812 269.302 1.00 29.71 N ANISOU 674 NH2 ARG A 443 2840 4846 3602 -951 -688 123 N ATOM 675 H ARG A 443 -35.567 -44.748 268.768 1.00 28.10 H ATOM 676 HA ARG A 443 -34.352 -45.712 266.537 1.00 27.44 H ATOM 677 HB2 ARG A 443 -33.401 -46.060 269.181 1.00 29.38 H ATOM 678 HB3 ARG A 443 -32.869 -46.933 267.965 1.00 29.38 H ATOM 679 HG2 ARG A 443 -31.837 -45.159 267.034 1.00 29.82 H ATOM 680 HG3 ARG A 443 -32.585 -44.142 267.998 1.00 29.82 H ATOM 681 HD2 ARG A 443 -30.263 -44.551 268.511 1.00 36.28 H ATOM 682 HD3 ARG A 443 -31.264 -44.669 269.738 1.00 36.28 H ATOM 683 HE ARG A 443 -31.082 -47.056 269.198 1.00 35.87 H ATOM 684 HH11 ARG A 443 -29.492 -48.615 269.650 1.00 38.14 H ATOM 685 HH12 ARG A 443 -28.060 -48.212 269.734 1.00 38.14 H ATOM 686 HH21 ARG A 443 -28.496 -44.994 269.142 1.00 35.67 H ATOM 687 HH22 ARG A 443 -27.460 -46.026 269.427 1.00 35.67 H ATOM 688 N SER A 444 -35.358 -47.960 266.628 1.00 24.14 N ANISOU 688 N SER A 444 3247 3091 2835 -432 -446 284 N ATOM 689 CA SER A 444 -36.154 -49.183 266.655 1.00 24.92 C ANISOU 689 CA SER A 444 3334 3134 3002 -401 -462 381 C ATOM 690 C SER A 444 -35.867 -50.005 267.903 1.00 24.40 C ANISOU 690 C SER A 444 3140 3139 2993 -305 -487 515 C ATOM 691 O SER A 444 -36.788 -50.581 268.506 1.00 23.89 O ANISOU 691 O SER A 444 3072 3080 2923 -287 -506 621 O ATOM 692 CB SER A 444 -35.866 -50.024 265.406 1.00 26.58 C ANISOU 692 CB SER A 444 3647 3165 3287 -461 -365 315 C ATOM 693 OG SER A 444 -34.499 -50.438 265.368 1.00 26.46 O ANISOU 693 OG SER A 444 3556 3102 3395 -392 -250 300 O ATOM 694 H SER A 444 -34.847 -47.884 265.941 1.00 29.00 H ATOM 695 HA SER A 444 -37.096 -48.952 266.654 1.00 29.94 H ATOM 696 HB2 SER A 444 -36.433 -50.811 265.419 1.00 31.92 H ATOM 697 HB3 SER A 444 -36.056 -49.492 264.618 1.00 31.92 H ATOM 698 HG SER A 444 -34.357 -50.897 264.679 1.00 31.78 H ATOM 699 N ASP A 445 -34.591 -50.081 268.298 1.00 25.71 N ANISOU 699 N ASP A 445 3181 3377 3210 -246 -487 537 N ATOM 700 CA ASP A 445 -34.195 -50.918 269.433 1.00 26.71 C ANISOU 700 CA ASP A 445 3180 3596 3375 -120 -537 718 C ATOM 701 C ASP A 445 -34.682 -50.335 270.752 1.00 28.14 C ANISOU 701 C ASP A 445 3362 3966 3365 -140 -655 776 C ATOM 702 O ASP A 445 -34.882 -51.074 271.724 1.00 29.55 O ANISOU 702 O ASP A 445 3521 4195 3513 -53 -689 950 O ATOM 703 CB ASP A 445 -32.675 -51.095 269.466 1.00 27.25 C ANISOU 703 CB ASP A 445 3042 3758 3553 -34 -537 765 C ATOM 704 CG ASP A 445 -31.921 -49.796 269.188 1.00 33.17 C ANISOU 704 CG ASP A 445 3722 4647 4235 -180 -573 601 C ATOM 705 OD1 ASP A 445 -31.849 -49.367 268.012 1.00 33.87 O ANISOU 705 OD1 ASP A 445 3911 4593 4365 -264 -448 447 O ATOM 706 OD2 ASP A 445 -31.389 -49.212 270.139 1.00 35.44 O ANISOU 706 OD2 ASP A 445 3880 5181 4404 -242 -719 624 O ATOM 707 H ASP A 445 -33.940 -49.660 267.926 1.00 30.88 H ATOM 708 HA ASP A 445 -34.595 -51.796 269.330 1.00 32.08 H ATOM 709 HB2 ASP A 445 -32.413 -51.411 270.345 1.00 32.73 H ATOM 710 HB3 ASP A 445 -32.418 -51.741 268.791 1.00 32.73 H ATOM 711 N GLU A 446 -34.872 -49.019 270.804 1.00 27.69 N ANISOU 711 N GLU A 446 3377 3980 3162 -252 -678 635 N ATOM 712 CA GLU A 446 -35.530 -48.412 271.951 1.00 26.09 C ANISOU 712 CA GLU A 446 3262 3890 2761 -281 -708 652 C ATOM 713 C GLU A 446 -36.980 -48.867 272.050 1.00 27.18 C ANISOU 713 C GLU A 446 3468 3935 2923 -224 -627 737 C ATOM 714 O GLU A 446 -37.473 -49.139 273.150 1.00 28.18 O ANISOU 714 O GLU A 446 3625 4136 2947 -192 -616 847 O ATOM 715 CB GLU A 446 -35.428 -46.890 271.856 1.00 24.63 C ANISOU 715 CB GLU A 446 3203 3718 2439 -406 -673 466 C ATOM 716 CG GLU A 446 -34.046 -46.367 272.160 1.00 28.22 C ANISOU 716 CG GLU A 446 3578 4330 2814 -546 -765 380 C ATOM 717 CD GLU A 446 -33.872 -44.878 271.879 1.00 31.61 C ANISOU 717 CD GLU A 446 4185 4697 3128 -722 -677 167 C ATOM 718 OE1 GLU A 446 -32.934 -44.285 272.451 1.00 33.88 O ANISOU 718 OE1 GLU A 446 4452 5142 3279 -921 -752 71 O ATOM 719 OE2 GLU A 446 -34.645 -44.306 271.070 1.00 30.88 O ANISOU 719 OE2 GLU A 446 4255 4403 3077 -675 -535 109 O ATOM 720 H GLU A 446 -34.632 -48.463 270.194 1.00 33.25 H ATOM 721 HA GLU A 446 -35.074 -48.692 272.760 1.00 31.33 H ATOM 722 HB2 GLU A 446 -35.660 -46.615 270.956 1.00 29.59 H ATOM 723 HB3 GLU A 446 -36.044 -46.493 272.492 1.00 29.59 H ATOM 724 HG2 GLU A 446 -33.855 -46.515 273.100 1.00 33.89 H ATOM 725 HG3 GLU A 446 -33.403 -46.848 271.615 1.00 33.89 H ATOM 726 N LEU A 447 -37.675 -48.985 270.910 1.00 25.36 N ANISOU 726 N LEU A 447 3252 3569 2816 -236 -573 697 N ATOM 727 CA LEU A 447 -39.039 -49.517 270.935 1.00 23.95 C ANISOU 727 CA LEU A 447 3059 3353 2687 -230 -522 790 C ATOM 728 C LEU A 447 -39.046 -50.979 271.360 1.00 25.55 C ANISOU 728 C LEU A 447 3233 3500 2975 -217 -502 932 C ATOM 729 O LEU A 447 -39.955 -51.430 272.073 1.00 25.21 O ANISOU 729 O LEU A 447 3181 3476 2921 -221 -441 1046 O ATOM 730 CB LEU A 447 -39.707 -49.355 269.567 1.00 23.67 C ANISOU 730 CB LEU A 447 3022 3243 2728 -291 -529 729 C ATOM 731 CG LEU A 447 -41.117 -49.954 269.417 1.00 26.25 C ANISOU 731 CG LEU A 447 3260 3589 3125 -349 -519 825 C ATOM 732 CD1 LEU A 447 -42.080 -49.413 270.468 1.00 28.71 C ANISOU 732 CD1 LEU A 447 3500 4018 3392 -263 -436 922 C ATOM 733 CD2 LEU A 447 -41.697 -49.739 268.011 1.00 27.39 C ANISOU 733 CD2 LEU A 447 3390 3730 3290 -441 -598 778 C ATOM 734 H LEU A 447 -37.386 -48.768 270.130 1.00 30.46 H ATOM 735 HA LEU A 447 -39.560 -49.016 271.582 1.00 28.76 H ATOM 736 HB2 LEU A 447 -39.775 -48.407 269.373 1.00 28.43 H ATOM 737 HB3 LEU A 447 -39.142 -49.779 268.902 1.00 28.43 H ATOM 738 HG LEU A 447 -41.052 -50.912 269.555 1.00 31.53 H ATOM 739 HD11 LEU A 447 -42.952 -49.817 270.335 1.00 34.48 H ATOM 740 HD12 LEU A 447 -41.742 -49.636 271.350 1.00 34.48 H ATOM 741 HD13 LEU A 447 -42.143 -48.450 270.372 1.00 34.48 H ATOM 742 HD21 LEU A 447 -42.582 -50.134 267.971 1.00 32.90 H ATOM 743 HD22 LEU A 447 -41.751 -48.787 267.834 1.00 32.90 H ATOM 744 HD23 LEU A 447 -41.115 -50.164 267.361 1.00 32.90 H ATOM 745 N THR A 448 -38.038 -51.738 270.937 1.00 26.77 N ANISOU 745 N THR A 448 3384 3559 3228 -189 -510 939 N ATOM 746 CA THR A 448 -37.956 -53.130 271.348 1.00 27.66 C ANISOU 746 CA THR A 448 3519 3557 3433 -133 -444 1099 C ATOM 747 C THR A 448 -37.827 -53.230 272.861 1.00 28.80 C ANISOU 747 C THR A 448 3652 3844 3445 -34 -479 1275 C ATOM 748 O THR A 448 -38.488 -54.059 273.493 1.00 29.68 O ANISOU 748 O THR A 448 3826 3891 3561 -28 -395 1426 O ATOM 749 CB THR A 448 -36.786 -53.801 270.634 1.00 30.13 C ANISOU 749 CB THR A 448 3831 3725 3891 -54 -393 1090 C ATOM 750 OG1 THR A 448 -37.050 -53.816 269.217 1.00 28.86 O ANISOU 750 OG1 THR A 448 3759 3406 3799 -188 -329 918 O ATOM 751 CG2 THR A 448 -36.557 -55.224 271.136 1.00 33.75 C ANISOU 751 CG2 THR A 448 4345 4018 4459 72 -281 1296 C ATOM 752 H THR A 448 -37.402 -51.475 270.422 1.00 32.15 H ATOM 753 HA THR A 448 -38.770 -53.587 271.086 1.00 33.22 H ATOM 754 HB THR A 448 -35.979 -53.290 270.800 1.00 36.18 H ATOM 755 HG1 THR A 448 -37.138 -53.031 268.933 1.00 34.66 H ATOM 756 HG21 THR A 448 -35.809 -55.625 270.665 1.00 40.52 H ATOM 757 HG22 THR A 448 -36.362 -55.213 272.086 1.00 40.52 H ATOM 758 HG23 THR A 448 -37.350 -55.761 270.983 1.00 40.52 H ATOM 759 N ARG A 449 -36.998 -52.372 273.461 1.00 25.03 N ANISOU 759 N ARG A 449 3121 3570 2820 4 -600 1252 N ATOM 760 CA ARG A 449 -36.874 -52.354 274.918 1.00 27.70 C ANISOU 760 CA ARG A 449 3490 4088 2946 50 -667 1402 C ATOM 761 C ARG A 449 -38.204 -52.002 275.574 1.00 28.13 C ANISOU 761 C ARG A 449 3662 4156 2870 -17 -556 1399 C ATOM 762 O ARG A 449 -38.611 -52.637 276.556 1.00 27.59 O ANISOU 762 O ARG A 449 3675 4104 2705 19 -498 1577 O ATOM 763 CB ARG A 449 -35.796 -51.358 275.329 1.00 26.43 C ANISOU 763 CB ARG A 449 3264 4167 2612 6 -836 1320 C ATOM 764 CG ARG A 449 -34.374 -51.813 275.073 1.00 30.41 C ANISOU 764 CG ARG A 449 3569 4754 3233 104 -955 1409 C ATOM 765 CD ARG A 449 -33.428 -50.652 275.285 1.00 28.11 C ANISOU 765 CD ARG A 449 3178 4717 2784 -41 -1117 1269 C ATOM 766 NE ARG A 449 -32.048 -51.086 275.380 1.00 30.56 N ANISOU 766 NE ARG A 449 3213 5221 3176 53 -1270 1419 N ATOM 767 CZ ARG A 449 -31.037 -50.292 275.704 1.00 32.36 C ANISOU 767 CZ ARG A 449 3278 5738 3279 -99 -1450 1344 C ATOM 768 NH1 ARG A 449 -29.811 -50.784 275.772 1.00 35.19 N ANISOU 768 NH1 ARG A 449 3341 6253 3777 17 -1542 1479 N ATOM 769 NH2 ARG A 449 -31.255 -49.006 275.958 1.00 31.85 N ANISOU 769 NH2 ARG A 449 3375 5749 2978 -372 -1474 1099 N ATOM 770 H ARG A 449 -36.503 -51.799 273.052 1.00 30.06 H ATOM 771 HA ARG A 449 -36.608 -53.234 275.226 1.00 33.27 H ATOM 772 HB2 ARG A 449 -35.933 -50.534 274.837 1.00 31.75 H ATOM 773 HB3 ARG A 449 -35.881 -51.187 276.280 1.00 31.75 H ATOM 774 HG2 ARG A 449 -34.141 -52.521 275.693 1.00 36.52 H ATOM 775 HG3 ARG A 449 -34.290 -52.119 274.156 1.00 36.52 H ATOM 776 HD2 ARG A 449 -33.502 -50.040 274.536 1.00 33.59 H ATOM 777 HD3 ARG A 449 -33.660 -50.199 276.111 1.00 33.59 H ATOM 778 HE ARG A 449 -31.874 -51.912 275.214 1.00 36.53 H ATOM 779 HH11 ARG A 449 -29.671 -51.616 275.605 1.00 42.09 H ATOM 780 HH12 ARG A 449 -29.152 -50.270 275.978 1.00 42.09 H ATOM 781 HH21 ARG A 449 -32.053 -48.689 275.915 1.00 38.08 H ATOM 782 HH22 ARG A 449 -30.598 -48.492 276.167 1.00 38.08 H ATOM 783 N HIS A 450 -38.902 -51.003 275.035 1.00 27.66 N ANISOU 783 N HIS A 450 3612 4081 2816 -93 -495 1223 N ATOM 784 CA HIS A 450 -40.224 -50.635 275.533 1.00 29.85 C ANISOU 784 CA HIS A 450 3942 4368 3032 -112 -339 1236 C ATOM 785 C HIS A 450 -41.214 -51.800 275.430 1.00 30.07 C ANISOU 785 C HIS A 450 3915 4289 3223 -137 -225 1378 C ATOM 786 O HIS A 450 -41.926 -52.102 276.387 1.00 32.28 O ANISOU 786 O HIS A 450 4246 4597 3421 -138 -90 1501 O ATOM 787 CB HIS A 450 -40.724 -49.407 274.763 1.00 32.13 C ANISOU 787 CB HIS A 450 4212 4638 3356 -126 -291 1069 C ATOM 788 CG HIS A 450 -42.094 -48.936 275.153 1.00 37.57 C ANISOU 788 CG HIS A 450 4893 5342 4040 -85 -97 1106 C ATOM 789 ND1 HIS A 450 -42.332 -48.202 276.294 1.00 40.67 N ANISOU 789 ND1 HIS A 450 5445 5787 4221 -50 56 1090 N ATOM 790 CD2 HIS A 450 -43.294 -49.076 274.540 1.00 39.21 C ANISOU 790 CD2 HIS A 450 4932 5536 4429 -76 -18 1164 C ATOM 791 CE1 HIS A 450 -43.621 -47.919 276.373 1.00 42.64 C ANISOU 791 CE1 HIS A 450 5616 6029 4557 25 268 1147 C ATOM 792 NE2 HIS A 450 -44.227 -48.439 275.321 1.00 43.23 N ANISOU 792 NE2 HIS A 450 5452 6092 4880 10 202 1208 N ATOM 793 H HIS A 450 -38.629 -50.521 274.377 1.00 33.22 H ATOM 794 HA HIS A 450 -40.150 -50.390 276.469 1.00 35.85 H ATOM 795 HB2 HIS A 450 -40.108 -48.674 274.915 1.00 38.58 H ATOM 796 HB3 HIS A 450 -40.747 -49.623 273.817 1.00 38.58 H ATOM 797 HD1 HIS A 450 -41.736 -47.967 276.868 1.00 48.83 H ATOM 798 HD2 HIS A 450 -43.457 -49.525 273.742 1.00 47.08 H ATOM 799 HE1 HIS A 450 -44.031 -47.437 277.054 1.00 51.20 H ATOM 800 N TYR A 451 -41.274 -52.475 274.275 1.00 29.86 N ANISOU 800 N TYR A 451 3812 4127 3405 -197 -253 1349 N ATOM 801 CA TYR A 451 -42.218 -53.587 274.144 1.00 32.32 C ANISOU 801 CA TYR A 451 4096 4326 3857 -305 -139 1450 C ATOM 802 C TYR A 451 -41.975 -54.664 275.193 1.00 34.33 C ANISOU 802 C TYR A 451 4478 4503 4064 -257 -50 1652 C ATOM 803 O TYR A 451 -42.914 -55.371 275.580 1.00 33.35 O ANISOU 803 O TYR A 451 4368 4315 3990 -356 108 1763 O ATOM 804 CB TYR A 451 -42.145 -54.223 272.753 1.00 35.80 C ANISOU 804 CB TYR A 451 4522 4608 4473 -429 -182 1357 C ATOM 805 CG TYR A 451 -43.098 -53.636 271.732 1.00 37.22 C ANISOU 805 CG TYR A 451 4563 4868 4712 -562 -236 1246 C ATOM 806 CD1 TYR A 451 -44.441 -53.448 272.032 1.00 39.33 C ANISOU 806 CD1 TYR A 451 4664 5268 5012 -635 -169 1318 C ATOM 807 CD2 TYR A 451 -42.652 -53.279 270.464 1.00 35.82 C ANISOU 807 CD2 TYR A 451 4404 4654 4553 -603 -351 1099 C ATOM 808 CE1 TYR A 451 -45.313 -52.913 271.102 1.00 39.77 C ANISOU 808 CE1 TYR A 451 4531 5452 5126 -724 -257 1274 C ATOM 809 CE2 TYR A 451 -43.512 -52.735 269.524 1.00 36.91 C ANISOU 809 CE2 TYR A 451 4422 4899 4704 -709 -440 1043 C ATOM 810 CZ TYR A 451 -44.838 -52.551 269.845 1.00 38.32 C ANISOU 810 CZ TYR A 451 4393 5243 4923 -758 -414 1145 C ATOM 811 OH TYR A 451 -45.691 -52.019 268.909 1.00 37.49 O ANISOU 811 OH TYR A 451 4112 5297 4837 -832 -540 1143 O ATOM 812 H TYR A 451 -40.796 -52.316 273.578 1.00 35.86 H ATOM 813 HA TYR A 451 -43.118 -53.248 274.269 1.00 38.81 H ATOM 814 HB2 TYR A 451 -41.245 -54.113 272.410 1.00 42.99 H ATOM 815 HB3 TYR A 451 -42.349 -55.168 272.834 1.00 42.99 H ATOM 816 HD1 TYR A 451 -44.758 -53.683 272.874 1.00 47.22 H ATOM 817 HD2 TYR A 451 -41.755 -53.396 270.247 1.00 43.01 H ATOM 818 HE1 TYR A 451 -46.209 -52.788 271.318 1.00 47.75 H ATOM 819 HE2 TYR A 451 -43.197 -52.498 268.682 1.00 44.32 H ATOM 820 HH TYR A 451 -45.271 -51.848 268.202 1.00 45.02 H ATOM 821 N ARG A 452 -40.733 -54.827 275.656 1.00 37.49 N ANISOU 821 N ARG A 452 4954 4918 4371 -110 -146 1730 N ATOM 822 CA ARG A 452 -40.491 -55.842 276.672 1.00 43.19 C ANISOU 822 CA ARG A 452 5808 5578 5025 -18 -76 1982 C ATOM 823 C ARG A 452 -40.993 -55.408 278.045 1.00 45.26 C ANISOU 823 C ARG A 452 6160 6014 5023 -12 -18 2083 C ATOM 824 O ARG A 452 -41.258 -56.269 278.892 1.00 46.09 O ANISOU 824 O ARG A 452 6405 6048 5059 12 107 2305 O ATOM 825 CB ARG A 452 -39.002 -56.217 276.690 1.00 46.09 C ANISOU 825 CB ARG A 452 6170 5945 5396 174 -215 2089 C ATOM 826 CG ARG A 452 -38.650 -57.045 275.444 1.00 47.24 C ANISOU 826 CG ARG A 452 6313 5813 5823 185 -136 2037 C ATOM 827 CD ARG A 452 -37.223 -57.563 275.355 1.00 50.70 C ANISOU 827 CD ARG A 452 6708 6208 6349 428 -191 2177 C ATOM 828 NE ARG A 452 -37.075 -58.261 274.078 1.00 53.50 N ANISOU 828 NE ARG A 452 7122 6246 6960 405 -29 2068 N ATOM 829 CZ ARG A 452 -35.941 -58.394 273.388 1.00 55.82 C ANISOU 829 CZ ARG A 452 7335 6474 7401 564 -18 2048 C ATOM 830 NH1 ARG A 452 -35.961 -59.035 272.224 1.00 56.06 N ANISOU 830 NH1 ARG A 452 7501 6176 7622 501 187 1916 N ATOM 831 NH2 ARG A 452 -34.795 -57.892 273.840 1.00 57.21 N ANISOU 831 NH2 ARG A 452 7296 6918 7525 756 -198 2152 N ATOM 832 H ARG A 452 -40.041 -54.381 275.407 1.00 45.01 H ATOM 833 HA ARG A 452 -40.985 -56.640 276.427 1.00 51.86 H ATOM 834 HB2 ARG A 452 -38.464 -55.410 276.687 1.00 55.33 H ATOM 835 HB3 ARG A 452 -38.811 -56.750 277.478 1.00 55.33 H ATOM 836 HG2 ARG A 452 -39.237 -57.816 275.415 1.00 56.72 H ATOM 837 HG3 ARG A 452 -38.805 -56.495 274.660 1.00 56.72 H ATOM 838 HD2 ARG A 452 -36.599 -56.821 275.382 1.00 60.87 H ATOM 839 HD3 ARG A 452 -37.052 -58.187 276.077 1.00 60.87 H ATOM 840 HE ARG A 452 -37.781 -58.619 273.743 1.00 64.23 H ATOM 841 HH11 ARG A 452 -36.697 -59.366 271.929 1.00 67.29 H ATOM 842 HH12 ARG A 452 -35.234 -59.134 271.776 1.00 67.29 H ATOM 843 HH21 ARG A 452 -34.776 -57.469 274.589 1.00 68.68 H ATOM 844 HH22 ARG A 452 -34.073 -57.989 273.383 1.00 68.68 H ATOM 845 N LYS A 453 -41.181 -54.104 278.273 1.00 46.46 N ANISOU 845 N LYS A 453 6283 6353 5017 -42 -57 1925 N ATOM 846 CA LYS A 453 -41.937 -53.676 279.447 1.00 49.46 C ANISOU 846 CA LYS A 453 6787 6840 5163 -67 101 1977 C ATOM 847 C LYS A 453 -43.367 -54.200 279.387 1.00 51.69 C ANISOU 847 C LYS A 453 7008 7015 5615 -163 363 2038 C ATOM 848 O LYS A 453 -43.924 -54.628 280.404 1.00 52.74 O ANISOU 848 O LYS A 453 7273 7147 5619 -182 557 2198 O ATOM 849 CB LYS A 453 -41.943 -52.151 279.553 1.00 49.66 C ANISOU 849 CB LYS A 453 6835 7007 5026 -82 86 1763 C ATOM 850 CG LYS A 453 -40.675 -51.540 280.120 1.00 51.78 C ANISOU 850 CG LYS A 453 7223 7444 5006 -78 -129 1710 C ATOM 851 CD LYS A 453 -40.635 -50.029 279.882 1.00 52.24 C ANISOU 851 CD LYS A 453 7327 7550 4972 -139 -113 1446 C ATOM 852 CE LYS A 453 -40.687 -49.220 281.176 1.00 56.01 C ANISOU 852 CE LYS A 453 8095 8144 5043 -215 -12 1382 C ATOM 853 NZ LYS A 453 -40.511 -47.753 280.907 1.00 54.97 N ANISOU 853 NZ LYS A 453 8072 7992 4823 -292 34 1108 N ATOM 854 H LYS A 453 -40.889 -53.466 277.777 1.00 55.78 H ATOM 855 HA LYS A 453 -41.517 -54.034 280.244 1.00 59.37 H ATOM 856 HB2 LYS A 453 -42.074 -51.781 278.666 1.00 59.62 H ATOM 857 HB3 LYS A 453 -42.678 -51.886 280.127 1.00 59.62 H ATOM 858 HG2 LYS A 453 -40.642 -51.699 281.076 1.00 62.16 H ATOM 859 HG3 LYS A 453 -39.905 -51.937 279.686 1.00 62.16 H ATOM 860 HD2 LYS A 453 -39.812 -49.804 279.422 1.00 62.71 H ATOM 861 HD3 LYS A 453 -41.398 -49.775 279.340 1.00 62.71 H ATOM 862 HE2 LYS A 453 -41.548 -49.351 281.603 1.00 67.24 H ATOM 863 HE3 LYS A 453 -39.972 -49.509 281.765 1.00 67.24 H ATOM 864 HZ1 LYS A 453 -40.544 -47.297 281.671 1.00 65.99 H ATOM 865 HZ2 LYS A 453 -39.724 -47.608 280.517 1.00 65.99 H ATOM 866 HZ3 LYS A 453 -41.158 -47.463 280.369 1.00 65.99 H ATOM 867 N HIS A 454 -43.971 -54.187 278.193 1.00 39.80 N ANISOU 867 N HIS A 454 5297 5441 4386 -251 368 1923 N ATOM 868 CA HIS A 454 -45.347 -54.655 278.038 1.00 42.68 C ANISOU 868 CA HIS A 454 5517 5767 4932 -397 575 1977 C ATOM 869 C HIS A 454 -45.438 -56.173 278.161 1.00 41.05 C ANISOU 869 C HIS A 454 5414 5359 4824 -515 677 2141 C ATOM 870 O HIS A 454 -46.379 -56.699 278.768 1.00 41.24 O ANISOU 870 O HIS A 454 5440 5356 4873 -631 917 2267 O ATOM 871 CB HIS A 454 -45.913 -54.219 276.678 1.00 45.67 C ANISOU 871 CB HIS A 454 5632 6184 5536 -487 482 1827 C ATOM 872 CG HIS A 454 -46.182 -52.749 276.554 1.00 47.90 C ANISOU 872 CG HIS A 454 5808 6623 5770 -359 474 1717 C ATOM 873 ND1 HIS A 454 -47.113 -52.092 277.328 1.00 50.40 N ANISOU 873 ND1 HIS A 454 6060 7047 6042 -285 713 1769 N ATOM 874 CD2 HIS A 454 -45.674 -51.819 275.707 1.00 46.98 C ANISOU 874 CD2 HIS A 454 5662 6535 5655 -282 305 1568 C ATOM 875 CE1 HIS A 454 -47.146 -50.815 276.984 1.00 50.37 C ANISOU 875 CE1 HIS A 454 6012 7107 6020 -144 698 1662 C ATOM 876 NE2 HIS A 454 -46.283 -50.623 276.002 1.00 48.20 N ANISOU 876 NE2 HIS A 454 5761 6786 5765 -151 442 1542 N ATOM 877 H HIS A 454 -43.606 -53.914 277.464 1.00 47.79 H ATOM 878 HA HIS A 454 -45.897 -54.262 278.734 1.00 51.24 H ATOM 879 HB2 HIS A 454 -45.277 -54.460 275.986 1.00 54.83 H ATOM 880 HB3 HIS A 454 -46.750 -54.685 276.527 1.00 54.83 H ATOM 881 HD1 HIS A 454 -47.588 -52.452 277.948 1.00 60.50 H ATOM 882 HD2 HIS A 454 -45.023 -51.962 275.059 1.00 56.41 H ATOM 883 HE1 HIS A 454 -47.688 -50.163 277.367 1.00 60.48 H ATOM 884 N THR A 455 -44.484 -56.896 277.577 1.00 48.26 N ANISOU 884 N THR A 455 6428 6100 5810 -487 546 2145 N ATOM 885 CA THR A 455 -44.573 -58.350 277.518 1.00 53.18 C ANISOU 885 CA THR A 455 7200 6446 6561 -596 692 2281 C ATOM 886 C THR A 455 -43.902 -59.051 278.687 1.00 56.04 C ANISOU 886 C THR A 455 7828 6713 6753 -416 768 2550 C ATOM 887 O THR A 455 -44.176 -60.238 278.913 1.00 59.33 O ANISOU 887 O THR A 455 8420 6879 7242 -497 947 2643 O ATOM 888 CB THR A 455 -43.938 -58.876 276.226 1.00 53.94 C ANISOU 888 CB THR A 455 7319 6335 6839 -642 593 2156 C ATOM 889 OG1 THR A 455 -42.548 -58.524 276.194 1.00 51.45 O ANISOU 889 OG1 THR A 455 7046 6057 6446 -378 413 2158 O ATOM 890 CG2 THR A 455 -44.644 -58.311 274.998 1.00 54.05 C ANISOU 890 CG2 THR A 455 7109 6449 6980 -856 495 1919 C ATOM 891 H THR A 455 -43.779 -56.569 277.209 1.00 57.95 H ATOM 892 HA THR A 455 -45.508 -58.606 277.515 1.00 63.85 H ATOM 893 HB THR A 455 -44.021 -59.842 276.203 1.00 64.75 H ATOM 894 HG1 THR A 455 -42.195 -58.810 275.488 1.00 61.77 H ATOM 895 HG21 THR A 455 -44.230 -58.654 274.190 1.00 64.89 H ATOM 896 HG22 THR A 455 -45.579 -58.567 275.006 1.00 64.89 H ATOM 897 HG23 THR A 455 -44.583 -57.343 274.997 1.00 64.89 H ATOM 898 N GLY A 456 -43.032 -58.366 279.427 1.00 54.98 N ANISOU 898 N GLY A 456 7740 6777 6373 -197 596 2581 N ATOM 899 CA GLY A 456 -42.214 -59.052 280.409 1.00 57.94 C ANISOU 899 CA GLY A 456 8329 7103 6583 -17 545 2734 C ATOM 900 C GLY A 456 -41.281 -60.095 279.829 1.00 58.12 C ANISOU 900 C GLY A 456 8411 6882 6789 118 503 2809 C ATOM 901 O GLY A 456 -40.693 -60.876 280.584 1.00 60.44 O ANISOU 901 O GLY A 456 8859 7102 7002 275 489 2984 O ATOM 902 H GLY A 456 -42.902 -57.518 279.378 1.00 66.00 H ATOM 903 HA2 GLY A 456 -41.676 -58.399 280.884 1.00 69.56 H ATOM 904 HA3 GLY A 456 -42.792 -59.491 281.052 1.00 69.56 H ATOM 905 N HIS A 457 -41.131 -60.121 278.507 1.00 60.69 N ANISOU 905 N HIS A 457 8627 7074 7358 65 499 2689 N ATOM 906 CA HIS A 457 -40.292 -61.100 277.824 1.00 62.44 C ANISOU 906 CA HIS A 457 8932 7013 7779 193 539 2725 C ATOM 907 C HIS A 457 -38.833 -60.955 278.250 1.00 64.19 C ANISOU 907 C HIS A 457 9076 7399 7916 515 323 2829 C ATOM 908 O HIS A 457 -38.296 -59.845 278.299 1.00 62.34 O ANISOU 908 O HIS A 457 8653 7474 7558 563 95 2749 O ATOM 909 CB HIS A 457 -40.450 -60.895 276.314 1.00 61.87 C ANISOU 909 CB HIS A 457 8773 6803 7931 30 573 2531 C ATOM 910 CG HIS A 457 -39.781 -61.930 275.462 1.00 64.40 C ANISOU 910 CG HIS A 457 9242 6763 8463 104 710 2501 C ATOM 911 ND1 HIS A 457 -39.705 -63.262 275.813 1.00 68.47 N ANISOU 911 ND1 HIS A 457 9989 6983 9042 165 903 2612 N ATOM 912 CD2 HIS A 457 -39.194 -61.827 274.246 1.00 63.29 C ANISOU 912 CD2 HIS A 457 9075 6491 8482 115 717 2354 C ATOM 913 CE1 HIS A 457 -39.076 -63.929 274.860 1.00 69.23 C ANISOU 913 CE1 HIS A 457 10189 6788 9327 232 1033 2526 C ATOM 914 NE2 HIS A 457 -38.756 -63.082 273.898 1.00 66.13 N ANISOU 914 NE2 HIS A 457 9654 6485 8987 196 931 2359 N ATOM 915 H HIS A 457 -41.516 -59.568 277.972 1.00 72.85 H ATOM 916 HA HIS A 457 -40.591 -61.996 278.047 1.00 74.95 H ATOM 917 HB2 HIS A 457 -41.396 -60.905 276.098 1.00 74.27 H ATOM 918 HB3 HIS A 457 -40.072 -60.033 276.078 1.00 74.27 H ATOM 919 HD2 HIS A 457 -39.093 -61.049 273.747 1.00 75.98 H ATOM 920 HE1 HIS A 457 -38.893 -64.840 274.865 1.00 83.10 H ATOM 921 HE2 HIS A 457 -38.342 -63.284 273.172 1.00 79.38 H ATOM 922 N ARG A 458 -38.195 -62.083 278.573 1.00 69.16 N ANISOU 922 N ARG A 458 6152 7649 12478 -80 132 2975 N ATOM 923 CA ARG A 458 -36.808 -62.122 279.048 1.00 65.31 C ANISOU 923 CA ARG A 458 6129 7227 11458 111 254 2501 C ATOM 924 C ARG A 458 -36.056 -63.124 278.197 1.00 61.97 C ANISOU 924 C ARG A 458 5889 6592 11066 -198 -182 2078 C ATOM 925 O ARG A 458 -35.856 -64.283 278.606 1.00 62.19 O ANISOU 925 O ARG A 458 5908 6420 11302 -233 -210 2158 O ATOM 926 CB ARG A 458 -36.736 -62.494 280.529 1.00 69.51 C ANISOU 926 CB ARG A 458 6668 7797 11947 466 707 2824 C ATOM 927 CG ARG A 458 -37.589 -61.633 281.436 1.00 73.72 C ANISOU 927 CG ARG A 458 7052 8514 12444 858 1194 3307 C ATOM 928 CD ARG A 458 -36.981 -60.262 281.654 1.00 72.11 C ANISOU 928 CD ARG A 458 7272 8510 11615 1146 1364 2961 C ATOM 929 NE ARG A 458 -37.638 -59.568 282.758 1.00 76.11 N ANISOU 929 NE ARG A 458 7791 9151 11977 1643 1890 3383 N ATOM 930 CZ ARG A 458 -37.467 -59.876 284.041 1.00 77.48 C ANISOU 930 CZ ARG A 458 8123 9366 11951 2020 2271 3594 C ATOM 931 NH1 ARG A 458 -36.659 -60.871 284.386 1.00 76.02 N ANISOU 931 NH1 ARG A 458 8053 9100 11732 1922 2167 3438 N ATOM 932 NH2 ARG A 458 -38.108 -59.192 284.982 1.00 80.71 N ANISOU 932 NH2 ARG A 458 8628 9924 12115 2455 2752 3912 N ATOM 933 H ARG A 458 -38.556 -62.862 278.523 1.00 83.02 H ATOM 934 HA ARG A 458 -36.401 -61.249 278.930 1.00 78.40 H ATOM 935 HB2 ARG A 458 -37.032 -63.413 280.632 1.00 83.44 H ATOM 936 HB3 ARG A 458 -35.816 -62.413 280.825 1.00 83.44 H ATOM 937 HG2 ARG A 458 -38.464 -61.515 281.034 1.00 88.49 H ATOM 938 HG3 ARG A 458 -37.674 -62.066 282.300 1.00 88.49 H ATOM 939 HD2 ARG A 458 -36.040 -60.358 281.870 1.00 86.56 H ATOM 940 HD3 ARG A 458 -37.090 -59.731 280.850 1.00 86.56 H ATOM 941 HE ARG A 458 -38.206 -58.951 282.564 1.00 91.36 H ATOM 942 HH11 ARG A 458 -36.243 -61.318 283.780 1.00 91.25 H ATOM 943 HH12 ARG A 458 -36.551 -61.069 285.216 1.00 91.25 H ATOM 944 HH21 ARG A 458 -38.633 -58.547 284.763 1.00 96.88 H ATOM 945 HH22 ARG A 458 -37.996 -59.393 285.811 1.00 96.88 H ATOM 946 N PRO A 459 -35.600 -62.731 277.007 1.00 59.52 N ANISOU 946 N PRO A 459 5776 6311 10529 -390 -513 1630 N ATOM 947 CA PRO A 459 -35.028 -63.708 276.070 1.00 58.81 C ANISOU 947 CA PRO A 459 5891 5995 10460 -637 -929 1252 C ATOM 948 C PRO A 459 -33.710 -64.308 276.526 1.00 53.46 C ANISOU 948 C PRO A 459 5527 5314 9472 -455 -810 937 C ATOM 949 O PRO A 459 -33.311 -65.350 275.994 1.00 55.29 O ANISOU 949 O PRO A 459 5925 5300 9782 -579 -1078 712 O ATOM 950 CB PRO A 459 -34.839 -62.903 274.775 1.00 58.85 C ANISOU 950 CB PRO A 459 6049 6121 10189 -782 -1206 893 C ATOM 951 CG PRO A 459 -35.596 -61.624 274.967 1.00 59.32 C ANISOU 951 CG PRO A 459 5886 6402 10250 -697 -1007 1174 C ATOM 952 CD PRO A 459 -35.617 -61.367 276.442 1.00 58.61 C ANISOU 952 CD PRO A 459 5728 6425 10117 -359 -512 1474 C ATOM 953 HA PRO A 459 -35.663 -64.423 275.908 1.00 70.60 H ATOM 954 HB2 PRO A 459 -33.895 -62.722 274.641 1.00 70.65 H ATOM 955 HB3 PRO A 459 -35.200 -63.403 274.027 1.00 70.65 H ATOM 956 HG2 PRO A 459 -35.139 -60.905 274.504 1.00 71.21 H ATOM 957 HG3 PRO A 459 -36.498 -61.728 274.627 1.00 71.21 H ATOM 958 HD2 PRO A 459 -34.826 -60.877 276.714 1.00 70.36 H ATOM 959 HD3 PRO A 459 -36.431 -60.904 276.695 1.00 70.36 H ATOM 960 N PHE A 460 -33.021 -63.698 277.480 1.00 50.06 N ANISOU 960 N PHE A 460 5209 5124 8689 -159 -444 921 N ATOM 961 CA PHE A 460 -31.639 -64.049 277.798 1.00 47.16 C ANISOU 961 CA PHE A 460 5124 4821 7974 4 -369 615 C ATOM 962 C PHE A 460 -31.613 -64.790 279.129 1.00 45.50 C ANISOU 962 C PHE A 460 4856 4533 7899 199 -100 914 C ATOM 963 O PHE A 460 -31.498 -64.182 280.194 1.00 44.34 O ANISOU 963 O PHE A 460 4742 4570 7534 449 213 1080 O ATOM 964 CB PHE A 460 -30.780 -62.797 277.828 1.00 45.46 C ANISOU 964 CB PHE A 460 5096 4921 7257 142 -258 380 C ATOM 965 CG PHE A 460 -30.743 -62.074 276.512 1.00 47.50 C ANISOU 965 CG PHE A 460 5403 5275 7371 -36 -501 120 C ATOM 966 CD1 PHE A 460 -29.796 -62.399 275.555 1.00 49.20 C ANISOU 966 CD1 PHE A 460 5802 5515 7375 -92 -696 -241 C ATOM 967 CD2 PHE A 460 -31.672 -61.086 276.225 1.00 48.93 C ANISOU 967 CD2 PHE A 460 5443 5526 7620 -109 -509 273 C ATOM 968 CE1 PHE A 460 -29.766 -61.742 274.339 1.00 50.47 C ANISOU 968 CE1 PHE A 460 6019 5786 7370 -225 -895 -446 C ATOM 969 CE2 PHE A 460 -31.650 -60.423 275.014 1.00 49.09 C ANISOU 969 CE2 PHE A 460 5507 5640 7504 -269 -738 63 C ATOM 970 CZ PHE A 460 -30.696 -60.747 274.070 1.00 49.88 C ANISOU 970 CZ PHE A 460 5803 5779 7371 -333 -932 -296 C ATOM 971 H PHE A 460 -33.336 -63.064 277.969 1.00 60.11 H ATOM 972 HA PHE A 460 -31.292 -64.640 277.112 1.00 56.62 H ATOM 973 HB2 PHE A 460 -31.135 -62.188 278.493 1.00 54.58 H ATOM 974 HB3 PHE A 460 -29.871 -63.045 278.058 1.00 54.58 H ATOM 975 HD1 PHE A 460 -29.170 -63.063 275.735 1.00 59.06 H ATOM 976 HD2 PHE A 460 -32.314 -60.862 276.859 1.00 58.74 H ATOM 977 HE1 PHE A 460 -29.122 -61.963 273.705 1.00 60.59 H ATOM 978 HE2 PHE A 460 -32.275 -59.758 274.836 1.00 58.93 H ATOM 979 HZ PHE A 460 -30.679 -60.303 273.253 1.00 59.89 H ATOM 980 N GLN A 461 -31.710 -66.115 279.056 1.00 50.00 N ANISOU 980 N GLN A 461 5385 4804 8807 95 -245 980 N ATOM 981 CA GLN A 461 -31.727 -66.962 280.241 1.00 53.38 C ANISOU 981 CA GLN A 461 5737 5125 9421 255 -16 1306 C ATOM 982 C GLN A 461 -30.303 -67.337 280.637 1.00 50.30 C ANISOU 982 C GLN A 461 5620 4812 8680 459 62 1031 C ATOM 983 O GLN A 461 -29.539 -67.855 279.815 1.00 48.14 O ANISOU 983 O GLN A 461 5532 4436 8324 396 -161 673 O ATOM 984 CB GLN A 461 -32.553 -68.225 279.978 1.00 58.80 C ANISOU 984 CB GLN A 461 6234 5402 10705 12 -251 1562 C ATOM 985 CG GLN A 461 -32.532 -69.255 281.104 1.00 64.45 C ANISOU 985 CG GLN A 461 6864 5960 11665 150 -49 1920 C ATOM 986 CD GLN A 461 -33.374 -68.839 282.288 1.00 67.80 C ANISOU 986 CD GLN A 461 6995 6559 12208 342 361 2502 C ATOM 987 OE1 GLN A 461 -34.525 -68.421 282.126 1.00 69.74 O ANISOU 987 OE1 GLN A 461 6930 6817 12750 228 373 2849 O ATOM 988 NE2 GLN A 461 -32.811 -68.955 283.493 1.00 67.33 N ANISOU 988 NE2 GLN A 461 7038 6644 11901 668 709 2642 N ATOM 989 H GLN A 461 -31.768 -66.552 278.318 1.00 60.02 H ATOM 990 HA GLN A 461 -32.133 -66.479 280.977 1.00 64.08 H ATOM 991 HB2 GLN A 461 -33.477 -67.965 279.837 1.00 70.59 H ATOM 992 HB3 GLN A 461 -32.211 -68.657 279.180 1.00 70.59 H ATOM 993 HG2 GLN A 461 -32.879 -70.097 280.769 1.00 77.37 H ATOM 994 HG3 GLN A 461 -31.619 -69.370 281.410 1.00 77.37 H ATOM 995 HE21 GLN A 461 -32.007 -69.253 283.565 1.00 80.83 H ATOM 996 HE22 GLN A 461 -33.251 -68.730 284.197 1.00 80.83 H ATOM 997 N CYS A 462 -29.953 -67.083 281.897 1.00 45.27 N ANISOU 997 N CYS A 462 5019 4360 7823 730 379 1222 N ATOM 998 CA CYS A 462 -28.687 -67.583 282.419 1.00 44.60 C ANISOU 998 CA CYS A 462 5129 4330 7487 914 436 1074 C ATOM 999 C CYS A 462 -28.708 -69.105 282.459 1.00 45.24 C ANISOU 999 C CYS A 462 5165 4069 7954 875 355 1190 C ATOM 1000 O CYS A 462 -29.636 -69.707 283.007 1.00 47.53 O ANISOU 1000 O CYS A 462 5255 4166 8640 842 445 1603 O ATOM 1001 CB CYS A 462 -28.423 -67.037 283.819 1.00 46.22 C ANISOU 1001 CB CYS A 462 5417 4768 7377 1202 738 1291 C ATOM 1002 SG CYS A 462 -26.948 -67.767 284.566 1.00 46.44 S ANISOU 1002 SG CYS A 462 5626 4855 7163 1411 769 1212 S ATOM 1003 H CYS A 462 -30.422 -66.631 282.459 1.00 54.36 H ATOM 1004 HA CYS A 462 -27.964 -67.301 281.838 1.00 53.55 H ATOM 1005 HB2 CYS A 462 -28.291 -66.078 283.766 1.00 55.49 H ATOM 1006 HB3 CYS A 462 -29.181 -67.239 284.388 1.00 55.49 H ATOM 1007 N GLN A 463 -27.675 -69.730 281.893 1.00 43.94 N ANISOU 1007 N GLN A 463 5186 3823 7687 900 199 864 N ATOM 1008 CA GLN A 463 -27.589 -71.186 281.859 1.00 46.89 C ANISOU 1008 CA GLN A 463 5600 3817 8398 894 95 918 C ATOM 1009 C GLN A 463 -26.939 -71.782 283.104 1.00 47.68 C ANISOU 1009 C GLN A 463 5711 3960 8445 1156 331 1153 C ATOM 1010 O GLN A 463 -26.741 -72.998 283.147 1.00 50.22 O ANISOU 1010 O GLN A 463 6088 3965 9030 1189 264 1206 O ATOM 1011 CB GLN A 463 -26.817 -71.651 280.617 1.00 47.14 C ANISOU 1011 CB GLN A 463 5881 3705 8326 875 -156 461 C ATOM 1012 CG GLN A 463 -27.370 -71.139 279.284 1.00 51.49 C ANISOU 1012 CG GLN A 463 6487 4204 8871 635 -429 194 C ATOM 1013 CD GLN A 463 -28.764 -71.666 278.966 1.00 53.64 C ANISOU 1013 CD GLN A 463 6636 4082 9663 328 -683 405 C ATOM 1014 OE1 GLN A 463 -28.955 -72.860 278.750 1.00 56.09 O ANISOU 1014 OE1 GLN A 463 7060 3945 10307 246 -901 417 O ATOM 1015 NE2 GLN A 463 -29.747 -70.766 278.933 1.00 49.08 N ANISOU 1015 NE2 GLN A 463 5819 3650 9178 153 -680 600 N ATOM 1016 H GLN A 463 -27.010 -69.331 281.522 1.00 52.59 H ATOM 1017 HA GLN A 463 -28.487 -71.546 281.798 1.00 56.13 H ATOM 1018 HB2 GLN A 463 -25.899 -71.344 280.690 1.00 56.43 H ATOM 1019 HB3 GLN A 463 -26.834 -72.621 280.588 1.00 56.43 H ATOM 1020 HG2 GLN A 463 -27.417 -70.171 279.315 1.00 61.81 H ATOM 1021 HG3 GLN A 463 -26.776 -71.418 278.570 1.00 61.81 H ATOM 1022 HE21 GLN A 463 -29.576 -69.937 279.088 1.00 58.75 H ATOM 1023 HE22 GLN A 463 -30.551 -71.014 278.758 1.00 58.75 H ATOM 1024 N LYS A 464 -26.601 -70.968 284.110 1.00 54.12 N ANISOU 1024 N LYS A 464 6518 5130 8914 1347 575 1293 N ATOM 1025 CA LYS A 464 -26.046 -71.469 285.362 1.00 57.50 C ANISOU 1025 CA LYS A 464 6974 5622 9250 1599 778 1550 C ATOM 1026 C LYS A 464 -26.949 -71.219 286.561 1.00 59.56 C ANISOU 1026 C LYS A 464 7117 5959 9552 1714 1057 2021 C ATOM 1027 O LYS A 464 -26.590 -71.607 287.678 1.00 62.72 O ANISOU 1027 O LYS A 464 7562 6425 9843 1945 1242 2279 O ATOM 1028 CB LYS A 464 -24.668 -70.848 285.636 1.00 57.03 C ANISOU 1028 CB LYS A 464 7076 5908 8686 1775 784 1334 C ATOM 1029 CG LYS A 464 -23.530 -71.471 284.832 1.00 58.09 C ANISOU 1029 CG LYS A 464 7289 5989 8795 1814 629 1038 C ATOM 1030 CD LYS A 464 -22.211 -71.480 285.604 1.00 58.78 C ANISOU 1030 CD LYS A 464 7426 6331 8576 2046 685 1093 C ATOM 1031 CE LYS A 464 -22.144 -72.629 286.600 1.00 61.25 C ANISOU 1031 CE LYS A 464 7722 6465 9084 2229 814 1417 C ATOM 1032 NZ LYS A 464 -20.951 -72.570 287.509 1.00 59.78 N ANISOU 1032 NZ LYS A 464 7572 6554 8589 2448 845 1539 N ATOM 1033 H LYS A 464 -26.688 -70.113 284.087 1.00 64.97 H ATOM 1034 HA LYS A 464 -25.925 -72.428 285.283 1.00 69.02 H ATOM 1035 HB2 LYS A 464 -24.703 -69.904 285.416 1.00 68.47 H ATOM 1036 HB3 LYS A 464 -24.459 -70.957 286.577 1.00 68.47 H ATOM 1037 HG2 LYS A 464 -23.759 -72.388 284.616 1.00 69.74 H ATOM 1038 HG3 LYS A 464 -23.399 -70.959 284.018 1.00 69.74 H ATOM 1039 HD2 LYS A 464 -21.476 -71.577 284.979 1.00 70.56 H ATOM 1040 HD3 LYS A 464 -22.124 -70.648 286.096 1.00 70.56 H ATOM 1041 HE2 LYS A 464 -22.941 -72.611 287.153 1.00 73.52 H ATOM 1042 HE3 LYS A 464 -22.103 -73.466 286.110 1.00 73.52 H ATOM 1043 HZ1 LYS A 464 -20.960 -73.262 288.068 1.00 71.77 H ATOM 1044 HZ2 LYS A 464 -20.202 -72.596 287.029 1.00 71.77 H ATOM 1045 HZ3 LYS A 464 -20.966 -71.816 287.981 1.00 71.77 H ATOM 1046 N CYS A 465 -28.102 -70.593 286.368 1.00 51.09 N ANISOU 1046 N CYS A 465 5897 4894 8619 1597 1113 2171 N ATOM 1047 CA CYS A 465 -29.058 -70.380 287.448 1.00 51.89 C ANISOU 1047 CA CYS A 465 5863 5075 8776 1768 1442 2681 C ATOM 1048 C CYS A 465 -30.396 -70.013 286.811 1.00 52.60 C ANISOU 1048 C CYS A 465 5686 5074 9226 1558 1418 2859 C ATOM 1049 O CYS A 465 -30.542 -70.029 285.586 1.00 51.11 O ANISOU 1049 O CYS A 465 5449 4732 9239 1260 1104 2576 O ATOM 1050 CB CYS A 465 -28.561 -69.310 288.427 1.00 49.50 C ANISOU 1050 CB CYS A 465 5822 5132 7855 2080 1656 2656 C ATOM 1051 SG CYS A 465 -28.825 -67.592 287.883 1.00 46.78 S ANISOU 1051 SG CYS A 465 5607 5018 7148 2040 1613 2366 S ATOM 1052 H CYS A 465 -28.359 -70.277 285.611 1.00 61.33 H ATOM 1053 HA CYS A 465 -29.173 -71.208 287.940 1.00 62.29 H ATOM 1054 HB2 CYS A 465 -29.024 -69.424 289.271 1.00 59.31 H ATOM 1055 HB3 CYS A 465 -27.608 -69.431 288.560 1.00 59.31 H ATOM 1056 N ASP A 466 -31.378 -69.682 287.654 1.00 59.69 N ANISOU 1056 N ASP A 466 6411 6079 10188 1743 1759 3362 N ATOM 1057 CA ASP A 466 -32.741 -69.461 287.183 1.00 63.88 C ANISOU 1057 CA ASP A 466 6586 6529 11155 1569 1775 3690 C ATOM 1058 C ASP A 466 -32.960 -68.071 286.599 1.00 62.80 C ANISOU 1058 C ASP A 466 6533 6606 10724 1559 1748 3422 C ATOM 1059 O ASP A 466 -33.983 -67.850 285.944 1.00 64.27 O ANISOU 1059 O ASP A 466 6422 6721 11278 1358 1666 3610 O ATOM 1060 CB ASP A 466 -33.732 -69.678 288.327 1.00 68.48 C ANISOU 1060 CB ASP A 466 6887 7283 11850 1750 2187 4264 C ATOM 1061 CG ASP A 466 -33.807 -71.131 288.765 1.00 74.10 C ANISOU 1061 CG ASP A 466 7393 7811 12951 1637 2157 4526 C ATOM 1062 OD1 ASP A 466 -32.907 -71.917 288.394 1.00 73.54 O ANISOU 1062 OD1 ASP A 466 7512 7481 12950 1515 1878 4262 O ATOM 1063 OD2 ASP A 466 -34.765 -71.485 289.484 1.00 79.06 O ANISOU 1063 OD2 ASP A 466 7657 8559 13825 1706 2421 5003 O ATOM 1064 H ASP A 466 -31.277 -69.579 288.501 1.00 71.65 H ATOM 1065 HA ASP A 466 -32.941 -70.109 286.489 1.00 76.68 H ATOM 1066 HB2 ASP A 466 -33.456 -69.148 289.090 1.00 82.21 H ATOM 1067 HB3 ASP A 466 -34.617 -69.406 288.035 1.00 82.21 H ATOM 1068 N ARG A 467 -32.035 -67.139 286.817 1.00 57.22 N ANISOU 1068 N ARG A 467 6207 6139 9396 1749 1780 3022 N ATOM 1069 CA ARG A 467 -32.283 -65.745 286.473 1.00 56.85 C ANISOU 1069 CA ARG A 467 6272 6281 9048 1797 1804 2841 C ATOM 1070 C ARG A 467 -32.315 -65.538 284.959 1.00 52.07 C ANISOU 1070 C ARG A 467 5571 5581 8632 1406 1409 2478 C ATOM 1071 O ARG A 467 -31.541 -66.146 284.215 1.00 48.33 O ANISOU 1071 O ARG A 467 5172 4985 8205 1185 1098 2125 O ATOM 1072 CB ARG A 467 -31.213 -64.861 287.113 1.00 58.92 C ANISOU 1072 CB ARG A 467 7000 6762 8625 2053 1855 2518 C ATOM 1073 CG ARG A 467 -31.211 -64.911 288.645 1.00 65.27 C ANISOU 1073 CG ARG A 467 8003 7674 9123 2490 2230 2853 C ATOM 1074 CD ARG A 467 -30.545 -63.687 289.264 1.00 68.72 C ANISOU 1074 CD ARG A 467 8950 8296 8866 2755 2253 2586 C ATOM 1075 NE ARG A 467 -31.162 -62.448 288.800 1.00 73.37 N ANISOU 1075 NE ARG A 467 9602 8935 9339 2778 2281 2495 N ATOM 1076 CZ ARG A 467 -30.823 -61.232 289.218 1.00 76.97 C ANISOU 1076 CZ ARG A 467 10521 9483 9242 2995 2280 2279 C ATOM 1077 NH1 ARG A 467 -31.445 -60.164 288.727 1.00 76.65 N ANISOU 1077 NH1 ARG A 467 10515 9451 9157 3015 2309 2221 N ATOM 1078 NH2 ARG A 467 -29.867 -61.084 290.129 1.00 80.01 N ANISOU 1078 NH2 ARG A 467 11353 9924 9125 3184 2213 2133 N ATOM 1079 H ARG A 467 -31.261 -67.287 287.160 1.00 68.70 H ATOM 1080 HA ARG A 467 -33.145 -65.479 286.830 1.00 68.25 H ATOM 1081 HB2 ARG A 467 -30.340 -65.154 286.805 1.00 70.73 H ATOM 1082 HB3 ARG A 467 -31.365 -63.942 286.845 1.00 70.73 H ATOM 1083 HG2 ARG A 467 -32.127 -64.947 288.962 1.00 78.35 H ATOM 1084 HG3 ARG A 467 -30.726 -65.698 288.936 1.00 78.35 H ATOM 1085 HD2 ARG A 467 -30.634 -63.728 290.229 1.00 82.50 H ATOM 1086 HD3 ARG A 467 -29.608 -63.672 289.014 1.00 82.50 H ATOM 1087 HE ARG A 467 -31.789 -62.508 288.214 1.00 88.07 H ATOM 1088 HH11 ARG A 467 -32.065 -60.260 288.139 1.00 92.00 H ATOM 1089 HH12 ARG A 467 -31.229 -59.377 288.999 1.00 92.00 H ATOM 1090 HH21 ARG A 467 -29.464 -61.775 290.446 1.00 96.04 H ATOM 1091 HH22 ARG A 467 -29.650 -60.297 290.400 1.00 96.04 H ATOM 1092 N ALA A 468 -33.230 -64.675 284.504 1.00 52.89 N ANISOU 1092 N ALA A 468 5522 5747 8826 1361 1440 2589 N ATOM 1093 CA ALA A 468 -33.328 -64.290 283.098 1.00 50.47 C ANISOU 1093 CA ALA A 468 5155 5394 8628 1026 1080 2270 C ATOM 1094 C ALA A 468 -33.352 -62.770 282.968 1.00 49.78 C ANISOU 1094 C ALA A 468 5241 5524 8147 1155 1159 2106 C ATOM 1095 O ALA A 468 -33.667 -62.044 283.918 1.00 51.39 O ANISOU 1095 O ALA A 468 5556 5862 8107 1501 1505 2329 O ATOM 1096 CB ALA A 468 -34.578 -64.880 282.428 1.00 51.66 C ANISOU 1096 CB ALA A 468 4873 5334 9421 739 916 2621 C ATOM 1097 H ALA A 468 -33.816 -64.294 285.004 1.00 63.49 H ATOM 1098 HA ALA A 468 -32.549 -64.621 282.624 1.00 60.60 H ATOM 1099 HB1 ALA A 468 -34.601 -64.598 281.500 1.00 62.02 H ATOM 1100 HB2 ALA A 468 -34.537 -65.847 282.480 1.00 62.02 H ATOM 1101 HB3 ALA A 468 -35.366 -64.556 282.892 1.00 62.02 H ATOM 1102 N PHE A 469 -33.037 -62.293 281.763 1.00 46.26 N ANISOU 1102 N PHE A 469 4851 5095 7631 895 835 1722 N ATOM 1103 CA PHE A 469 -32.801 -60.874 281.532 1.00 45.38 C ANISOU 1103 CA PHE A 469 4954 5162 7127 972 838 1497 C ATOM 1104 C PHE A 469 -33.394 -60.447 280.190 1.00 45.02 C ANISOU 1104 C PHE A 469 4722 5096 7288 684 571 1410 C ATOM 1105 O PHE A 469 -33.588 -61.256 279.280 1.00 45.03 O ANISOU 1105 O PHE A 469 4551 4950 7607 390 283 1351 O ATOM 1106 CB PHE A 469 -31.296 -60.570 281.585 1.00 42.31 C ANISOU 1106 CB PHE A 469 4927 4885 6266 990 707 1064 C ATOM 1107 CG PHE A 469 -30.637 -61.012 282.872 1.00 41.81 C ANISOU 1107 CG PHE A 469 5060 4845 5982 1248 898 1141 C ATOM 1108 CD1 PHE A 469 -30.200 -62.316 283.032 1.00 42.59 C ANISOU 1108 CD1 PHE A 469 5076 4839 6267 1200 857 1166 C ATOM 1109 CD2 PHE A 469 -30.466 -60.123 283.918 1.00 41.68 C ANISOU 1109 CD2 PHE A 469 5354 4929 5553 1552 1093 1189 C ATOM 1110 CE1 PHE A 469 -29.608 -62.732 284.220 1.00 44.35 C ANISOU 1110 CE1 PHE A 469 5467 5095 6288 1441 1023 1271 C ATOM 1111 CE2 PHE A 469 -29.870 -60.526 285.100 1.00 43.93 C ANISOU 1111 CE2 PHE A 469 5856 5238 5597 1789 1228 1265 C ATOM 1112 CZ PHE A 469 -29.441 -61.837 285.252 1.00 45.04 C ANISOU 1112 CZ PHE A 469 5855 5311 5947 1728 1200 1323 C ATOM 1113 H PHE A 469 -32.955 -62.778 281.058 1.00 55.54 H ATOM 1114 HA PHE A 469 -33.237 -60.362 282.231 1.00 54.48 H ATOM 1115 HB2 PHE A 469 -30.856 -61.030 280.853 1.00 50.80 H ATOM 1116 HB3 PHE A 469 -31.166 -59.613 281.498 1.00 50.80 H ATOM 1117 HD1 PHE A 469 -30.314 -62.926 282.339 1.00 51.14 H ATOM 1118 HD2 PHE A 469 -30.755 -59.243 283.826 1.00 50.04 H ATOM 1119 HE1 PHE A 469 -29.317 -63.610 284.313 1.00 53.24 H ATOM 1120 HE2 PHE A 469 -29.761 -59.919 285.796 1.00 52.74 H ATOM 1121 HZ PHE A 469 -29.039 -62.109 286.045 1.00 54.07 H ATOM 1122 N SER A 470 -33.676 -59.147 280.077 1.00 47.64 N ANISOU 1122 N SER A 470 5138 5553 7411 785 646 1397 N ATOM 1123 CA SER A 470 -34.234 -58.586 278.849 1.00 48.43 C ANISOU 1123 CA SER A 470 5077 5664 7660 544 406 1340 C ATOM 1124 C SER A 470 -33.170 -58.189 277.837 1.00 44.59 C ANISOU 1124 C SER A 470 4812 5258 6871 339 98 855 C ATOM 1125 O SER A 470 -33.500 -57.973 276.665 1.00 43.72 O ANISOU 1125 O SER A 470 4589 5150 6873 103 -159 766 O ATOM 1126 CB SER A 470 -35.087 -57.353 279.166 1.00 49.73 C ANISOU 1126 CB SER A 470 5215 5914 7768 779 651 1597 C ATOM 1127 OG SER A 470 -34.273 -56.274 279.596 1.00 48.30 O ANISOU 1127 OG SER A 470 5454 5824 7074 978 730 1334 O ATOM 1128 H SER A 470 -33.552 -58.568 280.700 1.00 57.20 H ATOM 1129 HA SER A 470 -34.809 -59.249 278.434 1.00 58.14 H ATOM 1130 HB2 SER A 470 -35.568 -57.087 278.366 1.00 59.71 H ATOM 1131 HB3 SER A 470 -35.715 -57.576 279.871 1.00 59.71 H ATOM 1132 HG SER A 470 -34.750 -55.604 279.767 1.00 57.99 H ATOM 1133 N ARG A 471 -31.913 -58.081 278.268 1.00 40.41 N ANISOU 1133 N ARG A 471 4577 4812 5966 432 115 588 N ATOM 1134 CA ARG A 471 -30.820 -57.617 277.428 1.00 37.35 C ANISOU 1134 CA ARG A 471 4358 4547 5286 282 -119 220 C ATOM 1135 C ARG A 471 -29.603 -58.496 277.671 1.00 37.60 C ANISOU 1135 C ARG A 471 4505 4597 5185 298 -161 34 C ATOM 1136 O ARG A 471 -29.362 -58.961 278.790 1.00 39.07 O ANISOU 1136 O ARG A 471 4763 4747 5337 480 13 148 O ATOM 1137 CB ARG A 471 -30.463 -56.153 277.721 1.00 36.83 C ANISOU 1137 CB ARG A 471 4523 4595 4876 386 -78 156 C ATOM 1138 CG ARG A 471 -31.573 -55.169 277.403 1.00 37.44 C ANISOU 1138 CG ARG A 471 4518 4656 5052 410 -30 326 C ATOM 1139 CD ARG A 471 -31.475 -53.890 278.222 1.00 37.16 C ANISOU 1139 CD ARG A 471 4792 4621 4705 648 110 350 C ATOM 1140 NE ARG A 471 -30.104 -53.398 278.402 1.00 33.71 N ANISOU 1140 NE ARG A 471 4658 4246 3906 595 -58 89 N ATOM 1141 CZ ARG A 471 -29.802 -52.149 278.759 1.00 31.19 C ANISOU 1141 CZ ARG A 471 4660 3890 3300 679 -109 28 C ATOM 1142 NH1 ARG A 471 -30.757 -51.253 278.938 1.00 30.67 N ANISOU 1142 NH1 ARG A 471 4693 3728 3231 869 36 172 N ATOM 1143 NH2 ARG A 471 -28.544 -51.781 278.909 1.00 28.58 N ANISOU 1143 NH2 ARG A 471 4551 3601 2707 571 -328 -153 N ATOM 1144 H ARG A 471 -31.666 -58.278 279.068 1.00 48.52 H ATOM 1145 HA ARG A 471 -31.073 -57.692 276.495 1.00 44.84 H ATOM 1146 HB2 ARG A 471 -30.253 -56.066 278.664 1.00 44.22 H ATOM 1147 HB3 ARG A 471 -29.690 -55.908 277.189 1.00 44.22 H ATOM 1148 HG2 ARG A 471 -31.523 -54.929 276.465 1.00 44.96 H ATOM 1149 HG3 ARG A 471 -32.428 -55.584 277.596 1.00 44.96 H ATOM 1150 HD2 ARG A 471 -31.983 -53.195 277.776 1.00 44.61 H ATOM 1151 HD3 ARG A 471 -31.848 -54.055 279.102 1.00 44.61 H ATOM 1152 HE ARG A 471 -29.462 -53.967 278.346 1.00 40.48 H ATOM 1153 HH11 ARG A 471 -31.582 -51.479 278.844 1.00 36.66 H ATOM 1154 HH12 ARG A 471 -30.554 -50.448 279.162 1.00 36.66 H ATOM 1155 HH21 ARG A 471 -27.911 -52.352 278.789 1.00 34.16 H ATOM 1156 HH22 ARG A 471 -28.356 -50.971 279.129 1.00 34.16 H ATOM 1157 N SER A 472 -28.835 -58.705 276.606 1.00 37.58 N ANISOU 1157 N SER A 472 4523 4667 5089 142 -373 -227 N ATOM 1158 CA SER A 472 -27.657 -59.557 276.675 1.00 37.95 C ANISOU 1158 CA SER A 472 4647 4748 5024 191 -397 -380 C ATOM 1159 C SER A 472 -26.576 -58.960 277.558 1.00 33.55 C ANISOU 1159 C SER A 472 4237 4349 4161 313 -330 -387 C ATOM 1160 O SER A 472 -25.801 -59.707 278.165 1.00 35.43 O ANISOU 1160 O SER A 472 4512 4593 4358 423 -277 -382 O ATOM 1161 CB SER A 472 -27.096 -59.794 275.267 1.00 42.65 C ANISOU 1161 CB SER A 472 5254 5416 5533 70 -591 -627 C ATOM 1162 OG SER A 472 -26.531 -58.603 274.733 1.00 43.48 O ANISOU 1162 OG SER A 472 5397 5751 5373 8 -659 -705 O ATOM 1163 H SER A 472 -28.976 -58.362 275.830 1.00 45.12 H ATOM 1164 HA SER A 472 -27.909 -60.416 277.048 1.00 45.57 H ATOM 1165 HB2 SER A 472 -26.407 -60.476 275.313 1.00 51.20 H ATOM 1166 HB3 SER A 472 -27.815 -60.089 274.687 1.00 51.20 H ATOM 1167 HG SER A 472 -26.228 -58.749 273.963 1.00 52.21 H ATOM 1168 N ASP A 473 -26.479 -57.630 277.636 1.00 32.62 N ANISOU 1168 N ASP A 473 4221 4338 3836 286 -372 -387 N ATOM 1169 CA ASP A 473 -25.424 -57.053 278.459 1.00 31.44 C ANISOU 1169 CA ASP A 473 4246 4292 3408 349 -411 -389 C ATOM 1170 C ASP A 473 -25.725 -57.234 279.939 1.00 31.09 C ANISOU 1170 C ASP A 473 4367 4134 3312 570 -243 -236 C ATOM 1171 O ASP A 473 -24.797 -57.424 280.736 1.00 32.04 O ANISOU 1171 O ASP A 473 4609 4304 3261 646 -282 -223 O ATOM 1172 CB ASP A 473 -25.202 -55.573 278.115 1.00 34.67 C ANISOU 1172 CB ASP A 473 4767 4784 3622 231 -567 -431 C ATOM 1173 CG ASP A 473 -26.440 -54.714 278.294 1.00 34.91 C ANISOU 1173 CG ASP A 473 4895 4684 3687 293 -480 -348 C ATOM 1174 OD1 ASP A 473 -27.566 -55.203 278.120 1.00 37.05 O ANISOU 1174 OD1 ASP A 473 5017 4861 4199 342 -336 -253 O ATOM 1175 OD2 ASP A 473 -26.278 -53.520 278.587 1.00 35.58 O ANISOU 1175 OD2 ASP A 473 5202 4746 3571 293 -574 -354 O ATOM 1176 H ASP A 473 -26.991 -57.064 277.239 1.00 39.17 H ATOM 1177 HA ASP A 473 -24.597 -57.523 278.271 1.00 37.76 H ATOM 1178 HB2 ASP A 473 -24.508 -55.218 278.692 1.00 41.63 H ATOM 1179 HB3 ASP A 473 -24.925 -55.505 277.188 1.00 41.63 H ATOM 1180 N HIS A 474 -27.004 -57.212 280.319 1.00 28.57 N ANISOU 1180 N HIS A 474 4037 3680 3138 693 -49 -77 N ATOM 1181 CA HIS A 474 -27.378 -57.546 281.692 1.00 30.18 C ANISOU 1181 CA HIS A 474 4378 3797 3293 964 182 123 C ATOM 1182 C HIS A 474 -26.956 -58.968 282.045 1.00 31.08 C ANISOU 1182 C HIS A 474 4369 3883 3557 1004 240 181 C ATOM 1183 O HIS A 474 -26.422 -59.219 283.132 1.00 31.62 O ANISOU 1183 O HIS A 474 4611 3964 3439 1178 304 255 O ATOM 1184 CB HIS A 474 -28.885 -57.380 281.871 1.00 31.63 C ANISOU 1184 CB HIS A 474 4464 3877 3679 1106 430 370 C ATOM 1185 CG HIS A 474 -29.347 -55.956 281.862 1.00 31.83 C ANISOU 1185 CG HIS A 474 4686 3898 3511 1189 447 365 C ATOM 1186 ND1 HIS A 474 -30.672 -55.609 281.720 1.00 33.12 N ANISOU 1186 ND1 HIS A 474 4703 4005 3876 1299 645 595 N ATOM 1187 CD2 HIS A 474 -28.663 -54.791 281.977 1.00 31.45 C ANISOU 1187 CD2 HIS A 474 4971 3869 3110 1181 274 185 C ATOM 1188 CE1 HIS A 474 -30.786 -54.293 281.751 1.00 41.86 C ANISOU 1188 CE1 HIS A 474 6071 5095 4737 1396 627 533 C ATOM 1189 NE2 HIS A 474 -29.579 -53.775 281.900 1.00 32.41 N ANISOU 1189 NE2 HIS A 474 5188 3921 3204 1309 382 271 N ATOM 1190 H HIS A 474 -27.665 -57.010 279.808 1.00 34.27 H ATOM 1191 HA HIS A 474 -26.931 -56.937 282.301 1.00 36.20 H ATOM 1192 HB2 HIS A 474 -29.338 -57.842 281.147 1.00 37.99 H ATOM 1193 HB3 HIS A 474 -29.143 -57.769 282.721 1.00 37.99 H ATOM 1194 HD2 HIS A 474 -27.744 -54.700 282.083 1.00 37.60 H ATOM 1195 HE1 HIS A 474 -31.578 -53.813 281.673 1.00 50.26 H ATOM 1196 HE2 HIS A 474 -29.399 -52.935 281.948 1.00 38.75 H ATOM 1197 N LEU A 475 -27.190 -59.920 281.138 1.00 34.88 N ANISOU 1197 N LEU A 475 4592 4300 4360 852 191 147 N ATOM 1198 CA LEU A 475 -26.810 -61.302 281.419 1.00 37.42 C ANISOU 1198 CA LEU A 475 4830 4539 4849 900 232 196 C ATOM 1199 C LEU A 475 -25.294 -61.444 281.508 1.00 37.30 C ANISOU 1199 C LEU A 475 4912 4668 4591 916 108 39 C ATOM 1200 O LEU A 475 -24.766 -62.042 282.456 1.00 36.86 O ANISOU 1200 O LEU A 475 4921 4611 4474 1070 183 148 O ATOM 1201 CB LEU A 475 -27.380 -62.232 280.348 1.00 38.70 C ANISOU 1201 CB LEU A 475 4785 4536 5384 727 135 153 C ATOM 1202 CG LEU A 475 -26.926 -63.692 280.407 1.00 41.63 C ANISOU 1202 CG LEU A 475 5120 4755 5942 762 121 148 C ATOM 1203 CD1 LEU A 475 -27.285 -64.326 281.744 1.00 43.50 C ANISOU 1203 CD1 LEU A 475 5332 4892 6303 947 346 469 C ATOM 1204 CD2 LEU A 475 -27.543 -64.468 279.275 1.00 45.14 C ANISOU 1204 CD2 LEU A 475 5465 4974 6713 573 -59 61 C ATOM 1205 H LEU A 475 -27.559 -59.795 280.372 1.00 41.88 H ATOM 1206 HA LEU A 475 -27.186 -61.564 282.274 1.00 44.93 H ATOM 1207 HB2 LEU A 475 -28.347 -62.228 280.426 1.00 46.47 H ATOM 1208 HB3 LEU A 475 -27.126 -61.886 279.478 1.00 46.47 H ATOM 1209 HG LEU A 475 -25.962 -63.728 280.306 1.00 49.98 H ATOM 1210 HD11 LEU A 475 -26.983 -65.248 281.747 1.00 52.22 H ATOM 1211 HD12 LEU A 475 -26.846 -63.832 282.455 1.00 52.22 H ATOM 1212 HD13 LEU A 475 -28.247 -64.292 281.862 1.00 52.22 H ATOM 1213 HD21 LEU A 475 -27.246 -65.390 279.326 1.00 54.20 H ATOM 1214 HD22 LEU A 475 -28.509 -64.427 279.353 1.00 54.20 H ATOM 1215 HD23 LEU A 475 -27.262 -64.076 278.433 1.00 54.20 H ATOM 1216 N ALA A 476 -24.577 -60.884 280.532 1.00 37.71 N ANISOU 1216 N ALA A 476 4948 4866 4513 767 -77 -165 N ATOM 1217 CA ALA A 476 -23.121 -60.965 280.538 1.00 39.24 C ANISOU 1217 CA ALA A 476 5150 5237 4522 780 -188 -231 C ATOM 1218 C ALA A 476 -22.531 -60.466 281.853 1.00 42.18 C ANISOU 1218 C ALA A 476 5704 5681 4643 881 -220 -108 C ATOM 1219 O ALA A 476 -21.585 -61.061 282.385 1.00 42.14 O ANISOU 1219 O ALA A 476 5682 5746 4583 968 -248 -38 O ATOM 1220 CB ALA A 476 -22.565 -60.176 279.358 1.00 37.49 C ANISOU 1220 CB ALA A 476 4862 5196 4187 614 -350 -378 C ATOM 1221 H ALA A 476 -24.908 -60.456 279.863 1.00 45.28 H ATOM 1222 HA ALA A 476 -22.858 -61.892 280.427 1.00 47.12 H ATOM 1223 HB1 ALA A 476 -21.597 -60.235 279.368 1.00 45.02 H ATOM 1224 HB2 ALA A 476 -22.911 -60.554 278.535 1.00 45.02 H ATOM 1225 HB3 ALA A 476 -22.842 -59.250 279.440 1.00 45.02 H ATOM 1226 N LEU A 477 -23.081 -59.383 282.409 1.00 43.05 N ANISOU 1226 N LEU A 477 6024 5754 4578 894 -233 -77 N ATOM 1227 CA LEU A 477 -22.596 -58.902 283.699 1.00 46.95 C ANISOU 1227 CA LEU A 477 6805 6261 4772 1014 -308 9 C ATOM 1228 C LEU A 477 -22.886 -59.906 284.806 1.00 48.76 C ANISOU 1228 C LEU A 477 7094 6402 5032 1261 -93 186 C ATOM 1229 O LEU A 477 -22.006 -60.238 285.602 1.00 50.42 O ANISOU 1229 O LEU A 477 7397 6674 5087 1340 -185 261 O ATOM 1230 CB LEU A 477 -23.222 -57.555 284.045 1.00 50.77 C ANISOU 1230 CB LEU A 477 7597 6663 5029 1042 -348 -19 C ATOM 1231 CG LEU A 477 -22.492 -56.288 283.611 1.00 52.76 C ANISOU 1231 CG LEU A 477 7970 6982 5096 821 -681 -135 C ATOM 1232 CD1 LEU A 477 -23.137 -55.105 284.307 1.00 53.65 C ANISOU 1232 CD1 LEU A 477 8520 6928 4936 948 -702 -155 C ATOM 1233 CD2 LEU A 477 -20.992 -56.328 283.914 1.00 54.00 C ANISOU 1233 CD2 LEU A 477 8116 7274 5125 697 -987 -98 C ATOM 1234 H LEU A 477 -23.721 -58.921 282.067 1.00 51.69 H ATOM 1235 HA LEU A 477 -21.635 -58.781 283.649 1.00 56.37 H ATOM 1236 HB2 LEU A 477 -24.103 -57.524 283.642 1.00 60.95 H ATOM 1237 HB3 LEU A 477 -23.314 -57.509 285.010 1.00 60.95 H ATOM 1238 HG LEU A 477 -22.603 -56.171 282.654 1.00 63.34 H ATOM 1239 HD11 LEU A 477 -22.679 -54.293 284.037 1.00 64.40 H ATOM 1240 HD12 LEU A 477 -24.071 -55.059 284.051 1.00 64.40 H ATOM 1241 HD13 LEU A 477 -23.061 -55.224 285.266 1.00 64.40 H ATOM 1242 HD21 LEU A 477 -20.588 -55.498 283.616 1.00 64.82 H ATOM 1243 HD22 LEU A 477 -20.866 -56.432 284.871 1.00 64.82 H ATOM 1244 HD23 LEU A 477 -20.595 -57.077 283.444 1.00 64.82 H ATOM 1245 N HIS A 478 -24.125 -60.392 284.874 1.00 45.16 N ANISOU 1245 N HIS A 478 6557 5806 4795 1376 181 304 N ATOM 1246 CA HIS A 478 -24.478 -61.400 285.865 1.00 52.66 C ANISOU 1246 CA HIS A 478 7510 6672 5828 1605 415 539 C ATOM 1247 C HIS A 478 -23.599 -62.636 285.732 1.00 48.13 C ANISOU 1247 C HIS A 478 6750 6112 5424 1576 360 546 C ATOM 1248 O HIS A 478 -23.101 -63.165 286.737 1.00 36.64 O ANISOU 1248 O HIS A 478 5393 4676 3850 1745 400 694 O ATOM 1249 CB HIS A 478 -25.949 -61.775 285.708 1.00 62.32 C ANISOU 1249 CB HIS A 478 8551 7748 7378 1662 686 729 C ATOM 1250 CG HIS A 478 -26.345 -63.007 286.457 1.00 72.81 C ANISOU 1250 CG HIS A 478 9764 8972 8930 1830 917 1024 C ATOM 1251 ND1 HIS A 478 -26.691 -62.988 287.790 1.00 77.74 N ANISOU 1251 ND1 HIS A 478 10583 9607 9349 2145 1165 1298 N ATOM 1252 CD2 HIS A 478 -26.460 -64.295 286.057 1.00 76.02 C ANISOU 1252 CD2 HIS A 478 9906 9237 9743 1738 931 1105 C ATOM 1253 CE1 HIS A 478 -26.999 -64.212 288.180 1.00 80.06 C ANISOU 1253 CE1 HIS A 478 10680 9798 9941 2223 1339 1573 C ATOM 1254 NE2 HIS A 478 -26.865 -65.025 287.147 1.00 78.65 N ANISOU 1254 NE2 HIS A 478 10228 9501 10154 1963 1180 1455 N ATOM 1255 H HIS A 478 -24.774 -60.155 284.361 1.00 54.22 H ATOM 1256 HA HIS A 478 -24.352 -61.032 286.754 1.00 63.22 H ATOM 1257 HB2 HIS A 478 -26.495 -61.042 286.035 1.00 74.81 H ATOM 1258 HB3 HIS A 478 -26.134 -61.928 284.768 1.00 74.81 H ATOM 1259 HD1 HIS A 478 -26.705 -62.289 288.290 1.00 93.32 H ATOM 1260 HD2 HIS A 478 -26.292 -64.624 285.204 1.00 91.25 H ATOM 1261 HE1 HIS A 478 -27.262 -64.460 289.036 1.00 96.10 H ATOM 1262 N MET A 479 -23.398 -63.113 284.499 1.00 43.85 N ANISOU 1262 N MET A 479 5974 5553 5135 1398 273 391 N ATOM 1263 CA MET A 479 -22.655 -64.351 284.285 1.00 44.59 C ANISOU 1263 CA MET A 479 5926 5615 5402 1434 262 391 C ATOM 1264 C MET A 479 -21.264 -64.273 284.898 1.00 43.73 C ANISOU 1264 C MET A 479 5880 5699 5036 1509 131 428 C ATOM 1265 O MET A 479 -20.726 -65.294 285.343 1.00 43.49 O ANISOU 1265 O MET A 479 5791 5640 5093 1647 184 549 O ATOM 1266 CB MET A 479 -22.564 -64.658 282.786 1.00 44.39 C ANISOU 1266 CB MET A 479 5748 5554 5565 1282 169 169 C ATOM 1267 CG MET A 479 -22.016 -66.054 282.434 1.00 49.88 C ANISOU 1267 CG MET A 479 6360 6127 6464 1378 193 146 C ATOM 1268 SD MET A 479 -23.007 -67.463 283.012 1.00 53.03 S ANISOU 1268 SD MET A 479 6730 6159 7261 1461 344 359 S ATOM 1269 CE MET A 479 -24.531 -67.180 282.108 1.00 53.11 C ANISOU 1269 CE MET A 479 6672 5970 7536 1227 287 302 C ATOM 1270 H MET A 479 -23.681 -62.740 283.777 1.00 52.65 H ATOM 1271 HA MET A 479 -23.139 -65.079 284.705 1.00 53.54 H ATOM 1272 HB2 MET A 479 -23.452 -64.588 282.403 1.00 53.30 H ATOM 1273 HB3 MET A 479 -21.980 -64.003 282.372 1.00 53.30 H ATOM 1274 HG2 MET A 479 -21.951 -66.123 281.468 1.00 59.88 H ATOM 1275 HG3 MET A 479 -21.132 -66.143 282.823 1.00 59.88 H ATOM 1276 HE1 MET A 479 -25.164 -67.880 282.331 1.00 63.75 H ATOM 1277 HE2 MET A 479 -24.891 -66.315 282.360 1.00 63.75 H ATOM 1278 HE3 MET A 479 -24.341 -67.195 281.157 1.00 63.75 H ATOM 1279 N LYS A 480 -20.679 -63.073 284.958 1.00 51.34 N ANISOU 1279 N LYS A 480 6957 6841 5710 1408 -72 359 N ATOM 1280 CA LYS A 480 -19.367 -62.917 285.579 1.00 53.64 C ANISOU 1280 CA LYS A 480 7285 7311 5785 1426 -279 451 C ATOM 1281 C LYS A 480 -19.385 -63.322 287.046 1.00 55.90 C ANISOU 1281 C LYS A 480 7776 7544 5918 1634 -222 652 C ATOM 1282 O LYS A 480 -18.373 -63.808 287.567 1.00 57.40 O ANISOU 1282 O LYS A 480 7915 7840 6053 1701 -335 789 O ATOM 1283 CB LYS A 480 -18.885 -61.470 285.437 1.00 55.65 C ANISOU 1283 CB LYS A 480 7659 7698 5787 1228 -572 375 C ATOM 1284 CG LYS A 480 -18.430 -61.113 284.020 1.00 57.51 C ANISOU 1284 CG LYS A 480 7637 8074 6142 1033 -661 257 C ATOM 1285 CD LYS A 480 -17.866 -59.701 283.937 1.00 62.57 C ANISOU 1285 CD LYS A 480 8365 8831 6580 807 -986 252 C ATOM 1286 CE LYS A 480 -17.003 -59.519 282.687 1.00 64.98 C ANISOU 1286 CE LYS A 480 8331 9359 6998 652 -1072 269 C ATOM 1287 NZ LYS A 480 -17.630 -60.065 281.443 1.00 64.32 N ANISOU 1287 NZ LYS A 480 8090 9249 7099 702 -815 109 N ATOM 1288 H LYS A 480 -21.018 -62.345 284.650 1.00 61.64 H ATOM 1289 HA LYS A 480 -18.732 -63.489 285.120 1.00 64.39 H ATOM 1290 HB2 LYS A 480 -19.611 -60.873 285.676 1.00 66.81 H ATOM 1291 HB3 LYS A 480 -18.133 -61.331 286.035 1.00 66.81 H ATOM 1292 HG2 LYS A 480 -17.736 -61.732 283.744 1.00 69.04 H ATOM 1293 HG3 LYS A 480 -19.188 -61.171 283.419 1.00 69.04 H ATOM 1294 HD2 LYS A 480 -18.597 -59.065 283.897 1.00 75.12 H ATOM 1295 HD3 LYS A 480 -17.313 -59.530 284.715 1.00 75.12 H ATOM 1296 HE2 LYS A 480 -16.847 -58.571 282.550 1.00 78.00 H ATOM 1297 HE3 LYS A 480 -16.158 -59.976 282.819 1.00 78.00 H ATOM 1298 HZ1 LYS A 480 -17.090 -59.933 280.747 1.00 77.21 H ATOM 1299 HZ2 LYS A 480 -17.777 -60.938 281.534 1.00 77.21 H ATOM 1300 HZ3 LYS A 480 -18.405 -59.655 281.288 1.00 77.21 H ATOM 1301 N ARG A 481 -20.520 -63.151 287.723 1.00 53.71 N ANISOU 1301 N ARG A 481 7716 7125 5568 1769 -29 714 N ATOM 1302 CA ARG A 481 -20.621 -63.469 289.144 1.00 59.50 C ANISOU 1302 CA ARG A 481 8693 7826 6089 2020 67 930 C ATOM 1303 C ARG A 481 -20.731 -64.965 289.419 1.00 61.68 C ANISOU 1303 C ARG A 481 8766 8014 6657 2175 298 1135 C ATOM 1304 O ARG A 481 -20.810 -65.358 290.591 1.00 59.39 O ANISOU 1304 O ARG A 481 8645 7708 6211 2403 409 1362 O ATOM 1305 CB ARG A 481 -21.819 -62.736 289.751 1.00 63.17 C ANISOU 1305 CB ARG A 481 9462 8191 6349 2183 260 974 C ATOM 1306 CG ARG A 481 -21.836 -61.249 289.402 1.00 64.82 C ANISOU 1306 CG ARG A 481 9906 8419 6303 2044 42 758 C ATOM 1307 CD ARG A 481 -23.102 -60.543 289.846 1.00 67.58 C ANISOU 1307 CD ARG A 481 10536 8656 6484 2263 295 805 C ATOM 1308 NE ARG A 481 -22.995 -60.014 291.208 1.00 73.33 N ANISOU 1308 NE ARG A 481 11809 9361 6690 2548 259 873 N ATOM 1309 CZ ARG A 481 -23.734 -60.404 292.247 1.00 77.33 C ANISOU 1309 CZ ARG A 481 12514 9829 7039 2933 610 1120 C ATOM 1310 NH1 ARG A 481 -24.672 -61.339 292.121 1.00 78.14 N ANISOU 1310 NH1 ARG A 481 12253 9904 7531 3045 1021 1376 N ATOM 1311 NH2 ARG A 481 -23.535 -59.843 293.429 1.00 80.93 N ANISOU 1311 NH2 ARG A 481 13408 10232 7110 3111 529 1051 N ATOM 1312 H ARG A 481 -21.249 -62.850 287.379 1.00 64.49 H ATOM 1313 HA ARG A 481 -19.822 -63.147 289.590 1.00 71.43 H ATOM 1314 HB2 ARG A 481 -22.637 -63.133 289.414 1.00 75.83 H ATOM 1315 HB3 ARG A 481 -21.783 -62.817 290.717 1.00 75.83 H ATOM 1316 HG2 ARG A 481 -21.084 -60.816 289.836 1.00 77.81 H ATOM 1317 HG3 ARG A 481 -21.762 -61.152 288.439 1.00 77.81 H ATOM 1318 HD2 ARG A 481 -23.279 -59.801 289.247 1.00 81.12 H ATOM 1319 HD3 ARG A 481 -23.841 -61.172 289.824 1.00 81.12 H ATOM 1320 HE ARG A 481 -22.408 -59.401 291.349 1.00 88.02 H ATOM 1321 HH11 ARG A 481 -24.810 -61.710 291.357 1.00 93.79 H ATOM 1322 HH12 ARG A 481 -25.138 -61.575 292.804 1.00 93.79 H ATOM 1323 HH21 ARG A 481 -22.932 -59.236 293.521 1.00 97.15 H ATOM 1324 HH22 ARG A 481 -24.007 -60.086 294.105 1.00 97.15 H ATOM 1325 N HIS A 482 -20.734 -65.806 288.382 1.00 41.28 N ANISOU 1325 N HIS A 482 5869 5348 4468 2075 359 1064 N ATOM 1326 CA HIS A 482 -20.733 -67.253 288.546 1.00 50.14 C ANISOU 1326 CA HIS A 482 6827 6325 5897 2202 520 1236 C ATOM 1327 C HIS A 482 -19.333 -67.850 288.545 1.00 45.68 C ANISOU 1327 C HIS A 482 6154 5881 5322 2255 375 1262 C ATOM 1328 O HIS A 482 -19.191 -69.053 288.786 1.00 47.19 O ANISOU 1328 O HIS A 482 6247 5944 5738 2399 494 1419 O ATOM 1329 CB HIS A 482 -21.540 -67.922 287.428 1.00 60.28 C ANISOU 1329 CB HIS A 482 7912 7378 7615 2085 622 1137 C ATOM 1330 CG HIS A 482 -23.022 -67.856 287.621 1.00 67.80 C ANISOU 1330 CG HIS A 482 8856 8163 8743 2077 818 1287 C ATOM 1331 ND1 HIS A 482 -23.711 -68.764 288.393 1.00 72.18 N ANISOU 1331 ND1 HIS A 482 9354 8545 9526 2219 1036 1621 N ATOM 1332 CD2 HIS A 482 -23.949 -67.005 287.124 1.00 68.67 C ANISOU 1332 CD2 HIS A 482 8961 8263 8867 1954 838 1207 C ATOM 1333 CE1 HIS A 482 -24.998 -68.470 288.373 1.00 72.66 C ANISOU 1333 CE1 HIS A 482 9345 8515 9748 2183 1192 1771 C ATOM 1334 NE2 HIS A 482 -25.169 -67.406 287.610 1.00 69.24 N ANISOU 1334 NE2 HIS A 482 8946 8176 9185 2031 1074 1516 N ATOM 1335 H HIS A 482 -20.737 -65.552 287.561 1.00 49.57 H ATOM 1336 HA HIS A 482 -21.152 -67.475 289.392 1.00 60.19 H ATOM 1337 HB2 HIS A 482 -21.332 -67.483 286.588 1.00 72.37 H ATOM 1338 HB3 HIS A 482 -21.290 -68.858 287.380 1.00 72.37 H ATOM 1339 HD1 HIS A 482 -23.358 -69.419 288.824 1.00 86.65 H ATOM 1340 HD2 HIS A 482 -23.789 -66.280 286.564 1.00 82.43 H ATOM 1341 HE1 HIS A 482 -25.669 -68.933 288.820 1.00 87.22 H ATOM 1342 N PHE A 483 -18.309 -67.050 288.275 1.00 68.34 N ANISOU 1342 N PHE A 483 9010 8985 7971 2144 121 1157 N ATOM 1343 CA PHE A 483 -16.959 -67.567 288.124 1.00 68.40 C ANISOU 1343 CA PHE A 483 8824 9148 8018 2198 -1 1239 C ATOM 1344 C PHE A 483 -15.974 -66.775 288.985 1.00 71.38 C ANISOU 1344 C PHE A 483 9298 9767 8056 2153 -310 1379 C ATOM 1345 O PHE A 483 -15.260 -65.899 288.494 1.00 70.97 O ANISOU 1345 O PHE A 483 9162 9904 7902 1967 -561 1318 O ATOM 1346 CB PHE A 483 -16.541 -67.526 286.648 1.00 65.79 C ANISOU 1346 CB PHE A 483 8269 8882 7847 2097 -18 1041 C ATOM 1347 CG PHE A 483 -17.451 -68.319 285.728 1.00 62.43 C ANISOU 1347 CG PHE A 483 7817 8179 7724 2122 192 870 C ATOM 1348 CD1 PHE A 483 -17.273 -69.685 285.560 1.00 62.56 C ANISOU 1348 CD1 PHE A 483 7768 8006 7998 2317 333 922 C ATOM 1349 CD2 PHE A 483 -18.476 -67.696 285.028 1.00 58.18 C ANISOU 1349 CD2 PHE A 483 7344 7542 7219 1944 204 668 C ATOM 1350 CE1 PHE A 483 -18.103 -70.417 284.716 1.00 60.50 C ANISOU 1350 CE1 PHE A 483 7548 7426 8012 2307 435 754 C ATOM 1351 CE2 PHE A 483 -19.308 -68.425 284.180 1.00 55.71 C ANISOU 1351 CE2 PHE A 483 7022 6955 7193 1925 308 529 C ATOM 1352 CZ PHE A 483 -19.120 -69.787 284.028 1.00 56.99 C ANISOU 1352 CZ PHE A 483 7160 6893 7599 2093 399 561 C ATOM 1353 H PHE A 483 -18.372 -66.198 288.173 1.00 82.03 H ATOM 1354 HA PHE A 483 -16.939 -68.491 288.417 1.00 82.11 H ATOM 1355 HB2 PHE A 483 -16.548 -66.603 286.348 1.00 78.98 H ATOM 1356 HB3 PHE A 483 -15.646 -67.891 286.567 1.00 78.98 H ATOM 1357 HD1 PHE A 483 -16.591 -70.118 286.021 1.00 75.10 H ATOM 1358 HD2 PHE A 483 -18.610 -66.781 285.126 1.00 69.84 H ATOM 1359 HE1 PHE A 483 -17.972 -71.332 284.615 1.00 72.62 H ATOM 1360 HE2 PHE A 483 -19.992 -67.996 283.719 1.00 66.89 H ATOM 1361 HZ PHE A 483 -19.674 -70.275 283.463 1.00 68.41 H TER 1362 PHE A 483 ATOM 1363 O5' DG B 1 -31.765 -56.086 286.091 1.00 53.63 O ANISOU 1363 O5' DG B 1 9680 6489 4209 612 115 879 O ATOM 1364 C5' DG B 1 -32.624 -55.687 287.172 1.00 49.65 C ANISOU 1364 C5' DG B 1 9237 6045 3582 484 270 879 C ATOM 1365 C4' DG B 1 -33.309 -54.355 286.874 1.00 40.74 C ANISOU 1365 C4' DG B 1 7856 5111 2513 402 359 809 C ATOM 1366 O4' DG B 1 -32.365 -53.260 287.036 1.00 38.03 O ANISOU 1366 O4' DG B 1 7360 4889 2200 614 180 728 O ATOM 1367 C3' DG B 1 -33.862 -54.186 285.457 1.00 37.72 C ANISOU 1367 C3' DG B 1 7216 4769 2346 279 411 786 C ATOM 1368 O3' DG B 1 -35.010 -53.363 285.505 1.00 37.87 O ANISOU 1368 O3' DG B 1 6997 4932 2460 119 568 706 O ATOM 1369 C2' DG B 1 -32.704 -53.533 284.710 1.00 38.17 C ANISOU 1369 C2' DG B 1 7054 4881 2566 479 189 733 C ATOM 1370 C1' DG B 1 -32.133 -52.612 285.780 1.00 37.63 C ANISOU 1370 C1' DG B 1 6972 4908 2417 625 102 665 C ATOM 1371 N9 DG B 1 -30.702 -52.353 285.693 1.00 37.00 N ANISOU 1371 N9 DG B 1 6847 4854 2357 850 -124 617 N ATOM 1372 C8 DG B 1 -29.698 -53.268 285.473 1.00 38.12 C ANISOU 1372 C8 DG B 1 7129 4906 2447 1001 -269 649 C ATOM 1373 N7 DG B 1 -28.503 -52.745 285.525 1.00 36.84 N ANISOU 1373 N7 DG B 1 6835 4833 2329 1180 -453 551 N ATOM 1374 C5 DG B 1 -28.734 -51.406 285.815 1.00 36.67 C ANISOU 1374 C5 DG B 1 6621 4947 2365 1141 -428 465 C ATOM 1375 C6 DG B 1 -27.823 -50.338 285.991 1.00 34.68 C ANISOU 1375 C6 DG B 1 6169 4826 2182 1245 -560 327 C ATOM 1376 O6 DG B 1 -26.595 -50.361 285.937 1.00 33.31 O ANISOU 1376 O6 DG B 1 5946 4711 1999 1406 -736 246 O ATOM 1377 N1 DG B 1 -28.473 -49.148 286.265 1.00 34.85 N ANISOU 1377 N1 DG B 1 6034 4917 2292 1139 -467 263 N ATOM 1378 C2 DG B 1 -29.828 -49.003 286.382 1.00 35.76 C ANISOU 1378 C2 DG B 1 6157 5008 2423 979 -279 311 C ATOM 1379 N2 DG B 1 -30.269 -47.772 286.670 1.00 35.31 N ANISOU 1379 N2 DG B 1 5935 5024 2455 931 -226 218 N ATOM 1380 N3 DG B 1 -30.693 -49.987 286.212 1.00 36.65 N ANISOU 1380 N3 DG B 1 6418 5033 2473 871 -150 424 N ATOM 1381 C4 DG B 1 -30.077 -51.156 285.930 1.00 36.60 C ANISOU 1381 C4 DG B 1 6593 4931 2382 949 -230 502 C ATOM 1382 H5' DG B 1 -32.096 -55.598 287.980 1.00 59.61 H ATOM 1383 H5'' DG B 1 -33.300 -56.368 287.308 1.00 59.61 H ATOM 1384 H4' DG B 1 -34.035 -54.234 287.506 1.00 48.92 H ATOM 1385 H3' DG B 1 -34.074 -55.049 285.069 1.00 45.29 H ATOM 1386 H2' DG B 1 -32.049 -54.195 284.438 1.00 45.83 H ATOM 1387 H2'' DG B 1 -33.025 -53.024 283.950 1.00 45.83 H ATOM 1388 H1' DG B 1 -32.612 -51.768 285.764 1.00 45.18 H ATOM 1389 H8 DG B 1 -29.855 -54.167 285.296 1.00 45.77 H ATOM 1390 H1 DG B 1 -27.987 -48.451 286.396 1.00 41.85 H ATOM 1391 H21 DG B 1 -31.112 -47.624 286.745 1.00 42.39 H ATOM 1392 H22 DG B 1 -29.708 -47.129 286.781 1.00 42.39 H ATOM 1393 HO5' DG B 1 -31.359 -56.821 286.127 1.00 64.39 H ATOM 1394 P DA B 2 -35.878 -53.039 284.198 1.00 38.54 P ANISOU 1394 P DA B 2 6753 5103 2788 -21 632 649 P ATOM 1395 OP1 DA B 2 -37.255 -52.868 284.727 1.00 38.67 O ANISOU 1395 OP1 DA B 2 6702 5224 2769 -220 854 585 O ATOM 1396 OP2 DA B 2 -35.553 -53.946 283.084 1.00 37.64 O ANISOU 1396 OP2 DA B 2 6680 4881 2739 -40 575 709 O ATOM 1397 O5' DA B 2 -35.331 -51.635 283.744 1.00 35.86 O ANISOU 1397 O5' DA B 2 6113 4875 2636 139 476 570 O ATOM 1398 C5' DA B 2 -35.564 -50.523 284.532 1.00 36.24 C ANISOU 1398 C5' DA B 2 6053 5030 2687 185 497 483 C ATOM 1399 C4' DA B 2 -34.865 -49.333 283.934 1.00 34.12 C ANISOU 1399 C4' DA B 2 5556 4808 2599 325 337 424 C ATOM 1400 O4' DA B 2 -33.444 -49.531 284.010 1.00 32.55 O ANISOU 1400 O4' DA B 2 5471 4549 2349 475 168 452 O ATOM 1401 C3' DA B 2 -35.170 -49.089 282.450 1.00 30.74 C ANISOU 1401 C3' DA B 2 4901 4401 2378 284 305 427 C ATOM 1402 O3' DA B 2 -35.984 -47.931 282.312 1.00 32.79 O ANISOU 1402 O3' DA B 2 4935 4756 2768 280 343 340 O ATOM 1403 C2' DA B 2 -33.788 -48.941 281.787 1.00 29.44 C ANISOU 1403 C2' DA B 2 4720 4187 2277 409 124 450 C ATOM 1404 C1' DA B 2 -32.843 -48.813 282.969 1.00 31.51 C ANISOU 1404 C1' DA B 2 5132 4437 2402 532 49 422 C ATOM 1405 N9 DA B 2 -31.512 -49.369 282.768 1.00 31.09 N ANISOU 1405 N9 DA B 2 5172 4338 2304 648 -98 444 N ATOM 1406 C8 DA B 2 -31.194 -50.658 282.490 1.00 29.51 C ANISOU 1406 C8 DA B 2 5143 4052 2019 662 -119 519 C ATOM 1407 N7 DA B 2 -29.911 -50.877 282.415 1.00 29.26 N ANISOU 1407 N7 DA B 2 5144 4015 1960 811 -275 495 N ATOM 1408 C5 DA B 2 -29.349 -49.645 282.695 1.00 29.31 C ANISOU 1408 C5 DA B 2 4987 4116 2032 871 -349 394 C ATOM 1409 C6 DA B 2 -28.020 -49.208 282.779 1.00 28.91 C ANISOU 1409 C6 DA B 2 4857 4133 1993 1002 -505 296 C ATOM 1410 N6 DA B 2 -26.977 -50.010 282.591 1.00 30.18 N ANISOU 1410 N6 DA B 2 5081 4292 2094 1132 -630 281 N ATOM 1411 N1 DA B 2 -27.800 -47.914 283.075 1.00 30.66 N ANISOU 1411 N1 DA B 2 4927 4432 2292 995 -526 195 N ATOM 1412 C2 DA B 2 -28.847 -47.122 283.288 1.00 32.66 C ANISOU 1412 C2 DA B 2 5126 4680 2604 897 -410 197 C ATOM 1413 N3 DA B 2 -30.144 -47.422 283.236 1.00 33.84 N ANISOU 1413 N3 DA B 2 5317 4789 2749 796 -270 274 N ATOM 1414 C4 DA B 2 -30.321 -48.710 282.921 1.00 31.23 C ANISOU 1414 C4 DA B 2 5124 4397 2344 774 -242 369 C ATOM 1415 H5' DA B 2 -35.224 -50.682 285.426 1.00 43.52 H ATOM 1416 H5'' DA B 2 -36.517 -50.350 284.575 1.00 43.52 H ATOM 1417 H4' DA B 2 -35.101 -48.540 284.440 1.00 40.97 H ATOM 1418 H3' DA B 2 -35.629 -49.859 282.080 1.00 36.92 H ATOM 1419 H2' DA B 2 -33.574 -49.729 281.263 1.00 35.35 H ATOM 1420 H2'' DA B 2 -33.757 -48.143 281.237 1.00 35.35 H ATOM 1421 H1' DA B 2 -32.768 -47.880 283.223 1.00 37.83 H ATOM 1422 H8 DA B 2 -31.832 -51.318 282.340 1.00 35.45 H ATOM 1423 H61 DA B 2 -26.178 -49.699 282.658 1.00 36.24 H ATOM 1424 H62 DA B 2 -27.101 -50.839 282.401 1.00 36.24 H ATOM 1425 H2 DA B 2 -28.647 -46.237 283.490 1.00 39.22 H ATOM 1426 P DG B 3 -36.428 -47.387 280.862 1.00 31.94 P ANISOU 1426 P DG B 3 4590 4686 2861 272 294 333 P ATOM 1427 OP1 DG B 3 -37.599 -46.525 281.101 1.00 35.18 O ANISOU 1427 OP1 DG B 3 4828 5198 3340 268 373 233 O ATOM 1428 OP2 DG B 3 -36.519 -48.502 279.881 1.00 30.08 O ANISOU 1428 OP2 DG B 3 4380 4421 2630 177 304 405 O ATOM 1429 O5' DG B 3 -35.215 -46.449 280.468 1.00 30.17 O ANISOU 1429 O5' DG B 3 4327 4410 2727 401 132 335 O ATOM 1430 C5' DG B 3 -35.012 -45.255 281.177 1.00 30.15 C ANISOU 1430 C5' DG B 3 4288 4414 2754 488 102 255 C ATOM 1431 C4' DG B 3 -33.821 -44.504 280.630 1.00 32.12 C ANISOU 1431 C4' DG B 3 4508 4607 3090 556 -34 255 C ATOM 1432 O4' DG B 3 -32.610 -45.276 280.866 1.00 33.39 O ANISOU 1432 O4' DG B 3 4792 4745 3151 580 -103 281 O ATOM 1433 C3' DG B 3 -33.874 -44.225 279.117 1.00 32.08 C ANISOU 1433 C3' DG B 3 4389 4579 3220 534 -87 310 C ATOM 1434 O3' DG B 3 -33.742 -42.822 278.896 1.00 32.65 O ANISOU 1434 O3' DG B 3 4394 4606 3404 586 -139 266 O ATOM 1435 C2' DG B 3 -32.710 -45.035 278.547 1.00 31.61 C ANISOU 1435 C2' DG B 3 4390 4496 3123 517 -157 364 C ATOM 1436 C1' DG B 3 -31.772 -45.183 279.746 1.00 31.50 C ANISOU 1436 C1' DG B 3 4489 4481 2998 578 -192 310 C ATOM 1437 N9 DG B 3 -30.905 -46.369 279.700 1.00 29.86 N ANISOU 1437 N9 DG B 3 4384 4267 2692 601 -243 344 N ATOM 1438 C8 DG B 3 -31.302 -47.686 279.592 1.00 28.71 C ANISOU 1438 C8 DG B 3 4348 4098 2462 566 -194 415 C ATOM 1439 N7 DG B 3 -30.312 -48.530 279.583 1.00 26.93 N ANISOU 1439 N7 DG B 3 4221 3850 2160 631 -272 424 N ATOM 1440 C5 DG B 3 -29.180 -47.726 279.689 1.00 28.75 C ANISOU 1440 C5 DG B 3 4370 4126 2428 706 -376 340 C ATOM 1441 C6 DG B 3 -27.810 -48.081 279.710 1.00 31.33 C ANISOU 1441 C6 DG B 3 4709 4486 2709 808 -497 280 C ATOM 1442 O6 DG B 3 -27.307 -49.212 279.656 1.00 32.35 O ANISOU 1442 O6 DG B 3 4946 4594 2752 886 -550 300 O ATOM 1443 N1 DG B 3 -26.984 -46.959 279.808 1.00 32.08 N ANISOU 1443 N1 DG B 3 4671 4647 2870 821 -560 171 N ATOM 1444 C2 DG B 3 -27.428 -45.660 279.870 1.00 30.53 C ANISOU 1444 C2 DG B 3 4386 4443 2772 749 -513 140 C ATOM 1445 N2 DG B 3 -26.482 -44.719 279.967 1.00 31.64 N ANISOU 1445 N2 DG B 3 4428 4631 2964 744 -572 23 N ATOM 1446 N3 DG B 3 -28.712 -45.311 279.858 1.00 29.65 N ANISOU 1446 N3 DG B 3 4279 4283 2703 689 -414 202 N ATOM 1447 C4 DG B 3 -29.529 -46.393 279.758 1.00 28.74 C ANISOU 1447 C4 DG B 3 4252 4142 2525 669 -351 294 C ATOM 1448 H5' DG B 3 -34.858 -45.461 282.112 1.00 36.21 H ATOM 1449 H5'' DG B 3 -35.803 -44.699 281.099 1.00 36.21 H ATOM 1450 H4' DG B 3 -33.746 -43.658 281.099 1.00 38.57 H ATOM 1451 H3' DG B 3 -34.714 -44.544 278.750 1.00 38.52 H ATOM 1452 H2' DG B 3 -33.015 -45.904 278.241 1.00 37.96 H ATOM 1453 H2'' DG B 3 -32.274 -44.550 277.829 1.00 37.96 H ATOM 1454 H1' DG B 3 -31.223 -44.387 279.823 1.00 37.83 H ATOM 1455 H8 DG B 3 -32.194 -47.948 279.552 1.00 34.48 H ATOM 1456 H1 DG B 3 -26.135 -47.091 279.834 1.00 38.52 H ATOM 1457 H21 DG B 3 -26.704 -43.890 280.022 1.00 38.00 H ATOM 1458 H22 DG B 3 -25.652 -44.943 279.975 1.00 38.00 H ATOM 1459 P DG B 4 -33.823 -42.182 277.428 1.00 34.11 P ANISOU 1459 P DG B 4 4502 4745 3713 581 -198 325 P ATOM 1460 OP1 DG B 4 -34.261 -40.785 277.617 1.00 34.96 O ANISOU 1460 OP1 DG B 4 4583 4790 3910 657 -213 268 O ATOM 1461 OP2 DG B 4 -34.594 -43.094 276.553 1.00 35.17 O ANISOU 1461 OP2 DG B 4 4581 4941 3841 533 -173 391 O ATOM 1462 O5' DG B 4 -32.306 -42.168 276.955 1.00 33.03 O ANISOU 1462 O5' DG B 4 4410 4565 3575 541 -269 345 O ATOM 1463 C5' DG B 4 -31.367 -41.400 277.657 1.00 31.74 C ANISOU 1463 C5' DG B 4 4282 4362 3415 555 -301 263 C ATOM 1464 C4' DG B 4 -29.995 -41.550 277.044 1.00 31.84 C ANISOU 1464 C4' DG B 4 4292 4380 3426 494 -355 261 C ATOM 1465 O4' DG B 4 -29.496 -42.866 277.344 1.00 31.63 O ANISOU 1465 O4' DG B 4 4290 4432 3296 511 -370 262 O ATOM 1466 C3' DG B 4 -29.960 -41.410 275.510 1.00 33.02 C ANISOU 1466 C3' DG B 4 4410 4500 3637 425 -367 349 C ATOM 1467 O3' DG B 4 -29.083 -40.355 275.118 1.00 31.47 O ANISOU 1467 O3' DG B 4 4224 4238 3498 354 -385 314 O ATOM 1468 C2' DG B 4 -29.488 -42.781 275.015 1.00 32.74 C ANISOU 1468 C2' DG B 4 4359 4548 3534 400 -378 383 C ATOM 1469 C1' DG B 4 -28.789 -43.357 276.241 1.00 31.82 C ANISOU 1469 C1' DG B 4 4278 4481 3331 459 -400 297 C ATOM 1470 N9 DG B 4 -28.770 -44.820 276.289 1.00 28.48 N ANISOU 1470 N9 DG B 4 3900 4103 2817 493 -403 330 N ATOM 1471 C8 DG B 4 -29.850 -45.677 276.250 1.00 27.10 C ANISOU 1471 C8 DG B 4 3772 3921 2606 488 -348 403 C ATOM 1472 N7 DG B 4 -29.508 -46.941 276.296 1.00 27.50 N ANISOU 1472 N7 DG B 4 3896 3980 2571 513 -361 418 N ATOM 1473 C5 DG B 4 -28.120 -46.920 276.360 1.00 26.36 C ANISOU 1473 C5 DG B 4 3734 3874 2408 565 -444 344 C ATOM 1474 C6 DG B 4 -27.188 -47.985 276.405 1.00 25.56 C ANISOU 1474 C6 DG B 4 3686 3799 2228 644 -510 309 C ATOM 1475 O6 DG B 4 -27.407 -49.204 276.410 1.00 25.03 O ANISOU 1475 O6 DG B 4 3733 3690 2085 681 -504 356 O ATOM 1476 N1 DG B 4 -25.879 -47.520 276.463 1.00 27.70 N ANISOU 1476 N1 DG B 4 3866 4147 2510 686 -590 194 N ATOM 1477 C2 DG B 4 -25.514 -46.189 276.456 1.00 31.40 C ANISOU 1477 C2 DG B 4 4227 4645 3058 618 -588 126 C ATOM 1478 N2 DG B 4 -24.205 -45.935 276.511 1.00 33.74 N ANISOU 1478 N2 DG B 4 4426 5038 3354 638 -657 -10 N ATOM 1479 N3 DG B 4 -26.371 -45.182 276.399 1.00 29.68 N ANISOU 1479 N3 DG B 4 3999 4364 2914 540 -524 175 N ATOM 1480 C4 DG B 4 -27.653 -45.620 276.351 1.00 28.91 C ANISOU 1480 C4 DG B 4 3968 4209 2806 535 -463 281 C ATOM 1481 H5' DG B 4 -31.338 -41.696 278.580 1.00 38.11 H ATOM 1482 H5'' DG B 4 -31.630 -40.467 277.627 1.00 38.11 H ATOM 1483 H4' DG B 4 -29.401 -40.890 277.434 1.00 38.24 H ATOM 1484 H3' DG B 4 -30.855 -41.233 275.178 1.00 39.65 H ATOM 1485 H2' DG B 4 -30.244 -43.333 274.760 1.00 39.32 H ATOM 1486 H2'' DG B 4 -28.865 -42.685 274.278 1.00 39.32 H ATOM 1487 H1' DG B 4 -27.878 -43.025 276.273 1.00 38.21 H ATOM 1488 H8 DG B 4 -30.732 -45.387 276.205 1.00 32.55 H ATOM 1489 H1 DG B 4 -25.250 -48.105 276.500 1.00 33.26 H ATOM 1490 H21 DG B 4 -23.924 -45.122 276.509 1.00 40.51 H ATOM 1491 H22 DG B 4 -23.642 -46.584 276.549 1.00 40.51 H ATOM 1492 P DT B 5 -28.991 -39.916 273.568 1.00 35.86 P ANISOU 1492 P DT B 5 4792 4737 4096 264 -386 410 P ATOM 1493 OP1 DT B 5 -28.470 -38.535 273.559 1.00 38.29 O ANISOU 1493 OP1 DT B 5 5164 4920 4462 195 -377 369 O ATOM 1494 OP2 DT B 5 -30.263 -40.288 272.899 1.00 33.65 O ANISOU 1494 OP2 DT B 5 4504 4465 3818 323 -389 516 O ATOM 1495 O5' DT B 5 -27.848 -40.865 272.992 1.00 34.68 O ANISOU 1495 O5' DT B 5 4584 4700 3891 185 -391 388 O ATOM 1496 C5' DT B 5 -26.600 -40.875 273.613 1.00 34.49 C ANISOU 1496 C5' DT B 5 4518 4739 3848 151 -404 258 C ATOM 1497 C4' DT B 5 -25.728 -41.988 273.070 1.00 35.22 C ANISOU 1497 C4' DT B 5 4536 4961 3884 131 -421 227 C ATOM 1498 O4' DT B 5 -26.180 -43.293 273.564 1.00 33.29 O ANISOU 1498 O4' DT B 5 4308 4768 3575 253 -449 250 O ATOM 1499 C3' DT B 5 -25.719 -42.117 271.534 1.00 37.97 C ANISOU 1499 C3' DT B 5 4874 5318 4234 31 -391 314 C ATOM 1500 O3' DT B 5 -24.397 -42.241 271.078 1.00 43.46 O ANISOU 1500 O3' DT B 5 5483 6117 4911 -63 -380 210 O ATOM 1501 C2' DT B 5 -26.493 -43.401 271.299 1.00 35.14 C ANISOU 1501 C2' DT B 5 4521 5000 3832 118 -406 388 C ATOM 1502 C1' DT B 5 -26.022 -44.192 272.493 1.00 35.51 C ANISOU 1502 C1' DT B 5 4559 5104 3830 225 -447 293 C ATOM 1503 N1 DT B 5 -26.747 -45.463 272.725 1.00 34.11 N ANISOU 1503 N1 DT B 5 4434 4929 3596 313 -453 348 N ATOM 1504 C2 DT B 5 -26.007 -46.599 272.966 1.00 32.31 C ANISOU 1504 C2 DT B 5 4214 4761 3301 389 -496 287 C ATOM 1505 O2 DT B 5 -24.789 -46.603 273.028 1.00 32.50 O ANISOU 1505 O2 DT B 5 4171 4866 3312 409 -541 173 O ATOM 1506 N3 DT B 5 -26.738 -47.737 273.143 1.00 29.64 N ANISOU 1506 N3 DT B 5 3968 4386 2908 444 -486 348 N ATOM 1507 C4 DT B 5 -28.102 -47.865 273.087 1.00 27.90 C ANISOU 1507 C4 DT B 5 3796 4109 2698 407 -427 443 C ATOM 1508 O4 DT B 5 -28.650 -48.939 273.256 1.00 27.47 O ANISOU 1508 O4 DT B 5 3827 4022 2588 425 -403 478 O ATOM 1509 C5 DT B 5 -28.835 -46.640 272.823 1.00 30.37 C ANISOU 1509 C5 DT B 5 4054 4398 3086 348 -396 485 C ATOM 1510 C7 DT B 5 -30.334 -46.655 272.758 1.00 31.78 C ANISOU 1510 C7 DT B 5 4237 4554 3283 328 -345 552 C ATOM 1511 C6 DT B 5 -28.125 -45.505 272.641 1.00 32.34 C ANISOU 1511 C6 DT B 5 4252 4648 3386 314 -415 446 C ATOM 1512 H5' DT B 5 -26.721 -41.003 274.567 1.00 41.42 H ATOM 1513 H5'' DT B 5 -26.161 -40.024 273.459 1.00 41.42 H ATOM 1514 H4' DT B 5 -24.818 -41.841 273.373 1.00 42.29 H ATOM 1515 H3' DT B 5 -26.164 -41.362 271.119 1.00 45.59 H ATOM 1516 H2' DT B 5 -27.450 -43.247 271.333 1.00 42.20 H ATOM 1517 H2'' DT B 5 -26.227 -43.825 270.468 1.00 42.20 H ATOM 1518 H1' DT B 5 -25.077 -44.387 272.386 1.00 42.64 H ATOM 1519 H3 DT B 5 -26.293 -48.457 273.297 1.00 35.60 H ATOM 1520 H71 DT B 5 -30.694 -46.063 273.437 1.00 38.16 H ATOM 1521 H72 DT B 5 -30.623 -46.355 271.882 1.00 38.16 H ATOM 1522 H73 DT B 5 -30.655 -47.557 272.913 1.00 38.16 H ATOM 1523 H6 DT B 5 -28.585 -44.714 272.474 1.00 38.83 H ATOM 1524 P DG B 6 -23.732 -41.168 270.092 1.00 42.74 P ANISOU 1524 P DG B 6 5398 5998 4844 -267 -310 203 P ATOM 1525 OP1 DG B 6 -23.159 -40.107 270.952 1.00 43.47 O ANISOU 1525 OP1 DG B 6 5492 6043 4982 -331 -297 88 O ATOM 1526 OP2 DG B 6 -24.664 -40.820 269.010 1.00 41.54 O ANISOU 1526 OP2 DG B 6 5354 5742 4687 -306 -284 376 O ATOM 1527 O5' DG B 6 -22.489 -41.988 269.511 1.00 39.67 O ANISOU 1527 O5' DG B 6 4867 5798 4407 -328 -298 80 O ATOM 1528 C5' DG B 6 -21.424 -42.340 270.397 1.00 37.00 C ANISOU 1528 C5' DG B 6 4400 5597 4062 -274 -343 -115 C ATOM 1529 C4' DG B 6 -20.778 -43.651 270.001 1.00 35.51 C ANISOU 1529 C4' DG B 6 4098 5575 3819 -194 -380 -198 C ATOM 1530 O4' DG B 6 -21.620 -44.766 270.404 1.00 32.41 O ANISOU 1530 O4' DG B 6 3785 5136 3394 0 -448 -106 O ATOM 1531 C3' DG B 6 -20.545 -43.823 268.506 1.00 34.89 C ANISOU 1531 C3' DG B 6 3985 5556 3714 -332 -303 -165 C ATOM 1532 O3' DG B 6 -19.268 -44.393 268.304 1.00 34.37 O ANISOU 1532 O3' DG B 6 3741 5696 3622 -337 -308 -365 O ATOM 1533 C2' DG B 6 -21.688 -44.746 268.081 1.00 34.56 C ANISOU 1533 C2' DG B 6 4045 5443 3645 -218 -333 -1 C ATOM 1534 C1' DG B 6 -21.828 -45.624 269.308 1.00 32.48 C ANISOU 1534 C1' DG B 6 3793 5176 3370 -6 -428 -45 C ATOM 1535 N9 DG B 6 -23.124 -46.276 269.461 1.00 31.67 N ANISOU 1535 N9 DG B 6 3817 4962 3255 94 -448 105 N ATOM 1536 C8 DG B 6 -24.361 -45.680 269.513 1.00 29.86 C ANISOU 1536 C8 DG B 6 3685 4606 3056 68 -423 248 C ATOM 1537 N7 DG B 6 -25.341 -46.526 269.685 1.00 27.81 N ANISOU 1537 N7 DG B 6 3494 4297 2774 152 -437 328 N ATOM 1538 C5 DG B 6 -24.715 -47.760 269.773 1.00 29.35 C ANISOU 1538 C5 DG B 6 3676 4557 2919 241 -475 251 C ATOM 1539 C6 DG B 6 -25.264 -49.052 269.961 1.00 29.49 C ANISOU 1539 C6 DG B 6 3782 4533 2891 332 -492 285 C ATOM 1540 O6 DG B 6 -26.457 -49.371 270.095 1.00 29.33 O ANISOU 1540 O6 DG B 6 3845 4433 2867 326 -463 382 O ATOM 1541 N1 DG B 6 -24.275 -50.034 269.978 1.00 28.54 N ANISOU 1541 N1 DG B 6 3647 4471 2724 432 -545 178 N ATOM 1542 C2 DG B 6 -22.928 -49.794 269.842 1.00 29.72 C ANISOU 1542 C2 DG B 6 3668 4748 2877 449 -579 31 C ATOM 1543 N2 DG B 6 -22.124 -50.863 269.902 1.00 32.63 N ANISOU 1543 N2 DG B 6 4028 5171 3199 590 -646 -80 N ATOM 1544 N3 DG B 6 -22.401 -48.590 269.665 1.00 29.63 N ANISOU 1544 N3 DG B 6 3546 4802 2908 331 -547 -17 N ATOM 1545 C4 DG B 6 -23.350 -47.624 269.641 1.00 30.64 C ANISOU 1545 C4 DG B 6 3730 4834 3078 228 -494 109 C ATOM 1546 H5' DG B 6 -21.776 -42.420 271.297 1.00 44.43 H ATOM 1547 H5'' DG B 6 -20.754 -41.640 270.380 1.00 44.43 H ATOM 1548 H4' DG B 6 -19.925 -43.726 270.458 1.00 42.64 H ATOM 1549 H3' DG B 6 -20.612 -42.968 268.053 1.00 41.89 H ATOM 1550 H2' DG B 6 -22.500 -44.241 267.920 1.00 41.51 H ATOM 1551 H2'' DG B 6 -21.440 -45.271 267.304 1.00 41.51 H ATOM 1552 H1' DG B 6 -21.131 -46.300 269.296 1.00 39.00 H ATOM 1553 H8 DG B 6 -24.489 -44.763 269.422 1.00 35.86 H ATOM 1554 H1 DG B 6 -24.525 -50.849 270.093 1.00 34.27 H ATOM 1555 H21 DG B 6 -21.273 -50.765 269.826 1.00 39.18 H ATOM 1556 H22 DG B 6 -22.459 -51.647 270.016 1.00 39.18 H ATOM 1557 P DT B 7 -18.669 -44.572 266.833 1.00 36.42 P ANISOU 1557 P DT B 7 3915 6084 3840 -501 -212 -408 P ATOM 1558 OP1 DT B 7 -17.200 -44.459 266.910 1.00 38.90 O ANISOU 1558 OP1 DT B 7 4011 6617 4154 -581 -185 -670 O ATOM 1559 OP2 DT B 7 -19.417 -43.683 265.917 1.00 36.70 O ANISOU 1559 OP2 DT B 7 4104 5976 3865 -683 -118 -216 O ATOM 1560 O5' DT B 7 -19.035 -46.072 266.477 1.00 33.82 O ANISOU 1560 O5' DT B 7 3594 5789 3468 -313 -278 -375 O ATOM 1561 C5' DT B 7 -18.631 -47.093 267.335 1.00 35.62 C ANISOU 1561 C5' DT B 7 3762 6083 3687 -82 -392 -495 C ATOM 1562 C4' DT B 7 -19.250 -48.406 266.939 1.00 34.66 C ANISOU 1562 C4' DT B 7 3727 5914 3529 64 -435 -417 C ATOM 1563 O4' DT B 7 -20.658 -48.373 267.210 1.00 34.59 O ANISOU 1563 O4' DT B 7 3902 5711 3530 87 -442 -204 O ATOM 1564 C3' DT B 7 -19.132 -48.757 265.454 1.00 35.63 C ANISOU 1564 C3' DT B 7 3803 6120 3613 -52 -356 -420 C ATOM 1565 O3' DT B 7 -18.061 -49.697 265.282 1.00 39.72 O ANISOU 1565 O3' DT B 7 4174 6811 4106 65 -395 -633 O ATOM 1566 C2' DT B 7 -20.528 -49.324 265.092 1.00 34.17 C ANISOU 1566 C2' DT B 7 3793 5776 3413 -15 -364 -217 C ATOM 1567 C1' DT B 7 -21.259 -49.369 266.438 1.00 34.14 C ANISOU 1567 C1' DT B 7 3909 5623 3440 122 -438 -133 C ATOM 1568 N1 DT B 7 -22.760 -49.106 266.414 1.00 33.75 N ANISOU 1568 N1 DT B 7 4003 5415 3404 82 -417 71 N ATOM 1569 C2 DT B 7 -23.632 -50.170 266.563 1.00 31.21 C ANISOU 1569 C2 DT B 7 3788 5008 3063 178 -446 139 C ATOM 1570 O2 DT B 7 -23.267 -51.329 266.659 1.00 32.60 O ANISOU 1570 O2 DT B 7 3984 5194 3207 294 -487 63 O ATOM 1571 N3 DT B 7 -24.952 -49.830 266.574 1.00 29.09 N ANISOU 1571 N3 DT B 7 3603 4638 2812 130 -423 287 N ATOM 1572 C4 DT B 7 -25.491 -48.565 266.466 1.00 29.96 C ANISOU 1572 C4 DT B 7 3717 4711 2956 39 -393 378 C ATOM 1573 O4 DT B 7 -26.701 -48.362 266.486 1.00 30.91 O ANISOU 1573 O4 DT B 7 3893 4760 3091 32 -388 485 O ATOM 1574 C5 DT B 7 -24.537 -47.493 266.331 1.00 31.43 C ANISOU 1574 C5 DT B 7 3836 4947 3158 -49 -368 322 C ATOM 1575 C7 DT B 7 -25.020 -46.081 266.211 1.00 33.29 C ANISOU 1575 C7 DT B 7 4120 5102 3427 -142 -338 420 C ATOM 1576 C6 DT B 7 -23.231 -47.806 266.321 1.00 32.86 C ANISOU 1576 C6 DT B 7 3918 5244 3323 -42 -372 170 C ATOM 1577 H5' DT B 7 -18.901 -46.873 268.241 1.00 42.77 H ATOM 1578 H5'' DT B 7 -17.665 -47.174 267.302 1.00 42.77 H ATOM 1579 H4' DT B 7 -18.846 -49.115 267.463 1.00 41.62 H ATOM 1580 H3' DT B 7 -18.956 -47.955 264.938 1.00 42.78 H ATOM 1581 H2' DT B 7 -20.987 -48.733 264.474 1.00 41.03 H ATOM 1582 H2'' DT B 7 -20.448 -50.215 264.717 1.00 41.03 H ATOM 1583 H1' DT B 7 -21.098 -50.230 266.854 1.00 41.00 H ATOM 1584 H3 DT B 7 -25.512 -50.478 266.648 1.00 34.93 H ATOM 1585 H71 DT B 7 -24.666 -45.554 266.945 1.00 39.98 H ATOM 1586 H72 DT B 7 -24.718 -45.706 265.369 1.00 39.98 H ATOM 1587 H73 DT B 7 -25.990 -46.067 266.242 1.00 39.98 H ATOM 1588 H6 DT B 7 -22.612 -47.116 266.240 1.00 39.46 H ATOM 1589 P DG B 8 -17.324 -49.903 263.866 1.00 45.61 P ANISOU 1589 P DG B 8 4776 7746 4808 -70 -298 -758 P ATOM 1590 OP1 DG B 8 -15.941 -50.317 264.179 1.00 48.37 O ANISOU 1590 OP1 DG B 8 4905 8314 5159 46 -345 -1044 O ATOM 1591 OP2 DG B 8 -17.591 -48.766 262.956 1.00 43.91 O ANISOU 1591 OP2 DG B 8 4594 7520 4570 -358 -160 -644 O ATOM 1592 O5' DG B 8 -18.065 -51.160 263.265 1.00 43.34 O ANISOU 1592 O5' DG B 8 4606 7377 4484 48 -331 -678 O ATOM 1593 C5' DG B 8 -18.106 -52.338 264.018 1.00 42.76 C ANISOU 1593 C5' DG B 8 4599 7233 4415 313 -453 -724 C ATOM 1594 C4' DG B 8 -18.998 -53.360 263.359 1.00 38.58 C ANISOU 1594 C4' DG B 8 4215 6588 3856 352 -453 -624 C ATOM 1595 O4' DG B 8 -20.394 -53.053 263.644 1.00 34.46 O ANISOU 1595 O4' DG B 8 3871 5872 3349 288 -443 -389 O ATOM 1596 C3' DG B 8 -18.899 -53.417 261.837 1.00 40.64 C ANISOU 1596 C3' DG B 8 4402 6971 4068 190 -352 -658 C ATOM 1597 O3' DG B 8 -19.088 -54.736 261.426 1.00 43.52 O ANISOU 1597 O3' DG B 8 4834 7295 4409 318 -389 -709 O ATOM 1598 C2' DG B 8 -20.047 -52.526 261.406 1.00 37.49 C ANISOU 1598 C2' DG B 8 4113 6471 3661 -6 -286 -428 C ATOM 1599 C1' DG B 8 -21.095 -52.944 262.422 1.00 34.75 C ANISOU 1599 C1' DG B 8 3934 5915 3353 124 -366 -292 C ATOM 1600 N9 DG B 8 -22.202 -52.019 262.601 1.00 30.58 N ANISOU 1600 N9 DG B 8 3499 5273 2846 16 -343 -93 N ATOM 1601 C8 DG B 8 -22.184 -50.652 262.475 1.00 30.88 C ANISOU 1601 C8 DG B 8 3510 5330 2893 -131 -291 -23 C ATOM 1602 N7 DG B 8 -23.343 -50.097 262.720 1.00 29.49 N ANISOU 1602 N7 DG B 8 3441 5026 2739 -159 -299 146 N ATOM 1603 C5 DG B 8 -24.165 -51.165 263.046 1.00 28.54 C ANISOU 1603 C5 DG B 8 3401 4819 2624 -49 -345 180 C ATOM 1604 C6 DG B 8 -25.532 -51.182 263.395 1.00 29.82 C ANISOU 1604 C6 DG B 8 3660 4864 2806 -38 -360 311 C ATOM 1605 O6 DG B 8 -26.311 -50.219 263.493 1.00 30.48 O ANISOU 1605 O6 DG B 8 3770 4900 2912 -88 -354 424 O ATOM 1606 N1 DG B 8 -25.985 -52.473 263.620 1.00 29.54 N ANISOU 1606 N1 DG B 8 3695 4769 2761 39 -380 288 N ATOM 1607 C2 DG B 8 -25.210 -53.606 263.540 1.00 31.04 C ANISOU 1607 C2 DG B 8 3891 4976 2925 127 -400 164 C ATOM 1608 N2 DG B 8 -25.822 -54.773 263.814 1.00 32.38 N ANISOU 1608 N2 DG B 8 4182 5036 3085 183 -411 167 N ATOM 1609 N3 DG B 8 -23.929 -53.600 263.208 1.00 29.23 N ANISOU 1609 N3 DG B 8 3561 4865 2682 156 -404 33 N ATOM 1610 C4 DG B 8 -23.479 -52.349 262.977 1.00 28.61 C ANISOU 1610 C4 DG B 8 3385 4873 2611 51 -369 44 C ATOM 1611 H5' DG B 8 -18.448 -52.140 264.904 1.00 51.34 H ATOM 1612 H5'' DG B 8 -17.209 -52.700 264.096 1.00 51.34 H ATOM 1613 H4' DG B 8 -18.790 -54.236 263.720 1.00 46.32 H ATOM 1614 H3' DG B 8 -18.048 -53.069 261.529 1.00 48.79 H ATOM 1615 H2' DG B 8 -19.818 -51.588 261.502 1.00 45.02 H ATOM 1616 H2'' DG B 8 -20.331 -52.732 260.502 1.00 45.02 H ATOM 1617 H1' DG B 8 -21.445 -53.815 262.177 1.00 41.72 H ATOM 1618 H8 DG B 8 -21.426 -50.170 262.234 1.00 37.08 H ATOM 1619 H1 DG B 8 -26.808 -52.571 263.851 1.00 35.48 H ATOM 1620 H21 DG B 8 -25.380 -55.510 263.773 1.00 38.88 H ATOM 1621 H22 DG B 8 -26.654 -54.781 264.030 1.00 38.88 H ATOM 1622 P DG B 9 -18.326 -55.363 260.170 1.00 47.13 P ANISOU 1622 P DG B 9 5159 7938 4812 296 -335 -900 P ATOM 1623 OP1 DG B 9 -17.027 -55.892 260.627 1.00 49.85 O ANISOU 1623 OP1 DG B 9 5353 8417 5173 502 -404 -1156 O ATOM 1624 OP2 DG B 9 -18.415 -54.420 259.024 1.00 46.23 O ANISOU 1624 OP2 DG B 9 4978 7947 4640 20 -203 -841 O ATOM 1625 O5' DG B 9 -19.236 -56.634 259.880 1.00 46.32 O ANISOU 1625 O5' DG B 9 5240 7665 4693 391 -375 -841 O ATOM 1626 C5' DG B 9 -19.530 -57.505 260.966 1.00 43.12 C ANISOU 1626 C5' DG B 9 5001 7060 4322 610 -483 -816 C ATOM 1627 C4' DG B 9 -20.779 -58.299 260.690 1.00 39.86 C ANISOU 1627 C4' DG B 9 4792 6456 3898 575 -475 -689 C ATOM 1628 O4' DG B 9 -21.952 -57.482 260.969 1.00 37.11 O ANISOU 1628 O4' DG B 9 4519 6017 3566 417 -440 -468 O ATOM 1629 C3' DG B 9 -20.919 -58.760 259.254 1.00 40.04 C ANISOU 1629 C3' DG B 9 4774 6569 3870 464 -408 -757 C ATOM 1630 O3' DG B 9 -21.482 -60.052 259.228 1.00 42.51 O ANISOU 1630 O3' DG B 9 5268 6704 4180 552 -440 -774 O ATOM 1631 C2' DG B 9 -21.823 -57.701 258.634 1.00 37.55 C ANISOU 1631 C2' DG B 9 4437 6300 3529 217 -333 -579 C ATOM 1632 C1' DG B 9 -22.730 -57.331 259.791 1.00 35.80 C ANISOU 1632 C1' DG B 9 4342 5898 3362 231 -371 -400 C ATOM 1633 N9 DG B 9 -23.222 -55.957 259.773 1.00 33.75 N ANISOU 1633 N9 DG B 9 4038 5679 3107 78 -333 -247 N ATOM 1634 C8 DG B 9 -22.490 -54.814 259.534 1.00 33.24 C ANISOU 1634 C8 DG B 9 3847 5754 3031 -14 -290 -259 C ATOM 1635 N7 DG B 9 -23.195 -53.725 259.625 1.00 32.31 N ANISOU 1635 N7 DG B 9 3761 5596 2921 -125 -272 -96 N ATOM 1636 C5 DG B 9 -24.467 -54.173 259.956 1.00 31.19 C ANISOU 1636 C5 DG B 9 3739 5312 2801 -97 -307 15 C ATOM 1637 C6 DG B 9 -25.651 -53.447 260.190 1.00 31.59 C ANISOU 1637 C6 DG B 9 3847 5285 2872 -156 -314 180 C ATOM 1638 O6 DG B 9 -25.822 -52.223 260.146 1.00 32.77 O ANISOU 1638 O6 DG B 9 3982 5446 3023 -228 -301 278 O ATOM 1639 N1 DG B 9 -26.719 -54.285 260.485 1.00 31.95 N ANISOU 1639 N1 DG B 9 3978 5226 2934 -126 -335 214 N ATOM 1640 C2 DG B 9 -26.642 -55.658 260.564 1.00 32.77 C ANISOU 1640 C2 DG B 9 4147 5269 3033 -58 -343 119 C ATOM 1641 N2 DG B 9 -27.778 -56.302 260.876 1.00 33.74 N ANISOU 1641 N2 DG B 9 4365 5285 3172 -80 -340 163 N ATOM 1642 N3 DG B 9 -25.531 -56.349 260.359 1.00 32.44 N ANISOU 1642 N3 DG B 9 4084 5268 2974 25 -350 -23 N ATOM 1643 C4 DG B 9 -24.491 -55.543 260.058 1.00 30.86 C ANISOU 1643 C4 DG B 9 3760 5207 2760 6 -334 -75 C ATOM 1644 H5' DG B 9 -19.658 -56.979 261.771 1.00 51.77 H ATOM 1645 H5'' DG B 9 -18.787 -58.114 261.098 1.00 51.77 H ATOM 1646 H4' DG B 9 -20.791 -59.075 261.271 1.00 47.86 H ATOM 1647 H3' DG B 9 -20.053 -58.760 258.817 1.00 48.07 H ATOM 1648 H2' DG B 9 -21.306 -56.934 258.343 1.00 45.08 H ATOM 1649 H2'' DG B 9 -22.336 -58.073 257.900 1.00 45.08 H ATOM 1650 H1' DG B 9 -23.482 -57.943 259.821 1.00 42.99 H ATOM 1651 H8 DG B 9 -21.583 -54.821 259.328 1.00 39.92 H ATOM 1652 H1 DG B 9 -27.482 -53.920 260.643 1.00 38.36 H ATOM 1653 H21 DG B 9 -27.782 -57.160 260.942 1.00 40.52 H ATOM 1654 H22 DG B 9 -28.502 -55.857 261.010 1.00 40.52 H ATOM 1655 P DC B 10 -21.530 -60.906 257.879 1.00 44.28 P ANISOU 1655 P DC B 10 5482 6990 4352 499 -395 -901 P ATOM 1656 OP1 DC B 10 -21.546 -62.333 258.275 1.00 47.16 O ANISOU 1656 OP1 DC B 10 6042 7143 4734 689 -458 -989 O ATOM 1657 OP2 DC B 10 -20.481 -60.429 256.948 1.00 44.18 O ANISOU 1657 OP2 DC B 10 5240 7252 4293 449 -340 -1056 O ATOM 1658 O5' DC B 10 -22.962 -60.547 257.289 1.00 40.45 O ANISOU 1658 O5' DC B 10 5056 6471 3841 263 -339 -723 O ATOM 1659 C5' DC B 10 -24.106 -61.007 257.942 1.00 38.71 C ANISOU 1659 C5' DC B 10 5020 6033 3655 246 -356 -600 C ATOM 1660 C4' DC B 10 -25.331 -60.256 257.481 1.00 37.13 C ANISOU 1660 C4' DC B 10 4793 5880 3436 36 -316 -444 C ATOM 1661 O4' DC B 10 -25.260 -58.882 257.908 1.00 34.38 O ANISOU 1661 O4' DC B 10 4352 5606 3103 -4 -315 -318 O ATOM 1662 C3' DC B 10 -25.515 -60.143 255.977 1.00 37.39 C ANISOU 1662 C3' DC B 10 4728 6093 3384 -108 -275 -491 C ATOM 1663 O3' DC B 10 -26.072 -61.341 255.432 1.00 40.09 O ANISOU 1663 O3' DC B 10 5163 6362 3707 -138 -269 -585 O ATOM 1664 C2' DC B 10 -26.458 -58.928 255.861 1.00 35.22 C ANISOU 1664 C2' DC B 10 4407 5882 3094 -248 -271 -305 C ATOM 1665 C1' DC B 10 -26.246 -58.166 257.186 1.00 33.85 C ANISOU 1665 C1' DC B 10 4245 5619 2998 -169 -292 -202 C ATOM 1666 N1 DC B 10 -25.811 -56.738 256.997 1.00 33.90 N ANISOU 1666 N1 DC B 10 4147 5752 2981 -230 -275 -121 N ATOM 1667 C2 DC B 10 -26.731 -55.714 257.209 1.00 33.10 C ANISOU 1667 C2 DC B 10 4056 5629 2891 -299 -287 46 C ATOM 1668 O2 DC B 10 -27.877 -56.001 257.576 1.00 33.29 O ANISOU 1668 O2 DC B 10 4139 5563 2948 -308 -310 109 O ATOM 1669 N3 DC B 10 -26.348 -54.433 257.016 1.00 32.78 N ANISOU 1669 N3 DC B 10 3965 5664 2825 -359 -268 123 N ATOM 1670 C4 DC B 10 -25.109 -54.153 256.635 1.00 33.68 C ANISOU 1670 C4 DC B 10 4006 5889 2902 -384 -221 34 C ATOM 1671 N4 DC B 10 -24.795 -52.872 256.470 1.00 32.93 N ANISOU 1671 N4 DC B 10 3892 5843 2778 -477 -186 116 N ATOM 1672 C5 DC B 10 -24.142 -55.178 256.406 1.00 35.85 C ANISOU 1672 C5 DC B 10 4225 6229 3165 -318 -204 -158 C ATOM 1673 C6 DC B 10 -24.534 -56.450 256.594 1.00 36.62 C ANISOU 1673 C6 DC B 10 4391 6233 3291 -225 -241 -226 C ATOM 1674 H5' DC B 10 -23.999 -60.884 258.898 1.00 46.48 H ATOM 1675 H5'' DC B 10 -24.222 -61.951 257.753 1.00 46.48 H ATOM 1676 H4' DC B 10 -26.120 -60.668 257.867 1.00 44.59 H ATOM 1677 H3' DC B 10 -24.665 -59.947 255.552 1.00 44.89 H ATOM 1678 HO3' DC B 10 -26.807 -61.316 255.027 1.00 48.14 H ATOM 1679 H2' DC B 10 -26.206 -58.374 255.106 1.00 42.29 H ATOM 1680 H2'' DC B 10 -27.379 -59.219 255.779 1.00 42.29 H ATOM 1681 H1' DC B 10 -27.075 -58.178 257.691 1.00 40.65 H ATOM 1682 H41 DC B 10 -24.001 -52.653 256.223 1.00 39.55 H ATOM 1683 H42 DC B 10 -25.385 -52.263 256.610 1.00 39.55 H ATOM 1684 H5 DC B 10 -23.277 -54.973 256.132 1.00 43.04 H ATOM 1685 H6 DC B 10 -23.931 -57.143 256.448 1.00 43.97 H TER 1686 DC B 10 ATOM 1687 O5' DG C 1 -33.542 -46.734 255.078 1.00 52.86 O ANISOU 1687 O5' DG C 1 7686 8169 4227 -1151 -806 654 O ATOM 1688 C5' DG C 1 -33.813 -46.746 256.459 1.00 43.71 C ANISOU 1688 C5' DG C 1 6286 6841 3481 -1052 -769 619 C ATOM 1689 C4' DG C 1 -34.180 -48.140 256.918 1.00 38.87 C ANISOU 1689 C4' DG C 1 5358 6262 3148 -872 -700 367 C ATOM 1690 O4' DG C 1 -33.080 -49.051 256.649 1.00 37.07 O ANISOU 1690 O4' DG C 1 5001 6307 2776 -934 -462 246 O ATOM 1691 C3' DG C 1 -34.462 -48.269 258.412 1.00 32.39 C ANISOU 1691 C3' DG C 1 4320 5280 2709 -798 -622 334 C ATOM 1692 O3' DG C 1 -35.441 -49.254 258.618 1.00 31.97 O ANISOU 1692 O3' DG C 1 4085 5137 2926 -639 -689 142 O ATOM 1693 C2' DG C 1 -33.103 -48.657 258.982 1.00 32.67 C ANISOU 1693 C2' DG C 1 4237 5483 2695 -898 -349 330 C ATOM 1694 C1' DG C 1 -32.535 -49.535 257.875 1.00 33.99 C ANISOU 1694 C1' DG C 1 4381 5899 2636 -912 -285 187 C ATOM 1695 N9 DG C 1 -31.079 -49.522 257.758 1.00 33.43 N ANISOU 1695 N9 DG C 1 4260 6071 2370 -1063 -59 169 N ATOM 1696 C8 DG C 1 -30.248 -48.429 257.683 1.00 33.90 C ANISOU 1696 C8 DG C 1 4439 6208 2232 -1282 56 334 C ATOM 1697 N7 DG C 1 -28.992 -48.746 257.527 1.00 33.82 N ANISOU 1697 N7 DG C 1 4290 6456 2105 -1394 276 209 N ATOM 1698 C5 DG C 1 -28.997 -50.134 257.482 1.00 34.15 C ANISOU 1698 C5 DG C 1 4125 6582 2271 -1208 272 -57 C ATOM 1699 C6 DG C 1 -27.930 -51.049 257.332 1.00 34.20 C ANISOU 1699 C6 DG C 1 3894 6836 2267 -1185 418 -338 C ATOM 1700 O6 DG C 1 -26.728 -50.806 257.181 1.00 35.80 O ANISOU 1700 O6 DG C 1 3983 7276 2345 -1342 618 -433 O ATOM 1701 N1 DG C 1 -28.378 -52.366 257.326 1.00 36.40 N ANISOU 1701 N1 DG C 1 4043 7063 2723 -956 297 -554 N ATOM 1702 C2 DG C 1 -29.692 -52.750 257.446 1.00 37.57 C ANISOU 1702 C2 DG C 1 4267 6968 3040 -808 101 -501 C ATOM 1703 N2 DG C 1 -29.936 -54.067 257.419 1.00 36.34 N ANISOU 1703 N2 DG C 1 3973 6769 3063 -628 5 -728 N ATOM 1704 N3 DG C 1 -30.698 -51.902 257.603 1.00 37.45 N ANISOU 1704 N3 DG C 1 4429 6751 3050 -835 -8 -271 N ATOM 1705 C4 DG C 1 -30.276 -50.619 257.609 1.00 34.62 C ANISOU 1705 C4 DG C 1 4214 6425 2515 -1020 70 -62 C ATOM 1706 H5' DG C 1 -34.549 -46.144 256.645 1.00 52.48 H ATOM 1707 H5'' DG C 1 -33.026 -46.448 256.941 1.00 52.48 H ATOM 1708 H4' DG C 1 -34.961 -48.437 256.424 1.00 46.67 H ATOM 1709 H3' DG C 1 -34.753 -47.419 258.776 1.00 38.90 H ATOM 1710 H2' DG C 1 -32.549 -47.872 259.119 1.00 39.24 H ATOM 1711 H2'' DG C 1 -33.204 -49.160 259.805 1.00 39.24 H ATOM 1712 H1' DG C 1 -32.832 -50.448 258.014 1.00 40.82 H ATOM 1713 H8 DG C 1 -30.548 -47.552 257.754 1.00 40.70 H ATOM 1714 H1 DG C 1 -27.790 -52.986 257.229 1.00 43.70 H ATOM 1715 H21 DG C 1 -30.741 -54.358 257.503 1.00 43.63 H ATOM 1716 H22 DG C 1 -29.287 -54.622 257.318 1.00 43.63 H ATOM 1717 HO5' DG C 1 -33.113 -47.366 254.729 1.00 63.46 H ATOM 1718 P DC C 2 -35.977 -49.629 260.080 1.00 34.38 P ANISOU 1718 P DC C 2 4183 5281 3599 -585 -589 78 P ATOM 1719 OP1 DC C 2 -37.432 -49.882 259.937 1.00 34.09 O ANISOU 1719 OP1 DC C 2 4044 5095 3813 -466 -762 -82 O ATOM 1720 OP2 DC C 2 -35.450 -48.656 261.065 1.00 33.66 O ANISOU 1720 OP2 DC C 2 4140 5141 3510 -665 -493 233 O ATOM 1721 O5' DC C 2 -35.320 -51.054 260.337 1.00 33.13 O ANISOU 1721 O5' DC C 2 3886 5220 3482 -575 -418 -37 O ATOM 1722 C5' DC C 2 -35.583 -52.095 259.434 1.00 35.17 C ANISOU 1722 C5' DC C 2 4085 5539 3739 -499 -498 -210 C ATOM 1723 C4' DC C 2 -34.977 -53.380 259.922 1.00 35.89 C ANISOU 1723 C4' DC C 2 4055 5649 3934 -477 -377 -319 C ATOM 1724 O4' DC C 2 -33.537 -53.342 259.737 1.00 35.26 O ANISOU 1724 O4' DC C 2 3998 5771 3627 -524 -268 -306 O ATOM 1725 C3' DC C 2 -35.215 -53.640 261.401 1.00 35.15 C ANISOU 1725 C3' DC C 2 3908 5366 4080 -504 -265 -266 C ATOM 1726 O3' DC C 2 -35.632 -54.973 261.603 1.00 37.92 O ANISOU 1726 O3' DC C 2 4173 5596 4640 -466 -276 -400 O ATOM 1727 C2' DC C 2 -33.869 -53.332 262.052 1.00 32.78 C ANISOU 1727 C2' DC C 2 3660 5153 3644 -550 -142 -166 C ATOM 1728 C1' DC C 2 -32.889 -53.668 260.949 1.00 34.32 C ANISOU 1728 C1' DC C 2 3832 5577 3630 -532 -157 -278 C ATOM 1729 N1 DC C 2 -31.623 -52.912 260.980 1.00 33.68 N ANISOU 1729 N1 DC C 2 3776 5670 3350 -616 -52 -212 N ATOM 1730 C2 DC C 2 -30.415 -53.599 260.895 1.00 34.29 C ANISOU 1730 C2 DC C 2 3747 5899 3381 -586 2 -375 C ATOM 1731 O2 DC C 2 -30.427 -54.828 260.840 1.00 36.89 O ANISOU 1731 O2 DC C 2 3995 6186 3835 -468 -69 -554 O ATOM 1732 N3 DC C 2 -29.264 -52.897 260.881 1.00 34.54 N ANISOU 1732 N3 DC C 2 3752 6108 3262 -686 117 -361 N ATOM 1733 C4 DC C 2 -29.294 -51.566 260.935 1.00 33.28 C ANISOU 1733 C4 DC C 2 3705 5951 2990 -828 170 -155 C ATOM 1734 N4 DC C 2 -28.127 -50.917 260.903 1.00 32.83 N ANISOU 1734 N4 DC C 2 3605 6062 2809 -961 296 -157 N ATOM 1735 C5 DC C 2 -30.520 -50.843 261.010 1.00 30.96 C ANISOU 1735 C5 DC C 2 3554 5474 2733 -840 77 27 C ATOM 1736 C6 DC C 2 -31.649 -51.549 261.022 1.00 30.62 C ANISOU 1736 C6 DC C 2 3498 5287 2849 -725 -29 -28 C ATOM 1737 H5' DC C 2 -35.207 -51.871 258.569 1.00 42.23 H ATOM 1738 H5'' DC C 2 -36.543 -52.207 259.346 1.00 42.23 H ATOM 1739 H4' DC C 2 -35.342 -54.117 259.408 1.00 43.10 H ATOM 1740 H3' DC C 2 -35.889 -53.029 261.737 1.00 42.20 H ATOM 1741 H2' DC C 2 -33.809 -52.394 262.291 1.00 39.37 H ATOM 1742 H2'' DC C 2 -33.724 -53.898 262.826 1.00 39.37 H ATOM 1743 H1' DC C 2 -32.698 -54.619 260.966 1.00 41.21 H ATOM 1744 H41 DC C 2 -28.112 -50.058 260.936 1.00 39.43 H ATOM 1745 H42 DC C 2 -27.391 -51.358 260.848 1.00 39.43 H ATOM 1746 H5 DC C 2 -30.531 -49.914 261.045 1.00 37.17 H ATOM 1747 H6 DC C 2 -32.466 -51.106 261.064 1.00 36.77 H ATOM 1748 P DC C 3 -36.241 -55.396 263.024 1.00 39.16 P ANISOU 1748 P DC C 3 4318 5525 5034 -540 -156 -348 P ATOM 1749 OP1 DC C 3 -37.109 -56.566 262.797 1.00 43.83 O ANISOU 1749 OP1 DC C 3 4817 5974 5861 -540 -209 -499 O ATOM 1750 OP2 DC C 3 -36.776 -54.197 263.725 1.00 39.59 O ANISOU 1750 OP2 DC C 3 4387 5548 5105 -600 -79 -238 O ATOM 1751 O5' DC C 3 -34.954 -55.836 263.837 1.00 36.66 O ANISOU 1751 O5' DC C 3 4100 5202 4626 -539 -89 -276 O ATOM 1752 C5' DC C 3 -34.105 -56.835 263.318 1.00 36.79 C ANISOU 1752 C5' DC C 3 4099 5265 4614 -451 -181 -406 C ATOM 1753 C4' DC C 3 -32.796 -56.878 264.079 1.00 35.89 C ANISOU 1753 C4' DC C 3 4059 5168 4408 -419 -161 -365 C ATOM 1754 O4' DC C 3 -31.980 -55.746 263.730 1.00 32.71 O ANISOU 1754 O4' DC C 3 3630 4996 3804 -433 -108 -325 O ATOM 1755 C3' DC C 3 -32.936 -56.811 265.598 1.00 35.96 C ANISOU 1755 C3' DC C 3 4218 4974 4469 -486 -81 -201 C ATOM 1756 O3' DC C 3 -32.863 -58.108 266.128 1.00 42.14 O ANISOU 1756 O3' DC C 3 5107 5534 5371 -462 -166 -235 O ATOM 1757 C2' DC C 3 -31.774 -55.908 266.059 1.00 32.57 C ANISOU 1757 C2' DC C 3 3821 4672 3880 -462 -52 -138 C ATOM 1758 C1' DC C 3 -31.052 -55.542 264.769 1.00 33.12 C ANISOU 1758 C1' DC C 3 3745 5012 3827 -424 -79 -264 C ATOM 1759 N1 DC C 3 -30.567 -54.124 264.679 1.00 33.55 N ANISOU 1759 N1 DC C 3 3788 5233 3727 -499 7 -166 N ATOM 1760 C2 DC C 3 -29.235 -53.877 264.342 1.00 34.61 C ANISOU 1760 C2 DC C 3 3835 5566 3750 -493 23 -267 C ATOM 1761 O2 DC C 3 -28.478 -54.833 264.177 1.00 37.11 O ANISOU 1761 O2 DC C 3 4065 5926 4107 -392 -48 -466 O ATOM 1762 N3 DC C 3 -28.808 -52.589 264.222 1.00 33.78 N ANISOU 1762 N3 DC C 3 3730 5588 3518 -606 109 -166 N ATOM 1763 C4 DC C 3 -29.667 -51.581 264.421 1.00 34.26 C ANISOU 1763 C4 DC C 3 3891 5561 3566 -684 131 23 C ATOM 1764 N4 DC C 3 -29.207 -50.332 264.309 1.00 35.23 N ANISOU 1764 N4 DC C 3 4040 5766 3581 -799 180 125 N ATOM 1765 C5 DC C 3 -31.034 -51.813 264.753 1.00 33.57 C ANISOU 1765 C5 DC C 3 3863 5290 3602 -653 97 84 C ATOM 1766 C6 DC C 3 -31.440 -53.088 264.860 1.00 33.95 C ANISOU 1766 C6 DC C 3 3892 5236 3769 -580 58 -12 C ATOM 1767 H5' DC C 3 -33.925 -56.647 262.384 1.00 44.17 H ATOM 1768 H5'' DC C 3 -34.544 -57.697 263.391 1.00 44.17 H ATOM 1769 H4' DC C 3 -32.323 -57.691 263.842 1.00 43.09 H ATOM 1770 H3' DC C 3 -33.784 -56.404 265.834 1.00 43.17 H ATOM 1771 H2' DC C 3 -32.116 -55.111 266.494 1.00 39.11 H ATOM 1772 H2'' DC C 3 -31.181 -56.394 266.653 1.00 39.11 H ATOM 1773 H1' DC C 3 -30.301 -56.143 264.645 1.00 39.77 H ATOM 1774 H41 DC C 3 -29.737 -49.666 264.432 1.00 42.31 H ATOM 1775 H42 DC C 3 -28.381 -50.194 264.113 1.00 42.31 H ATOM 1776 H5 DC C 3 -31.624 -51.107 264.886 1.00 40.31 H ATOM 1777 H6 DC C 3 -32.328 -53.269 265.069 1.00 40.76 H ATOM 1778 P DA C 4 -33.025 -58.367 267.705 1.00 46.73 P ANISOU 1778 P DA C 4 5933 5861 5959 -553 -102 -58 P ATOM 1779 OP1 DA C 4 -33.557 -59.740 267.806 1.00 51.43 O ANISOU 1779 OP1 DA C 4 6629 6195 6718 -601 -179 -86 O ATOM 1780 OP2 DA C 4 -33.703 -57.226 268.375 1.00 45.73 O ANISOU 1780 OP2 DA C 4 5821 5784 5770 -674 95 82 O ATOM 1781 O5' DA C 4 -31.524 -58.330 268.222 1.00 44.62 O ANISOU 1781 O5' DA C 4 5762 5618 5575 -415 -234 -77 O ATOM 1782 C5' DA C 4 -30.558 -59.082 267.563 1.00 43.38 C ANISOU 1782 C5' DA C 4 5522 5500 5463 -252 -435 -282 C ATOM 1783 C4' DA C 4 -29.172 -58.638 267.975 1.00 41.23 C ANISOU 1783 C4' DA C 4 5240 5329 5097 -130 -522 -349 C ATOM 1784 O4' DA C 4 -28.927 -57.284 267.495 1.00 36.96 O ANISOU 1784 O4' DA C 4 4524 5082 4439 -187 -361 -335 O ATOM 1785 C3' DA C 4 -28.934 -58.597 269.490 1.00 39.92 C ANISOU 1785 C3' DA C 4 5360 4940 4869 -131 -573 -186 C ATOM 1786 O3' DA C 4 -27.696 -59.172 269.788 1.00 44.22 O ANISOU 1786 O3' DA C 4 5947 5408 5447 64 -838 -352 O ATOM 1787 C2' DA C 4 -28.962 -57.121 269.811 1.00 37.44 C ANISOU 1787 C2' DA C 4 4989 4809 4428 -216 -382 -68 C ATOM 1788 C1' DA C 4 -28.377 -56.524 268.547 1.00 35.75 C ANISOU 1788 C1' DA C 4 4472 4905 4206 -188 -343 -234 C ATOM 1789 N9 DA C 4 -28.707 -55.120 268.349 1.00 33.06 N ANISOU 1789 N9 DA C 4 4050 4737 3775 -309 -161 -118 N ATOM 1790 C8 DA C 4 -29.912 -54.517 268.593 1.00 32.33 C ANISOU 1790 C8 DA C 4 4020 4592 3673 -429 -24 50 C ATOM 1791 N7 DA C 4 -29.921 -53.235 268.332 1.00 33.67 N ANISOU 1791 N7 DA C 4 4111 4904 3776 -495 60 109 N ATOM 1792 C5 DA C 4 -28.630 -52.980 267.865 1.00 32.38 C ANISOU 1792 C5 DA C 4 3831 4913 3561 -456 16 -7 C ATOM 1793 C6 DA C 4 -27.999 -51.802 267.427 1.00 31.41 C ANISOU 1793 C6 DA C 4 3609 4969 3358 -536 76 3 C ATOM 1794 N6 DA C 4 -28.621 -50.616 267.378 1.00 30.32 N ANISOU 1794 N6 DA C 4 3510 4831 3178 -640 141 154 N ATOM 1795 N1 DA C 4 -26.701 -51.881 267.064 1.00 32.41 N ANISOU 1795 N1 DA C 4 3591 5258 3466 -515 56 -168 N ATOM 1796 C2 DA C 4 -26.088 -53.070 267.124 1.00 33.93 C ANISOU 1796 C2 DA C 4 3729 5430 3733 -374 -61 -366 C ATOM 1797 N3 DA C 4 -26.581 -54.248 267.515 1.00 32.92 N ANISOU 1797 N3 DA C 4 3719 5101 3687 -261 -178 -381 N ATOM 1798 C4 DA C 4 -27.867 -54.128 267.881 1.00 31.67 C ANISOU 1798 C4 DA C 4 3719 4789 3526 -333 -113 -175 C ATOM 1799 H5' DA C 4 -30.660 -58.965 266.605 1.00 52.09 H ATOM 1800 H5'' DA C 4 -30.674 -60.018 267.786 1.00 52.09 H ATOM 1801 H4' DA C 4 -28.521 -59.235 267.573 1.00 49.50 H ATOM 1802 H3' DA C 4 -29.647 -59.060 269.958 1.00 47.94 H ATOM 1803 H2' DA C 4 -29.872 -56.814 269.951 1.00 44.96 H ATOM 1804 H2'' DA C 4 -28.404 -56.922 270.579 1.00 44.96 H ATOM 1805 H1' DA C 4 -27.413 -56.632 268.555 1.00 42.92 H ATOM 1806 H8 DA C 4 -30.655 -54.976 268.914 1.00 38.83 H ATOM 1807 H61 DA C 4 -28.193 -49.917 267.118 1.00 36.41 H ATOM 1808 H62 DA C 4 -29.447 -50.554 267.607 1.00 36.41 H ATOM 1809 H2 DA C 4 -25.199 -53.077 266.850 1.00 40.74 H ATOM 1810 P DC C 5 -27.305 -59.594 271.284 1.00 45.76 P ANISOU 1810 P DC C 5 6522 5285 5580 134 -1037 -233 P ATOM 1811 OP1 DC C 5 -27.298 -61.073 271.301 1.00 49.32 O ANISOU 1811 OP1 DC C 5 7161 5424 6154 224 -1312 -299 O ATOM 1812 OP2 DC C 5 -28.092 -58.819 272.270 1.00 48.75 O ANISOU 1812 OP2 DC C 5 7109 5618 5796 -45 -813 46 O ATOM 1813 O5' DC C 5 -25.805 -59.089 271.410 1.00 44.76 O ANISOU 1813 O5' DC C 5 6239 5311 5458 332 -1209 -456 O ATOM 1814 C5' DC C 5 -24.867 -59.423 270.391 1.00 43.77 C ANISOU 1814 C5' DC C 5 5783 5373 5473 489 -1340 -805 C ATOM 1815 C4' DC C 5 -23.761 -58.389 270.334 1.00 41.94 C ANISOU 1815 C4' DC C 5 5288 5420 5227 537 -1297 -979 C ATOM 1816 O4' DC C 5 -24.320 -57.112 269.937 1.00 35.94 O ANISOU 1816 O4' DC C 5 4404 4904 4347 316 -952 -801 O ATOM 1817 C3' DC C 5 -23.051 -58.152 271.664 1.00 42.92 C ANISOU 1817 C3' DC C 5 5619 5366 5320 663 -1509 -959 C ATOM 1818 O3' DC C 5 -21.670 -58.383 271.519 1.00 47.52 O ANISOU 1818 O3' DC C 5 5962 6033 6061 884 -1762 -1349 O ATOM 1819 C2' DC C 5 -23.366 -56.699 272.023 1.00 39.11 C ANISOU 1819 C2' DC C 5 5120 5042 4697 483 -1229 -747 C ATOM 1820 C1' DC C 5 -23.719 -56.086 270.680 1.00 36.55 C ANISOU 1820 C1' DC C 5 4479 5036 4371 309 -931 -767 C ATOM 1821 N1 DC C 5 -24.676 -54.963 270.744 1.00 35.08 N ANISOU 1821 N1 DC C 5 4347 4921 4061 99 -655 -488 N ATOM 1822 C2 DC C 5 -24.257 -53.679 270.383 1.00 34.61 C ANISOU 1822 C2 DC C 5 4084 5096 3971 -11 -499 -501 C ATOM 1823 O2 DC C 5 -23.081 -53.510 270.040 1.00 35.67 O ANISOU 1823 O2 DC C 5 3981 5398 4175 36 -548 -745 O ATOM 1824 N3 DC C 5 -25.152 -52.654 270.437 1.00 29.67 N ANISOU 1824 N3 DC C 5 3522 4492 3258 -173 -310 -268 N ATOM 1825 C4 DC C 5 -26.411 -52.892 270.797 1.00 28.11 C ANISOU 1825 C4 DC C 5 3522 4140 3019 -224 -245 -74 C ATOM 1826 N4 DC C 5 -27.262 -51.865 270.811 1.00 27.83 N ANISOU 1826 N4 DC C 5 3501 4137 2937 -352 -90 87 N ATOM 1827 C5 DC C 5 -26.857 -54.199 271.156 1.00 28.99 C ANISOU 1827 C5 DC C 5 3818 4042 3155 -155 -345 -58 C ATOM 1828 C6 DC C 5 -25.966 -55.194 271.112 1.00 33.03 C ANISOU 1828 C6 DC C 5 4320 4491 3740 4 -562 -247 C ATOM 1829 H5' DC C 5 -25.321 -59.455 269.535 1.00 52.55 H ATOM 1830 H5'' DC C 5 -24.483 -60.293 270.582 1.00 52.55 H ATOM 1831 H4' DC C 5 -23.106 -58.665 269.673 1.00 50.35 H ATOM 1832 H3' DC C 5 -23.415 -58.745 272.340 1.00 51.53 H ATOM 1833 H2' DC C 5 -24.121 -56.652 272.630 1.00 46.96 H ATOM 1834 H2'' DC C 5 -22.588 -56.263 272.405 1.00 46.96 H ATOM 1835 H1' DC C 5 -22.909 -55.796 270.234 1.00 43.89 H ATOM 1836 H41 DC C 5 -28.082 -51.988 271.040 1.00 33.43 H ATOM 1837 H42 DC C 5 -26.991 -51.079 270.591 1.00 33.43 H ATOM 1838 H5 DC C 5 -27.738 -54.353 271.413 1.00 34.81 H ATOM 1839 H6 DC C 5 -26.230 -56.057 271.340 1.00 39.67 H ATOM 1840 P DA C 6 -20.773 -58.619 272.823 1.00 50.75 P ANISOU 1840 P DA C 6 6604 6173 6506 1128 -2166 -1448 P ATOM 1841 OP1 DA C 6 -19.549 -59.344 272.420 1.00 53.92 O ANISOU 1841 OP1 DA C 6 6729 6605 7152 1401 -2501 -1934 O ATOM 1842 OP2 DA C 6 -21.648 -59.131 273.911 1.00 51.79 O ANISOU 1842 OP2 DA C 6 7295 5914 6467 1096 -2273 -1085 O ATOM 1843 O5' DA C 6 -20.379 -57.148 273.269 1.00 47.91 O ANISOU 1843 O5' DA C 6 6114 6017 6072 1032 -1983 -1401 O ATOM 1844 C5' DA C 6 -19.777 -56.270 272.351 1.00 45.58 C ANISOU 1844 C5' DA C 6 5348 6107 5861 923 -1745 -1611 C ATOM 1845 C4' DA C 6 -19.746 -54.868 272.919 1.00 44.57 C ANISOU 1845 C4' DA C 6 5219 6072 5643 783 -1569 -1449 C ATOM 1846 O4' DA C 6 -21.051 -54.264 272.783 1.00 40.60 O ANISOU 1846 O4' DA C 6 4879 5588 4959 541 -1251 -1063 O ATOM 1847 C3' DA C 6 -19.397 -54.789 274.409 1.00 47.90 C ANISOU 1847 C3' DA C 6 5951 6226 6021 962 -1869 -1409 C ATOM 1848 O3' DA C 6 -18.154 -54.122 274.576 1.00 50.69 O ANISOU 1848 O3' DA C 6 6003 6717 6538 1050 -1983 -1724 O ATOM 1849 C2' DA C 6 -20.580 -54.027 275.044 1.00 45.25 C ANISOU 1849 C2' DA C 6 5924 5818 5452 771 -1630 -986 C ATOM 1850 C1' DA C 6 -21.255 -53.373 273.850 1.00 40.34 C ANISOU 1850 C1' DA C 6 5047 5460 4819 507 -1235 -873 C ATOM 1851 N9 DA C 6 -22.700 -53.145 273.991 1.00 34.83 N ANISOU 1851 N9 DA C 6 4588 4692 3956 335 -1006 -523 N ATOM 1852 C8 DA C 6 -23.649 -54.072 274.305 1.00 33.88 C ANISOU 1852 C8 DA C 6 4770 4361 3744 327 -1019 -343 C ATOM 1853 N7 DA C 6 -24.869 -53.593 274.321 1.00 32.73 N ANISOU 1853 N7 DA C 6 4711 4229 3495 144 -762 -103 N ATOM 1854 C5 DA C 6 -24.712 -52.262 273.985 1.00 30.67 C ANISOU 1854 C5 DA C 6 4223 4175 3255 48 -610 -112 C ATOM 1855 C6 DA C 6 -25.632 -51.210 273.843 1.00 28.70 C ANISOU 1855 C6 DA C 6 3938 4008 2957 -117 -381 51 C ATOM 1856 N6 DA C 6 -26.950 -51.357 274.029 1.00 27.28 N ANISOU 1856 N6 DA C 6 3906 3750 2711 -215 -233 219 N ATOM 1857 N1 DA C 6 -25.147 -49.996 273.502 1.00 26.79 N ANISOU 1857 N1 DA C 6 3496 3919 2763 -183 -326 9 N ATOM 1858 C2 DA C 6 -23.832 -49.865 273.319 1.00 28.43 C ANISOU 1858 C2 DA C 6 3519 4220 3063 -121 -441 -192 C ATOM 1859 N3 DA C 6 -22.876 -50.781 273.426 1.00 31.07 N ANISOU 1859 N3 DA C 6 3811 4525 3469 41 -638 -404 N ATOM 1860 C4 DA C 6 -23.386 -51.968 273.770 1.00 31.64 C ANISOU 1860 C4 DA C 6 4117 4416 3488 138 -738 -346 C ATOM 1861 H5' DA C 6 -20.285 -56.271 271.525 1.00 54.72 H ATOM 1862 H5'' DA C 6 -18.871 -56.564 272.171 1.00 54.72 H ATOM 1863 H4' DA C 6 -19.103 -54.341 272.418 1.00 53.51 H ATOM 1864 H3' DA C 6 -19.344 -55.683 274.781 1.00 57.50 H ATOM 1865 H2' DA C 6 -21.186 -54.643 275.485 1.00 54.33 H ATOM 1866 H2'' DA C 6 -20.259 -53.355 275.667 1.00 54.33 H ATOM 1867 H1' DA C 6 -20.814 -52.531 273.654 1.00 48.43 H ATOM 1868 H8 DA C 6 -23.449 -54.961 274.491 1.00 40.69 H ATOM 1869 H61 DA C 6 -27.476 -50.683 273.932 1.00 32.77 H ATOM 1870 H62 DA C 6 -27.270 -52.125 274.247 1.00 32.77 H ATOM 1871 H2 DA C 6 -23.545 -49.013 273.082 1.00 34.14 H ATOM 1872 P DC C 7 -17.423 -54.060 276.008 1.00 53.05 P ANISOU 1872 P DC C 7 6532 6772 6852 1309 -2393 -1833 P ATOM 1873 OP1 DC C 7 -15.976 -54.190 275.759 1.00 57.41 O ANISOU 1873 OP1 DC C 7 6667 7442 7706 1502 -2642 -2355 O ATOM 1874 OP2 DC C 7 -18.089 -54.952 276.981 1.00 54.09 O ANISOU 1874 OP2 DC C 7 7243 6530 6779 1440 -2640 -1578 O ATOM 1875 O5' DC C 7 -17.686 -52.566 276.478 1.00 49.78 O ANISOU 1875 O5' DC C 7 6120 6461 6334 1121 -2152 -1631 O ATOM 1876 C5' DC C 7 -17.421 -51.505 275.596 1.00 47.14 C ANISOU 1876 C5' DC C 7 5363 6437 6112 883 -1831 -1705 C ATOM 1877 C4' DC C 7 -18.053 -50.227 276.102 1.00 44.00 C ANISOU 1877 C4' DC C 7 5100 6039 5580 708 -1633 -1418 C ATOM 1878 O4' DC C 7 -19.472 -50.286 275.891 1.00 40.96 O ANISOU 1878 O4' DC C 7 4965 5613 4984 550 -1386 -1045 O ATOM 1879 C3' DC C 7 -17.865 -49.971 277.601 1.00 43.33 C ANISOU 1879 C3' DC C 7 5321 5730 5412 905 -1920 -1403 C ATOM 1880 O3' DC C 7 -17.062 -48.833 277.801 1.00 45.55 O ANISOU 1880 O3' DC C 7 5338 6113 5857 869 -1939 -1586 O ATOM 1881 C2' DC C 7 -19.284 -49.782 278.154 1.00 40.02 C ANISOU 1881 C2' DC C 7 5308 5194 4703 798 -1742 -994 C ATOM 1882 C1' DC C 7 -20.106 -49.553 276.911 1.00 38.01 C ANISOU 1882 C1' DC C 7 4869 5120 4453 531 -1365 -825 C ATOM 1883 N1 DC C 7 -21.514 -50.011 276.992 1.00 34.00 N ANISOU 1883 N1 DC C 7 4663 4515 3739 443 -1198 -518 N ATOM 1884 C2 DC C 7 -22.538 -49.120 276.650 1.00 30.51 C ANISOU 1884 C2 DC C 7 4190 4164 3238 232 -906 -309 C ATOM 1885 O2 DC C 7 -22.249 -47.955 276.347 1.00 30.62 O ANISOU 1885 O2 DC C 7 3987 4299 3346 128 -821 -344 O ATOM 1886 N3 DC C 7 -23.815 -49.545 276.692 1.00 28.54 N ANISOU 1886 N3 DC C 7 4148 3846 2849 148 -747 -92 N ATOM 1887 C4 DC C 7 -24.092 -50.805 277.027 1.00 30.34 C ANISOU 1887 C4 DC C 7 4629 3913 2984 222 -839 -42 C ATOM 1888 N4 DC C 7 -25.376 -51.164 277.059 1.00 27.71 N ANISOU 1888 N4 DC C 7 4465 3523 2540 93 -645 155 N ATOM 1889 C5 DC C 7 -23.062 -51.741 277.368 1.00 33.06 C ANISOU 1889 C5 DC C 7 5067 4127 3368 432 -1160 -211 C ATOM 1890 C6 DC C 7 -21.796 -51.304 277.327 1.00 33.13 C ANISOU 1890 C6 DC C 7 4838 4217 3531 555 -1341 -466 C ATOM 1891 H5' DC C 7 -17.782 -51.717 274.722 1.00 56.60 H ATOM 1892 H5'' DC C 7 -16.461 -51.380 275.525 1.00 56.60 H ATOM 1893 H4' DC C 7 -17.691 -49.476 275.606 1.00 52.83 H ATOM 1894 H3' DC C 7 -17.451 -50.744 278.016 1.00 52.02 H ATOM 1895 H2' DC C 7 -19.580 -50.581 278.617 1.00 48.05 H ATOM 1896 H2'' DC C 7 -19.324 -49.009 278.738 1.00 48.05 H ATOM 1897 H1' DC C 7 -20.088 -48.610 276.685 1.00 45.64 H ATOM 1898 H41 DC C 7 -25.593 -51.969 277.270 1.00 33.11 H ATOM 1899 H42 DC C 7 -25.987 -50.590 276.867 1.00 33.11 H ATOM 1900 H5 DC C 7 -23.263 -52.618 277.604 1.00 39.70 H ATOM 1901 H6 DC C 7 -21.102 -51.888 277.532 1.00 39.78 H ATOM 1902 P DC C 8 -16.617 -48.405 279.278 1.00 49.32 P ANISOU 1902 P DC C 8 6044 6400 6296 1094 -2274 -1671 P ATOM 1903 OP1 DC C 8 -15.239 -47.894 279.143 1.00 52.26 O ANISOU 1903 OP1 DC C 8 5976 6884 6998 1145 -2426 -2087 O ATOM 1904 OP2 DC C 8 -16.927 -49.501 280.230 1.00 51.38 O ANISOU 1904 OP2 DC C 8 6802 6392 6329 1343 -2574 -1576 O ATOM 1905 O5' DC C 8 -17.597 -47.199 279.609 1.00 48.29 O ANISOU 1905 O5' DC C 8 6059 6286 6002 896 -2012 -1361 O ATOM 1906 C5' DC C 8 -17.781 -46.187 278.661 1.00 44.98 C ANISOU 1906 C5' DC C 8 5334 6054 5702 604 -1690 -1289 C ATOM 1907 C4' DC C 8 -18.895 -45.256 279.074 1.00 40.49 C ANISOU 1907 C4' DC C 8 4978 5439 4967 484 -1519 -1002 C ATOM 1908 O4' DC C 8 -20.163 -45.900 278.850 1.00 38.27 O ANISOU 1908 O4' DC C 8 4942 5131 4467 421 -1331 -726 O ATOM 1909 C3' DC C 8 -18.871 -44.834 280.547 1.00 41.49 C ANISOU 1909 C3' DC C 8 5376 5410 4976 680 -1753 -1036 C ATOM 1910 O3' DC C 8 -18.836 -43.412 280.642 1.00 42.98 O ANISOU 1910 O3' DC C 8 5411 5629 5288 562 -1694 -1051 O ATOM 1911 C2' DC C 8 -20.147 -45.430 281.139 1.00 39.08 C ANISOU 1911 C2' DC C 8 5501 5011 4337 710 -1658 -766 C ATOM 1912 C1' DC C 8 -21.036 -45.623 279.919 1.00 37.58 C ANISOU 1912 C1' DC C 8 5188 4931 4159 477 -1330 -568 C ATOM 1913 N1 DC C 8 -21.998 -46.763 280.030 1.00 35.23 N ANISOU 1913 N1 DC C 8 5190 4558 3637 482 -1239 -378 N ATOM 1914 C2 DC C 8 -23.381 -46.525 280.022 1.00 32.78 C ANISOU 1914 C2 DC C 8 5002 4268 3185 335 -974 -161 C ATOM 1915 O2 DC C 8 -23.801 -45.354 279.951 1.00 31.73 O ANISOU 1915 O2 DC C 8 4745 4199 3111 239 -856 -136 O ATOM 1916 N3 DC C 8 -24.224 -47.589 280.113 1.00 30.59 N ANISOU 1916 N3 DC C 8 4968 3920 2735 301 -873 -9 N ATOM 1917 C4 DC C 8 -23.733 -48.829 280.196 1.00 32.57 C ANISOU 1917 C4 DC C 8 5379 4053 2943 413 -1053 -37 C ATOM 1918 N4 DC C 8 -24.598 -49.848 280.266 1.00 33.60 N ANISOU 1918 N4 DC C 8 5763 4084 2921 342 -949 130 N ATOM 1919 C5 DC C 8 -22.332 -49.083 280.200 1.00 34.69 C ANISOU 1919 C5 DC C 8 5539 4286 3357 602 -1367 -268 C ATOM 1920 C6 DC C 8 -21.512 -48.033 280.109 1.00 35.02 C ANISOU 1920 C6 DC C 8 5295 4431 3578 625 -1433 -445 C ATOM 1921 H5' DC C 8 -18.002 -46.588 277.806 1.00 54.00 H ATOM 1922 H5'' DC C 8 -16.958 -45.680 278.572 1.00 54.00 H ATOM 1923 H4' DC C 8 -18.851 -44.458 278.524 1.00 48.61 H ATOM 1924 H3' DC C 8 -18.094 -45.215 280.987 1.00 49.81 H ATOM 1925 H2' DC C 8 -19.961 -46.282 281.565 1.00 46.93 H ATOM 1926 H2'' DC C 8 -20.555 -44.813 281.766 1.00 46.93 H ATOM 1927 H1' DC C 8 -21.521 -44.803 279.738 1.00 45.12 H ATOM 1928 H41 DC C 8 -24.308 -50.655 280.320 1.00 40.35 H ATOM 1929 H42 DC C 8 -25.444 -49.695 280.256 1.00 40.35 H ATOM 1930 H5 DC C 8 -22.001 -49.950 280.250 1.00 41.66 H ATOM 1931 H6 DC C 8 -20.592 -48.171 280.106 1.00 42.05 H ATOM 1932 P DT C 9 -18.612 -42.682 282.056 1.00 47.60 P ANISOU 1932 P DT C 9 6174 6090 5820 755 -1949 -1170 P ATOM 1933 OP1 DT C 9 -18.123 -41.320 281.720 1.00 49.78 O ANISOU 1933 OP1 DT C 9 6129 6403 6381 597 -1923 -1277 O ATOM 1934 OP2 DT C 9 -17.841 -43.575 282.951 1.00 46.89 O ANISOU 1934 OP2 DT C 9 6276 5888 5652 1055 -2305 -1364 O ATOM 1935 O5' DT C 9 -20.095 -42.536 282.638 1.00 42.57 O ANISOU 1935 O5' DT C 9 5888 5417 4870 733 -1775 -906 O ATOM 1936 C5' DT C 9 -21.012 -41.721 281.962 1.00 38.70 C ANISOU 1936 C5' DT C 9 5282 4991 4432 512 -1507 -738 C ATOM 1937 C4' DT C 9 -22.361 -41.751 282.638 1.00 37.48 C ANISOU 1937 C4' DT C 9 5423 4820 3998 531 -1363 -582 C ATOM 1938 O4' DT C 9 -22.975 -43.040 282.427 1.00 36.56 O ANISOU 1938 O4' DT C 9 5495 4714 3683 506 -1223 -424 O ATOM 1939 C3' DT C 9 -22.323 -41.534 284.154 1.00 40.42 C ANISOU 1939 C3' DT C 9 6079 5124 4154 740 -1546 -696 C ATOM 1940 O3' DT C 9 -23.085 -40.365 284.487 1.00 42.48 O ANISOU 1940 O3' DT C 9 6307 5405 4427 702 -1461 -715 O ATOM 1941 C2' DT C 9 -22.913 -42.827 284.740 1.00 39.26 C ANISOU 1941 C2' DT C 9 6326 4949 3644 797 -1480 -559 C ATOM 1942 C1' DT C 9 -23.702 -43.395 283.581 1.00 37.38 C ANISOU 1942 C1' DT C 9 5967 4774 3461 592 -1194 -367 C ATOM 1943 N1 DT C 9 -23.866 -44.876 283.571 1.00 36.00 N ANISOU 1943 N1 DT C 9 6043 4540 3097 599 -1171 -242 N ATOM 1944 C2 DT C 9 -25.125 -45.404 283.428 1.00 35.63 C ANISOU 1944 C2 DT C 9 6126 4521 2890 446 -884 -60 C ATOM 1945 O2 DT C 9 -26.126 -44.720 283.355 1.00 35.41 O ANISOU 1945 O2 DT C 9 6005 4582 2867 329 -655 -28 O ATOM 1946 N3 DT C 9 -25.176 -46.776 283.385 1.00 34.84 N ANISOU 1946 N3 DT C 9 6260 4325 2653 439 -898 55 N ATOM 1947 C4 DT C 9 -24.114 -47.649 283.458 1.00 36.17 C ANISOU 1947 C4 DT C 9 6547 4363 2834 599 -1201 -8 C ATOM 1948 O4 DT C 9 -24.267 -48.863 283.407 1.00 38.76 O ANISOU 1948 O4 DT C 9 7105 4570 3051 588 -1231 101 O ATOM 1949 C5 DT C 9 -22.813 -47.032 283.603 1.00 39.21 C ANISOU 1949 C5 DT C 9 6751 4744 3402 782 -1504 -241 C ATOM 1950 C7 DT C 9 -21.578 -47.883 283.702 1.00 43.73 C ANISOU 1950 C7 DT C 9 7384 5182 4050 1000 -1887 -402 C ATOM 1951 C6 DT C 9 -22.750 -45.689 283.640 1.00 36.04 C ANISOU 1951 C6 DT C 9 6112 4446 3135 756 -1456 -338 C ATOM 1952 H5' DT C 9 -21.106 -42.037 281.049 1.00 46.47 H ATOM 1953 H5'' DT C 9 -20.681 -40.810 281.951 1.00 46.47 H ATOM 1954 H4' DT C 9 -22.923 -41.068 282.239 1.00 45.00 H ATOM 1955 H3' DT C 9 -21.405 -41.426 284.449 1.00 48.53 H ATOM 1956 H2' DT C 9 -22.207 -43.436 285.006 1.00 47.15 H ATOM 1957 H2'' DT C 9 -23.498 -42.628 285.488 1.00 47.15 H ATOM 1958 H1' DT C 9 -24.576 -42.975 283.551 1.00 44.88 H ATOM 1959 H3 DT C 9 -25.957 -47.128 283.304 1.00 41.84 H ATOM 1960 H71 DT C 9 -20.978 -47.669 282.971 1.00 52.50 H ATOM 1961 H72 DT C 9 -21.133 -47.711 284.546 1.00 52.50 H ATOM 1962 H73 DT C 9 -21.826 -48.820 283.652 1.00 52.50 H ATOM 1963 H6 DT C 9 -21.915 -45.288 283.726 1.00 43.27 H ATOM 1964 P DC C 10 -23.054 -39.725 285.963 1.00 44.64 P ANISOU 1964 P DC C 10 6792 5644 4524 904 -1641 -895 P ATOM 1965 OP1 DC C 10 -23.272 -38.259 285.832 1.00 43.82 O ANISOU 1965 OP1 DC C 10 6454 5528 4669 858 -1664 -1000 O ATOM 1966 OP2 DC C 10 -21.843 -40.178 286.678 1.00 45.09 O ANISOU 1966 OP2 DC C 10 6987 5619 4526 1116 -1970 -1049 O ATOM 1967 O5' DC C 10 -24.374 -40.334 286.618 1.00 43.74 O ANISOU 1967 O5' DC C 10 7005 5605 4010 880 -1385 -770 O ATOM 1968 C5' DC C 10 -25.627 -40.107 285.989 1.00 39.32 C ANISOU 1968 C5' DC C 10 6313 5130 3499 702 -1077 -666 C ATOM 1969 C4' DC C 10 -26.704 -41.000 286.570 1.00 38.68 C ANISOU 1969 C4' DC C 10 6527 5125 3043 639 -809 -561 C ATOM 1970 O4' DC C 10 -26.580 -42.327 286.023 1.00 37.78 O ANISOU 1970 O4' DC C 10 6527 4968 2861 555 -744 -367 O ATOM 1971 C3' DC C 10 -26.641 -41.193 288.092 1.00 40.22 C ANISOU 1971 C3' DC C 10 7124 5334 2824 779 -876 -649 C ATOM 1972 O3' DC C 10 -27.433 -40.226 288.756 1.00 43.96 O ANISOU 1972 O3' DC C 10 7556 5924 3224 802 -759 -829 O ATOM 1973 C2' DC C 10 -27.174 -42.607 288.315 1.00 40.98 C ANISOU 1973 C2' DC C 10 7572 5426 2573 658 -670 -440 C ATOM 1974 C1' DC C 10 -27.209 -43.233 286.907 1.00 40.61 C ANISOU 1974 C1' DC C 10 7281 5339 2811 517 -586 -275 C ATOM 1975 N1 DC C 10 -26.513 -44.530 286.836 1.00 41.23 N ANISOU 1975 N1 DC C 10 7610 5279 2778 551 -739 -137 N ATOM 1976 C2 DC C 10 -27.250 -45.679 286.588 1.00 41.51 C ANISOU 1976 C2 DC C 10 7822 5286 2662 379 -515 61 C ATOM 1977 O2 DC C 10 -28.468 -45.579 286.426 1.00 37.72 O ANISOU 1977 O2 DC C 10 7254 4921 2157 191 -171 100 O ATOM 1978 N3 DC C 10 -26.613 -46.869 286.539 1.00 42.54 N ANISOU 1978 N3 DC C 10 8203 5251 2711 430 -707 172 N ATOM 1979 C4 DC C 10 -25.298 -46.930 286.738 1.00 44.38 C ANISOU 1979 C4 DC C 10 8486 5366 3011 662 -1109 62 C ATOM 1980 N4 DC C 10 -24.714 -48.128 286.677 1.00 46.68 N ANISOU 1980 N4 DC C 10 9007 5474 3256 736 -1332 134 N ATOM 1981 C5 DC C 10 -24.524 -45.764 287.005 1.00 43.81 C ANISOU 1981 C5 DC C 10 8203 5342 3099 831 -1321 -160 C ATOM 1982 C6 DC C 10 -25.168 -44.596 287.053 1.00 41.68 C ANISOU 1982 C6 DC C 10 7717 5220 2900 759 -1124 -236 C ATOM 1983 H5' DC C 10 -25.544 -40.287 285.039 1.00 47.22 H ATOM 1984 H5'' DC C 10 -25.882 -39.179 286.115 1.00 47.22 H ATOM 1985 H4' DC C 10 -27.573 -40.641 286.334 1.00 46.44 H ATOM 1986 H3' DC C 10 -25.722 -41.134 288.395 1.00 48.29 H ATOM 1987 HO3' DC C 10 -28.071 -40.469 289.246 1.00 52.78 H ATOM 1988 H2' DC C 10 -26.575 -43.107 288.893 1.00 49.20 H ATOM 1989 H2'' DC C 10 -28.066 -42.577 288.694 1.00 49.20 H ATOM 1990 H1' DC C 10 -28.132 -43.352 286.635 1.00 48.76 H ATOM 1991 H41 DC C 10 -23.866 -48.199 286.801 1.00 56.05 H ATOM 1992 H42 DC C 10 -25.185 -48.828 286.514 1.00 56.05 H ATOM 1993 H5 DC C 10 -23.605 -45.814 287.136 1.00 52.59 H ATOM 1994 H6 DC C 10 -24.691 -43.815 287.218 1.00 50.04 H TER 1995 DC C 10 HETATM 1996 ZN ZN A 501 -26.938 -67.029 286.695 1.00 46.44 ZN HETATM 1997 ZN ZN A 502 -46.091 -48.981 274.689 1.00 33.39 ZN HETATM 1998 ZN ZN A 503 -25.643 -33.081 265.877 1.00 36.05 ZN HETATM 1999 O HOH A 601 -38.986 -58.230 280.058 1.00 44.28 O HETATM 2000 O HOH A 602 -45.074 -51.151 266.642 1.00 39.21 O HETATM 2001 O HOH A 603 -49.354 -43.732 276.228 1.00 63.00 O HETATM 2002 O HOH A 604 -15.204 -39.649 260.910 1.00 61.81 O HETATM 2003 O HOH A 605 -17.650 -41.448 264.786 1.00 41.03 O HETATM 2004 O HOH A 606 -32.519 -57.269 282.180 1.00 46.45 O HETATM 2005 O HOH A 607 -28.885 -47.834 261.641 1.00 66.86 O HETATM 2006 O HOH A 608 -34.616 -52.986 265.789 1.00 31.19 O HETATM 2007 O HOH A 609 -32.364 -41.104 254.713 1.00 72.08 O HETATM 2008 O HOH A 610 -37.148 -53.377 278.639 1.00 36.89 O HETATM 2009 O HOH A 611 -31.230 -40.402 268.135 1.00 52.61 O HETATM 2010 O HOH A 612 -19.513 -63.943 292.461 1.00 54.24 O HETATM 2011 O HOH A 613 -38.878 -41.555 273.367 1.00 37.36 O HETATM 2012 O HOH A 614 -32.809 -44.979 275.115 1.00 27.30 O HETATM 2013 O HOH A 615 -19.643 -62.264 280.824 1.00 47.22 O HETATM 2014 O HOH A 616 -47.314 -44.956 270.021 1.00 35.04 O HETATM 2015 O HOH A 617 -30.755 -47.936 265.908 1.00 30.48 O HETATM 2016 O HOH A 618 -24.006 -38.492 255.633 1.00 56.30 O HETATM 2017 O HOH A 619 -33.061 -37.788 260.916 1.00 35.40 O HETATM 2018 O HOH A 620 -40.256 -47.231 277.917 1.00 36.76 O HETATM 2019 O HOH A 621 -34.691 -36.389 261.955 1.00 31.74 O HETATM 2020 O HOH A 622 -39.521 -64.555 278.810 1.00 51.91 O HETATM 2021 O HOH A 623 -34.425 -54.249 268.259 1.00 29.99 O HETATM 2022 O HOH A 624 -36.548 -47.665 275.395 1.00 30.65 O HETATM 2023 O HOH A 625 -26.265 -48.406 261.178 1.00 38.64 O HETATM 2024 O HOH A 626 -32.237 -58.006 272.562 1.00 47.82 O HETATM 2025 O HOH A 627 -25.538 -33.261 258.943 1.00 32.88 O HETATM 2026 O HOH A 628 -36.030 -37.677 268.776 1.00 31.05 O HETATM 2027 O HOH A 629 -36.342 -41.920 271.730 1.00 29.99 O HETATM 2028 O HOH A 630 -34.946 -53.986 277.883 1.00 30.85 O HETATM 2029 O HOH A 631 -33.678 -51.538 278.759 1.00 29.32 O HETATM 2030 O HOH A 632 -22.630 -44.704 255.172 1.00 40.37 O HETATM 2031 O HOH A 633 -31.650 -53.478 273.698 1.00 42.85 O HETATM 2032 O HOH A 634 -43.780 -47.336 264.064 1.00 35.73 O HETATM 2033 O HOH A 635 -41.805 -37.454 265.227 1.00 37.38 O HETATM 2034 O HOH A 636 -33.197 -28.360 268.464 1.00 69.42 O HETATM 2035 O HOH A 637 -33.838 -47.482 275.897 1.00 24.81 O HETATM 2036 O HOH A 638 -18.527 -37.455 267.224 1.00 46.54 O HETATM 2037 O HOH A 639 -43.269 -40.473 263.023 1.00 35.50 O HETATM 2038 O HOH A 640 -41.223 -58.835 273.438 1.00 52.61 O HETATM 2039 O HOH A 641 -33.205 -47.196 264.544 1.00 27.99 O HETATM 2040 O HOH A 642 -43.452 -40.503 273.202 1.00 35.86 O HETATM 2041 O HOH A 643 -28.191 -43.279 267.435 1.00 37.94 O HETATM 2042 O HOH A 644 -34.535 -55.194 275.461 1.00 45.39 O HETATM 2043 O HOH A 645 -32.739 -45.641 262.392 1.00 41.76 O HETATM 2044 O HOH A 646 -43.726 -39.038 265.655 1.00 45.91 O HETATM 2045 O HOH A 647 -47.221 -41.146 275.746 1.00 62.09 O HETATM 2046 O HOH A 648 -19.936 -38.790 268.065 1.00 47.91 O HETATM 2047 O HOH A 649 -28.689 -46.422 263.602 1.00 42.16 O HETATM 2048 O HOH A 650 -17.403 -64.834 292.797 1.00 70.85 O HETATM 2049 O HOH A 651 -29.035 -41.221 268.961 1.00 54.77 O HETATM 2050 O HOH B 101 -25.546 -42.611 267.910 1.00 39.32 O HETATM 2051 O HOH B 102 -36.458 -44.565 276.144 1.00 36.73 O HETATM 2052 O HOH B 103 -19.639 -48.486 261.708 1.00 36.92 O HETATM 2053 O HOH B 104 -20.216 -43.973 263.559 1.00 44.47 O HETATM 2054 O HOH B 105 -26.721 -38.019 271.696 1.00 38.80 O HETATM 2055 O HOH B 106 -22.335 -51.361 258.897 1.00 36.55 O HETATM 2056 O HOH B 107 -30.767 -50.441 272.618 1.00 35.17 O HETATM 2057 O HOH B 108 -25.196 -42.788 276.850 1.00 27.61 O HETATM 2058 O HOH B 109 -30.444 -42.732 271.739 1.00 36.27 O HETATM 2059 O HOH B 110 -26.647 -38.983 269.318 1.00 35.93 O HETATM 2060 O HOH B 111 -38.046 -48.385 277.587 1.00 36.55 O HETATM 2061 O HOH B 112 -31.805 -45.207 283.861 1.00 39.95 O HETATM 2062 O HOH B 113 -22.202 -45.409 273.190 1.00 42.02 O HETATM 2063 O HOH B 114 -29.235 -42.678 280.873 1.00 43.92 O HETATM 2064 O HOH B 115 -19.915 -47.953 270.953 1.00 37.04 O HETATM 2065 O HOH B 116 -34.067 -48.834 278.351 1.00 30.52 O HETATM 2066 O HOH B 117 -33.513 -52.726 281.335 1.00 26.42 O HETATM 2067 O HOH B 118 -28.847 -46.408 265.761 1.00 30.35 O HETATM 2068 O HOH B 119 -33.251 -46.824 286.326 1.00 55.64 O HETATM 2069 O HOH C 101 -20.721 -46.617 274.793 1.00 44.73 O HETATM 2070 O HOH C 102 -22.979 -51.087 283.881 1.00 37.98 O HETATM 2071 O HOH C 103 -33.637 -49.622 262.873 1.00 30.75 O HETATM 2072 O HOH C 104 -32.624 -55.335 258.035 1.00 39.46 O HETATM 2073 O HOH C 105 -23.808 -57.704 275.113 1.00 34.62 O HETATM 2074 O HOH C 106 -20.209 -49.856 272.943 1.00 40.43 O HETATM 2075 O HOH C 107 -29.686 -57.288 274.116 1.00 42.60 O HETATM 2076 O HOH C 108 -28.171 -42.649 282.952 1.00 36.53 O HETATM 2077 O HOH C 109 -33.099 -59.798 270.810 1.00 70.60 O HETATM 2078 O HOH C 110 -28.752 -53.635 275.048 1.00 44.26 O HETATM 2079 O HOH C 111 -25.259 -38.173 289.562 1.00 52.96 O CONECT 50 1998 CONECT 110 1998 CONECT 314 1998 CONECT 388 1998 CONECT 511 1997 CONECT 576 1997 CONECT 792 1997 CONECT 876 1997 CONECT 1002 1996 CONECT 1051 1996 CONECT 1254 1996 CONECT 1334 1996 CONECT 1996 1002 1051 1254 1334 CONECT 1997 511 576 792 876 CONECT 1998 50 110 314 388 MASTER 384 0 3 3 6 0 3 6 1195 3 15 10 END
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Related entries of code: 5ke6
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4m9e
RCSB PDB
PDBbind
88aa, >4M9E_1|Chain... at 100%
5ke8
RCSB PDB
PDBbind
93aa, >5KE8_1|Chain... at 98%
5ke9
RCSB PDB
PDBbind
93aa, >5KE9_1|Chain... at 98%
5keb
RCSB PDB
PDBbind
93aa, >5KEB_1|Chain... at 98%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
5ke9
RCSB PDB
PDBbind
10-mer WT-TpG DNA, sequence is T/A
Entry Information
PDB ID
5ke6
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
mouse Krueppel-like factor 4, Klf4 ZnF1-3
Ligand Name
10-mer WT-TpG DNA, sequence is T/A
EC.Number
E.C.-.-.-.-
Resolution
1.99(Å)
Affinity (Kd/Ki/IC50)
Kd=0.19uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Nucleic Acids Res. Vol. 44: pp. 10177-10185
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q60793
Entrez Gene ID
NCBI Entrez Gene ID:
16600
ASD
Information of known allosteric effects of PDB entries
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