Browse entries in the PDBbind-CN Database
HEADER TRANSFERASE/DNA 26-FEB-15 4YGI TITLE CRYSTAL STRUCTURE OF SUVH5 SRA BOUND TO FULLY HYDROXYMETHYLATED CG DNA COMPND MOL_ID: 1; COMPND 2 MOLECULE: HISTONE-LYSINE N-METHYLTRANSFERASE, H3 LYSINE-9 SPECIFIC COMPND 3 SUVH5; COMPND 4 CHAIN: A; COMPND 5 FRAGMENT: SUVH5 SRA DOMAIN, UNP RESIDUES 362-528; COMPND 6 SYNONYM: HISTONE H3-K9 METHYLTRANSFERASE 5,H3-K9-HMTASE 5,PROTEIN SET COMPND 7 DOMAIN GROUP 9,SUPPRESSOR OF VARIEGATION 3-9 HOMOLOG PROTEIN 5, COMPND 8 SU(VAR)3-9 HOMOLOG PROTEIN 5; COMPND 9 EC: 2.1.1.43; COMPND 10 ENGINEERED: YES; COMPND 11 MOL_ID: 2; COMPND 12 MOLECULE: POLYDEOXYRIBONUCLEOTIDE; COMPND 13 CHAIN: B; COMPND 14 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ARABIDOPSIS THALIANA; SOURCE 3 ORGANISM_COMMON: MOUSE-EAR CRESS; SOURCE 4 ORGANISM_TAXID: 3702; SOURCE 5 GENE: SUVH5, SDG9, SET9, AT2G35160, T4C15.17; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: ROSETTA2 DE3; SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PETSUMO; SOURCE 11 MOL_ID: 2; SOURCE 12 SYNTHETIC: YES; SOURCE 13 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; SOURCE 14 ORGANISM_TAXID: 32630; SOURCE 15 OTHER_DETAILS: CHEMICALLY SYNTHESIZED KEYWDS SUVH5 SRA, FULLY HYDROXYMETHYLATED CG, 5-HYDROXYMETHYLCYTOSINE, 5HMC KEYWDS 2 BINDING PROTEIN., TRANSFERASE-DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR E.RAJAKUMARA REVDAT 2 02-MAR-16 4YGI 1 JRNL REVDAT 1 17-FEB-16 4YGI 0 JRNL AUTH E.RAJAKUMARA,N.K.NAKARAKANTI,M.A.NIVYA,M.SATISH JRNL TITL MECHANISTIC INSIGHTS INTO THE RECOGNITION OF JRNL TITL 2 5-METHYLCYTOSINE OXIDATION DERIVATIVES BY THE SUVH5 SRA JRNL TITL 3 DOMAIN JRNL REF SCI REP V. 6 20161 2016 JRNL REFN ESSN 2045-2322 JRNL PMID 26841909 JRNL DOI 10.1038/SREP20161 REMARK 2 REMARK 2 RESOLUTION. 2.60 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX 1.9_1692 REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE, REMARK 3 : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER, REMARK 3 : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY, REMARK 3 : REETAL PAI,RANDY READ,JANE RICHARDSON, REMARK 3 : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI, REMARK 3 : NICHOLAS SAUTER,JACOB SMITH,LAURENT REMARK 3 : STORONI,TOM TERWILLIGER,PETER ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : ML REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.60 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 33.96 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.350 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.0 REMARK 3 NUMBER OF REFLECTIONS : 7039 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.237 REMARK 3 R VALUE (WORKING SET) : 0.235 REMARK 3 FREE R VALUE : 0.283 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.700 REMARK 3 FREE R VALUE TEST SET COUNT : 331 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 33.9586 - 3.2698 0.98 3430 159 0.2188 0.2544 REMARK 3 2 3.2698 - 2.5956 0.99 3278 172 0.2979 0.3905 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) : 0.410 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 35.320 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 70.40 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 68.38 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 : 0.003 1381 REMARK 3 ANGLE : 0.607 1910 REMARK 3 CHIRALITY : 0.024 211 REMARK 3 PLANARITY : 0.003 215 REMARK 3 DIHEDRAL : 17.280 515 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 NCS DETAILS REMARK 3 NUMBER OF NCS GROUPS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 4YGI COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 02-MAR-15. REMARK 100 THE DEPOSITION ID IS D_1000207324. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 08-NOV-11 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 6.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : NSLS REMARK 200 BEAMLINE : X29A REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.0718 REMARK 200 MONOCHROMATOR : SI(111) REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 315R REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 7060 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.600 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 98.8 REMARK 200 DATA REDUNDANCY : 4.600 REMARK 200 R MERGE (I) : 0.06600 REMARK 200 R SYM (I) : NULL REMARK 200
FOR THE DATA SET : 21.7000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.60 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.69 REMARK 200 COMPLETENESS FOR SHELL (%) : 99.1 REMARK 200 DATA REDUNDANCY IN SHELL : 4.70 REMARK 200 R MERGE FOR SHELL (I) : 0.75000 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200
FOR SHELL : 2.400 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: MOLREP REMARK 200 STARTING MODEL: 3Q0B REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 49.96 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.46 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.2M SODIUM CHLORIDE, 0.1M BIS-TRIS PH REMARK 280 6.5, 25%(W/V) POLYETHYLENE GLYCOL 3,350, VAPOR DIFFUSION, REMARK 280 SITTING DROP, TEMPERATURE 291K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 42 21 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z REMARK 290 3555 -Y+1/2,X+1/2,Z+1/2 REMARK 290 4555 Y+1/2,-X+1/2,Z+1/2 REMARK 290 5555 -X+1/2,Y+1/2,-Z+1/2 REMARK 290 6555 X+1/2,-Y+1/2,-Z+1/2 REMARK 290 7555 Y,X,-Z REMARK 290 8555 -Y,-X,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 38.49000 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 38.49000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 36.05550 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 38.49000 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 38.49000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 36.05550 REMARK 290 SMTRY1 5 -1.000000 0.000000 0.000000 38.49000 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 38.49000 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 36.05550 REMARK 290 SMTRY1 6 1.000000 0.000000 0.000000 38.49000 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 38.49000 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 36.05550 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 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TETRAMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TETRAMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 5010 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 16480 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -41.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 BIOMT1 2 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT2 2 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT3 2 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 LYS A 439 REMARK 465 ASN A 440 REMARK 465 ASN A 441 REMARK 465 ASN A 474 REMARK 465 THR A 475 REMARK 465 THR A 476 REMARK 465 LEU A 477 REMARK 465 GLN A 478 REMARK 465 SER A 479 REMARK 465 SER A 480 REMARK 465 VAL A 481 REMARK 465 VAL A 482 REMARK 465 ALA A 483 REMARK 465 LYS A 525 REMARK 465 GLU A 526 REMARK 465 VAL A 527 REMARK 465 ALA A 528 REMARK 465 DT B 11 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 LYS A 399 CG CD CE NZ REMARK 470 ASP A 401 CB CG OD1 OD2 REMARK 470 GLU A 404 CG CD OE1 OE2 REMARK 470 ASN A 417 CG OD1 ND2 REMARK 470 LYS A 437 CG CD CE NZ REMARK 470 LYS A 438 CG CD CE NZ REMARK 470 GLU A 442 CG CD OE1 OE2 REMARK 470 LYS A 473 CG CD CE NZ REMARK 470 SER A 503 CB OG REMARK 470 GLU A 521 CG CD OE1 OE2 REMARK 470 TRP A 524 CG CD1 CD2 NE1 CE2 CE3 CZ2 REMARK 470 TRP A 524 CZ3 CH2 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 TYR A 416 -146.71 -124.09 REMARK 500 ASN A 434 74.87 55.94 REMARK 500 LYS A 437 30.86 -96.45 REMARK 500 THR A 451 -123.49 53.22 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH A 711 DISTANCE = 6.58 ANGSTROMS REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue MG A 601 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue MG B 101 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue MG B 102 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 3Q0B RELATED DB: PDB REMARK 900 3Q0B CONTAINS THE SAME SUVH5 SRA COMPLEXED WITH FULLY METHYLATED CG REMARK 900 DNA IN SPACE GROUP P42212. REMARK 900 RELATED ID: 3Q0C RELATED DB: PDB REMARK 900 3Q0C CONTAINS THE SAME SUVH5 SRA COMPLEXED WITH FULLY METHYLATED CG REMARK 900 DNA IN SPACE GROUP P6122. REMARK 900 RELATED ID: 3Q0D RELATED DB: PDB REMARK 900 3Q0D CONTAINS THE SAME SUVH5 SRA COMPLEXED WITH HEMI METHYLATED CG REMARK 900 DNA. REMARK 900 RELATED ID: 3Q0F RELATED DB: PDB REMARK 900 3Q0F CONTAINS THE SAME SUVH5 SRA COMPLEXED WITH METHYLATED CHH DNA. DBREF 4YGI A 362 528 UNP O82175 SUVH5_ARATH 362 528 DBREF 4YGI B 1 11 PDB 4YGI 4YGI 1 11 SEQRES 1 A 167 GLN ILE ILE GLY THR VAL PRO GLY VAL GLU VAL GLY ASP SEQRES 2 A 167 GLU PHE GLN TYR ARG MET GLU LEU ASN LEU LEU GLY ILE SEQRES 3 A 167 HIS ARG PRO SER GLN SER GLY ILE ASP TYR MET LYS ASP SEQRES 4 A 167 ASP GLY GLY GLU LEU VAL ALA THR SER ILE VAL SER SER SEQRES 5 A 167 GLY GLY TYR ASN ASP VAL LEU ASP ASN SER ASP VAL LEU SEQRES 6 A 167 ILE TYR THR GLY GLN GLY GLY ASN VAL GLY LYS LYS LYS SEQRES 7 A 167 ASN ASN GLU PRO PRO LYS ASP GLN GLN LEU VAL THR GLY SEQRES 8 A 167 ASN LEU ALA LEU LYS ASN SER ILE ASN LYS LYS ASN PRO SEQRES 9 A 167 VAL ARG VAL ILE ARG GLY ILE LYS ASN THR THR LEU GLN SEQRES 10 A 167 SER SER VAL VAL ALA LYS ASN TYR VAL TYR ASP GLY LEU SEQRES 11 A 167 TYR LEU VAL GLU GLU TYR TRP GLU GLU THR GLY SER HIS SEQRES 12 A 167 GLY LYS LEU VAL PHE LYS PHE LYS LEU ARG ARG ILE PRO SEQRES 13 A 167 GLY GLN PRO GLU LEU PRO TRP LYS GLU VAL ALA SEQRES 1 B 11 DA DC DT DA 5HC DG DT DA DG DT DT HET 5HC B 5 21 HET MG A 601 1 HET MG B 101 1 HET MG B 102 1 HETNAM 5HC 2'-DEOXY-5-(HYDROXYMETHYL)CYTIDINE 5'-(DIHYDROGEN HETNAM 2 5HC PHOSPHATE) HETNAM MG MAGNESIUM ION FORMUL 2 5HC C10 H16 N3 O8 P FORMUL 3 MG 3(MG 2+) FORMUL 6 HOH *16(H2 O) HELIX 1 AA1 TYR A 378 LEU A 385 1 8 HELIX 2 AA2 VAL A 450 LYS A 463 1 14 SHEET 1 AA1 5 GLU A 375 PHE A 376 0 SHEET 2 AA1 5 TYR A 486 THR A 501 -1 O TYR A 486 N PHE A 376 SHEET 3 AA1 5 VAL A 466 GLY A 471 -1 N VAL A 466 O TYR A 492 SHEET 4 AA1 5 LEU A 405 SER A 412 1 N ILE A 410 O ARG A 467 SHEET 5 AA1 5 ILE A 395 LYS A 399 -1 N MET A 398 O VAL A 406 SHEET 1 AA2 4 GLU A 375 PHE A 376 0 SHEET 2 AA2 4 TYR A 486 THR A 501 -1 O TYR A 486 N PHE A 376 SHEET 3 AA2 4 LEU A 507 ARG A 515 -1 O VAL A 508 N GLU A 500 SHEET 4 AA2 4 VAL A 425 THR A 429 -1 N TYR A 428 O PHE A 511 LINK O3' DA B 4 P 5HC B 5 1555 1555 1.61 LINK O3' 5HC B 5 P DG B 6 1555 1555 1.61 SITE 1 AC1 3 ASP A 421 VAL A 425 GLU A 500 SITE 1 AC2 1 DT B 10 SITE 1 AC3 1 DG B 9 CRYST1 76.980 76.980 72.111 90.00 90.00 90.00 P 42 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 0.012990 0.000000 0.000000 0.00000 SCALE2 0.000000 0.012990 0.000000 0.00000 SCALE3 0.000000 0.000000 0.013868 0.00000 ATOM 1 N GLN A 362 29.575 30.997 19.052 1.00 77.76 N ATOM 2 CA GLN A 362 28.303 31.659 18.784 1.00 86.27 C ATOM 3 C GLN A 362 28.047 32.760 19.809 1.00 91.60 C ATOM 4 O GLN A 362 28.397 32.622 20.981 1.00 91.98 O ATOM 5 CB GLN A 362 27.164 30.638 18.791 1.00 88.18 C ATOM 6 CG GLN A 362 25.839 31.167 18.278 1.00 74.60 C ATOM 7 CD GLN A 362 24.698 30.195 18.510 1.00 78.47 C ATOM 8 OE1 GLN A 362 24.838 29.217 19.244 1.00 79.46 O ATOM 9 NE2 GLN A 362 23.559 30.460 17.881 1.00 78.58 N ATOM 10 N ILE A 363 27.434 33.853 19.364 1.00 83.16 N ATOM 11 CA ILE A 363 27.234 35.018 20.220 1.00 84.26 C ATOM 12 C ILE A 363 25.763 35.432 20.282 1.00 82.12 C ATOM 13 O ILE A 363 24.973 35.087 19.403 1.00 77.11 O ATOM 14 CB ILE A 363 28.087 36.215 19.732 1.00 88.37 C ATOM 15 CG1 ILE A 363 28.355 37.201 20.872 1.00 83.21 C ATOM 16 CG2 ILE A 363 27.430 36.904 18.540 1.00 81.83 C ATOM 17 CD1 ILE A 363 29.292 38.328 20.494 1.00 91.18 C ATOM 18 N ILE A 364 25.400 36.163 21.333 1.00 79.61 N ATOM 19 CA ILE A 364 24.048 36.690 21.477 1.00 69.74 C ATOM 20 C ILE A 364 24.037 38.206 21.312 1.00 70.04 C ATOM 21 O ILE A 364 24.657 38.929 22.091 1.00 77.19 O ATOM 22 CB ILE A 364 23.436 36.332 22.845 1.00 73.30 C ATOM 23 CG1 ILE A 364 23.331 34.814 23.004 1.00 82.83 C ATOM 24 CG2 ILE A 364 22.067 36.979 23.003 1.00 68.29 C ATOM 25 CD1 ILE A 364 22.730 34.379 24.324 1.00 81.97 C ATOM 26 N GLY A 365 23.330 38.682 20.293 1.00 71.52 N ATOM 27 CA GLY A 365 23.229 40.106 20.037 1.00 65.12 C ATOM 28 C GLY A 365 24.000 40.543 18.808 1.00 70.22 C ATOM 29 O GLY A 365 24.087 39.808 17.823 1.00 71.33 O ATOM 30 N THR A 366 24.563 41.745 18.870 1.00 75.01 N ATOM 31 CA THR A 366 25.289 42.323 17.745 1.00 73.17 C ATOM 32 C THR A 366 26.556 41.536 17.421 1.00 75.58 C ATOM 33 O THR A 366 27.283 41.113 18.319 1.00 77.64 O ATOM 34 CB THR A 366 25.668 43.793 18.021 1.00 75.63 C ATOM 35 OG1 THR A 366 24.524 44.500 18.517 1.00 86.06 O ATOM 36 CG2 THR A 366 26.171 44.470 16.753 1.00 67.52 C ATOM 37 N VAL A 367 26.808 41.337 16.131 1.00 77.72 N ATOM 38 CA VAL A 367 28.024 40.676 15.678 1.00 76.26 C ATOM 39 C VAL A 367 28.992 41.700 15.094 1.00 76.95 C ATOM 40 O VAL A 367 28.635 42.438 14.175 1.00 77.47 O ATOM 41 CB VAL A 367 27.726 39.593 14.626 1.00 75.31 C ATOM 42 CG1 VAL A 367 29.018 38.967 14.127 1.00 72.13 C ATOM 43 CG2 VAL A 367 26.802 38.533 15.204 1.00 65.25 C ATOM 44 N PRO A 368 30.219 41.751 15.635 1.00 78.82 N ATOM 45 CA PRO A 368 31.258 42.697 15.209 1.00 77.27 C ATOM 46 C PRO A 368 31.534 42.648 13.708 1.00 76.99 C ATOM 47 O PRO A 368 31.861 41.588 13.173 1.00 71.39 O ATOM 48 CB PRO A 368 32.487 42.242 15.999 1.00 76.00 C ATOM 49 CG PRO A 368 31.926 41.594 17.214 1.00 72.75 C ATOM 50 CD PRO A 368 30.672 40.907 16.755 1.00 78.17 C ATOM 51 N GLY A 369 31.398 43.790 13.042 1.00 77.34 N ATOM 52 CA GLY A 369 31.660 43.879 11.618 1.00 77.75 C ATOM 53 C GLY A 369 30.426 43.633 10.772 1.00 81.87 C ATOM 54 O GLY A 369 30.500 43.617 9.543 1.00 84.57 O ATOM 55 N VAL A 370 29.288 43.438 11.430 1.00 77.17 N ATOM 56 CA VAL A 370 28.028 43.207 10.732 1.00 78.09 C ATOM 57 C VAL A 370 27.044 44.341 10.998 1.00 72.99 C ATOM 58 O VAL A 370 26.491 44.452 12.092 1.00 73.90 O ATOM 59 CB VAL A 370 27.387 41.871 11.146 1.00 78.38 C ATOM 60 CG1 VAL A 370 26.104 41.638 10.367 1.00 70.12 C ATOM 61 CG2 VAL A 370 28.363 40.727 10.925 1.00 65.79 C ATOM 62 N GLU A 371 26.828 45.178 9.989 1.00 72.61 N ATOM 63 CA GLU A 371 25.992 46.363 10.142 1.00 77.82 C ATOM 64 C GLU A 371 24.552 46.111 9.705 1.00 75.07 C ATOM 65 O GLU A 371 24.292 45.264 8.850 1.00 75.08 O ATOM 66 CB GLU A 371 26.580 47.527 9.341 1.00 81.52 C ATOM 67 CG GLU A 371 26.351 48.892 9.964 1.00 89.78 C ATOM 68 CD GLU A 371 27.323 49.193 11.090 1.00 93.05 C ATOM 69 OE1 GLU A 371 28.173 48.330 11.396 1.00 82.17 O ATOM 70 OE2 GLU A 371 27.236 50.295 11.670 1.00 96.73 O ATOM 71 N VAL A 372 23.621 46.852 10.297 1.00 69.28 N ATOM 72 CA VAL A 372 22.221 46.775 9.900 1.00 64.77 C ATOM 73 C VAL A 372 22.052 47.324 8.489 1.00 69.16 C ATOM 74 O VAL A 372 22.239 48.516 8.251 1.00 79.26 O ATOM 75 CB VAL A 372 21.305 47.555 10.862 1.00 67.12 C ATOM 76 CG1 VAL A 372 19.893 47.610 10.318 1.00 68.84 C ATOM 77 CG2 VAL A 372 21.314 46.920 12.239 1.00 62.57 C ATOM 78 N GLY A 373 21.704 46.448 7.554 1.00 63.71 N ATOM 79 CA GLY A 373 21.549 46.844 6.168 1.00 61.22 C ATOM 80 C GLY A 373 22.500 46.094 5.262 1.00 64.04 C ATOM 81 O GLY A 373 22.361 46.126 4.039 1.00 62.89 O ATOM 82 N ASP A 374 23.473 45.417 5.866 1.00 70.76 N ATOM 83 CA ASP A 374 24.438 44.629 5.109 1.00 74.89 C ATOM 84 C ASP A 374 23.739 43.505 4.357 1.00 70.87 C ATOM 85 O ASP A 374 22.809 42.885 4.872 1.00 69.66 O ATOM 86 CB ASP A 374 25.516 44.056 6.031 1.00 76.03 C ATOM 87 CG ASP A 374 26.469 45.116 6.542 1.00 83.89 C ATOM 88 OD1 ASP A 374 26.506 46.218 5.955 1.00 86.68 O ATOM 89 OD2 ASP A 374 27.188 44.845 7.527 1.00 83.23 O ATOM 90 N GLU A 375 24.189 43.251 3.134 1.00 71.81 N ATOM 91 CA GLU A 375 23.548 42.261 2.279 1.00 73.06 C ATOM 92 C GLU A 375 24.480 41.088 1.988 1.00 74.95 C ATOM 93 O GLU A 375 25.696 41.254 1.881 1.00 74.65 O ATOM 94 CB GLU A 375 23.082 42.911 0.975 1.00 75.89 C ATOM 95 CG GLU A 375 22.244 44.163 1.186 1.00 75.95 C ATOM 96 CD GLU A 375 21.430 44.540 -0.035 1.00 86.64 C ATOM 97 OE1 GLU A 375 21.849 44.200 -1.162 1.00 86.61 O ATOM 98 OE2 GLU A 375 20.372 45.180 0.132 1.00 87.11 O ATOM 99 N PHE A 376 23.898 39.899 1.870 1.00 74.56 N ATOM 100 CA PHE A 376 24.674 38.681 1.668 1.00 69.43 C ATOM 101 C PHE A 376 24.057 37.811 0.580 1.00 69.98 C ATOM 102 O PHE A 376 22.848 37.846 0.355 1.00 73.62 O ATOM 103 CB PHE A 376 24.783 37.902 2.980 1.00 70.03 C ATOM 104 CG PHE A 376 25.243 38.740 4.137 1.00 67.66 C ATOM 105 CD1 PHE A 376 26.592 38.967 4.350 1.00 60.59 C ATOM 106 CD2 PHE A 376 24.327 39.312 5.004 1.00 64.99 C ATOM 107 CE1 PHE A 376 27.019 39.745 5.409 1.00 66.10 C ATOM 108 CE2 PHE A 376 24.748 40.090 6.066 1.00 68.96 C ATOM 109 CZ PHE A 376 26.096 40.306 6.268 1.00 70.68 C ATOM 110 N GLN A 377 24.896 37.031 -0.093 1.00 73.91 N ATOM 111 CA GLN A 377 24.447 36.219 -1.215 1.00 73.08 C ATOM 112 C GLN A 377 23.991 34.834 -0.770 1.00 67.97 C ATOM 113 O GLN A 377 22.938 34.354 -1.190 1.00 75.87 O ATOM 114 CB GLN A 377 25.562 36.092 -2.256 1.00 73.76 C ATOM 115 CG GLN A 377 25.101 35.561 -3.603 1.00 78.18 C ATOM 116 CD GLN A 377 26.212 35.552 -4.634 1.00 82.86 C ATOM 117 OE1 GLN A 377 27.390 35.438 -4.292 1.00 87.04 O ATOM 118 NE2 GLN A 377 25.844 35.673 -5.904 1.00 77.71 N ATOM 119 N TYR A 378 24.784 34.195 0.084 1.00 65.43 N ATOM 120 CA TYR A 378 24.494 32.830 0.505 1.00 62.07 C ATOM 121 C TYR A 378 24.373 32.686 2.018 1.00 62.34 C ATOM 122 O TYR A 378 24.897 33.501 2.778 1.00 63.60 O ATOM 123 CB TYR A 378 25.570 31.877 -0.020 1.00 68.77 C ATOM 124 CG TYR A 378 25.638 31.816 -1.527 1.00 66.18 C ATOM 125 CD1 TYR A 378 24.649 31.174 -2.259 1.00 69.20 C ATOM 126 CD2 TYR A 378 26.690 32.400 -2.219 1.00 68.08 C ATOM 127 CE1 TYR A 378 24.705 31.115 -3.637 1.00 74.10 C ATOM 128 CE2 TYR A 378 26.755 32.346 -3.599 1.00 63.35 C ATOM 129 CZ TYR A 378 25.759 31.702 -4.302 1.00 72.63 C ATOM 130 OH TYR A 378 25.816 31.644 -5.676 1.00 73.12 O ATOM 131 N ARG A 379 23.677 31.635 2.440 1.00 60.42 N ATOM 132 CA ARG A 379 23.467 31.346 3.855 1.00 54.64 C ATOM 133 C ARG A 379 24.775 31.031 4.574 1.00 63.82 C ATOM 134 O ARG A 379 24.904 31.271 5.774 1.00 69.08 O ATOM 135 CB ARG A 379 22.492 30.177 4.017 1.00 54.90 C ATOM 136 CG ARG A 379 21.041 30.517 3.715 1.00 56.79 C ATOM 137 CD ARG A 379 20.394 31.244 4.883 1.00 56.99 C ATOM 138 NE ARG A 379 20.420 30.437 6.100 1.00 56.18 N ATOM 139 CZ ARG A 379 19.430 29.642 6.494 1.00 56.80 C ATOM 140 NH1 ARG A 379 18.324 29.545 5.769 1.00 54.02 N ATOM 141 NH2 ARG A 379 19.544 28.944 7.615 1.00 60.95 N ATOM 142 N MET A 380 25.742 30.493 3.838 1.00 62.13 N ATOM 143 CA MET A 380 27.013 30.089 4.430 1.00 63.89 C ATOM 144 C MET A 380 27.873 31.288 4.819 1.00 67.51 C ATOM 145 O MET A 380 28.804 31.156 5.615 1.00 68.93 O ATOM 146 CB MET A 380 27.782 29.176 3.473 1.00 60.73 C ATOM 147 CG MET A 380 27.169 27.786 3.292 1.00 76.96 C ATOM 148 SD MET A 380 27.597 26.595 4.586 1.00 66.02 S ATOM 149 CE MET A 380 26.363 26.935 5.842 1.00 57.23 C ATOM 150 N GLU A 381 27.564 32.454 4.259 1.00 65.11 N ATOM 151 CA GLU A 381 28.229 33.686 4.668 1.00 62.20 C ATOM 152 C GLU A 381 27.795 34.052 6.080 1.00 64.37 C ATOM 153 O GLU A 381 28.594 34.529 6.886 1.00 67.54 O ATOM 154 CB GLU A 381 27.914 34.831 3.706 1.00 63.58 C ATOM 155 CG GLU A 381 28.388 34.606 2.282 1.00 67.43 C ATOM 156 CD GLU A 381 28.275 35.857 1.434 1.00 72.22 C ATOM 157 OE1 GLU A 381 28.488 36.963 1.975 1.00 80.36 O ATOM 158 OE2 GLU A 381 27.970 35.735 0.229 1.00 78.48 O ATOM 159 N LEU A 382 26.519 33.819 6.368 1.00 61.96 N ATOM 160 CA LEU A 382 25.968 34.059 7.695 1.00 59.64 C ATOM 161 C LEU A 382 26.596 33.106 8.706 1.00 62.49 C ATOM 162 O LEU A 382 26.690 33.415 9.893 1.00 58.85 O ATOM 163 CB LEU A 382 24.447 33.898 7.680 1.00 60.43 C ATOM 164 CG LEU A 382 23.721 34.586 6.522 1.00 60.87 C ATOM 165 CD1 LEU A 382 22.229 34.289 6.561 1.00 57.35 C ATOM 166 CD2 LEU A 382 23.974 36.085 6.544 1.00 60.68 C ATOM 167 N ASN A 383 27.023 31.944 8.220 1.00 65.65 N ATOM 168 CA ASN A 383 27.712 30.964 9.049 1.00 64.87 C ATOM 169 C ASN A 383 29.132 31.411 9.379 1.00 65.14 C ATOM 170 O ASN A 383 29.554 31.368 10.535 1.00 65.69 O ATOM 171 CB ASN A 383 27.740 29.603 8.350 1.00 67.71 C ATOM 172 CG ASN A 383 28.482 28.550 9.151 1.00 66.02 C ATOM 173 OD1 ASN A 383 29.703 28.426 9.055 1.00 70.36 O ATOM 174 ND2 ASN A 383 27.745 27.780 9.943 1.00 62.38 N ATOM 175 N LEU A 384 29.861 31.837 8.352 1.00 66.28 N ATOM 176 CA LEU A 384 31.241 32.286 8.511 1.00 71.52 C ATOM 177 C LEU A 384 31.340 33.515 9.408 1.00 73.50 C ATOM 178 O LEU A 384 32.197 33.586 10.288 1.00 71.74 O ATOM 179 CB LEU A 384 31.860 32.592 7.146 1.00 72.48 C ATOM 180 CG LEU A 384 33.277 33.171 7.161 1.00 78.12 C ATOM 181 CD1 LEU A 384 34.293 32.102 7.535 1.00 77.39 C ATOM 182 CD2 LEU A 384 33.619 33.800 5.818 1.00 75.39 C ATOM 183 N LEU A 385 30.455 34.480 9.180 1.00 67.97 N ATOM 184 CA LEU A 385 30.478 35.730 9.930 1.00 62.10 C ATOM 185 C LEU A 385 29.789 35.592 11.285 1.00 65.52 C ATOM 186 O LEU A 385 29.717 36.551 12.053 1.00 67.27 O ATOM 187 CB LEU A 385 29.824 36.847 9.115 1.00 64.92 C ATOM 188 CG LEU A 385 30.440 37.094 7.736 1.00 72.08 C ATOM 189 CD1 LEU A 385 29.753 38.255 7.039 1.00 65.79 C ATOM 190 CD2 LEU A 385 31.937 37.342 7.849 1.00 68.31 C ATOM 191 N GLY A 386 29.284 34.397 11.573 1.00 58.09 N ATOM 192 CA GLY A 386 28.672 34.115 12.859 1.00 54.64 C ATOM 193 C GLY A 386 27.290 34.716 13.027 1.00 59.93 C ATOM 194 O GLY A 386 26.797 34.856 14.147 1.00 61.75 O ATOM 195 N ILE A 387 26.661 35.071 11.912 1.00 58.97 N ATOM 196 CA ILE A 387 25.321 35.643 11.938 1.00 55.62 C ATOM 197 C ILE A 387 24.267 34.555 12.118 1.00 60.51 C ATOM 198 O ILE A 387 23.386 34.663 12.971 1.00 59.14 O ATOM 199 CB ILE A 387 25.017 36.428 10.649 1.00 59.41 C ATOM 200 CG1 ILE A 387 26.117 37.454 10.374 1.00 53.38 C ATOM 201 CG2 ILE A 387 23.663 37.110 10.746 1.00 58.66 C ATOM 202 CD1 ILE A 387 25.948 38.181 9.063 1.00 54.84 C ATOM 203 N HIS A 388 24.370 33.507 11.307 1.00 60.31 N ATOM 204 CA HIS A 388 23.417 32.404 11.341 1.00 57.47 C ATOM 205 C HIS A 388 24.104 31.108 10.916 1.00 58.46 C ATOM 206 O HIS A 388 24.358 30.888 9.731 1.00 64.72 O ATOM 207 CB HIS A 388 22.220 32.704 10.434 1.00 51.11 C ATOM 208 CG HIS A 388 21.033 31.827 10.684 1.00 53.43 C ATOM 209 ND1 HIS A 388 20.250 31.939 11.813 1.00 57.25 N ATOM 210 CD2 HIS A 388 20.486 30.834 9.944 1.00 53.59 C ATOM 211 CE1 HIS A 388 19.276 31.048 11.761 1.00 57.99 C ATOM 212 NE2 HIS A 388 19.396 30.365 10.637 1.00 54.65 N ATOM 213 N ARG A 389 24.401 30.257 11.893 1.00 58.72 N ATOM 214 CA ARG A 389 25.175 29.039 11.659 1.00 63.32 C ATOM 215 C ARG A 389 24.497 27.964 10.790 1.00 66.89 C ATOM 216 O ARG A 389 25.159 27.388 9.927 1.00 67.06 O ATOM 217 CB ARG A 389 25.578 28.417 13.000 1.00 62.23 C ATOM 218 CG ARG A 389 26.511 29.280 13.825 1.00 66.16 C ATOM 219 CD ARG A 389 26.757 28.654 15.185 1.00 73.40 C ATOM 220 NE ARG A 389 25.670 27.758 15.572 1.00 80.45 N ATOM 221 CZ ARG A 389 25.521 27.247 16.789 1.00 78.74 C ATOM 222 NH1 ARG A 389 26.390 27.540 17.746 1.00 84.82 N ATOM 223 NH2 ARG A 389 24.504 26.439 17.047 1.00 74.93 N ATOM 224 N PRO A 390 23.196 27.674 11.011 1.00 61.37 N ATOM 225 CA PRO A 390 22.601 26.594 10.210 1.00 57.29 C ATOM 226 C PRO A 390 22.632 26.856 8.707 1.00 60.92 C ATOM 227 O PRO A 390 22.716 28.005 8.273 1.00 64.26 O ATOM 228 CB PRO A 390 21.155 26.541 10.714 1.00 57.31 C ATOM 229 CG PRO A 390 21.223 27.083 12.091 1.00 53.56 C ATOM 230 CD PRO A 390 22.248 28.171 12.024 1.00 58.47 C ATOM 231 N SER A 391 22.570 25.782 7.927 1.00 61.55 N ATOM 232 CA SER A 391 22.627 25.878 6.475 1.00 60.57 C ATOM 233 C SER A 391 21.237 26.047 5.869 1.00 56.77 C ATOM 234 O SER A 391 21.074 26.716 4.850 1.00 58.61 O ATOM 235 CB SER A 391 23.308 24.641 5.889 1.00 57.56 C ATOM 236 OG SER A 391 22.694 23.453 6.359 1.00 56.36 O ATOM 237 N GLN A 392 20.238 25.437 6.500 1.00 55.93 N ATOM 238 CA GLN A 392 18.865 25.516 6.011 1.00 58.52 C ATOM 239 C GLN A 392 17.896 25.990 7.088 1.00 56.59 C ATOM 240 O GLN A 392 16.983 26.766 6.808 1.00 58.55 O ATOM 241 CB GLN A 392 18.401 24.159 5.480 1.00 53.11 C ATOM 242 CG GLN A 392 19.205 23.622 4.314 1.00 54.73 C ATOM 243 CD GLN A 392 18.619 22.338 3.761 1.00 59.13 C ATOM 244 OE1 GLN A 392 17.430 22.066 3.923 1.00 58.45 O ATOM 245 NE2 GLN A 392 19.453 21.539 3.110 1.00 54.00 N ATOM 246 N SER A 393 18.098 25.510 8.312 1.00 55.07 N ATOM 247 CA SER A 393 17.197 25.803 9.424 1.00 56.14 C ATOM 248 C SER A 393 17.019 27.301 9.645 1.00 55.97 C ATOM 249 O SER A 393 17.992 28.054 9.687 1.00 56.90 O ATOM 250 CB SER A 393 17.706 25.147 10.709 1.00 54.99 C ATOM 251 OG SER A 393 16.843 25.428 11.797 1.00 53.71 O ATOM 252 N GLY A 394 15.767 27.723 9.783 1.00 55.85 N ATOM 253 CA GLY A 394 15.449 29.127 9.952 1.00 54.88 C ATOM 254 C GLY A 394 15.845 29.679 11.307 1.00 54.27 C ATOM 255 O GLY A 394 16.102 30.873 11.441 1.00 50.43 O ATOM 256 N ILE A 395 15.903 28.813 12.313 1.00 57.36 N ATOM 257 CA ILE A 395 16.187 29.252 13.675 1.00 55.51 C ATOM 258 C ILE A 395 17.519 28.714 14.195 1.00 53.65 C ATOM 259 O ILE A 395 17.815 27.528 14.061 1.00 52.31 O ATOM 260 CB ILE A 395 15.067 28.819 14.641 1.00 52.95 C ATOM 261 CG1 ILE A 395 13.694 29.050 14.006 1.00 51.62 C ATOM 262 CG2 ILE A 395 15.190 29.555 15.969 1.00 51.35 C ATOM 263 CD1 ILE A 395 12.538 28.545 14.841 1.00 49.66 C ATOM 264 N ASP A 396 18.317 29.598 14.787 1.00 58.47 N ATOM 265 CA ASP A 396 19.567 29.203 15.429 1.00 63.81 C ATOM 266 C ASP A 396 19.480 29.470 16.929 1.00 65.32 C ATOM 267 O ASP A 396 18.856 30.441 17.356 1.00 61.98 O ATOM 268 CB ASP A 396 20.755 29.953 14.823 1.00 63.32 C ATOM 269 CG ASP A 396 22.093 29.359 15.231 1.00 68.18 C ATOM 270 OD1 ASP A 396 22.110 28.425 16.060 1.00 65.05 O ATOM 271 OD2 ASP A 396 23.132 29.827 14.720 1.00 62.51 O ATOM 272 N TYR A 397 20.110 28.613 17.726 1.00 65.32 N ATOM 273 CA TYR A 397 20.005 28.731 19.176 1.00 69.04 C ATOM 274 C TYR A 397 21.224 28.204 19.927 1.00 71.79 C ATOM 275 O TYR A 397 22.147 27.645 19.332 1.00 74.65 O ATOM 276 CB TYR A 397 18.752 28.004 19.668 1.00 68.69 C ATOM 277 CG TYR A 397 18.697 26.536 19.304 1.00 74.96 C ATOM 278 CD1 TYR A 397 19.223 25.569 20.151 1.00 69.61 C ATOM 279 CD2 TYR A 397 18.112 26.118 18.115 1.00 68.43 C ATOM 280 CE1 TYR A 397 19.172 24.227 19.822 1.00 72.15 C ATOM 281 CE2 TYR A 397 18.057 24.779 17.779 1.00 66.15 C ATOM 282 CZ TYR A 397 18.588 23.838 18.635 1.00 66.23 C ATOM 283 OH TYR A 397 18.534 22.504 18.303 1.00 66.99 O ATOM 284 N MET A 398 21.207 28.389 21.244 1.00 75.99 N ATOM 285 CA MET A 398 22.271 27.915 22.121 1.00 71.23 C ATOM 286 C MET A 398 21.736 27.682 23.530 1.00 77.38 C ATOM 287 O MET A 398 20.606 28.058 23.845 1.00 76.02 O ATOM 288 CB MET A 398 23.426 28.916 22.171 1.00 72.17 C ATOM 289 CG MET A 398 23.020 30.291 22.681 1.00 75.26 C ATOM 290 SD MET A 398 24.404 31.257 23.316 1.00 73.54 S ATOM 291 CE MET A 398 25.569 31.123 21.966 1.00 71.75 C ATOM 292 N LYS A 399 22.553 27.062 24.374 1.00 80.14 N ATOM 293 CA LYS A 399 22.228 26.924 25.789 1.00 81.90 C ATOM 294 C LYS A 399 23.053 27.923 26.597 1.00 86.14 C ATOM 295 O LYS A 399 24.262 28.042 26.400 1.00 87.44 O ATOM 296 CB LYS A 399 22.483 25.494 26.272 1.00 83.42 C ATOM 297 N ASP A 400 22.395 28.649 27.496 1.00 90.92 N ATOM 298 CA ASP A 400 23.064 29.687 28.272 1.00 92.74 C ATOM 299 C ASP A 400 23.524 29.155 29.624 1.00 94.33 C ATOM 300 O ASP A 400 23.605 27.943 29.827 1.00 96.31 O ATOM 301 CB ASP A 400 22.137 30.889 28.469 1.00 94.90 C ATOM 302 CG ASP A 400 20.860 30.530 29.214 1.00 97.56 C ATOM 303 OD1 ASP A 400 20.446 29.354 29.160 1.00 95.96 O ATOM 304 OD2 ASP A 400 20.268 31.425 29.857 1.00 95.88 O ATOM 305 N ASP A 401 23.831 30.068 30.542 1.00 98.50 N ATOM 306 CA ASP A 401 24.183 29.695 31.900 1.00 90.77 C ATOM 307 C ASP A 401 23.014 28.980 32.545 1.00 97.92 C ATOM 308 O ASP A 401 22.058 29.610 32.994 1.00103.03 O ATOM 309 N GLY A 402 23.093 27.654 32.584 1.00 97.96 N ATOM 310 CA GLY A 402 21.956 26.837 32.958 1.00 93.76 C ATOM 311 C GLY A 402 21.264 26.379 31.689 1.00 96.28 C ATOM 312 O GLY A 402 20.532 27.148 31.065 1.00101.39 O ATOM 313 N GLY A 403 21.507 25.126 31.312 1.00 94.41 N ATOM 314 CA GLY A 403 21.074 24.581 30.035 1.00 92.17 C ATOM 315 C GLY A 403 19.637 24.835 29.621 1.00 92.67 C ATOM 316 O GLY A 403 18.807 23.926 29.632 1.00 90.43 O ATOM 317 N GLU A 404 19.346 26.077 29.247 1.00 89.14 N ATOM 318 CA GLU A 404 18.039 26.436 28.710 1.00 84.06 C ATOM 319 C GLU A 404 18.201 27.014 27.309 1.00 79.73 C ATOM 320 O GLU A 404 18.968 27.955 27.104 1.00 81.96 O ATOM 321 CB GLU A 404 17.329 27.435 29.626 1.00 91.61 C ATOM 322 N LEU A 405 17.481 26.444 26.347 1.00 79.57 N ATOM 323 CA LEU A 405 17.605 26.848 24.949 1.00 75.55 C ATOM 324 C LEU A 405 17.158 28.289 24.720 1.00 72.88 C ATOM 325 O LEU A 405 16.073 28.686 25.141 1.00 70.00 O ATOM 326 CB LEU A 405 16.799 25.907 24.050 1.00 67.38 C ATOM 327 CG LEU A 405 17.288 24.460 23.952 1.00 76.24 C ATOM 328 CD1 LEU A 405 16.475 23.686 22.925 1.00 68.61 C ATOM 329 CD2 LEU A 405 18.771 24.414 23.615 1.00 77.99 C ATOM 330 N VAL A 406 18.005 29.069 24.054 1.00 69.63 N ATOM 331 CA VAL A 406 17.679 30.450 23.713 1.00 68.49 C ATOM 332 C VAL A 406 18.031 30.754 22.260 1.00 65.59 C ATOM 333 O VAL A 406 19.122 30.428 21.792 1.00 68.09 O ATOM 334 CB VAL A 406 18.405 31.457 24.634 1.00 67.84 C ATOM 335 CG1 VAL A 406 17.762 31.480 26.008 1.00 70.73 C ATOM 336 CG2 VAL A 406 19.888 31.125 24.738 1.00 76.37 C ATOM 337 N ALA A 407 17.098 31.375 21.547 1.00 63.64 N ATOM 338 CA ALA A 407 17.314 31.722 20.148 1.00 62.96 C ATOM 339 C ALA A 407 18.352 32.831 20.014 1.00 60.62 C ATOM 340 O ALA A 407 18.454 33.704 20.876 1.00 63.62 O ATOM 341 CB ALA A 407 16.007 32.138 19.497 1.00 57.55 C ATOM 342 N THR A 408 19.122 32.790 18.932 1.00 57.37 N ATOM 343 CA THR A 408 20.142 33.802 18.683 1.00 60.94 C ATOM 344 C THR A 408 19.882 34.539 17.375 1.00 63.77 C ATOM 345 O THR A 408 20.205 35.720 17.243 1.00 63.53 O ATOM 346 CB THR A 408 21.554 33.185 18.640 1.00 65.77 C ATOM 347 OG1 THR A 408 21.627 32.223 17.581 1.00 68.12 O ATOM 348 CG2 THR A 408 21.882 32.509 19.961 1.00 64.16 C ATOM 349 N SER A 409 19.296 33.836 16.411 1.00 66.49 N ATOM 350 CA SER A 409 19.004 34.423 15.109 1.00 61.31 C ATOM 351 C SER A 409 17.927 33.641 14.365 1.00 57.75 C ATOM 352 O SER A 409 17.835 32.420 14.490 1.00 61.47 O ATOM 353 CB SER A 409 20.276 34.494 14.258 1.00 64.86 C ATOM 354 OG SER A 409 20.800 33.201 14.013 1.00 65.88 O ATOM 355 N ILE A 410 17.107 34.353 13.597 1.00 60.76 N ATOM 356 CA ILE A 410 16.108 33.716 12.746 1.00 55.10 C ATOM 357 C ILE A 410 16.195 34.249 11.319 1.00 53.41 C ATOM 358 O ILE A 410 16.681 35.356 11.087 1.00 61.08 O ATOM 359 CB ILE A 410 14.673 33.926 13.274 1.00 47.54 C ATOM 360 CG1 ILE A 410 14.307 35.410 13.264 1.00 53.87 C ATOM 361 CG2 ILE A 410 14.518 33.333 14.668 1.00 50.95 C ATOM 362 CD1 ILE A 410 12.866 35.682 13.632 1.00 48.72 C ATOM 363 N VAL A 411 15.726 33.452 10.365 1.00 55.28 N ATOM 364 CA VAL A 411 15.735 33.850 8.963 1.00 57.53 C ATOM 365 C VAL A 411 14.350 33.706 8.343 1.00 55.07 C ATOM 366 O VAL A 411 13.764 32.624 8.354 1.00 51.30 O ATOM 367 CB VAL A 411 16.744 33.021 8.142 1.00 55.17 C ATOM 368 CG1 VAL A 411 16.581 33.303 6.655 1.00 50.62 C ATOM 369 CG2 VAL A 411 18.167 33.314 8.593 1.00 51.90 C ATOM 370 N SER A 412 13.830 34.806 7.809 1.00 53.62 N ATOM 371 CA SER A 412 12.541 34.792 7.130 1.00 54.00 C ATOM 372 C SER A 412 12.722 35.075 5.643 1.00 55.87 C ATOM 373 O SER A 412 12.901 36.224 5.240 1.00 58.27 O ATOM 374 CB SER A 412 11.590 35.815 7.753 1.00 50.07 C ATOM 375 OG SER A 412 10.315 35.765 7.138 1.00 54.60 O ATOM 376 N SER A 413 12.679 34.023 4.833 1.00 56.35 N ATOM 377 CA SER A 413 12.895 34.161 3.397 1.00 61.94 C ATOM 378 C SER A 413 11.766 33.530 2.586 1.00 59.24 C ATOM 379 O SER A 413 12.010 32.880 1.569 1.00 58.73 O ATOM 380 CB SER A 413 14.235 33.539 3.000 1.00 56.72 C ATOM 381 OG SER A 413 14.294 32.172 3.371 1.00 67.13 O ATOM 382 N GLY A 414 10.533 33.724 3.042 1.00 60.00 N ATOM 383 CA GLY A 414 9.366 33.245 2.324 1.00 58.64 C ATOM 384 C GLY A 414 9.231 31.734 2.285 1.00 61.10 C ATOM 385 O GLY A 414 8.446 31.196 1.505 1.00 66.43 O ATOM 386 N GLY A 415 9.993 31.048 3.129 1.00 64.86 N ATOM 387 CA GLY A 415 9.945 29.599 3.189 1.00 57.41 C ATOM 388 C GLY A 415 8.661 29.091 3.815 1.00 62.10 C ATOM 389 O GLY A 415 8.260 27.949 3.592 1.00 71.05 O ATOM 390 N TYR A 416 8.016 29.944 4.604 1.00 65.03 N ATOM 391 CA TYR A 416 6.755 29.590 5.246 1.00 61.11 C ATOM 392 C TYR A 416 5.652 30.589 4.901 1.00 62.79 C ATOM 393 O TYR A 416 5.624 31.142 3.801 1.00 71.64 O ATOM 394 CB TYR A 416 6.933 29.499 6.763 1.00 58.42 C ATOM 395 CG TYR A 416 7.497 28.176 7.235 1.00 58.83 C ATOM 396 CD1 TYR A 416 6.720 27.291 7.973 1.00 54.83 C ATOM 397 CD2 TYR A 416 8.801 27.807 6.935 1.00 61.43 C ATOM 398 CE1 TYR A 416 7.232 26.079 8.406 1.00 65.35 C ATOM 399 CE2 TYR A 416 9.321 26.599 7.363 1.00 57.57 C ATOM 400 CZ TYR A 416 8.533 25.739 8.097 1.00 61.04 C ATOM 401 OH TYR A 416 9.048 24.536 8.522 1.00 52.85 O ATOM 402 N ASN A 417 4.749 30.818 5.848 1.00 69.77 N ATOM 403 CA ASN A 417 3.584 31.666 5.611 1.00 75.71 C ATOM 404 C ASN A 417 3.860 33.152 5.821 1.00 72.99 C ATOM 405 O ASN A 417 3.099 34.000 5.351 1.00 78.79 O ATOM 406 CB ASN A 417 2.430 31.232 6.517 1.00 68.09 C ATOM 407 N ASP A 418 4.950 33.455 6.521 1.00 70.83 N ATOM 408 CA ASP A 418 5.271 34.821 6.930 1.00 65.50 C ATOM 409 C ASP A 418 5.284 35.823 5.779 1.00 72.70 C ATOM 410 O ASP A 418 5.903 35.588 4.740 1.00 76.18 O ATOM 411 CB ASP A 418 6.629 34.855 7.636 1.00 67.98 C ATOM 412 CG ASP A 418 6.797 33.728 8.632 1.00 60.20 C ATOM 413 OD1 ASP A 418 5.790 33.317 9.244 1.00 63.10 O ATOM 414 OD2 ASP A 418 7.940 33.256 8.806 1.00 60.07 O ATOM 415 N VAL A 419 4.589 36.938 5.978 1.00 77.44 N ATOM 416 CA VAL A 419 4.636 38.060 5.048 1.00 79.94 C ATOM 417 C VAL A 419 5.187 39.285 5.770 1.00 72.98 C ATOM 418 O VAL A 419 4.648 39.707 6.794 1.00 66.88 O ATOM 419 CB VAL A 419 3.249 38.382 4.460 1.00 86.87 C ATOM 420 CG1 VAL A 419 3.314 39.644 3.613 1.00 85.33 C ATOM 421 CG2 VAL A 419 2.737 37.210 3.636 1.00 80.73 C ATOM 422 N LEU A 420 6.264 39.849 5.236 1.00 75.19 N ATOM 423 CA LEU A 420 6.954 40.953 5.892 1.00 79.34 C ATOM 424 C LEU A 420 6.569 42.319 5.335 1.00 80.28 C ATOM 425 O LEU A 420 6.676 42.564 4.134 1.00 83.80 O ATOM 426 CB LEU A 420 8.468 40.767 5.782 1.00 84.00 C ATOM 427 CG LEU A 420 9.081 39.656 6.634 1.00 79.80 C ATOM 428 CD1 LEU A 420 9.967 38.755 5.791 1.00 79.77 C ATOM 429 CD2 LEU A 420 9.871 40.258 7.783 1.00 73.11 C ATOM 430 N ASP A 421 6.122 43.206 6.219 1.00 78.66 N ATOM 431 CA ASP A 421 5.889 44.600 5.855 1.00 83.71 C ATOM 432 C ASP A 421 6.968 45.472 6.487 1.00 81.73 C ATOM 433 O ASP A 421 7.813 44.971 7.224 1.00 78.89 O ATOM 434 CB ASP A 421 4.491 45.059 6.291 1.00 85.32 C ATOM 435 CG ASP A 421 4.172 44.694 7.732 1.00 81.41 C ATOM 436 OD1 ASP A 421 2.983 44.757 8.108 1.00 85.32 O ATOM 437 OD2 ASP A 421 5.103 44.341 8.489 1.00 82.87 O ATOM 438 N ASN A 422 6.952 46.770 6.202 1.00 88.57 N ATOM 439 CA ASN A 422 7.907 47.679 6.830 1.00 85.89 C ATOM 440 C ASN A 422 7.388 48.176 8.173 1.00 85.69 C ATOM 441 O ASN A 422 7.165 49.375 8.366 1.00 84.33 O ATOM 442 CB ASN A 422 8.219 48.856 5.909 1.00 90.59 C ATOM 443 CG ASN A 422 8.887 48.424 4.624 1.00100.90 C ATOM 444 OD1 ASN A 422 8.986 47.232 4.327 1.00102.23 O ATOM 445 ND2 ASN A 422 9.340 49.395 3.844 1.00103.12 N ATOM 446 N SER A 423 7.182 47.235 9.089 1.00 78.92 N ATOM 447 CA SER A 423 6.749 47.550 10.442 1.00 69.35 C ATOM 448 C SER A 423 7.852 47.204 11.436 1.00 63.23 C ATOM 449 O SER A 423 8.921 46.732 11.048 1.00 69.10 O ATOM 450 CB SER A 423 5.461 46.797 10.794 1.00 70.02 C ATOM 451 OG SER A 423 5.039 47.096 12.113 1.00 69.03 O ATOM 452 N ASP A 424 7.594 47.443 12.717 1.00 62.68 N ATOM 453 CA ASP A 424 8.554 47.083 13.752 1.00 61.83 C ATOM 454 C ASP A 424 8.186 45.740 14.376 1.00 61.22 C ATOM 455 O ASP A 424 8.967 45.158 15.128 1.00 63.61 O ATOM 456 CB ASP A 424 8.631 48.171 14.827 1.00 61.02 C ATOM 457 CG ASP A 424 7.292 48.444 15.482 1.00 64.64 C ATOM 458 OD1 ASP A 424 6.262 48.420 14.775 1.00 65.13 O ATOM 459 OD2 ASP A 424 7.271 48.685 16.708 1.00 65.69 O ATOM 460 N VAL A 425 6.994 45.248 14.050 1.00 55.87 N ATOM 461 CA VAL A 425 6.522 43.970 14.570 1.00 56.43 C ATOM 462 C VAL A 425 6.485 42.905 13.478 1.00 54.94 C ATOM 463 O VAL A 425 5.901 43.110 12.414 1.00 57.51 O ATOM 464 CB VAL A 425 5.119 44.101 15.199 1.00 59.81 C ATOM 465 CG1 VAL A 425 4.549 42.731 15.534 1.00 58.03 C ATOM 466 CG2 VAL A 425 5.173 44.982 16.438 1.00 58.67 C ATOM 467 N LEU A 426 7.114 41.767 13.752 1.00 58.70 N ATOM 468 CA LEU A 426 7.176 40.665 12.798 1.00 54.31 C ATOM 469 C LEU A 426 6.517 39.406 13.356 1.00 56.03 C ATOM 470 O LEU A 426 6.727 39.046 14.513 1.00 57.23 O ATOM 471 CB LEU A 426 8.633 40.375 12.422 1.00 52.29 C ATOM 472 CG LEU A 426 9.016 38.943 12.033 1.00 59.65 C ATOM 473 CD1 LEU A 426 8.463 38.569 10.664 1.00 65.35 C ATOM 474 CD2 LEU A 426 10.526 38.763 12.071 1.00 62.79 C ATOM 475 N ILE A 427 5.714 38.746 12.527 1.00 56.82 N ATOM 476 CA ILE A 427 5.121 37.465 12.890 1.00 50.94 C ATOM 477 C ILE A 427 5.899 36.330 12.233 1.00 51.23 C ATOM 478 O ILE A 427 5.969 36.242 11.007 1.00 51.04 O ATOM 479 CB ILE A 427 3.642 37.382 12.477 1.00 47.96 C ATOM 480 CG1 ILE A 427 2.883 38.618 12.963 1.00 47.87 C ATOM 481 CG2 ILE A 427 3.010 36.109 13.018 1.00 53.03 C ATOM 482 CD1 ILE A 427 2.863 38.769 14.467 1.00 59.43 C ATOM 483 N TYR A 428 6.481 35.464 13.056 1.00 51.55 N ATOM 484 CA TYR A 428 7.351 34.402 12.566 1.00 47.65 C ATOM 485 C TYR A 428 6.755 33.026 12.849 1.00 47.40 C ATOM 486 O TYR A 428 6.428 32.705 13.991 1.00 48.57 O ATOM 487 CB TYR A 428 8.735 34.529 13.205 1.00 52.06 C ATOM 488 CG TYR A 428 9.832 33.740 12.525 1.00 50.21 C ATOM 489 CD1 TYR A 428 10.454 34.222 11.379 1.00 44.71 C ATOM 490 CD2 TYR A 428 10.265 32.527 13.044 1.00 49.36 C ATOM 491 CE1 TYR A 428 11.466 33.509 10.760 1.00 47.55 C ATOM 492 CE2 TYR A 428 11.276 31.808 12.433 1.00 49.99 C ATOM 493 CZ TYR A 428 11.873 32.304 11.293 1.00 49.23 C ATOM 494 OH TYR A 428 12.877 31.590 10.681 1.00 51.52 O ATOM 495 N THR A 429 6.612 32.219 11.803 1.00 44.57 N ATOM 496 CA THR A 429 6.058 30.877 11.943 1.00 51.29 C ATOM 497 C THR A 429 7.120 29.901 12.442 1.00 51.79 C ATOM 498 O THR A 429 8.281 29.974 12.037 1.00 49.10 O ATOM 499 CB THR A 429 5.478 30.361 10.608 1.00 51.41 C ATOM 500 OG1 THR A 429 4.593 31.342 10.056 1.00 52.99 O ATOM 501 CG2 THR A 429 4.717 29.058 10.814 1.00 49.23 C ATOM 502 N GLY A 430 6.720 28.995 13.329 1.00 53.48 N ATOM 503 CA GLY A 430 7.614 27.963 13.822 1.00 51.01 C ATOM 504 C GLY A 430 7.957 26.959 12.738 1.00 57.13 C ATOM 505 O GLY A 430 7.284 26.890 11.710 1.00 56.35 O ATOM 506 N GLN A 431 9.006 26.176 12.968 1.00 61.05 N ATOM 507 CA GLN A 431 9.453 25.192 11.988 1.00 56.19 C ATOM 508 C GLN A 431 8.847 23.818 12.257 1.00 54.43 C ATOM 509 O GLN A 431 8.475 23.503 13.387 1.00 52.91 O ATOM 510 CB GLN A 431 10.981 25.100 11.984 1.00 55.36 C ATOM 511 CG GLN A 431 11.582 24.676 13.315 1.00 51.75 C ATOM 512 CD GLN A 431 13.098 24.685 13.300 1.00 54.59 C ATOM 513 OE1 GLN A 431 13.719 25.097 12.320 1.00 50.09 O ATOM 514 NE2 GLN A 431 13.704 24.230 14.391 1.00 62.23 N ATOM 515 N GLY A 432 8.749 23.007 11.208 1.00 51.15 N ATOM 516 CA GLY A 432 8.230 21.657 11.333 1.00 58.26 C ATOM 517 C GLY A 432 6.792 21.520 10.873 1.00 65.08 C ATOM 518 O GLY A 432 6.187 22.480 10.395 1.00 75.41 O ATOM 519 N GLY A 433 6.246 20.316 11.012 1.00 70.17 N ATOM 520 CA GLY A 433 4.867 20.052 10.643 1.00 72.36 C ATOM 521 C GLY A 433 4.637 20.003 9.144 1.00 78.10 C ATOM 522 O GLY A 433 3.494 19.940 8.691 1.00 80.97 O ATOM 523 N ASN A 434 5.729 20.032 8.383 1.00 75.78 N ATOM 524 CA ASN A 434 5.682 20.009 6.922 1.00 78.22 C ATOM 525 C ASN A 434 4.833 21.136 6.337 1.00 79.82 C ATOM 526 O ASN A 434 3.712 20.909 5.883 1.00 87.12 O ATOM 527 CB ASN A 434 5.163 18.657 6.426 1.00 85.59 C ATOM 528 CG ASN A 434 6.043 17.500 6.857 1.00 85.49 C ATOM 529 OD1 ASN A 434 5.597 16.596 7.564 1.00 80.35 O ATOM 530 ND2 ASN A 434 7.300 17.521 6.431 1.00 80.93 N ATOM 531 N VAL A 435 5.374 22.351 6.359 1.00 82.66 N ATOM 532 CA VAL A 435 4.700 23.510 5.780 1.00 74.61 C ATOM 533 C VAL A 435 5.659 24.322 4.911 1.00 75.56 C ATOM 534 O VAL A 435 6.531 25.023 5.424 1.00 78.20 O ATOM 535 CB VAL A 435 4.107 24.434 6.868 1.00 81.19 C ATOM 536 CG1 VAL A 435 3.379 25.605 6.227 1.00 86.91 C ATOM 537 CG2 VAL A 435 3.166 23.660 7.781 1.00 79.97 C ATOM 538 N GLY A 436 5.496 24.225 3.594 1.00 81.64 N ATOM 539 CA GLY A 436 6.330 24.972 2.669 1.00 75.92 C ATOM 540 C GLY A 436 6.869 24.130 1.529 1.00 83.91 C ATOM 541 O GLY A 436 6.379 24.206 0.402 1.00 82.00 O ATOM 542 N LYS A 437 7.888 23.328 1.822 1.00 90.13 N ATOM 543 CA LYS A 437 8.480 22.443 0.824 1.00 84.31 C ATOM 544 C LYS A 437 7.894 21.040 0.930 1.00 86.04 C ATOM 545 O LYS A 437 8.566 20.051 0.638 1.00 85.32 O ATOM 546 CB LYS A 437 10.001 22.393 0.982 1.00 82.58 C ATOM 547 N LYS A 438 6.635 20.963 1.350 1.00 90.01 N ATOM 548 CA LYS A 438 5.958 19.684 1.518 1.00 87.77 C ATOM 549 C LYS A 438 4.445 19.842 1.412 1.00 80.68 C ATOM 550 O LYS A 438 3.789 19.130 0.652 1.00 85.15 O ATOM 551 CB LYS A 438 6.329 19.057 2.863 1.00 85.34 C ATOM 552 N GLU A 442 4.777 15.478 1.276 1.00 87.84 N ATOM 553 CA GLU A 442 4.801 14.979 2.646 1.00 90.92 C ATOM 554 C GLU A 442 3.534 15.380 3.398 1.00 92.14 C ATOM 555 O GLU A 442 3.055 16.506 3.258 1.00 91.51 O ATOM 556 CB GLU A 442 6.037 15.488 3.373 1.00 91.58 C ATOM 557 N PRO A 443 2.986 14.453 4.199 1.00 92.85 N ATOM 558 CA PRO A 443 1.747 14.675 4.953 1.00 89.79 C ATOM 559 C PRO A 443 1.928 15.611 6.147 1.00 88.87 C ATOM 560 O PRO A 443 2.962 15.561 6.813 1.00 86.95 O ATOM 561 CB PRO A 443 1.369 13.268 5.419 1.00 91.85 C ATOM 562 CG PRO A 443 2.671 12.557 5.525 1.00 93.01 C ATOM 563 CD PRO A 443 3.519 13.094 4.405 1.00 96.48 C ATOM 564 N PRO A 444 0.923 16.461 6.413 1.00 87.64 N ATOM 565 CA PRO A 444 0.945 17.442 7.506 1.00 87.85 C ATOM 566 C PRO A 444 0.825 16.809 8.891 1.00 83.57 C ATOM 567 O PRO A 444 0.096 15.833 9.068 1.00 81.96 O ATOM 568 CB PRO A 444 -0.280 18.322 7.215 1.00 84.76 C ATOM 569 CG PRO A 444 -0.648 18.037 5.791 1.00 85.21 C ATOM 570 CD PRO A 444 -0.275 16.610 5.572 1.00 89.44 C ATOM 571 N LYS A 445 1.538 17.374 9.861 1.00 73.74 N ATOM 572 CA LYS A 445 1.449 16.933 11.248 1.00 73.61 C ATOM 573 C LYS A 445 1.635 18.119 12.191 1.00 78.62 C ATOM 574 O LYS A 445 1.971 19.219 11.753 1.00 76.56 O ATOM 575 CB LYS A 445 2.487 15.848 11.542 1.00 77.47 C ATOM 576 CG LYS A 445 3.928 16.288 11.339 1.00 78.76 C ATOM 577 CD LYS A 445 4.896 15.160 11.659 1.00 78.12 C ATOM 578 CE LYS A 445 6.336 15.578 11.410 1.00 84.32 C ATOM 579 NZ LYS A 445 6.587 15.879 9.973 1.00 86.89 N ATOM 580 N ASP A 446 1.406 17.895 13.481 1.00 74.45 N ATOM 581 CA ASP A 446 1.575 18.943 14.484 1.00 70.54 C ATOM 582 C ASP A 446 3.026 19.397 14.586 1.00 76.44 C ATOM 583 O ASP A 446 3.948 18.594 14.442 1.00 81.86 O ATOM 584 CB ASP A 446 1.095 18.460 15.856 1.00 73.91 C ATOM 585 CG ASP A 446 -0.387 18.685 16.070 1.00 78.17 C ATOM 586 OD1 ASP A 446 -1.100 18.945 15.081 1.00 81.84 O ATOM 587 OD2 ASP A 446 -0.840 18.602 17.231 1.00 82.12 O ATOM 588 N GLN A 447 3.224 20.688 14.834 1.00 74.54 N ATOM 589 CA GLN A 447 4.556 21.205 15.115 1.00 67.27 C ATOM 590 C GLN A 447 4.918 20.905 16.564 1.00 64.30 C ATOM 591 O GLN A 447 4.037 20.725 17.405 1.00 68.30 O ATOM 592 CB GLN A 447 4.636 22.709 14.842 1.00 62.95 C ATOM 593 CG GLN A 447 4.740 23.067 13.368 1.00 65.94 C ATOM 594 CD GLN A 447 5.164 24.506 13.147 1.00 61.65 C ATOM 595 OE1 GLN A 447 5.161 25.315 14.075 1.00 64.23 O ATOM 596 NE2 GLN A 447 5.538 24.830 11.915 1.00 55.25 N ATOM 597 N GLN A 448 6.212 20.848 16.853 1.00 68.61 N ATOM 598 CA GLN A 448 6.669 20.484 18.188 1.00 72.67 C ATOM 599 C GLN A 448 7.390 21.636 18.876 1.00 71.70 C ATOM 600 O GLN A 448 8.111 22.403 18.237 1.00 70.53 O ATOM 601 CB GLN A 448 7.582 19.258 18.120 1.00 71.18 C ATOM 602 CG GLN A 448 6.946 18.053 17.445 1.00 71.14 C ATOM 603 CD GLN A 448 5.659 17.618 18.119 1.00 77.15 C ATOM 604 OE1 GLN A 448 5.523 17.699 19.340 1.00 80.74 O ATOM 605 NE2 GLN A 448 4.702 17.157 17.321 1.00 82.58 N ATOM 606 N LEU A 449 7.189 21.748 20.185 1.00 71.35 N ATOM 607 CA LEU A 449 7.828 22.794 20.972 1.00 68.88 C ATOM 608 C LEU A 449 9.208 22.337 21.435 1.00 69.34 C ATOM 609 O LEU A 449 9.483 22.253 22.633 1.00 71.66 O ATOM 610 CB LEU A 449 6.952 23.176 22.168 1.00 70.51 C ATOM 611 CG LEU A 449 7.266 24.491 22.887 1.00 74.15 C ATOM 612 CD1 LEU A 449 7.459 25.622 21.889 1.00 73.49 C ATOM 613 CD2 LEU A 449 6.160 24.827 23.875 1.00 76.68 C ATOM 614 N VAL A 450 10.070 22.028 20.472 1.00 70.26 N ATOM 615 CA VAL A 450 11.436 21.611 20.759 1.00 64.32 C ATOM 616 C VAL A 450 12.425 22.394 19.903 1.00 64.61 C ATOM 617 O VAL A 450 12.035 23.037 18.928 1.00 65.22 O ATOM 618 CB VAL A 450 11.640 20.102 20.509 1.00 71.71 C ATOM 619 CG1 VAL A 450 10.761 19.279 21.439 1.00 70.16 C ATOM 620 CG2 VAL A 450 11.356 19.762 19.055 1.00 67.48 C ATOM 621 N THR A 451 13.700 22.328 20.278 1.00 70.36 N ATOM 622 CA THR A 451 14.787 22.976 19.543 1.00 65.23 C ATOM 623 C THR A 451 14.536 24.465 19.306 1.00 63.47 C ATOM 624 O THR A 451 14.324 25.225 20.251 1.00 66.34 O ATOM 625 CB THR A 451 15.034 22.290 18.180 1.00 64.96 C ATOM 626 OG1 THR A 451 13.921 22.526 17.308 1.00 71.70 O ATOM 627 CG2 THR A 451 15.228 20.793 18.364 1.00 65.45 C ATOM 628 N GLY A 452 14.562 24.868 18.038 1.00 64.35 N ATOM 629 CA GLY A 452 14.396 26.260 17.660 1.00 56.04 C ATOM 630 C GLY A 452 13.085 26.867 18.119 1.00 56.43 C ATOM 631 O GLY A 452 13.053 27.999 18.603 1.00 62.17 O ATOM 632 N ASN A 453 12.000 26.114 17.964 1.00 56.75 N ATOM 633 CA ASN A 453 10.689 26.557 18.421 1.00 61.87 C ATOM 634 C ASN A 453 10.676 26.782 19.928 1.00 62.38 C ATOM 635 O ASN A 453 10.125 27.769 20.416 1.00 65.86 O ATOM 636 CB ASN A 453 9.614 25.541 18.031 1.00 59.01 C ATOM 637 CG ASN A 453 9.331 25.534 16.541 1.00 57.72 C ATOM 638 OD1 ASN A 453 9.970 26.253 15.773 1.00 56.19 O ATOM 639 ND2 ASN A 453 8.370 24.717 16.125 1.00 55.67 N ATOM 640 N LEU A 454 11.293 25.858 20.657 1.00 63.64 N ATOM 641 CA LEU A 454 11.406 25.965 22.106 1.00 69.38 C ATOM 642 C LEU A 454 12.293 27.140 22.504 1.00 67.21 C ATOM 643 O LEU A 454 11.988 27.870 23.447 1.00 69.30 O ATOM 644 CB LEU A 454 11.963 24.667 22.693 1.00 70.73 C ATOM 645 CG LEU A 454 12.359 24.686 24.171 1.00 73.85 C ATOM 646 CD1 LEU A 454 11.143 24.922 25.054 1.00 77.35 C ATOM 647 CD2 LEU A 454 13.066 23.395 24.552 1.00 64.12 C ATOM 648 N ALA A 455 13.389 27.314 21.772 1.00 63.13 N ATOM 649 CA ALA A 455 14.359 28.363 22.065 1.00 62.93 C ATOM 650 C ALA A 455 13.753 29.755 21.917 1.00 67.53 C ATOM 651 O ALA A 455 13.970 30.627 22.759 1.00 67.35 O ATOM 652 CB ALA A 455 15.568 28.220 21.166 1.00 62.11 C ATOM 653 N LEU A 456 13.002 29.956 20.839 1.00 67.55 N ATOM 654 CA LEU A 456 12.316 31.222 20.605 1.00 62.45 C ATOM 655 C LEU A 456 11.328 31.523 21.727 1.00 63.52 C ATOM 656 O LEU A 456 11.174 32.674 22.137 1.00 70.92 O ATOM 657 CB LEU A 456 11.590 31.201 19.259 1.00 61.02 C ATOM 658 CG LEU A 456 12.364 31.678 18.029 1.00 54.58 C ATOM 659 CD1 LEU A 456 11.530 31.488 16.776 1.00 50.30 C ATOM 660 CD2 LEU A 456 12.762 33.136 18.185 1.00 46.24 C ATOM 661 N LYS A 457 10.665 30.482 22.219 1.00 68.24 N ATOM 662 CA LYS A 457 9.702 30.630 23.304 1.00 72.02 C ATOM 663 C LYS A 457 10.380 31.054 24.602 1.00 71.59 C ATOM 664 O LYS A 457 9.882 31.922 25.318 1.00 73.43 O ATOM 665 CB LYS A 457 8.936 29.327 23.528 1.00 75.73 C ATOM 666 CG LYS A 457 7.972 29.393 24.697 1.00 78.36 C ATOM 667 CD LYS A 457 7.563 28.012 25.168 1.00 80.37 C ATOM 668 CE LYS A 457 6.798 28.091 26.477 1.00 79.62 C ATOM 669 NZ LYS A 457 7.601 28.753 27.542 1.00 81.56 N ATOM 670 N ASN A 458 11.516 30.436 24.906 1.00 68.23 N ATOM 671 CA ASN A 458 12.255 30.766 26.119 1.00 71.59 C ATOM 672 C ASN A 458 12.847 32.169 26.045 1.00 75.75 C ATOM 673 O ASN A 458 13.072 32.814 27.069 1.00 75.65 O ATOM 674 CB ASN A 458 13.362 29.742 26.368 1.00 68.35 C ATOM 675 CG ASN A 458 12.831 28.328 26.495 1.00 75.09 C ATOM 676 OD1 ASN A 458 11.657 28.117 26.800 1.00 75.55 O ATOM 677 ND2 ASN A 458 13.696 27.348 26.258 1.00 70.65 N ATOM 678 N SER A 459 13.086 32.637 24.823 1.00 73.62 N ATOM 679 CA SER A 459 13.652 33.963 24.598 1.00 68.74 C ATOM 680 C SER A 459 12.680 35.063 25.014 1.00 68.35 C ATOM 681 O SER A 459 13.074 36.214 25.199 1.00 73.95 O ATOM 682 CB SER A 459 14.045 34.132 23.130 1.00 69.78 C ATOM 683 OG SER A 459 15.176 33.339 22.813 1.00 70.54 O ATOM 684 N ILE A 460 11.409 34.701 25.154 1.00 65.39 N ATOM 685 CA ILE A 460 10.397 35.627 25.645 1.00 69.46 C ATOM 686 C ILE A 460 10.701 36.029 27.084 1.00 75.18 C ATOM 687 O ILE A 460 10.730 37.214 27.417 1.00 75.48 O ATOM 688 CB ILE A 460 8.986 35.013 25.577 1.00 70.32 C ATOM 689 CG1 ILE A 460 8.639 34.627 24.139 1.00 68.57 C ATOM 690 CG2 ILE A 460 7.956 35.981 26.132 1.00 67.22 C ATOM 691 CD1 ILE A 460 7.423 33.738 24.025 1.00 72.43 C ATOM 692 N ASN A 461 10.935 35.032 27.930 1.00 74.85 N ATOM 693 CA ASN A 461 11.238 35.271 29.335 1.00 77.05 C ATOM 694 C ASN A 461 12.625 35.871 29.533 1.00 80.76 C ATOM 695 O ASN A 461 12.796 36.832 30.283 1.00 82.21 O ATOM 696 CB ASN A 461 11.117 33.970 30.131 1.00 77.46 C ATOM 697 CG ASN A 461 9.698 33.432 30.159 1.00 84.07 C ATOM 698 OD1 ASN A 461 8.840 33.951 30.872 1.00 78.41 O ATOM 699 ND2 ASN A 461 9.446 32.386 29.380 1.00 86.80 N ATOM 700 N LYS A 462 13.613 35.306 28.850 1.00 78.02 N ATOM 701 CA LYS A 462 14.993 35.743 29.011 1.00 76.56 C ATOM 702 C LYS A 462 15.225 37.139 28.426 1.00 76.33 C ATOM 703 O LYS A 462 16.216 37.796 28.750 1.00 74.86 O ATOM 704 CB LYS A 462 15.947 34.734 28.368 1.00 78.87 C ATOM 705 CG LYS A 462 15.821 33.314 28.920 1.00 87.70 C ATOM 706 CD LYS A 462 17.178 32.729 29.287 1.00 92.32 C ATOM 707 CE LYS A 462 17.048 31.307 29.818 1.00 94.81 C ATOM 708 NZ LYS A 462 15.949 30.552 29.154 1.00 85.49 N ATOM 709 N LYS A 463 14.313 37.577 27.562 1.00 75.97 N ATOM 710 CA LYS A 463 14.359 38.923 26.994 1.00 73.62 C ATOM 711 C LYS A 463 15.674 39.207 26.267 1.00 64.63 C ATOM 712 O LYS A 463 16.187 40.323 26.312 1.00 77.66 O ATOM 713 CB LYS A 463 14.134 39.968 28.093 1.00 79.59 C ATOM 714 CG LYS A 463 12.803 39.833 28.822 1.00 76.45 C ATOM 715 CD LYS A 463 12.831 40.550 30.166 1.00 80.10 C ATOM 716 CE LYS A 463 11.460 40.540 30.828 1.00 84.51 C ATOM 717 NZ LYS A 463 10.391 41.023 29.910 1.00 90.03 N ATOM 718 N ASN A 464 16.218 38.194 25.600 1.00 61.45 N ATOM 719 CA ASN A 464 17.486 38.344 24.893 1.00 62.79 C ATOM 720 C ASN A 464 17.294 38.805 23.452 1.00 69.39 C ATOM 721 O ASN A 464 16.292 38.473 22.820 1.00 64.26 O ATOM 722 CB ASN A 464 18.266 37.026 24.921 1.00 66.62 C ATOM 723 CG ASN A 464 17.635 35.953 24.053 1.00 64.88 C ATOM 724 OD1 ASN A 464 16.751 35.221 24.497 1.00 66.73 O ATOM 725 ND2 ASN A 464 18.095 35.848 22.810 1.00 62.64 N ATOM 726 N PRO A 465 18.254 39.584 22.931 1.00 69.76 N ATOM 727 CA PRO A 465 18.221 40.037 21.536 1.00 62.61 C ATOM 728 C PRO A 465 18.317 38.880 20.546 1.00 65.50 C ATOM 729 O PRO A 465 19.119 37.966 20.742 1.00 64.42 O ATOM 730 CB PRO A 465 19.454 40.942 21.429 1.00 65.21 C ATOM 731 CG PRO A 465 19.743 41.360 22.830 1.00 61.08 C ATOM 732 CD PRO A 465 19.369 40.189 23.679 1.00 64.19 C ATOM 733 N VAL A 466 17.502 38.923 19.496 1.00 69.15 N ATOM 734 CA VAL A 466 17.532 37.899 18.458 1.00 60.60 C ATOM 735 C VAL A 466 17.754 38.530 17.088 1.00 57.60 C ATOM 736 O VAL A 466 16.990 39.397 16.666 1.00 63.80 O ATOM 737 CB VAL A 466 16.228 37.075 18.431 1.00 58.06 C ATOM 738 CG1 VAL A 466 16.290 36.018 17.337 1.00 60.21 C ATOM 739 CG2 VAL A 466 15.976 36.430 19.784 1.00 53.19 C ATOM 740 N ARG A 467 18.803 38.093 16.398 1.00 56.67 N ATOM 741 CA ARG A 467 19.118 38.617 15.073 1.00 54.28 C ATOM 742 C ARG A 467 18.078 38.177 14.047 1.00 58.34 C ATOM 743 O ARG A 467 17.556 37.066 14.115 1.00 59.68 O ATOM 744 CB ARG A 467 20.515 38.170 14.636 1.00 59.93 C ATOM 745 CG ARG A 467 21.645 38.806 15.432 1.00 66.53 C ATOM 746 CD ARG A 467 23.008 38.337 14.947 1.00 60.85 C ATOM 747 NE ARG A 467 23.207 36.908 15.170 1.00 61.07 N ATOM 748 CZ ARG A 467 23.662 36.385 16.304 1.00 64.64 C ATOM 749 NH1 ARG A 467 23.965 37.174 17.326 1.00 62.24 N ATOM 750 NH2 ARG A 467 23.813 35.073 16.418 1.00 64.92 N ATOM 751 N VAL A 468 17.774 39.058 13.100 1.00 60.64 N ATOM 752 CA VAL A 468 16.795 38.752 12.065 1.00 52.69 C ATOM 753 C VAL A 468 17.369 38.995 10.674 1.00 57.58 C ATOM 754 O VAL A 468 17.830 40.093 10.361 1.00 65.20 O ATOM 755 CB VAL A 468 15.507 39.582 12.243 1.00 48.93 C ATOM 756 CG1 VAL A 468 14.664 39.546 10.979 1.00 58.80 C ATOM 757 CG2 VAL A 468 14.712 39.067 13.432 1.00 54.21 C ATOM 758 N ILE A 469 17.344 37.955 9.847 1.00 54.42 N ATOM 759 CA ILE A 469 17.844 38.044 8.482 1.00 56.23 C ATOM 760 C ILE A 469 16.702 37.840 7.495 1.00 58.93 C ATOM 761 O ILE A 469 16.093 36.772 7.449 1.00 59.68 O ATOM 762 CB ILE A 469 18.952 37.007 8.203 1.00 59.64 C ATOM 763 CG1 ILE A 469 20.155 37.230 9.125 1.00 64.43 C ATOM 764 CG2 ILE A 469 19.382 37.067 6.745 1.00 53.96 C ATOM 765 CD1 ILE A 469 20.083 36.473 10.440 1.00 62.64 C ATOM 766 N ARG A 470 16.415 38.870 6.709 1.00 61.02 N ATOM 767 CA ARG A 470 15.308 38.822 5.764 1.00 61.90 C ATOM 768 C ARG A 470 15.790 38.500 4.353 1.00 60.80 C ATOM 769 O ARG A 470 16.801 39.031 3.895 1.00 59.29 O ATOM 770 CB ARG A 470 14.546 40.148 5.773 1.00 68.22 C ATOM 771 CG ARG A 470 13.323 40.176 4.872 1.00 73.81 C ATOM 772 CD ARG A 470 12.457 41.390 5.164 1.00 89.76 C ATOM 773 NE ARG A 470 13.189 42.642 4.997 1.00 87.28 N ATOM 774 CZ ARG A 470 13.148 43.389 3.899 1.00 95.66 C ATOM 775 NH1 ARG A 470 12.407 43.011 2.866 1.00 94.68 N ATOM 776 NH2 ARG A 470 13.846 44.515 3.833 1.00 90.97 N ATOM 777 N GLY A 471 15.061 37.622 3.672 1.00 59.37 N ATOM 778 CA GLY A 471 15.382 37.264 2.304 1.00 58.08 C ATOM 779 C GLY A 471 14.769 38.232 1.311 1.00 66.23 C ATOM 780 O GLY A 471 13.595 38.585 1.422 1.00 67.36 O ATOM 781 N ILE A 472 15.566 38.665 0.340 1.00 65.01 N ATOM 782 CA ILE A 472 15.091 39.600 -0.674 1.00 77.47 C ATOM 783 C ILE A 472 14.990 38.930 -2.042 1.00 84.04 C ATOM 784 O ILE A 472 15.778 38.043 -2.371 1.00 81.36 O ATOM 785 CB ILE A 472 16.007 40.835 -0.776 1.00 77.35 C ATOM 786 CG1 ILE A 472 17.459 40.409 -1.000 1.00 76.96 C ATOM 787 CG2 ILE A 472 15.896 41.681 0.482 1.00 77.00 C ATOM 788 CD1 ILE A 472 18.423 41.568 -1.125 1.00 80.06 C ATOM 789 N LYS A 473 14.010 39.360 -2.832 1.00 89.68 N ATOM 790 CA LYS A 473 13.772 38.783 -4.151 1.00 88.90 C ATOM 791 C LYS A 473 14.925 39.071 -5.107 1.00 89.96 C ATOM 792 O LYS A 473 15.280 38.232 -5.935 1.00 87.58 O ATOM 793 CB LYS A 473 12.462 39.314 -4.736 1.00 87.58 C ATOM 794 N LYS A 484 22.578 40.252 -2.175 1.00 79.96 N ATOM 795 CA LYS A 484 21.915 39.571 -3.281 1.00 81.78 C ATOM 796 C LYS A 484 20.590 38.948 -2.858 1.00 81.82 C ATOM 797 O LYS A 484 19.551 39.221 -3.460 1.00 84.46 O ATOM 798 CB LYS A 484 22.826 38.493 -3.869 1.00 81.78 C ATOM 799 CG LYS A 484 23.791 39.002 -4.927 1.00 81.53 C ATOM 800 CD LYS A 484 23.031 39.582 -6.110 1.00 79.40 C ATOM 801 CE LYS A 484 23.966 40.016 -7.228 1.00 78.83 C ATOM 802 NZ LYS A 484 24.896 41.096 -6.802 1.00 84.38 N ATOM 803 N ASN A 485 20.633 38.118 -1.817 1.00 78.93 N ATOM 804 CA ASN A 485 19.471 37.339 -1.399 1.00 77.02 C ATOM 805 C ASN A 485 19.115 37.479 0.083 1.00 69.54 C ATOM 806 O ASN A 485 18.018 37.102 0.495 1.00 71.60 O ATOM 807 CB ASN A 485 19.699 35.860 -1.711 1.00 72.88 C ATOM 808 CG ASN A 485 19.992 35.611 -3.175 1.00 74.36 C ATOM 809 OD1 ASN A 485 19.086 35.590 -4.008 1.00 80.64 O ATOM 810 ND2 ASN A 485 21.265 35.417 -3.497 1.00 76.73 N ATOM 811 N TYR A 486 20.041 37.994 0.886 1.00 62.90 N ATOM 812 CA TYR A 486 19.796 38.138 2.320 1.00 65.42 C ATOM 813 C TYR A 486 20.244 39.497 2.852 1.00 69.64 C ATOM 814 O TYR A 486 21.250 40.046 2.409 1.00 73.58 O ATOM 815 CB TYR A 486 20.499 37.022 3.095 1.00 63.99 C ATOM 816 CG TYR A 486 19.982 35.642 2.765 1.00 64.18 C ATOM 817 CD1 TYR A 486 18.840 35.142 3.378 1.00 57.27 C ATOM 818 CD2 TYR A 486 20.631 34.842 1.835 1.00 63.53 C ATOM 819 CE1 TYR A 486 18.362 33.881 3.076 1.00 60.20 C ATOM 820 CE2 TYR A 486 20.161 33.581 1.526 1.00 64.80 C ATOM 821 CZ TYR A 486 19.026 33.105 2.149 1.00 63.65 C ATOM 822 OH TYR A 486 18.556 31.849 1.843 1.00 57.60 O ATOM 823 N VAL A 487 19.479 40.034 3.800 1.00 66.93 N ATOM 824 CA VAL A 487 19.798 41.310 4.437 1.00 62.67 C ATOM 825 C VAL A 487 19.642 41.221 5.954 1.00 63.73 C ATOM 826 O VAL A 487 18.664 40.667 6.453 1.00 62.40 O ATOM 827 CB VAL A 487 18.897 42.457 3.917 1.00 65.98 C ATOM 828 CG1 VAL A 487 19.296 43.783 4.554 1.00 65.33 C ATOM 829 CG2 VAL A 487 18.968 42.560 2.403 1.00 74.14 C ATOM 830 N TYR A 488 20.609 41.770 6.683 1.00 66.90 N ATOM 831 CA TYR A 488 20.524 41.851 8.137 1.00 64.53 C ATOM 832 C TYR A 488 19.701 43.066 8.555 1.00 67.25 C ATOM 833 O TYR A 488 20.061 44.203 8.248 1.00 69.36 O ATOM 834 CB TYR A 488 21.924 41.914 8.748 1.00 56.99 C ATOM 835 CG TYR A 488 21.946 42.099 10.247 1.00 59.25 C ATOM 836 CD1 TYR A 488 21.433 41.128 11.096 1.00 61.24 C ATOM 837 CD2 TYR A 488 22.497 43.240 10.814 1.00 65.21 C ATOM 838 CE1 TYR A 488 21.457 41.295 12.469 1.00 60.46 C ATOM 839 CE2 TYR A 488 22.527 43.415 12.183 1.00 58.89 C ATOM 840 CZ TYR A 488 22.007 42.440 13.006 1.00 54.38 C ATOM 841 OH TYR A 488 22.035 42.610 14.370 1.00 60.17 O ATOM 842 N ASP A 489 18.596 42.829 9.257 1.00 67.43 N ATOM 843 CA ASP A 489 17.694 43.921 9.603 1.00 65.10 C ATOM 844 C ASP A 489 17.809 44.370 11.052 1.00 65.95 C ATOM 845 O ASP A 489 17.103 45.285 11.473 1.00 71.91 O ATOM 846 CB ASP A 489 16.249 43.535 9.310 1.00 61.34 C ATOM 847 CG ASP A 489 15.975 43.415 7.822 1.00 76.90 C ATOM 848 OD1 ASP A 489 16.859 43.773 7.021 1.00 77.55 O ATOM 849 OD2 ASP A 489 14.878 42.973 7.433 1.00 86.83 O ATOM 850 N GLY A 490 18.705 43.741 11.808 1.00 59.84 N ATOM 851 CA GLY A 490 18.973 44.167 13.173 1.00 58.66 C ATOM 852 C GLY A 490 18.486 43.232 14.265 1.00 56.91 C ATOM 853 O GLY A 490 18.197 42.063 14.015 1.00 60.80 O ATOM 854 N LEU A 491 18.397 43.754 15.486 1.00 60.01 N ATOM 855 CA LEU A 491 18.017 42.951 16.648 1.00 54.70 C ATOM 856 C LEU A 491 16.529 43.057 16.983 1.00 58.17 C ATOM 857 O LEU A 491 15.930 44.126 16.871 1.00 52.52 O ATOM 858 CB LEU A 491 18.842 43.360 17.871 1.00 61.77 C ATOM 859 CG LEU A 491 20.357 43.165 17.789 1.00 69.27 C ATOM 860 CD1 LEU A 491 21.016 43.563 19.100 1.00 67.99 C ATOM 861 CD2 LEU A 491 20.698 41.727 17.435 1.00 65.35 C ATOM 862 N TYR A 492 15.943 41.938 17.398 1.00 62.52 N ATOM 863 CA TYR A 492 14.532 41.888 17.766 1.00 57.87 C ATOM 864 C TYR A 492 14.347 41.232 19.131 1.00 56.46 C ATOM 865 O TYR A 492 15.243 40.549 19.627 1.00 56.40 O ATOM 866 CB TYR A 492 13.723 41.121 16.713 1.00 51.85 C ATOM 867 CG TYR A 492 13.432 41.886 15.437 1.00 56.34 C ATOM 868 CD1 TYR A 492 12.126 42.175 15.063 1.00 56.76 C ATOM 869 CD2 TYR A 492 14.459 42.308 14.603 1.00 54.73 C ATOM 870 CE1 TYR A 492 11.852 42.865 13.897 1.00 50.20 C ATOM 871 CE2 TYR A 492 14.194 43.000 13.437 1.00 52.11 C ATOM 872 CZ TYR A 492 12.890 43.276 13.089 1.00 50.75 C ATOM 873 OH TYR A 492 12.621 43.964 11.928 1.00 60.99 O ATOM 874 N LEU A 493 13.182 41.444 19.734 1.00 60.28 N ATOM 875 CA LEU A 493 12.821 40.762 20.971 1.00 55.85 C ATOM 876 C LEU A 493 11.565 39.925 20.765 1.00 60.11 C ATOM 877 O LEU A 493 10.584 40.397 20.192 1.00 58.27 O ATOM 878 CB LEU A 493 12.603 41.763 22.109 1.00 57.78 C ATOM 879 CG LEU A 493 13.832 42.456 22.700 1.00 64.78 C ATOM 880 CD1 LEU A 493 13.418 43.430 23.792 1.00 61.32 C ATOM 881 CD2 LEU A 493 14.820 41.433 23.240 1.00 58.67 C ATOM 882 N VAL A 494 11.601 38.680 21.228 1.00 57.70 N ATOM 883 CA VAL A 494 10.443 37.802 21.130 1.00 56.12 C ATOM 884 C VAL A 494 9.439 38.153 22.222 1.00 57.91 C ATOM 885 O VAL A 494 9.619 37.784 23.381 1.00 62.67 O ATOM 886 CB VAL A 494 10.837 36.320 21.250 1.00 54.49 C ATOM 887 CG1 VAL A 494 9.696 35.433 20.782 1.00 57.43 C ATOM 888 CG2 VAL A 494 12.090 36.040 20.439 1.00 53.02 C ATOM 889 N GLU A 495 8.386 38.872 21.849 1.00 59.10 N ATOM 890 CA GLU A 495 7.416 39.352 22.826 1.00 58.90 C ATOM 891 C GLU A 495 6.481 38.247 23.309 1.00 62.80 C ATOM 892 O GLU A 495 6.164 38.180 24.498 1.00 69.12 O ATOM 893 CB GLU A 495 6.606 40.514 22.248 1.00 63.75 C ATOM 894 CG GLU A 495 7.435 41.765 21.998 1.00 62.71 C ATOM 895 CD GLU A 495 6.591 43.019 21.901 1.00 72.59 C ATOM 896 OE1 GLU A 495 5.360 42.901 21.730 1.00 74.30 O ATOM 897 OE2 GLU A 495 7.160 44.126 22.004 1.00 74.81 O ATOM 898 N GLU A 496 6.045 37.383 22.396 1.00 61.34 N ATOM 899 CA GLU A 496 5.169 36.272 22.762 1.00 64.89 C ATOM 900 C GLU A 496 5.046 35.215 21.667 1.00 61.36 C ATOM 901 O GLU A 496 5.691 35.300 20.623 1.00 61.29 O ATOM 902 CB GLU A 496 3.776 36.788 23.117 1.00 70.46 C ATOM 903 CG GLU A 496 3.060 37.451 21.962 1.00 64.78 C ATOM 904 CD GLU A 496 1.647 37.844 22.319 1.00 77.08 C ATOM 905 OE1 GLU A 496 1.477 38.744 23.168 1.00 80.00 O ATOM 906 OE2 GLU A 496 0.707 37.246 21.753 1.00 75.79 O ATOM 907 N TYR A 497 4.199 34.222 21.925 1.00 64.02 N ATOM 908 CA TYR A 497 3.939 33.146 20.978 1.00 62.92 C ATOM 909 C TYR A 497 2.561 32.543 21.233 1.00 58.38 C ATOM 910 O TYR A 497 1.995 32.717 22.312 1.00 65.14 O ATOM 911 CB TYR A 497 5.010 32.060 21.084 1.00 61.07 C ATOM 912 CG TYR A 497 4.711 31.023 22.143 1.00 70.51 C ATOM 913 CD1 TYR A 497 4.279 29.749 21.794 1.00 68.27 C ATOM 914 CD2 TYR A 497 4.846 31.320 23.493 1.00 70.84 C ATOM 915 CE1 TYR A 497 3.999 28.800 22.757 1.00 70.13 C ATOM 916 CE2 TYR A 497 4.567 30.377 24.464 1.00 70.65 C ATOM 917 CZ TYR A 497 4.145 29.119 24.091 1.00 75.16 C ATOM 918 OH TYR A 497 3.866 28.176 25.055 1.00 76.85 O ATOM 919 N TRP A 498 2.027 31.831 20.245 1.00 58.72 N ATOM 920 CA TRP A 498 0.748 31.145 20.409 1.00 62.52 C ATOM 921 C TRP A 498 0.573 30.023 19.389 1.00 58.31 C ATOM 922 O TRP A 498 1.383 29.869 18.475 1.00 58.76 O ATOM 923 CB TRP A 498 -0.415 32.136 20.303 1.00 60.83 C ATOM 924 CG TRP A 498 -0.598 32.723 18.938 1.00 57.42 C ATOM 925 CD1 TRP A 498 -1.346 32.210 17.919 1.00 59.85 C ATOM 926 CD2 TRP A 498 -0.030 33.942 18.443 1.00 61.36 C ATOM 927 NE1 TRP A 498 -1.276 33.030 16.820 1.00 61.07 N ATOM 928 CE2 TRP A 498 -0.474 34.101 17.117 1.00 58.20 C ATOM 929 CE3 TRP A 498 0.812 34.913 18.994 1.00 65.95 C ATOM 930 CZ2 TRP A 498 -0.106 35.191 16.331 1.00 56.94 C ATOM 931 CZ3 TRP A 498 1.178 35.994 18.212 1.00 64.77 C ATOM 932 CH2 TRP A 498 0.719 36.124 16.895 1.00 57.34 C ATOM 933 N GLU A 499 -0.490 29.243 19.554 1.00 63.59 N ATOM 934 CA GLU A 499 -0.772 28.126 18.660 1.00 63.98 C ATOM 935 C GLU A 499 -1.875 28.459 17.662 1.00 64.48 C ATOM 936 O GLU A 499 -2.958 28.899 18.044 1.00 62.33 O ATOM 937 CB GLU A 499 -1.172 26.882 19.460 1.00 72.00 C ATOM 938 CG GLU A 499 -0.076 26.306 20.340 1.00 77.79 C ATOM 939 CD GLU A 499 -0.527 25.057 21.074 1.00 91.45 C ATOM 940 OE1 GLU A 499 -1.664 24.602 20.830 1.00 91.35 O ATOM 941 OE2 GLU A 499 0.255 24.528 21.893 1.00 99.82 O ATOM 942 N GLU A 500 -1.592 28.245 16.381 1.00 68.63 N ATOM 943 CA GLU A 500 -2.611 28.358 15.345 1.00 66.92 C ATOM 944 C GLU A 500 -2.932 26.984 14.773 1.00 66.82 C ATOM 945 O GLU A 500 -2.081 26.095 14.755 1.00 71.48 O ATOM 946 CB GLU A 500 -2.162 29.298 14.223 1.00 62.86 C ATOM 947 CG GLU A 500 -2.191 30.773 14.582 1.00 61.44 C ATOM 948 CD GLU A 500 -2.115 31.669 13.358 1.00 58.58 C ATOM 949 OE1 GLU A 500 -2.157 31.139 12.228 1.00 55.16 O ATOM 950 OE2 GLU A 500 -2.016 32.903 13.527 1.00 67.02 O ATOM 951 N THR A 501 -4.165 26.814 14.311 1.00 68.91 N ATOM 952 CA THR A 501 -4.585 25.565 13.689 1.00 71.06 C ATOM 953 C THR A 501 -4.999 25.815 12.245 1.00 76.27 C ATOM 954 O THR A 501 -6.137 26.199 11.974 1.00 78.31 O ATOM 955 CB THR A 501 -5.755 24.912 14.451 1.00 72.59 C ATOM 956 OG1 THR A 501 -6.968 25.622 14.171 1.00 79.84 O ATOM 957 CG2 THR A 501 -5.494 24.925 15.950 1.00 63.15 C ATOM 958 N GLY A 502 -4.069 25.598 11.320 1.00 80.18 N ATOM 959 CA GLY A 502 -4.319 25.849 9.912 1.00 87.71 C ATOM 960 C GLY A 502 -5.324 24.896 9.292 1.00 93.60 C ATOM 961 O GLY A 502 -5.940 24.086 9.985 1.00 88.36 O ATOM 962 N SER A 503 -5.486 24.992 7.975 1.00 94.50 N ATOM 963 CA SER A 503 -6.411 24.140 7.249 1.00100.48 C ATOM 964 C SER A 503 -5.993 22.682 7.269 1.00103.50 C ATOM 965 O SER A 503 -6.791 21.791 6.967 1.00 99.58 O ATOM 966 N HIS A 504 -4.734 22.444 7.623 1.00103.75 N ATOM 967 CA HIS A 504 -4.203 21.093 7.762 1.00 98.81 C ATOM 968 C HIS A 504 -4.980 20.320 8.819 1.00 97.31 C ATOM 969 O HIS A 504 -5.281 19.137 8.651 1.00101.80 O ATOM 970 CB HIS A 504 -2.722 21.132 8.145 1.00 96.30 C ATOM 971 CG HIS A 504 -1.971 22.287 7.558 1.00101.99 C ATOM 972 ND1 HIS A 504 -1.203 23.139 8.322 1.00100.96 N ATOM 973 CD2 HIS A 504 -1.868 22.729 6.282 1.00101.11 C ATOM 974 CE1 HIS A 504 -0.662 24.059 7.544 1.00104.20 C ATOM 975 NE2 HIS A 504 -1.048 23.833 6.301 1.00106.93 N ATOM 976 N GLY A 505 -5.302 21.010 9.908 1.00 95.02 N ATOM 977 CA GLY A 505 -5.891 20.385 11.075 1.00 88.49 C ATOM 978 C GLY A 505 -4.809 20.185 12.116 1.00 80.19 C ATOM 979 O GLY A 505 -5.005 19.500 13.120 1.00 80.48 O ATOM 980 N LYS A 506 -3.658 20.800 11.867 1.00 83.99 N ATOM 981 CA LYS A 506 -2.487 20.626 12.716 1.00 78.09 C ATOM 982 C LYS A 506 -2.011 21.949 13.305 1.00 72.76 C ATOM 983 O LYS A 506 -2.286 23.019 12.761 1.00 77.19 O ATOM 984 CB LYS A 506 -1.356 19.968 11.924 1.00 75.99 C ATOM 985 CG LYS A 506 -1.731 18.622 11.325 1.00 79.77 C ATOM 986 CD LYS A 506 -2.233 17.670 12.397 1.00 70.24 C ATOM 987 CE LYS A 506 -2.696 16.353 11.803 1.00 72.88 C ATOM 988 NZ LYS A 506 -3.193 15.423 12.854 1.00 79.27 N ATOM 989 N LEU A 507 -1.293 21.865 14.419 1.00 70.16 N ATOM 990 CA LEU A 507 -0.805 23.050 15.113 1.00 67.17 C ATOM 991 C LEU A 507 0.426 23.651 14.447 1.00 69.31 C ATOM 992 O LEU A 507 1.354 22.936 14.067 1.00 65.89 O ATOM 993 CB LEU A 507 -0.480 22.718 16.571 1.00 72.68 C ATOM 994 CG LEU A 507 -1.638 22.356 17.499 1.00 77.97 C ATOM 995 CD1 LEU A 507 -1.108 21.937 18.860 1.00 78.37 C ATOM 996 CD2 LEU A 507 -2.594 23.527 17.637 1.00 74.30 C ATOM 997 N VAL A 508 0.423 24.972 14.309 1.00 65.56 N ATOM 998 CA VAL A 508 1.613 25.707 13.903 1.00 60.68 C ATOM 999 C VAL A 508 1.886 26.798 14.932 1.00 56.25 C ATOM 1000 O VAL A 508 0.961 27.321 15.554 1.00 59.70 O ATOM 1001 CB VAL A 508 1.468 26.329 12.498 1.00 60.15 C ATOM 1002 CG1 VAL A 508 1.344 25.240 11.443 1.00 70.40 C ATOM 1003 CG2 VAL A 508 0.276 27.270 12.444 1.00 69.04 C ATOM 1004 N PHE A 509 3.157 27.128 15.125 1.00 56.72 N ATOM 1005 CA PHE A 509 3.524 28.152 16.094 1.00 57.53 C ATOM 1006 C PHE A 509 3.723 29.503 15.423 1.00 53.28 C ATOM 1007 O PHE A 509 4.230 29.587 14.305 1.00 51.41 O ATOM 1008 CB PHE A 509 4.790 27.750 16.852 1.00 60.51 C ATOM 1009 CG PHE A 509 4.585 26.618 17.817 1.00 69.59 C ATOM 1010 CD1 PHE A 509 3.871 26.811 18.988 1.00 68.37 C ATOM 1011 CD2 PHE A 509 5.108 25.363 17.555 1.00 64.98 C ATOM 1012 CE1 PHE A 509 3.680 25.773 19.879 1.00 75.35 C ATOM 1013 CE2 PHE A 509 4.921 24.321 18.443 1.00 67.73 C ATOM 1014 CZ PHE A 509 4.206 24.526 19.606 1.00 74.41 C ATOM 1015 N LYS A 510 3.309 30.559 16.115 1.00 54.72 N ATOM 1016 CA LYS A 510 3.491 31.920 15.633 1.00 54.52 C ATOM 1017 C LYS A 510 4.250 32.739 16.666 1.00 49.73 C ATOM 1018 O LYS A 510 3.832 32.835 17.818 1.00 52.33 O ATOM 1019 CB LYS A 510 2.143 32.573 15.326 1.00 57.26 C ATOM 1020 CG LYS A 510 1.359 31.895 14.217 1.00 53.72 C ATOM 1021 CD LYS A 510 2.071 32.021 12.881 1.00 51.87 C ATOM 1022 CE LYS A 510 1.309 31.301 11.781 1.00 51.44 C ATOM 1023 NZ LYS A 510 1.959 31.474 10.454 1.00 55.47 N ATOM 1024 N PHE A 511 5.367 33.326 16.253 1.00 55.34 N ATOM 1025 CA PHE A 511 6.190 34.108 17.166 1.00 57.34 C ATOM 1026 C PHE A 511 6.139 35.595 16.836 1.00 50.19 C ATOM 1027 O PHE A 511 6.508 36.014 15.738 1.00 51.18 O ATOM 1028 CB PHE A 511 7.634 33.607 17.142 1.00 54.78 C ATOM 1029 CG PHE A 511 7.790 32.192 17.619 1.00 52.27 C ATOM 1030 CD1 PHE A 511 7.980 31.918 18.963 1.00 53.93 C ATOM 1031 CD2 PHE A 511 7.747 31.136 16.724 1.00 47.20 C ATOM 1032 CE1 PHE A 511 8.121 30.616 19.408 1.00 62.54 C ATOM 1033 CE2 PHE A 511 7.889 29.832 17.162 1.00 57.92 C ATOM 1034 CZ PHE A 511 8.077 29.572 18.505 1.00 55.18 C ATOM 1035 N LYS A 512 5.675 36.386 17.797 1.00 53.76 N ATOM 1036 CA LYS A 512 5.577 37.831 17.633 1.00 55.14 C ATOM 1037 C LYS A 512 6.849 38.524 18.106 1.00 55.03 C ATOM 1038 O LYS A 512 7.131 38.571 19.303 1.00 57.15 O ATOM 1039 CB LYS A 512 4.370 38.373 18.400 1.00 57.59 C ATOM 1040 CG LYS A 512 4.265 39.888 18.410 1.00 61.72 C ATOM 1041 CD LYS A 512 3.181 40.352 19.371 1.00 69.24 C ATOM 1042 CE LYS A 512 3.225 41.857 19.572 1.00 66.83 C ATOM 1043 NZ LYS A 512 2.631 42.263 20.877 1.00 71.74 N ATOM 1044 N LEU A 513 7.614 39.061 17.162 1.00 50.54 N ATOM 1045 CA LEU A 513 8.859 39.746 17.491 1.00 57.82 C ATOM 1046 C LEU A 513 8.764 41.240 17.204 1.00 58.98 C ATOM 1047 O LEU A 513 8.184 41.651 16.199 1.00 52.78 O ATOM 1048 CB LEU A 513 10.034 39.143 16.714 1.00 50.32 C ATOM 1049 CG LEU A 513 10.536 37.750 17.107 1.00 52.62 C ATOM 1050 CD1 LEU A 513 9.655 36.650 16.532 1.00 51.96 C ATOM 1051 CD2 LEU A 513 11.983 37.565 16.672 1.00 52.18 C ATOM 1052 N ARG A 514 9.335 42.049 18.090 1.00 61.98 N ATOM 1053 CA ARG A 514 9.372 43.492 17.882 1.00 59.11 C ATOM 1054 C ARG A 514 10.806 43.993 17.755 1.00 55.69 C ATOM 1055 O ARG A 514 11.685 43.600 18.521 1.00 56.16 O ATOM 1056 CB ARG A 514 8.662 44.229 19.019 1.00 54.70 C ATOM 1057 CG ARG A 514 8.618 45.739 18.825 1.00 62.01 C ATOM 1058 CD ARG A 514 7.981 46.447 20.007 1.00 59.10 C ATOM 1059 NE ARG A 514 6.613 45.995 20.242 1.00 54.12 N ATOM 1060 CZ ARG A 514 5.544 46.506 19.640 1.00 52.08 C ATOM 1061 NH1 ARG A 514 5.682 47.488 18.760 1.00 49.58 N ATOM 1062 NH2 ARG A 514 4.337 46.032 19.915 1.00 54.29 N ATOM 1063 N ARG A 515 11.030 44.865 16.778 1.00 55.45 N ATOM 1064 CA ARG A 515 12.344 45.448 16.549 1.00 51.86 C ATOM 1065 C ARG A 515 12.703 46.420 17.667 1.00 61.36 C ATOM 1066 O ARG A 515 11.930 47.324 17.985 1.00 67.00 O ATOM 1067 CB ARG A 515 12.377 46.156 15.194 1.00 51.03 C ATOM 1068 CG ARG A 515 13.768 46.421 14.646 1.00 51.26 C ATOM 1069 CD ARG A 515 13.688 46.866 13.195 1.00 47.51 C ATOM 1070 NE ARG A 515 15.005 47.026 12.586 1.00 61.03 N ATOM 1071 CZ ARG A 515 15.612 48.195 12.419 1.00 65.48 C ATOM 1072 NH1 ARG A 515 15.022 49.314 12.817 1.00 61.80 N ATOM 1073 NH2 ARG A 515 16.810 48.247 11.853 1.00 64.79 N ATOM 1074 N ILE A 516 13.873 46.222 18.266 1.00 62.37 N ATOM 1075 CA ILE A 516 14.342 47.095 19.337 1.00 58.48 C ATOM 1076 C ILE A 516 14.583 48.505 18.807 1.00 61.90 C ATOM 1077 O ILE A 516 15.334 48.690 17.850 1.00 60.09 O ATOM 1078 CB ILE A 516 15.635 46.557 19.980 1.00 64.23 C ATOM 1079 CG1 ILE A 516 15.407 45.150 20.538 1.00 60.06 C ATOM 1080 CG2 ILE A 516 16.120 47.494 21.076 1.00 61.87 C ATOM 1081 CD1 ILE A 516 16.634 44.541 21.182 1.00 52.75 C ATOM 1082 N PRO A 517 13.934 49.503 19.427 1.00 64.41 N ATOM 1083 CA PRO A 517 14.027 50.905 19.005 1.00 61.08 C ATOM 1084 C PRO A 517 15.457 51.439 19.033 1.00 59.28 C ATOM 1085 O PRO A 517 16.232 51.068 19.913 1.00 56.73 O ATOM 1086 CB PRO A 517 13.157 51.640 20.031 1.00 60.25 C ATOM 1087 CG PRO A 517 12.229 50.600 20.561 1.00 54.90 C ATOM 1088 CD PRO A 517 13.024 49.333 20.573 1.00 59.13 C ATOM 1089 N GLY A 518 15.797 52.295 18.073 1.00 60.49 N ATOM 1090 CA GLY A 518 17.107 52.918 18.037 1.00 65.33 C ATOM 1091 C GLY A 518 17.940 52.536 16.829 1.00 68.95 C ATOM 1092 O GLY A 518 18.818 53.287 16.405 1.00 73.69 O ATOM 1093 N GLN A 519 17.660 51.363 16.272 1.00 68.32 N ATOM 1094 CA GLN A 519 18.430 50.840 15.151 1.00 64.57 C ATOM 1095 C GLN A 519 18.104 51.563 13.847 1.00 68.02 C ATOM 1096 O GLN A 519 16.999 52.083 13.685 1.00 68.93 O ATOM 1097 CB GLN A 519 18.176 49.340 14.998 1.00 70.39 C ATOM 1098 CG GLN A 519 18.707 48.510 16.151 1.00 69.20 C ATOM 1099 CD GLN A 519 18.051 47.149 16.235 1.00 67.27 C ATOM 1100 OE1 GLN A 519 18.641 46.138 15.856 1.00 70.40 O ATOM 1101 NE2 GLN A 519 16.822 47.116 16.737 1.00 67.36 N ATOM 1102 N PRO A 520 19.074 51.609 12.918 1.00 68.99 N ATOM 1103 CA PRO A 520 18.855 52.183 11.586 1.00 65.32 C ATOM 1104 C PRO A 520 17.691 51.517 10.855 1.00 71.99 C ATOM 1105 O PRO A 520 17.522 50.302 10.952 1.00 75.91 O ATOM 1106 CB PRO A 520 20.177 51.909 10.865 1.00 63.54 C ATOM 1107 CG PRO A 520 21.185 51.831 11.954 1.00 63.71 C ATOM 1108 CD PRO A 520 20.476 51.197 13.114 1.00 66.52 C ATOM 1109 N GLU A 521 16.900 52.309 10.137 1.00 72.31 N ATOM 1110 CA GLU A 521 15.746 51.789 9.411 1.00 73.68 C ATOM 1111 C GLU A 521 16.153 51.184 8.076 1.00 79.58 C ATOM 1112 O GLU A 521 17.171 51.560 7.497 1.00 88.56 O ATOM 1113 CB GLU A 521 14.712 52.893 9.180 1.00 76.80 C ATOM 1114 N LEU A 522 15.347 50.255 7.580 1.00 83.16 N ATOM 1115 CA LEU A 522 15.643 49.619 6.306 1.00 87.91 C ATOM 1116 C LEU A 522 14.403 49.579 5.415 1.00 94.47 C ATOM 1117 O LEU A 522 13.315 49.239 5.878 1.00102.19 O ATOM 1118 CB LEU A 522 16.199 48.218 6.548 1.00 80.85 C ATOM 1119 CG LEU A 522 17.725 48.142 6.604 1.00 87.43 C ATOM 1120 CD1 LEU A 522 18.155 46.921 7.348 1.00 78.82 C ATOM 1121 CD2 LEU A 522 18.278 48.089 5.203 1.00 83.14 C ATOM 1122 N PRO A 523 14.566 49.946 4.132 1.00100.31 N ATOM 1123 CA PRO A 523 13.466 50.116 3.175 1.00103.15 C ATOM 1124 C PRO A 523 13.141 48.864 2.363 1.00102.72 C ATOM 1125 O PRO A 523 14.021 48.047 2.095 1.00102.78 O ATOM 1126 CB PRO A 523 13.981 51.229 2.258 1.00102.52 C ATOM 1127 CG PRO A 523 15.490 51.169 2.366 1.00103.95 C ATOM 1128 CD PRO A 523 15.865 50.263 3.515 1.00 99.07 C ATOM 1129 N TRP A 524 11.875 48.729 1.977 1.00103.66 N ATOM 1130 CA TRP A 524 11.423 47.606 1.164 1.00103.67 C ATOM 1131 C TRP A 524 10.122 47.957 0.451 1.00104.65 C ATOM 1132 O TRP A 524 9.383 47.076 0.013 1.00105.09 O ATOM 1133 CB TRP A 524 11.244 46.361 2.022 1.00102.48 C TER 1134 TRP A 524 ATOM 1135 O5' DA B 1 21.893 6.567 9.995 1.00 68.94 O ATOM 1136 C5' DA B 1 21.271 5.944 11.114 1.00 68.08 C ATOM 1137 C4' DA B 1 20.002 6.680 11.522 1.00 78.21 C ATOM 1138 O4' DA B 1 20.343 7.864 12.282 1.00 78.23 O ATOM 1139 C3' DA B 1 19.123 7.157 10.375 1.00 87.33 C ATOM 1140 O3' DA B 1 17.753 7.094 10.753 1.00 89.21 O ATOM 1141 C2' DA B 1 19.583 8.598 10.146 1.00 80.74 C ATOM 1142 C1' DA B 1 20.094 9.033 11.523 1.00 75.94 C ATOM 1143 N9 DA B 1 21.333 9.805 11.461 1.00 72.39 N ATOM 1144 C8 DA B 1 22.487 9.458 10.815 1.00 69.60 C ATOM 1145 N7 DA B 1 23.447 10.345 10.930 1.00 68.24 N ATOM 1146 C5 DA B 1 22.885 11.343 11.708 1.00 59.45 C ATOM 1147 C6 DA B 1 23.389 12.567 12.191 1.00 61.86 C ATOM 1148 N6 DA B 1 24.630 13.001 11.944 1.00 58.16 N ATOM 1149 N1 DA B 1 22.566 13.329 12.941 1.00 66.68 N ATOM 1150 C2 DA B 1 21.325 12.891 13.186 1.00 62.07 C ATOM 1151 N3 DA B 1 20.740 11.762 12.787 1.00 63.90 N ATOM 1152 C4 DA B 1 21.582 11.026 12.045 1.00 63.61 C ATOM 1153 P DC B 2 16.602 7.440 9.686 1.00102.27 P ATOM 1154 OP1 DC B 2 15.389 6.681 10.063 1.00 96.77 O ATOM 1155 OP2 DC B 2 17.177 7.285 8.331 1.00 96.45 O ATOM 1156 O5' DC B 2 16.324 8.995 9.922 1.00 89.68 O ATOM 1157 C5' DC B 2 15.990 9.464 11.220 1.00 86.89 C ATOM 1158 C4' DC B 2 15.905 10.977 11.234 1.00 85.36 C ATOM 1159 O4' DC B 2 17.232 11.535 11.316 1.00 87.33 O ATOM 1160 C3' DC B 2 15.257 11.594 9.991 1.00 81.64 C ATOM 1161 O3' DC B 2 14.013 12.194 10.344 1.00 84.70 O ATOM 1162 C2' DC B 2 16.280 12.629 9.489 1.00 75.56 C ATOM 1163 C1' DC B 2 17.242 12.772 10.659 1.00 74.50 C ATOM 1164 N1 DC B 2 18.640 13.066 10.239 1.00 66.27 N ATOM 1165 C2 DC B 2 19.322 14.148 10.805 1.00 63.67 C ATOM 1166 O2 DC B 2 18.751 14.846 11.652 1.00 64.79 O ATOM 1167 N3 DC B 2 20.595 14.400 10.409 1.00 60.82 N ATOM 1168 C4 DC B 2 21.176 13.623 9.493 1.00 64.22 C ATOM 1169 N4 DC B 2 22.431 13.910 9.134 1.00 61.79 N ATOM 1170 C5 DC B 2 20.495 12.517 8.904 1.00 61.17 C ATOM 1171 C6 DC B 2 19.241 12.278 9.302 1.00 64.92 C ATOM 1172 P DT B 3 13.233 13.144 9.307 1.00 94.50 P ATOM 1173 OP1 DT B 3 11.802 13.107 9.679 1.00 97.28 O ATOM 1174 OP2 DT B 3 13.633 12.784 7.928 1.00 70.69 O ATOM 1175 O5' DT B 3 13.799 14.600 9.641 1.00 80.35 O ATOM 1176 C5' DT B 3 13.906 15.018 10.996 1.00 74.99 C ATOM 1177 C4' DT B 3 14.594 16.364 11.096 1.00 75.92 C ATOM 1178 O4' DT B 3 15.986 16.229 10.718 1.00 73.77 O ATOM 1179 C3' DT B 3 14.005 17.456 10.198 1.00 79.86 C ATOM 1180 O3' DT B 3 13.720 18.613 10.970 1.00 80.49 O ATOM 1181 C2' DT B 3 15.101 17.718 9.161 1.00 71.06 C ATOM 1182 C1' DT B 3 16.358 17.323 9.919 1.00 69.50 C ATOM 1183 N1 DT B 3 17.477 16.897 9.034 1.00 62.52 N ATOM 1184 C2 DT B 3 18.669 17.580 9.081 1.00 56.52 C ATOM 1185 O2 DT B 3 18.865 18.531 9.816 1.00 55.29 O ATOM 1186 N3 DT B 3 19.633 17.108 8.231 1.00 55.65 N ATOM 1187 C4 DT B 3 19.526 16.042 7.357 1.00 57.15 C ATOM 1188 O4 DT B 3 20.452 15.694 6.630 1.00 58.43 O ATOM 1189 C5 DT B 3 18.248 15.370 7.356 1.00 55.37 C ATOM 1190 C7 DT B 3 18.012 14.199 6.449 1.00 64.89 C ATOM 1191 C6 DT B 3 17.297 15.824 8.186 1.00 57.46 C ATOM 1192 P DA B 4 12.521 19.593 10.541 1.00 88.23 P ATOM 1193 OP1 DA B 4 11.963 20.187 11.776 1.00 67.90 O ATOM 1194 OP2 DA B 4 11.638 18.849 9.615 1.00 70.63 O ATOM 1195 O5' DA B 4 13.255 20.741 9.706 1.00 80.35 O ATOM 1196 C5' DA B 4 14.273 21.519 10.322 1.00 63.54 C ATOM 1197 C4' DA B 4 15.124 22.218 9.279 1.00 59.99 C ATOM 1198 O4' DA B 4 16.085 21.289 8.733 1.00 65.24 O ATOM 1199 C3' DA B 4 14.346 22.779 8.082 1.00 62.17 C ATOM 1200 O3' DA B 4 14.478 24.192 8.035 1.00 61.48 O ATOM 1201 C2' DA B 4 14.994 22.111 6.858 1.00 55.88 C ATOM 1202 C1' DA B 4 16.337 21.654 7.406 1.00 62.25 C ATOM 1203 N9 DA B 4 16.899 20.508 6.697 1.00 58.45 N ATOM 1204 C8 DA B 4 16.220 19.431 6.199 1.00 54.57 C ATOM 1205 N7 DA B 4 16.987 18.552 5.599 1.00 55.55 N ATOM 1206 C5 DA B 4 18.259 19.091 5.710 1.00 56.85 C ATOM 1207 C6 DA B 4 19.522 18.642 5.275 1.00 50.02 C ATOM 1208 N6 DA B 4 19.709 17.496 4.613 1.00 51.49 N ATOM 1209 N1 DA B 4 20.590 19.421 5.548 1.00 51.41 N ATOM 1210 C2 DA B 4 20.399 20.568 6.211 1.00 53.19 C ATOM 1211 N3 DA B 4 19.264 21.092 6.669 1.00 54.32 N ATOM 1212 C4 DA B 4 18.222 20.297 6.383 1.00 57.81 C HETATM 1213 P 5HC B 5 13.219 25.129 8.381 1.00 47.35 P HETATM 1214 OP1 5HC B 5 13.462 25.829 9.739 1.00 52.58 O HETATM 1215 OP2 5HC B 5 11.901 24.305 8.214 1.00 60.28 O HETATM 1216 O5' 5HC B 5 13.260 26.275 7.267 1.00 58.04 O HETATM 1217 C5' 5HC B 5 13.029 25.942 5.887 1.00 52.01 C HETATM 1218 C4' 5HC B 5 13.194 27.013 4.850 1.00 65.06 C HETATM 1219 O4' 5HC B 5 12.196 27.958 4.957 1.00 65.89 O HETATM 1220 C3' 5HC B 5 14.456 27.721 5.016 1.00 61.46 C HETATM 1221 O3' 5HC B 5 14.904 28.171 3.724 1.00 65.04 O HETATM 1222 C2' 5HC B 5 14.150 28.834 5.808 1.00 54.40 C HETATM 1223 C1' 5HC B 5 12.740 29.133 5.491 1.00 61.42 C HETATM 1224 N1 5HC B 5 11.885 29.692 6.643 1.00 58.12 N HETATM 1225 C2 5HC B 5 11.201 30.833 6.492 1.00 56.19 C HETATM 1226 O2 5HC B 5 11.256 31.435 5.490 1.00 59.77 O HETATM 1227 N3 5HC B 5 10.437 31.310 7.512 1.00 47.81 N HETATM 1228 C4 5HC B 5 10.358 30.634 8.678 1.00 48.38 C HETATM 1229 N4 5HC B 5 9.509 31.179 9.780 1.00 49.20 N HETATM 1230 C5 5HC B 5 11.042 29.479 8.832 1.00 54.14 C HETATM 1231 C5M 5HC B 5 10.969 28.709 10.122 1.00 54.20 C HETATM 1232 O5 5HC B 5 12.168 28.600 10.903 1.00 54.31 O HETATM 1233 C6 5HC B 5 11.805 29.007 7.811 1.00 56.85 C ATOM 1234 P DG B 6 15.305 27.111 2.582 1.00 76.65 P ATOM 1235 OP1 DG B 6 14.299 27.221 1.503 1.00 63.03 O ATOM 1236 OP2 DG B 6 15.569 25.799 3.216 1.00 66.31 O ATOM 1237 O5' DG B 6 16.703 27.655 2.037 1.00 60.00 O ATOM 1238 C5' DG B 6 17.761 27.909 2.947 1.00 57.45 C ATOM 1239 C4' DG B 6 19.099 27.554 2.331 1.00 57.99 C ATOM 1240 O4' DG B 6 19.197 26.115 2.178 1.00 59.13 O ATOM 1241 C3' DG B 6 19.349 28.149 0.947 1.00 55.15 C ATOM 1242 O3' DG B 6 20.684 28.610 0.859 1.00 54.00 O ATOM 1243 C2' DG B 6 19.096 26.974 0.005 1.00 57.77 C ATOM 1244 C1' DG B 6 19.556 25.799 0.853 1.00 54.74 C ATOM 1245 N9 DG B 6 18.919 24.537 0.497 1.00 53.91 N ATOM 1246 C8 DG B 6 17.646 24.132 0.819 1.00 56.13 C ATOM 1247 N7 DG B 6 17.349 22.945 0.368 1.00 54.59 N ATOM 1248 C5 DG B 6 18.499 22.536 -0.294 1.00 51.15 C ATOM 1249 C6 DG B 6 18.772 21.333 -0.984 1.00 49.44 C ATOM 1250 O6 DG B 6 18.027 20.357 -1.153 1.00 56.26 O ATOM 1251 N1 DG B 6 20.061 21.324 -1.510 1.00 50.47 N ATOM 1252 C2 DG B 6 20.970 22.348 -1.385 1.00 54.40 C ATOM 1253 N2 DG B 6 22.166 22.155 -1.961 1.00 57.32 N ATOM 1254 N3 DG B 6 20.726 23.480 -0.741 1.00 56.37 N ATOM 1255 C4 DG B 6 19.475 23.505 -0.223 1.00 56.41 C ATOM 1256 P DT B 7 21.047 29.831 -0.117 1.00 66.96 P ATOM 1257 OP1 DT B 7 22.309 30.428 0.371 1.00 68.29 O ATOM 1258 OP2 DT B 7 19.835 30.672 -0.249 1.00 64.50 O ATOM 1259 O5' DT B 7 21.318 29.124 -1.525 1.00 58.25 O ATOM 1260 C5' DT B 7 22.425 28.246 -1.669 1.00 62.02 C ATOM 1261 C4' DT B 7 22.392 27.543 -3.013 1.00 63.27 C ATOM 1262 O4' DT B 7 21.617 26.334 -2.916 1.00 62.05 O ATOM 1263 C3' DT B 7 21.767 28.346 -4.159 1.00 63.88 C ATOM 1264 O3' DT B 7 22.793 28.792 -5.044 1.00 70.60 O ATOM 1265 C2' DT B 7 20.801 27.354 -4.843 1.00 62.20 C ATOM 1266 C1' DT B 7 21.153 26.019 -4.197 1.00 57.53 C ATOM 1267 N1 DT B 7 19.995 25.085 -4.071 1.00 57.97 N ATOM 1268 C2 DT B 7 20.087 23.825 -4.614 1.00 53.67 C ATOM 1269 O2 DT B 7 21.075 23.422 -5.200 1.00 53.92 O ATOM 1270 N3 DT B 7 18.974 23.046 -4.446 1.00 51.03 N ATOM 1271 C4 DT B 7 17.800 23.393 -3.804 1.00 45.04 C ATOM 1272 O4 DT B 7 16.853 22.620 -3.705 1.00 55.12 O ATOM 1273 C5 DT B 7 17.768 24.729 -3.257 1.00 51.15 C ATOM 1274 C7 DT B 7 16.546 25.219 -2.537 1.00 55.77 C ATOM 1275 C6 DT B 7 18.854 25.503 -3.416 1.00 59.27 C ATOM 1276 P DA B 8 22.447 29.668 -6.348 1.00 75.33 P ATOM 1277 OP1 DA B 8 23.435 30.767 -6.416 1.00 65.96 O ATOM 1278 OP2 DA B 8 21.003 29.990 -6.366 1.00 77.51 O ATOM 1279 O5' DA B 8 22.749 28.666 -7.550 1.00 66.10 O ATOM 1280 C5' DA B 8 23.940 27.895 -7.535 1.00 64.69 C ATOM 1281 C4' DA B 8 23.929 26.872 -8.650 1.00 59.86 C ATOM 1282 O4' DA B 8 23.048 25.777 -8.291 1.00 59.92 O ATOM 1283 C3' DA B 8 23.440 27.404 -9.993 1.00 63.74 C ATOM 1284 O3' DA B 8 24.280 26.939 -11.029 1.00 64.96 O ATOM 1285 C2' DA B 8 22.022 26.845 -10.116 1.00 61.41 C ATOM 1286 C1' DA B 8 22.104 25.554 -9.314 1.00 56.50 C ATOM 1287 N9 DA B 8 20.837 25.190 -8.688 1.00 55.32 N ATOM 1288 C8 DA B 8 20.045 25.990 -7.914 1.00 58.85 C ATOM 1289 N7 DA B 8 18.959 25.400 -7.478 1.00 59.86 N ATOM 1290 C5 DA B 8 19.042 24.121 -8.002 1.00 51.41 C ATOM 1291 C6 DA B 8 18.195 23.000 -7.907 1.00 51.82 C ATOM 1292 N6 DA B 8 17.050 23.000 -7.217 1.00 53.79 N ATOM 1293 N1 DA B 8 18.572 21.876 -8.550 1.00 55.45 N ATOM 1294 C2 DA B 8 19.719 21.881 -9.239 1.00 50.62 C ATOM 1295 N3 DA B 8 20.596 22.870 -9.401 1.00 55.47 N ATOM 1296 C4 DA B 8 20.195 23.974 -8.751 1.00 57.96 C ATOM 1297 P DG B 9 24.286 27.678 -12.455 1.00 57.58 P ATOM 1298 OP1 DG B 9 25.697 27.941 -12.815 1.00 61.40 O ATOM 1299 OP2 DG B 9 23.321 28.798 -12.394 1.00 70.97 O ATOM 1300 O5' DG B 9 23.693 26.574 -13.442 1.00 57.87 O ATOM 1301 C5' DG B 9 24.172 25.240 -13.369 1.00 65.39 C ATOM 1302 C4' DG B 9 23.090 24.255 -13.763 1.00 65.30 C ATOM 1303 O4' DG B 9 22.084 24.203 -12.739 1.00 67.14 O ATOM 1304 C3' DG B 9 22.335 24.609 -15.039 1.00 60.40 C ATOM 1305 O3' DG B 9 22.873 23.881 -16.134 1.00 77.89 O ATOM 1306 C2' DG B 9 20.877 24.202 -14.749 1.00 65.50 C ATOM 1307 C1' DG B 9 20.920 23.675 -13.313 1.00 60.95 C ATOM 1308 N9 DG B 9 19.771 24.076 -12.505 1.00 54.62 N ATOM 1309 C8 DG B 9 19.519 25.321 -11.981 1.00 58.36 C ATOM 1310 N7 DG B 9 18.410 25.381 -11.297 1.00 60.78 N ATOM 1311 C5 DG B 9 17.893 24.094 -11.373 1.00 56.56 C ATOM 1312 C6 DG B 9 16.705 23.554 -10.823 1.00 56.77 C ATOM 1313 O6 DG B 9 15.847 24.126 -10.137 1.00 57.82 O ATOM 1314 N1 DG B 9 16.559 22.205 -11.140 1.00 53.37 N ATOM 1315 C2 DG B 9 17.446 21.473 -11.891 1.00 54.63 C ATOM 1316 N2 DG B 9 17.135 20.184 -12.091 1.00 59.20 N ATOM 1317 N3 DG B 9 18.562 21.967 -12.412 1.00 61.43 N ATOM 1318 C4 DG B 9 18.719 23.280 -12.114 1.00 58.20 C ATOM 1319 P DT B 10 22.341 24.150 -17.625 1.00 78.52 P ATOM 1320 OP1 DT B 10 23.424 23.772 -18.559 1.00 79.61 O ATOM 1321 OP2 DT B 10 21.781 25.520 -17.662 1.00 75.84 O ATOM 1322 O5' DT B 10 21.128 23.120 -17.789 1.00 76.05 O ATOM 1323 C5' DT B 10 21.315 21.747 -17.466 1.00 69.22 C ATOM 1324 C4' DT B 10 19.992 21.002 -17.479 1.00 72.60 C ATOM 1325 O4' DT B 10 19.182 21.425 -16.350 1.00 74.35 O ATOM 1326 C3' DT B 10 19.137 21.226 -18.730 1.00 75.23 C ATOM 1327 O3' DT B 10 18.654 19.980 -19.217 1.00 67.59 O ATOM 1328 C2' DT B 10 17.997 22.116 -18.231 1.00 68.01 C ATOM 1329 C1' DT B 10 17.866 21.659 -16.788 1.00 73.09 C ATOM 1330 N1 DT B 10 17.235 22.675 -15.890 1.00 67.09 N ATOM 1331 C2 DT B 10 16.212 22.291 -15.053 1.00 64.96 C ATOM 1332 O2 DT B 10 15.786 21.152 -14.999 1.00 64.41 O ATOM 1333 N3 DT B 10 15.703 23.295 -14.272 1.00 58.66 N ATOM 1334 C4 DT B 10 16.105 24.618 -14.245 1.00 61.70 C ATOM 1335 O4 DT B 10 15.584 25.448 -13.507 1.00 58.82 O ATOM 1336 C5 DT B 10 17.181 24.955 -15.148 1.00 65.28 C ATOM 1337 C7 DT B 10 17.702 26.360 -15.209 1.00 62.31 C ATOM 1338 C6 DT B 10 17.685 23.979 -15.919 1.00 63.15 C TER 1339 DT B 10 HETATM 1340 MG MG A 601 -2.675 34.430 10.846 1.00 69.25 MG HETATM 1341 MG MG B 101 17.424 17.559 -17.826 1.00 80.24 MG HETATM 1342 MG MG B 102 16.120 27.456 -9.380 1.00 72.25 MG HETATM 1343 O HOH A 701 7.339 46.704 -0.965 1.00 69.73 O HETATM 1344 O HOH A 702 32.588 39.392 13.925 1.00 68.02 O HETATM 1345 O HOH A 703 3.136 40.394 23.936 1.00 65.36 O HETATM 1346 O HOH A 704 16.681 30.922 3.473 1.00 57.85 O HETATM 1347 O HOH A 705 19.872 23.503 8.441 1.00 53.40 O HETATM 1348 O HOH A 706 27.853 39.124 0.379 1.00 70.39 O HETATM 1349 O HOH A 707 25.792 45.079 1.773 1.00 71.99 O HETATM 1350 O HOH A 708 21.212 25.653 16.304 1.00 73.42 O HETATM 1351 O HOH A 709 2.596 47.688 22.149 1.00 57.27 O HETATM 1352 O HOH A 710 4.219 15.048 21.825 1.00 86.02 O HETATM 1353 O HOH A 711 2.588 13.374 23.338 1.00 82.22 O HETATM 1354 O HOH B 201 18.673 18.278 -20.708 1.00 68.35 O HETATM 1355 O HOH B 202 12.545 18.746 7.368 1.00 60.57 O HETATM 1356 O HOH B 203 18.517 29.498 -7.678 1.00 64.75 O HETATM 1357 O HOH B 204 17.250 18.805 1.355 1.00 60.37 O HETATM 1358 O HOH B 205 16.916 30.746 -6.048 1.00 79.90 O CONECT 1200 1213 CONECT 1213 1200 1214 1215 1216 CONECT 1214 1213 CONECT 1215 1213 CONECT 1216 1213 1217 CONECT 1217 1216 1218 CONECT 1218 1217 1219 1220 CONECT 1219 1218 1223 CONECT 1220 1218 1221 1222 CONECT 1221 1220 1234 CONECT 1222 1220 1223 CONECT 1223 1219 1222 1224 CONECT 1224 1223 1225 1233 CONECT 1225 1224 1226 1227 CONECT 1226 1225 CONECT 1227 1225 1228 CONECT 1228 1227 1229 1230 CONECT 1229 1228 CONECT 1230 1228 1231 1233 CONECT 1231 1230 1232 CONECT 1232 1231 CONECT 1233 1224 1230 CONECT 1234 1221 MASTER 316 0 4 2 9 0 3 6 1356 2 23 14 END
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Related entries of code: 4ygi
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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Complexes with the same small molecule ligand
PDB Code
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Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4ygi
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
SUVH5 SRA domain
Ligand Name
11-mer fully hydroxymethylated CG DNA
EC.Number
E.C.2.1.1.43
Resolution
2.6(Å)
Affinity (Kd/Ki/IC50)
Kd=1.5uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Sci Rep Vol. 6: pp. 20161-20161
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):
O82175
Entrez Gene ID
NCBI Entrez Gene ID:
818083
ASD
Information of known allosteric effects of PDB entries
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