Browse entries in the PDBbind-CN Database
HEADER DNA BINDING PROTEIN/DNA 03-APR-09 3GYH TITLE CRYSTAL STRUCTURE ANALYSIS OF S. POMBE ATL IN COMPLEX WITH DAMAGED DNA TITLE 2 CONTAINING POB COMPND MOL_ID: 1; COMPND 2 MOLECULE: ALKYLTRANSFERASE-LIKE PROTEIN 1; COMPND 3 CHAIN: X; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: DNA (5'-D(*GP*CP*CP*AP*TP*GP*GP*CP*TP*AP*GP*TP*A)-3'); COMPND 7 CHAIN: Y; COMPND 8 ENGINEERED: YES; COMPND 9 MOL_ID: 3; COMPND 10 MOLECULE: DNA (5'-D(*CP*TP*AP*CP*TP*AP*GP*CP*CP*AP*TP*GP*G)-3'); COMPND 11 CHAIN: Z; COMPND 12 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: SCHIZOSACCHAROMYCES POMBE; SOURCE 3 ORGANISM_COMMON: FISSION YEAST; SOURCE 4 ORGANISM_TAXID: 4896; SOURCE 5 GENE: ATL1, SPAC1250.04C; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 MOL_ID: 2; SOURCE 9 SYNTHETIC: YES; SOURCE 10 MOL_ID: 3; SOURCE 11 SYNTHETIC: YES KEYWDS DNA DAMAGE, DNA REPAIR, DNA-BINDING, DNA BINDING PROTEIN-DNA COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR J.L.TUBBS,A.S.ARVAI,J.A.TAINER,D.S.SHIN REVDAT 3 13-JUL-11 3GYH 1 VERSN REVDAT 2 28-JUL-09 3GYH 1 JRNL REVDAT 1 16-JUN-09 3GYH 0 JRNL AUTH J.L.TUBBS,V.LATYPOV,S.KANUGULA,A.BUTT,M.MELIKISHVILI, JRNL AUTH 2 R.KRAEHENBUEHL,O.FLECK,A.MARRIOTT,A.J.WATSON,B.VERBEEK, JRNL AUTH 3 G.MCGOWN,M.THORNCROFT,M.F.SANTIBANEZ-KOREF,C.MILLINGTON, JRNL AUTH 4 A.S.ARVAI,M.D.KROEGER,L.A.PETERSON,D.M.WILLIAMS,M.G.FRIED, JRNL AUTH 5 G.P.MARGISON,A.E.PEGG,J.A.TAINER JRNL TITL FLIPPING OF ALKYLATED DNA DAMAGE BRIDGES BASE AND NUCLEOTIDE JRNL TITL 2 EXCISION REPAIR. JRNL REF NATURE V. 459 808 2009 JRNL REFN ISSN 0028-0836 JRNL PMID 19516334 JRNL DOI 10.1038/NATURE08076 REMARK 2 REMARK 2 RESOLUTION. 2.80 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.2.0019 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.80 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 34.94 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 93.9 REMARK 3 NUMBER OF REFLECTIONS : 6078 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING + TEST SET) : 0.243 REMARK 3 R VALUE (WORKING SET) : 0.240 REMARK 3 FREE R VALUE : 0.285 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.600 REMARK 3 FREE R VALUE TEST SET COUNT : 341 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.80 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.87 REMARK 3 REFLECTION IN BIN (WORKING SET) : 225 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 73.10 REMARK 3 BIN R VALUE (WORKING SET) : 0.4450 REMARK 3 BIN FREE R VALUE SET COUNT : 6 REMARK 3 BIN FREE R VALUE : 0.6380 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 890 REMARK 3 NUCLEIC ACID ATOMS : 527 REMARK 3 HETEROGEN ATOMS : 11 REMARK 3 SOLVENT ATOMS : 2 REMARK 3 REMARK 3 B VALUES. REMARK 3 B VALUE TYPE : LIKELY RESIDUAL REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 84.27 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 5.59000 REMARK 3 B22 (A**2) : 5.59000 REMARK 3 B33 (A**2) : -8.38000 REMARK 3 B12 (A**2) : 2.79000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 6.232 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.414 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.352 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 42.393 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.935 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.903 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 1515 ; 0.008 ; 0.021 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 2146 ; 1.308 ; 2.398 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 107 ; 9.552 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 46 ;39.370 ;23.043 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 163 ;24.108 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 8 ;22.091 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 225 ; 0.082 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 987 ; 0.004 ; 0.021 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 537 ; 1.000 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 869 ; 1.951 ; 2.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 978 ; 2.840 ; 3.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 1277 ; 4.494 ; 4.500 REMARK 3 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 NCS RESTRAINTS STATISTICS REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : 3 REMARK 3 REMARK 3 TLS GROUP : 1 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : X 1 X 108 REMARK 3 ORIGIN FOR THE GROUP (A): 28.7896 -21.3040 1.8135 REMARK 3 T TENSOR REMARK 3 T11: 0.1113 T22: 0.2578 REMARK 3 T33: 0.2130 T12: 0.0865 REMARK 3 T13: 0.0618 T23: 0.0360 REMARK 3 L TENSOR REMARK 3 L11: 2.0731 L22: 1.4976 REMARK 3 L33: 4.4228 L12: -1.0662 REMARK 3 L13: 0.3162 L23: -0.7987 REMARK 3 S TENSOR REMARK 3 S11: -0.0770 S12: 0.2720 S13: 0.0127 REMARK 3 S21: 0.0728 S22: 0.0276 S23: -0.0510 REMARK 3 S31: -0.4299 S32: -0.1499 S33: 0.0493 REMARK 3 REMARK 3 TLS GROUP : 2 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : Y 201 Y 213 REMARK 3 ORIGIN FOR THE GROUP (A): 29.7547 -38.3685 6.7585 REMARK 3 T TENSOR REMARK 3 T11: 0.2658 T22: 0.2788 REMARK 3 T33: 0.2015 T12: -0.0357 REMARK 3 T13: 0.1401 T23: -0.0390 REMARK 3 L TENSOR REMARK 3 L11: 1.3533 L22: 3.5641 REMARK 3 L33: 6.1664 L12: 0.7280 REMARK 3 L13: 1.1953 L23: 1.5781 REMARK 3 S TENSOR REMARK 3 S11: -0.3327 S12: 0.0133 S13: 0.0125 REMARK 3 S21: -0.1573 S22: 0.2228 S23: -0.0374 REMARK 3 S31: 0.4091 S32: -0.2994 S33: 0.1099 REMARK 3 REMARK 3 TLS GROUP : 3 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : Z 214 Z 226 REMARK 3 ORIGIN FOR THE GROUP (A): 29.8901 -38.9211 6.0434 REMARK 3 T TENSOR REMARK 3 T11: 0.1132 T22: 0.1479 REMARK 3 T33: 0.1272 T12: 0.0223 REMARK 3 T13: 0.0379 T23: 0.0278 REMARK 3 L TENSOR REMARK 3 L11: 1.3445 L22: 1.5510 REMARK 3 L33: 10.1397 L12: 0.1743 REMARK 3 L13: -1.9671 L23: 0.4917 REMARK 3 S TENSOR REMARK 3 S11: 0.0126 S12: 0.2219 S13: 0.2456 REMARK 3 S21: 0.0988 S22: -0.0488 S23: -0.1716 REMARK 3 S31: 0.6378 S32: -0.6942 S33: 0.0362 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.40 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE RIDING REMARK 3 POSITIONS U VALUES: RESIDUAL ONLY REMARK 4 REMARK 4 3GYH COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 04-JUN-09. REMARK 100 THE RCSB ID CODE IS RCSB052464. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 30-MAY-08 REMARK 200 TEMPERATURE (KELVIN) : NULL REMARK 200 PH : NULL REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : SSRL REMARK 200 BEAMLINE : BL11-1 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : NULL REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : NULL REMARK 200 DETECTOR MANUFACTURER : NULL REMARK 200 INTENSITY-INTEGRATION SOFTWARE : NULL REMARK 200 DATA SCALING SOFTWARE : NULL REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 6078 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.800 REMARK 200 RESOLUTION RANGE LOW (A) : 35.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : NULL REMARK 200 DATA REDUNDANCY : NULL REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : NULL REMARK 200
FOR THE DATA SET : NULL REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : NULL REMARK 200 COMPLETENESS FOR SHELL (%) : NULL REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200
FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL REMARK 200 SOFTWARE USED: NULL REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 56.83 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.85 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: NULL REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 61 2 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+1/3 REMARK 290 3555 -X+Y,-X,Z+2/3 REMARK 290 4555 -X,-Y,Z+1/2 REMARK 290 5555 Y,-X+Y,Z+5/6 REMARK 290 6555 X-Y,X,Z+1/6 REMARK 290 7555 Y,X,-Z+1/3 REMARK 290 8555 X-Y,-Y,-Z REMARK 290 9555 -X,-X+Y,-Z+2/3 REMARK 290 10555 -Y,-X,-Z+5/6 REMARK 290 11555 -X+Y,Y,-Z+1/2 REMARK 290 12555 X,X-Y,-Z+1/6 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 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 78.51533 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 157.03067 REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 117.77300 REMARK 290 SMTRY1 5 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 5 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 196.28833 REMARK 290 SMTRY1 6 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 39.25767 REMARK 290 SMTRY1 7 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 7 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 78.51533 REMARK 290 SMTRY1 8 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 9 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 9 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 9 0.000000 0.000000 -1.000000 157.03067 REMARK 290 SMTRY1 10 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 10 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 10 0.000000 0.000000 -1.000000 196.28833 REMARK 290 SMTRY1 11 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 11 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 11 0.000000 0.000000 -1.000000 117.77300 REMARK 290 SMTRY1 12 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 12 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 12 0.000000 0.000000 -1.000000 39.25767 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TRIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TRIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 3530 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 9650 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -15.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: X, Y, Z REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLY X 109 REMARK 465 SER X 110 REMARK 465 HIS X 111 REMARK 465 HIS X 112 REMARK 465 HIS X 113 REMARK 465 HIS X 114 REMARK 465 HIS X 115 REMARK 465 HIS X 116 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 NH2 ARG X 39 N3 DC Z 221 2.17 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. REMARK 500 REMARK 500 DISTANCE CUTOFF: REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE REMARK 500 NH2 ARG X 2 OD2 ASP X 12 12545 2.11 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION REMARK 500 DG Y 207 C6 DG Y 207 N1 -0.045 REMARK 500 DG Y 207 C5 DG Y 207 N7 -0.038 REMARK 500 DG Y 207 N7 DG Y 207 C8 0.055 REMARK 500 DG Y 207 C6 DG Y 207 O6 0.135 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 DT Y 205 O4' - C1' - N1 ANGL. DEV. = -4.2 DEGREES REMARK 500 DG Y 207 O4' - C1' - N9 ANGL. DEV. = 2.3 DEGREES REMARK 500 DG Y 207 C6 - N1 - C2 ANGL. DEV. = -4.9 DEGREES REMARK 500 DG Y 207 C2 - N3 - C4 ANGL. DEV. = 7.8 DEGREES REMARK 500 DG Y 207 N3 - C4 - C5 ANGL. DEV. = -9.2 DEGREES REMARK 500 DG Y 207 C5 - C6 - N1 ANGL. DEV. = 7.1 DEGREES REMARK 500 DG Y 207 C4 - C5 - N7 ANGL. DEV. = -4.3 DEGREES REMARK 500 DG Y 207 C5 - N7 - C8 ANGL. DEV. = 3.6 DEGREES REMARK 500 DG Y 207 N7 - C8 - N9 ANGL. DEV. = -4.4 DEGREES REMARK 500 DG Y 207 N9 - C4 - C5 ANGL. DEV. = 2.9 DEGREES REMARK 500 DG Y 207 N3 - C4 - N9 ANGL. DEV. = 6.3 DEGREES REMARK 500 DG Y 207 C5 - C6 - O6 ANGL. DEV. = -8.2 DEGREES REMARK 500 DG Y 206 C3' - O3' - P ANGL. DEV. = -8.3 DEGREES REMARK 500 DG Y 207 O3' - P - OP2 ANGL. DEV. = 28.6 DEGREES REMARK 500 DG Y 207 O3' - P - OP1 ANGL. DEV. = -27.4 DEGREES REMARK 500 DG Y 207 C3' - O3' - P ANGL. DEV. = -12.8 DEGREES REMARK 500 DC Y 208 O3' - P - OP2 ANGL. DEV. = 16.1 DEGREES REMARK 500 DC Y 208 O3' - P - OP1 ANGL. DEV. = -15.9 DEGREES REMARK 500 DG Y 211 O4' - C1' - N9 ANGL. DEV. = 3.9 DEGREES REMARK 500 DC Z 214 O4' - C1' - N1 ANGL. DEV. = 2.5 DEGREES REMARK 500 DT Z 218 O4' - C1' - N1 ANGL. DEV. = 4.3 DEGREES REMARK 500 DT Z 224 N3 - C4 - O4 ANGL. DEV. = 4.1 DEGREES REMARK 500 DG Z 225 O4' - C1' - N9 ANGL. DEV. = 2.8 DEGREES REMARK 500 DG Z 226 O4' - C4' - C3' ANGL. DEV. = -2.8 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 TYR X 25 -64.48 -29.69 REMARK 500 HIS X 47 36.11 -98.31 REMARK 500 HIS X 53 47.22 -104.84 REMARK 500 ILE X 60 -163.58 -103.02 REMARK 500 ILE X 71 46.72 -96.23 REMARK 500 SER X 72 163.35 40.39 REMARK 500 THR X 92 -144.18 -104.27 REMARK 500 LEU X 94 52.47 -140.22 REMARK 500 GLU X 96 76.52 -7.11 REMARK 500 TYR X 97 129.23 -38.59 REMARK 500 GLU X 103 -82.14 -54.45 REMARK 500 LYS X 107 85.65 -156.40 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: NON-CIS, NON-TRANS REMARK 500 REMARK 500 THE FOLLOWING PEPTIDE BONDS DEVIATE SIGNIFICANTLY FROM BOTH REMARK 500 CIS AND TRANS CONFORMATION. CIS BONDS, IF ANY, ARE LISTED REMARK 500 ON CISPEP RECORDS. TRANS IS DEFINED AS 180 +/- 30 AND REMARK 500 CIS IS DEFINED AS 0 +/- 30 DEGREES. REMARK 500 MODEL OMEGA REMARK 500 SER X 93 LEU X 94 123.74 REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PBO Y 200 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 3GVA RELATED DB: PDB REMARK 900 SAME PROTEIN WITHOUT DNA REMARK 900 RELATED ID: 3GX4 RELATED DB: PDB REMARK 900 SAME PROTEIN WITH DNA DBREF 3GYH X 1 108 UNP Q9UTN9 ATL1_SCHPO 1 108 DBREF 3GYH Y 201 213 PDB 3GYH 3GYH 201 213 DBREF 3GYH Z 214 226 PDB 3GYH 3GYH 214 226 SEQADV 3GYH GLY X 109 UNP Q9UTN9 EXPRESSION TAG SEQADV 3GYH SER X 110 UNP Q9UTN9 EXPRESSION TAG SEQADV 3GYH HIS X 111 UNP Q9UTN9 EXPRESSION TAG SEQADV 3GYH HIS X 112 UNP Q9UTN9 EXPRESSION TAG SEQADV 3GYH HIS X 113 UNP Q9UTN9 EXPRESSION TAG SEQADV 3GYH HIS X 114 UNP Q9UTN9 EXPRESSION TAG SEQADV 3GYH HIS X 115 UNP Q9UTN9 EXPRESSION TAG SEQADV 3GYH HIS X 116 UNP Q9UTN9 EXPRESSION TAG SEQRES 1 X 116 MET ARG MET ASP GLU PHE TYR THR LYS VAL TYR ASP ALA SEQRES 2 X 116 VAL CYS GLU ILE PRO TYR GLY LYS VAL SER THR TYR GLY SEQRES 3 X 116 GLU ILE ALA ARG TYR VAL GLY MET PRO SER TYR ALA ARG SEQRES 4 X 116 GLN VAL GLY GLN ALA MET LYS HIS LEU HIS PRO GLU THR SEQRES 5 X 116 HIS VAL PRO TRP HIS ARG VAL ILE ASN SER ARG GLY THR SEQRES 6 X 116 ILE SER LYS ARG ASP ILE SER ALA GLY GLU GLN ARG GLN SEQRES 7 X 116 LYS ASP ARG LEU GLU GLU GLU GLY VAL GLU ILE TYR GLN SEQRES 8 X 116 THR SER LEU GLY GLU TYR LYS LEU ASN LEU PRO GLU TYR SEQRES 9 X 116 MET TRP LYS PRO GLY SER HIS HIS HIS HIS HIS HIS SEQRES 1 Y 13 DG DC DC DA DT DG DG DC DT DA DG DT DA SEQRES 1 Z 13 DC DT DA DC DT DA DG DC DC DA DT DG DG HET PBO Y 200 11 HETNAM PBO 1-PYRIDIN-3-YLBUTAN-1-ONE FORMUL 4 PBO C9 H11 N O FORMUL 5 HOH *2(H2 O) HELIX 1 1 ARG X 2 CYS X 15 1 14 HELIX 2 2 TYR X 25 VAL X 32 1 8 HELIX 3 3 TYR X 37 HIS X 47 1 11 HELIX 4 4 PRO X 55 HIS X 57 5 3 HELIX 5 5 SER X 72 GLY X 74 5 3 HELIX 6 6 GLU X 75 GLY X 86 1 12 SHEET 1 A 2 SER X 23 THR X 24 0 SHEET 2 A 2 VAL X 59 ILE X 60 1 O ILE X 60 N SER X 23 LINK O6 DG Y 207 C10 PBO Y 200 1555 1555 1.43 SITE 1 AC1 8 MET X 45 LEU X 48 PRO X 50 TRP X 56 SITE 2 AC1 8 ARG X 77 ARG X 81 DG Y 207 DG Y 211 CRYST1 60.180 60.180 235.546 90.00 90.00 120.00 P 61 2 2 12 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 0.016617 0.009594 0.000000 0.00000 SCALE2 0.000000 0.019187 0.000000 0.00000 SCALE3 0.000000 0.000000 0.004245 0.00000 ATOM 1 N MET X 1 39.341 -24.450 22.284 1.00 85.58 N ATOM 2 CA MET X 1 38.308 -23.687 21.525 1.00 84.04 C ATOM 3 C MET X 1 36.932 -24.258 21.840 1.00 82.71 C ATOM 4 O MET X 1 36.604 -25.355 21.405 1.00 82.46 O ATOM 5 CB MET X 1 38.595 -23.795 20.027 1.00 84.42 C ATOM 6 CG MET X 1 37.746 -22.899 19.145 1.00 88.03 C ATOM 7 SD MET X 1 38.203 -22.995 17.394 1.00 93.90 S ATOM 8 CE MET X 1 39.618 -21.889 17.333 1.00 96.96 C ATOM 9 N ARG X 2 36.132 -23.522 22.606 1.00 81.26 N ATOM 10 CA ARG X 2 34.716 -23.850 22.755 1.00 79.41 C ATOM 11 C ARG X 2 33.969 -23.716 21.423 1.00 78.92 C ATOM 12 O ARG X 2 34.412 -23.017 20.510 1.00 79.87 O ATOM 13 CB ARG X 2 34.070 -22.960 23.816 1.00 79.06 C ATOM 14 CG ARG X 2 34.329 -23.402 25.244 1.00 76.74 C ATOM 15 CD ARG X 2 33.715 -22.430 26.244 1.00 71.59 C ATOM 16 NE ARG X 2 34.549 -21.244 26.448 1.00 66.36 N ATOM 17 CZ ARG X 2 34.454 -20.126 25.731 1.00 67.97 C ATOM 18 NH1 ARG X 2 33.558 -20.021 24.751 1.00 62.69 N ATOM 19 NH2 ARG X 2 35.258 -19.105 25.996 1.00 69.71 N ATOM 20 N MET X 3 32.835 -24.386 21.299 1.00 77.50 N ATOM 21 CA MET X 3 32.112 -24.325 20.047 1.00 77.50 C ATOM 22 C MET X 3 31.604 -22.911 19.789 1.00 76.82 C ATOM 23 O MET X 3 31.713 -22.404 18.681 1.00 76.32 O ATOM 24 CB MET X 3 30.979 -25.357 20.012 1.00 77.86 C ATOM 25 CG MET X 3 31.436 -26.786 19.662 1.00 78.56 C ATOM 26 SD MET X 3 32.266 -26.960 18.049 1.00 76.95 S ATOM 27 CE MET X 3 30.858 -26.940 16.929 1.00 78.34 C ATOM 28 N ASP X 4 31.072 -22.274 20.828 1.00 76.83 N ATOM 29 CA ASP X 4 30.562 -20.914 20.719 1.00 77.27 C ATOM 30 C ASP X 4 31.622 -20.032 20.090 1.00 77.82 C ATOM 31 O ASP X 4 31.310 -19.017 19.448 1.00 76.66 O ATOM 32 CB ASP X 4 30.170 -20.360 22.095 1.00 77.22 C ATOM 33 CG ASP X 4 31.327 -20.350 23.078 1.00 77.90 C ATOM 34 OD1 ASP X 4 31.784 -19.244 23.445 1.00 79.70 O ATOM 35 OD2 ASP X 4 31.773 -21.443 23.493 1.00 75.29 O ATOM 36 N GLU X 5 32.875 -20.438 20.274 1.00 77.70 N ATOM 37 CA GLU X 5 34.003 -19.749 19.676 1.00 78.55 C ATOM 38 C GLU X 5 34.129 -20.095 18.200 1.00 78.01 C ATOM 39 O GLU X 5 33.946 -19.223 17.341 1.00 79.00 O ATOM 40 CB GLU X 5 35.286 -20.079 20.429 1.00 79.27 C ATOM 41 CG GLU X 5 35.046 -20.305 21.917 1.00 84.91 C ATOM 42 CD GLU X 5 36.297 -20.116 22.762 1.00 90.81 C ATOM 43 OE1 GLU X 5 37.075 -19.178 22.473 1.00 92.30 O ATOM 44 OE2 GLU X 5 36.496 -20.901 23.719 1.00 93.41 O ATOM 45 N PHE X 6 34.424 -21.362 17.902 1.00 76.86 N ATOM 46 CA PHE X 6 34.399 -21.859 16.518 1.00 74.20 C ATOM 47 C PHE X 6 33.350 -21.090 15.728 1.00 74.43 C ATOM 48 O PHE X 6 33.660 -20.465 14.706 1.00 73.81 O ATOM 49 CB PHE X 6 34.080 -23.356 16.506 1.00 74.10 C ATOM 50 CG PHE X 6 33.864 -23.952 15.124 1.00 70.98 C ATOM 51 CD1 PHE X 6 34.873 -23.970 14.183 1.00 69.69 C ATOM 52 CD2 PHE X 6 32.664 -24.559 14.796 1.00 72.20 C ATOM 53 CE1 PHE X 6 34.679 -24.546 12.929 1.00 67.01 C ATOM 54 CE2 PHE X 6 32.467 -25.144 13.528 1.00 71.29 C ATOM 55 CZ PHE X 6 33.478 -25.135 12.603 1.00 65.47 C ATOM 56 N TYR X 7 32.115 -21.119 16.228 1.00 73.31 N ATOM 57 CA TYR X 7 30.995 -20.533 15.526 1.00 73.70 C ATOM 58 C TYR X 7 31.263 -19.095 15.110 1.00 74.33 C ATOM 59 O TYR X 7 31.008 -18.719 13.963 1.00 74.05 O ATOM 60 CB TYR X 7 29.728 -20.624 16.362 1.00 74.45 C ATOM 61 CG TYR X 7 28.911 -21.840 16.041 1.00 76.98 C ATOM 62 CD1 TYR X 7 29.478 -23.103 16.109 1.00 77.39 C ATOM 63 CD2 TYR X 7 27.577 -21.730 15.653 1.00 79.71 C ATOM 64 CE1 TYR X 7 28.749 -24.235 15.811 1.00 79.30 C ATOM 65 CE2 TYR X 7 26.832 -22.856 15.348 1.00 82.06 C ATOM 66 CZ TYR X 7 27.429 -24.114 15.430 1.00 84.46 C ATOM 67 OH TYR X 7 26.716 -25.263 15.135 1.00 87.80 O ATOM 68 N THR X 8 31.778 -18.284 16.027 1.00 74.28 N ATOM 69 CA THR X 8 31.973 -16.880 15.701 1.00 74.48 C ATOM 70 C THR X 8 33.083 -16.729 14.686 1.00 74.40 C ATOM 71 O THR X 8 32.910 -16.051 13.662 1.00 74.04 O ATOM 72 CB THR X 8 32.299 -16.017 16.917 1.00 74.36 C ATOM 73 OG1 THR X 8 31.133 -15.900 17.740 1.00 75.49 O ATOM 74 CG2 THR X 8 32.699 -14.630 16.450 1.00 74.78 C ATOM 75 N LYS X 9 34.222 -17.361 14.971 1.00 73.60 N ATOM 76 CA LYS X 9 35.368 -17.281 14.067 1.00 72.91 C ATOM 77 C LYS X 9 34.874 -17.518 12.639 1.00 72.22 C ATOM 78 O LYS X 9 34.897 -16.610 11.798 1.00 72.57 O ATOM 79 CB LYS X 9 36.450 -18.300 14.446 1.00 73.23 C ATOM 80 CG LYS X 9 37.097 -18.078 15.820 1.00 74.68 C ATOM 81 CD LYS X 9 38.555 -18.554 15.890 1.00 74.85 C ATOM 82 CE LYS X 9 39.229 -18.018 17.163 1.00 79.07 C ATOM 83 NZ LYS X 9 40.681 -18.366 17.303 1.00 81.89 N ATOM 84 N VAL X 10 34.397 -18.735 12.388 1.00 70.16 N ATOM 85 CA VAL X 10 33.684 -19.046 11.161 1.00 68.39 C ATOM 86 C VAL X 10 32.895 -17.855 10.647 1.00 69.64 C ATOM 87 O VAL X 10 33.090 -17.414 9.514 1.00 68.82 O ATOM 88 CB VAL X 10 32.708 -20.192 11.375 1.00 67.69 C ATOM 89 CG1 VAL X 10 31.859 -20.411 10.128 1.00 64.56 C ATOM 90 CG2 VAL X 10 33.452 -21.443 11.768 1.00 66.34 C ATOM 91 N TYR X 11 31.987 -17.347 11.477 1.00 71.60 N ATOM 92 CA TYR X 11 31.113 -16.274 11.050 1.00 72.45 C ATOM 93 C TYR X 11 31.980 -15.129 10.552 1.00 74.30 C ATOM 94 O TYR X 11 31.849 -14.690 9.409 1.00 74.76 O ATOM 95 CB TYR X 11 30.174 -15.839 12.180 1.00 72.60 C ATOM 96 CG TYR X 11 29.065 -16.834 12.422 1.00 69.80 C ATOM 97 CD1 TYR X 11 28.548 -17.035 13.688 1.00 68.01 C ATOM 98 CD2 TYR X 11 28.548 -17.586 11.376 1.00 68.51 C ATOM 99 CE1 TYR X 11 27.539 -17.962 13.914 1.00 68.59 C ATOM 100 CE2 TYR X 11 27.538 -18.521 11.589 1.00 70.78 C ATOM 101 CZ TYR X 11 27.036 -18.703 12.863 1.00 69.12 C ATOM 102 OH TYR X 11 26.041 -19.631 13.084 1.00 65.76 O ATOM 103 N ASP X 12 32.908 -14.680 11.390 1.00 76.33 N ATOM 104 CA ASP X 12 33.825 -13.623 10.978 1.00 77.26 C ATOM 105 C ASP X 12 34.411 -13.952 9.609 1.00 76.73 C ATOM 106 O ASP X 12 34.238 -13.193 8.652 1.00 78.13 O ATOM 107 CB ASP X 12 34.917 -13.425 12.024 1.00 78.07 C ATOM 108 CG ASP X 12 34.357 -12.995 13.382 1.00 82.18 C ATOM 109 OD1 ASP X 12 35.156 -12.847 14.336 1.00 83.70 O ATOM 110 OD2 ASP X 12 33.122 -12.801 13.495 1.00 83.93 O ATOM 111 N ALA X 13 35.068 -15.103 9.513 1.00 74.99 N ATOM 112 CA ALA X 13 35.628 -15.568 8.251 1.00 73.21 C ATOM 113 C ALA X 13 34.662 -15.431 7.085 1.00 72.74 C ATOM 114 O ALA X 13 34.948 -14.746 6.109 1.00 71.73 O ATOM 115 CB ALA X 13 36.068 -16.992 8.387 1.00 72.95 C ATOM 116 N VAL X 14 33.520 -16.102 7.194 1.00 73.48 N ATOM 117 CA VAL X 14 32.546 -16.158 6.113 1.00 73.77 C ATOM 118 C VAL X 14 32.141 -14.760 5.720 1.00 75.44 C ATOM 119 O VAL X 14 31.746 -14.516 4.587 1.00 75.57 O ATOM 120 CB VAL X 14 31.284 -16.907 6.538 1.00 73.69 C ATOM 121 CG1 VAL X 14 30.263 -16.900 5.412 1.00 70.34 C ATOM 122 CG2 VAL X 14 31.639 -18.337 6.954 1.00 73.09 C ATOM 123 N CYS X 15 32.253 -13.840 6.668 1.00 76.95 N ATOM 124 CA CYS X 15 31.858 -12.461 6.448 1.00 78.11 C ATOM 125 C CYS X 15 32.915 -11.697 5.674 1.00 79.00 C ATOM 126 O CYS X 15 32.703 -10.539 5.310 1.00 79.03 O ATOM 127 CB CYS X 15 31.599 -11.767 7.787 1.00 78.72 C ATOM 128 SG CYS X 15 29.877 -11.745 8.278 1.00 78.03 S ATOM 129 N GLU X 16 34.053 -12.341 5.429 1.00 79.81 N ATOM 130 CA GLU X 16 35.133 -11.718 4.670 1.00 81.36 C ATOM 131 C GLU X 16 35.137 -12.115 3.201 1.00 81.55 C ATOM 132 O GLU X 16 36.118 -11.892 2.497 1.00 82.16 O ATOM 133 CB GLU X 16 36.482 -12.057 5.287 1.00 81.56 C ATOM 134 CG GLU X 16 36.630 -11.591 6.707 1.00 85.20 C ATOM 135 CD GLU X 16 38.027 -11.820 7.239 1.00 91.13 C ATOM 136 OE1 GLU X 16 38.512 -10.973 8.023 1.00 93.90 O ATOM 137 OE2 GLU X 16 38.643 -12.848 6.872 1.00 94.68 O ATOM 138 N ILE X 17 34.047 -12.714 2.737 1.00 82.73 N ATOM 139 CA ILE X 17 33.909 -13.035 1.317 1.00 83.66 C ATOM 140 C ILE X 17 33.287 -11.850 0.581 1.00 84.37 C ATOM 141 O ILE X 17 32.244 -11.328 0.998 1.00 84.18 O ATOM 142 CB ILE X 17 33.049 -14.307 1.079 1.00 83.51 C ATOM 143 CG1 ILE X 17 33.532 -15.468 1.954 1.00 82.29 C ATOM 144 CG2 ILE X 17 33.073 -14.702 -0.394 1.00 84.46 C ATOM 145 CD1 ILE X 17 32.648 -16.713 1.885 1.00 81.66 C ATOM 146 N PRO X 18 33.936 -11.410 -0.511 1.00 84.74 N ATOM 147 CA PRO X 18 33.457 -10.264 -1.270 1.00 84.58 C ATOM 148 C PRO X 18 32.233 -10.617 -2.090 1.00 84.65 C ATOM 149 O PRO X 18 32.041 -11.776 -2.460 1.00 83.96 O ATOM 150 CB PRO X 18 34.629 -9.940 -2.193 1.00 84.83 C ATOM 151 CG PRO X 18 35.325 -11.230 -2.365 1.00 85.16 C ATOM 152 CD PRO X 18 35.186 -11.957 -1.063 1.00 84.35 C ATOM 153 N TYR X 19 31.409 -9.613 -2.358 1.00 85.22 N ATOM 154 CA TYR X 19 30.336 -9.738 -3.327 1.00 85.43 C ATOM 155 C TYR X 19 30.858 -10.490 -4.544 1.00 85.24 C ATOM 156 O TYR X 19 31.961 -10.220 -5.026 1.00 85.43 O ATOM 157 CB TYR X 19 29.860 -8.348 -3.724 1.00 85.80 C ATOM 158 CG TYR X 19 28.550 -8.309 -4.465 1.00 87.44 C ATOM 159 CD1 TYR X 19 27.344 -8.336 -3.778 1.00 89.09 C ATOM 160 CD2 TYR X 19 28.520 -8.212 -5.852 1.00 89.76 C ATOM 161 CE1 TYR X 19 26.140 -8.286 -4.456 1.00 91.41 C ATOM 162 CE2 TYR X 19 27.324 -8.156 -6.540 1.00 90.79 C ATOM 163 CZ TYR X 19 26.136 -8.195 -5.838 1.00 91.90 C ATOM 164 OH TYR X 19 24.940 -8.144 -6.517 1.00 91.38 O ATOM 165 N GLY X 20 30.079 -11.455 -5.019 1.00 84.78 N ATOM 166 CA GLY X 20 30.390 -12.130 -6.275 1.00 84.51 C ATOM 167 C GLY X 20 31.491 -13.180 -6.216 1.00 84.04 C ATOM 168 O GLY X 20 31.580 -14.028 -7.110 1.00 84.10 O ATOM 169 N LYS X 21 32.337 -13.123 -5.183 1.00 83.28 N ATOM 170 CA LYS X 21 33.212 -14.259 -4.817 1.00 82.13 C ATOM 171 C LYS X 21 32.516 -15.271 -3.898 1.00 80.05 C ATOM 172 O LYS X 21 31.602 -14.920 -3.155 1.00 80.14 O ATOM 173 CB LYS X 21 34.493 -13.767 -4.139 1.00 81.83 C ATOM 174 CG LYS X 21 35.666 -13.616 -5.075 1.00 84.42 C ATOM 175 CD LYS X 21 35.424 -12.497 -6.073 1.00 90.06 C ATOM 176 CE LYS X 21 36.633 -11.569 -6.152 1.00 92.70 C ATOM 177 NZ LYS X 21 36.487 -10.569 -7.254 1.00 94.95 N ATOM 178 N VAL X 22 32.957 -16.523 -3.945 1.00 77.62 N ATOM 179 CA VAL X 22 32.563 -17.489 -2.925 1.00 75.87 C ATOM 180 C VAL X 22 33.744 -18.138 -2.216 1.00 75.20 C ATOM 181 O VAL X 22 34.892 -17.916 -2.578 1.00 74.92 O ATOM 182 CB VAL X 22 31.656 -18.600 -3.480 1.00 75.03 C ATOM 183 CG1 VAL X 22 30.387 -18.023 -4.055 1.00 75.53 C ATOM 184 CG2 VAL X 22 32.393 -19.441 -4.490 1.00 73.29 C ATOM 185 N SER X 23 33.436 -18.932 -1.192 1.00 75.15 N ATOM 186 CA SER X 23 34.364 -19.912 -0.659 1.00 74.93 C ATOM 187 C SER X 23 33.706 -21.254 -0.312 1.00 75.22 C ATOM 188 O SER X 23 32.582 -21.552 -0.743 1.00 74.44 O ATOM 189 CB SER X 23 35.108 -19.357 0.545 1.00 73.64 C ATOM 190 OG SER X 23 35.848 -20.390 1.163 1.00 76.63 O ATOM 191 N THR X 24 34.420 -22.066 0.464 1.00 75.59 N ATOM 192 CA THR X 24 34.084 -23.471 0.594 1.00 75.96 C ATOM 193 C THR X 24 34.178 -23.972 2.036 1.00 75.55 C ATOM 194 O THR X 24 35.145 -23.680 2.755 1.00 76.46 O ATOM 195 CB THR X 24 34.943 -24.334 -0.353 1.00 77.13 C ATOM 196 OG1 THR X 24 34.255 -25.559 -0.626 1.00 80.13 O ATOM 197 CG2 THR X 24 36.336 -24.637 0.247 1.00 77.18 C ATOM 198 N TYR X 25 33.154 -24.712 2.458 1.00 74.82 N ATOM 199 CA TYR X 25 33.112 -25.327 3.788 1.00 73.75 C ATOM 200 C TYR X 25 34.518 -25.644 4.269 1.00 72.83 C ATOM 201 O TYR X 25 35.002 -25.059 5.243 1.00 72.10 O ATOM 202 CB TYR X 25 32.266 -26.604 3.751 1.00 73.75 C ATOM 203 CG TYR X 25 30.809 -26.344 3.389 1.00 76.48 C ATOM 204 CD1 TYR X 25 30.086 -27.238 2.614 1.00 77.19 C ATOM 205 CD2 TYR X 25 30.168 -25.190 3.820 1.00 77.07 C ATOM 206 CE1 TYR X 25 28.763 -26.991 2.276 1.00 76.46 C ATOM 207 CE2 TYR X 25 28.855 -24.938 3.500 1.00 76.05 C ATOM 208 CZ TYR X 25 28.149 -25.834 2.726 1.00 78.04 C ATOM 209 OH TYR X 25 26.825 -25.558 2.415 1.00 73.17 O ATOM 210 N GLY X 26 35.168 -26.555 3.547 1.00 71.33 N ATOM 211 CA GLY X 26 36.520 -26.977 3.854 1.00 70.19 C ATOM 212 C GLY X 26 37.463 -25.823 4.118 1.00 70.24 C ATOM 213 O GLY X 26 38.095 -25.757 5.173 1.00 68.72 O ATOM 214 N GLU X 27 37.564 -24.908 3.160 1.00 70.00 N ATOM 215 CA GLU X 27 38.578 -23.881 3.235 1.00 69.85 C ATOM 216 C GLU X 27 38.394 -23.071 4.500 1.00 68.56 C ATOM 217 O GLU X 27 39.320 -22.908 5.289 1.00 68.76 O ATOM 218 CB GLU X 27 38.525 -22.972 2.013 1.00 71.33 C ATOM 219 CG GLU X 27 39.835 -22.198 1.779 1.00 77.88 C ATOM 220 CD GLU X 27 41.033 -23.117 1.550 1.00 83.57 C ATOM 221 OE1 GLU X 27 41.108 -23.733 0.464 1.00 85.61 O ATOM 222 OE2 GLU X 27 41.897 -23.231 2.452 1.00 86.20 O ATOM 223 N ILE X 28 37.182 -22.580 4.695 1.00 67.92 N ATOM 224 CA ILE X 28 36.870 -21.744 5.835 1.00 66.90 C ATOM 225 C ILE X 28 37.138 -22.483 7.120 1.00 67.19 C ATOM 226 O ILE X 28 37.560 -21.896 8.118 1.00 66.89 O ATOM 227 CB ILE X 28 35.415 -21.364 5.805 1.00 67.95 C ATOM 228 CG1 ILE X 28 35.116 -20.700 4.473 1.00 67.70 C ATOM 229 CG2 ILE X 28 35.082 -20.416 6.954 1.00 65.47 C ATOM 230 CD1 ILE X 28 35.617 -19.276 4.436 1.00 70.51 C ATOM 231 N ALA X 29 36.908 -23.787 7.091 1.00 67.51 N ATOM 232 CA ALA X 29 37.308 -24.626 8.212 1.00 68.45 C ATOM 233 C ALA X 29 38.821 -24.658 8.428 1.00 68.20 C ATOM 234 O ALA X 29 39.286 -24.752 9.563 1.00 67.68 O ATOM 235 CB ALA X 29 36.749 -26.030 8.064 1.00 69.15 C ATOM 236 N ARG X 30 39.584 -24.587 7.342 1.00 68.79 N ATOM 237 CA ARG X 30 41.034 -24.467 7.446 1.00 68.94 C ATOM 238 C ARG X 30 41.377 -23.072 7.933 1.00 68.87 C ATOM 239 O ARG X 30 42.043 -22.911 8.954 1.00 66.62 O ATOM 240 CB ARG X 30 41.694 -24.731 6.100 1.00 67.90 C ATOM 241 CG ARG X 30 41.528 -26.154 5.631 1.00 70.44 C ATOM 242 CD ARG X 30 42.500 -26.506 4.492 1.00 72.18 C ATOM 243 NE ARG X 30 41.968 -26.185 3.165 1.00 73.28 N ATOM 244 CZ ARG X 30 40.781 -26.585 2.707 1.00 79.04 C ATOM 245 NH1 ARG X 30 39.978 -27.318 3.471 1.00 81.27 N ATOM 246 NH2 ARG X 30 40.388 -26.250 1.483 1.00 78.59 N ATOM 247 N TYR X 31 40.882 -22.075 7.204 1.00 69.95 N ATOM 248 CA TYR X 31 41.203 -20.663 7.444 1.00 72.20 C ATOM 249 C TYR X 31 41.235 -20.311 8.936 1.00 71.54 C ATOM 250 O TYR X 31 42.094 -19.551 9.377 1.00 72.29 O ATOM 251 CB TYR X 31 40.199 -19.766 6.688 1.00 73.45 C ATOM 252 CG TYR X 31 40.443 -18.250 6.740 1.00 77.58 C ATOM 253 CD1 TYR X 31 40.976 -17.566 5.641 1.00 80.89 C ATOM 254 CD2 TYR X 31 40.095 -17.500 7.868 1.00 82.35 C ATOM 255 CE1 TYR X 31 41.179 -16.177 5.673 1.00 84.10 C ATOM 256 CE2 TYR X 31 40.294 -16.116 7.911 1.00 87.20 C ATOM 257 CZ TYR X 31 40.834 -15.461 6.813 1.00 87.07 C ATOM 258 OH TYR X 31 41.027 -14.096 6.866 1.00 85.65 O ATOM 259 N VAL X 32 40.305 -20.870 9.703 1.00 70.97 N ATOM 260 CA VAL X 32 40.165 -20.543 11.127 1.00 70.83 C ATOM 261 C VAL X 32 40.974 -21.522 11.970 1.00 70.60 C ATOM 262 O VAL X 32 40.973 -21.452 13.207 1.00 70.46 O ATOM 263 CB VAL X 32 38.708 -20.676 11.580 1.00 70.35 C ATOM 264 CG1 VAL X 32 37.784 -19.929 10.634 1.00 72.43 C ATOM 265 CG2 VAL X 32 38.323 -22.139 11.624 1.00 70.30 C ATOM 266 N GLY X 33 41.635 -22.454 11.292 1.00 69.35 N ATOM 267 CA GLY X 33 42.533 -23.386 11.956 1.00 69.58 C ATOM 268 C GLY X 33 41.875 -24.623 12.523 1.00 68.50 C ATOM 269 O GLY X 33 42.255 -25.092 13.589 1.00 68.59 O ATOM 270 N MET X 34 40.895 -25.162 11.808 1.00 68.43 N ATOM 271 CA MET X 34 40.256 -26.407 12.228 1.00 68.89 C ATOM 272 C MET X 34 40.063 -27.377 11.061 1.00 67.84 C ATOM 273 O MET X 34 38.934 -27.698 10.706 1.00 68.45 O ATOM 274 CB MET X 34 38.895 -26.101 12.856 1.00 69.37 C ATOM 275 CG MET X 34 38.958 -25.240 14.114 1.00 73.00 C ATOM 276 SD MET X 34 39.717 -26.114 15.500 1.00 76.83 S ATOM 277 CE MET X 34 38.290 -26.930 16.226 1.00 77.30 C ATOM 278 N PRO X 35 41.162 -27.837 10.444 1.00 66.40 N ATOM 279 CA PRO X 35 40.990 -28.406 9.109 1.00 64.33 C ATOM 280 C PRO X 35 39.977 -29.547 9.056 1.00 62.15 C ATOM 281 O PRO X 35 39.381 -29.785 8.004 1.00 61.91 O ATOM 282 CB PRO X 35 42.395 -28.899 8.737 1.00 63.70 C ATOM 283 CG PRO X 35 43.200 -28.799 9.987 1.00 66.13 C ATOM 284 CD PRO X 35 42.577 -27.736 10.822 1.00 65.28 C ATOM 285 N SER X 36 39.760 -30.240 10.168 1.00 58.95 N ATOM 286 CA SER X 36 38.813 -31.344 10.146 1.00 57.74 C ATOM 287 C SER X 36 37.346 -30.926 10.364 1.00 58.98 C ATOM 288 O SER X 36 36.499 -31.773 10.629 1.00 60.42 O ATOM 289 CB SER X 36 39.206 -32.366 11.189 1.00 56.48 C ATOM 290 OG SER X 36 39.307 -31.731 12.445 1.00 57.94 O ATOM 291 N TYR X 37 37.038 -29.636 10.262 1.00 57.83 N ATOM 292 CA TYR X 37 35.746 -29.151 10.703 1.00 58.32 C ATOM 293 C TYR X 37 34.782 -28.677 9.622 1.00 58.42 C ATOM 294 O TYR X 37 33.944 -27.802 9.860 1.00 57.73 O ATOM 295 CB TYR X 37 35.916 -28.088 11.765 1.00 58.63 C ATOM 296 CG TYR X 37 35.941 -28.673 13.145 1.00 65.92 C ATOM 297 CD1 TYR X 37 36.946 -29.561 13.530 1.00 68.67 C ATOM 298 CD2 TYR X 37 34.950 -28.364 14.065 1.00 67.48 C ATOM 299 CE1 TYR X 37 36.964 -30.112 14.803 1.00 68.65 C ATOM 300 CE2 TYR X 37 34.964 -28.911 15.332 1.00 71.76 C ATOM 301 CZ TYR X 37 35.972 -29.784 15.696 1.00 69.78 C ATOM 302 OH TYR X 37 35.972 -30.316 16.964 1.00 71.30 O ATOM 303 N ALA X 38 34.874 -29.261 8.438 1.00 58.01 N ATOM 304 CA ALA X 38 34.099 -28.723 7.330 1.00 57.89 C ATOM 305 C ALA X 38 32.619 -28.960 7.624 1.00 57.57 C ATOM 306 O ALA X 38 31.791 -28.056 7.538 1.00 57.27 O ATOM 307 CB ALA X 38 34.493 -29.406 6.055 1.00 59.23 C ATOM 308 N ARG X 39 32.291 -30.187 8.004 1.00 55.65 N ATOM 309 CA ARG X 39 30.960 -30.451 8.480 1.00 52.43 C ATOM 310 C ARG X 39 30.499 -29.329 9.398 1.00 51.76 C ATOM 311 O ARG X 39 29.469 -28.682 9.129 1.00 51.98 O ATOM 312 CB ARG X 39 30.863 -31.825 9.128 1.00 51.04 C ATOM 313 CG ARG X 39 30.230 -32.816 8.176 1.00 52.75 C ATOM 314 CD ARG X 39 30.354 -34.270 8.589 1.00 49.08 C ATOM 315 NE ARG X 39 29.277 -35.038 7.969 1.00 51.97 N ATOM 316 CZ ARG X 39 29.351 -36.328 7.657 1.00 61.36 C ATOM 317 NH1 ARG X 39 28.309 -36.933 7.089 1.00 66.13 N ATOM 318 NH2 ARG X 39 30.458 -37.021 7.908 1.00 59.21 N ATOM 319 N GLN X 40 31.268 -29.064 10.452 1.00 49.05 N ATOM 320 CA GLN X 40 30.816 -28.125 11.452 1.00 48.18 C ATOM 321 C GLN X 40 30.742 -26.712 10.900 1.00 51.28 C ATOM 322 O GLN X 40 29.924 -25.905 11.366 1.00 50.71 O ATOM 323 CB GLN X 40 31.636 -28.189 12.721 1.00 45.33 C ATOM 324 CG GLN X 40 31.492 -29.504 13.460 1.00 45.83 C ATOM 325 CD GLN X 40 32.220 -30.653 12.726 1.00 55.55 C ATOM 326 OE1 GLN X 40 31.969 -31.841 12.993 1.00 48.27 O ATOM 327 NE2 GLN X 40 33.110 -30.295 11.776 1.00 44.71 N ATOM 328 N VAL X 41 31.555 -26.411 9.892 1.00 53.00 N ATOM 329 CA VAL X 41 31.411 -25.119 9.256 1.00 57.32 C ATOM 330 C VAL X 41 30.015 -25.034 8.698 1.00 60.04 C ATOM 331 O VAL X 41 29.358 -23.998 8.795 1.00 61.77 O ATOM 332 CB VAL X 41 32.407 -24.859 8.137 1.00 57.98 C ATOM 333 CG1 VAL X 41 32.120 -23.508 7.496 1.00 56.64 C ATOM 334 CG2 VAL X 41 33.826 -24.892 8.674 1.00 59.37 C ATOM 335 N GLY X 42 29.549 -26.137 8.135 1.00 62.72 N ATOM 336 CA GLY X 42 28.184 -26.196 7.628 1.00 64.48 C ATOM 337 C GLY X 42 27.189 -26.015 8.755 1.00 67.21 C ATOM 338 O GLY X 42 26.168 -25.331 8.609 1.00 67.12 O ATOM 339 N GLN X 43 27.477 -26.634 9.893 1.00 68.93 N ATOM 340 CA GLN X 43 26.483 -26.690 10.940 1.00 70.77 C ATOM 341 C GLN X 43 26.267 -25.273 11.406 1.00 70.44 C ATOM 342 O GLN X 43 25.157 -24.886 11.741 1.00 72.69 O ATOM 343 CB GLN X 43 26.936 -27.600 12.080 1.00 72.04 C ATOM 344 CG GLN X 43 26.447 -29.048 11.920 1.00 82.14 C ATOM 345 CD GLN X 43 24.992 -29.150 11.397 1.00 94.08 C ATOM 346 OE1 GLN X 43 24.039 -28.719 12.070 1.00 97.42 O ATOM 347 NE2 GLN X 43 24.824 -29.728 10.196 1.00 95.05 N ATOM 348 N ALA X 44 27.337 -24.490 11.375 1.00 69.13 N ATOM 349 CA ALA X 44 27.277 -23.091 11.718 1.00 67.66 C ATOM 350 C ALA X 44 26.318 -22.374 10.798 1.00 67.97 C ATOM 351 O ALA X 44 25.496 -21.591 11.258 1.00 66.50 O ATOM 352 CB ALA X 44 28.655 -22.471 11.618 1.00 68.10 C ATOM 353 N MET X 45 26.440 -22.624 9.497 1.00 69.00 N ATOM 354 CA MET X 45 25.663 -21.876 8.511 1.00 71.88 C ATOM 355 C MET X 45 24.218 -22.259 8.688 1.00 73.16 C ATOM 356 O MET X 45 23.335 -21.399 8.758 1.00 72.63 O ATOM 357 CB MET X 45 26.078 -22.209 7.070 1.00 71.57 C ATOM 358 CG MET X 45 27.480 -21.790 6.688 1.00 74.13 C ATOM 359 SD MET X 45 27.807 -20.008 6.652 1.00 76.43 S ATOM 360 CE MET X 45 28.692 -19.799 8.200 1.00 70.60 C ATOM 361 N LYS X 46 23.994 -23.566 8.766 1.00 74.87 N ATOM 362 CA LYS X 46 22.667 -24.104 8.969 1.00 77.43 C ATOM 363 C LYS X 46 22.022 -23.464 10.180 1.00 80.03 C ATOM 364 O LYS X 46 20.803 -23.396 10.257 1.00 82.09 O ATOM 365 CB LYS X 46 22.725 -25.615 9.157 1.00 77.51 C ATOM 366 CG LYS X 46 21.417 -26.316 8.893 1.00 76.03 C ATOM 367 CD LYS X 46 21.295 -27.540 9.759 1.00 76.83 C ATOM 368 CE LYS X 46 19.874 -28.085 9.748 1.00 79.52 C ATOM 369 NZ LYS X 46 19.763 -29.209 10.728 1.00 82.78 N ATOM 370 N HIS X 47 22.844 -22.981 11.111 1.00 82.58 N ATOM 371 CA HIS X 47 22.372 -22.530 12.424 1.00 84.35 C ATOM 372 C HIS X 47 22.182 -21.031 12.532 1.00 83.18 C ATOM 373 O HIS X 47 22.443 -20.456 13.581 1.00 84.37 O ATOM 374 CB HIS X 47 23.341 -22.975 13.520 1.00 85.11 C ATOM 375 CG HIS X 47 23.032 -24.328 14.077 1.00 93.88 C ATOM 376 ND1 HIS X 47 23.353 -24.695 15.368 1.00100.94 N ATOM 377 CD2 HIS X 47 22.421 -25.403 13.519 1.00 99.77 C ATOM 378 CE1 HIS X 47 22.960 -25.941 15.579 1.00102.90 C ATOM 379 NE2 HIS X 47 22.393 -26.393 14.473 1.00103.29 N ATOM 380 N LEU X 48 21.732 -20.394 11.464 1.00 82.43 N ATOM 381 CA LEU X 48 21.724 -18.940 11.426 1.00 82.94 C ATOM 382 C LEU X 48 20.330 -18.395 11.185 1.00 83.88 C ATOM 383 O LEU X 48 19.589 -18.935 10.368 1.00 83.96 O ATOM 384 CB LEU X 48 22.637 -18.451 10.312 1.00 82.44 C ATOM 385 CG LEU X 48 24.127 -18.531 10.599 1.00 79.90 C ATOM 386 CD1 LEU X 48 24.870 -18.646 9.291 1.00 76.33 C ATOM 387 CD2 LEU X 48 24.553 -17.291 11.357 1.00 76.75 C ATOM 388 N HIS X 49 19.975 -17.312 11.868 1.00 85.16 N ATOM 389 CA HIS X 49 18.687 -16.669 11.599 1.00 85.92 C ATOM 390 C HIS X 49 18.636 -16.099 10.182 1.00 86.16 C ATOM 391 O HIS X 49 19.608 -15.510 9.714 1.00 85.22 O ATOM 392 CB HIS X 49 18.380 -15.600 12.643 1.00 85.70 C ATOM 393 CG HIS X 49 18.372 -16.125 14.041 1.00 88.03 C ATOM 394 ND1 HIS X 49 18.110 -17.448 14.332 1.00 89.12 N ATOM 395 CD2 HIS X 49 18.607 -15.516 15.228 1.00 90.37 C ATOM 396 CE1 HIS X 49 18.178 -17.629 15.640 1.00 92.23 C ATOM 397 NE2 HIS X 49 18.480 -16.473 16.207 1.00 92.07 N ATOM 398 N PRO X 50 17.501 -16.296 9.488 1.00 86.68 N ATOM 399 CA PRO X 50 17.294 -15.798 8.130 1.00 86.95 C ATOM 400 C PRO X 50 17.565 -14.306 8.036 1.00 87.68 C ATOM 401 O PRO X 50 17.923 -13.807 6.969 1.00 88.22 O ATOM 402 CB PRO X 50 15.811 -16.062 7.886 1.00 86.34 C ATOM 403 CG PRO X 50 15.497 -17.205 8.745 1.00 86.96 C ATOM 404 CD PRO X 50 16.338 -17.052 9.976 1.00 86.45 C ATOM 405 N GLU X 51 17.398 -13.610 9.154 1.00 88.23 N ATOM 406 CA GLU X 51 17.617 -12.171 9.217 1.00 89.67 C ATOM 407 C GLU X 51 19.100 -11.821 9.177 1.00 89.72 C ATOM 408 O GLU X 51 19.475 -10.686 8.876 1.00 89.16 O ATOM 409 CB GLU X 51 16.988 -11.617 10.495 1.00 90.42 C ATOM 410 CG GLU X 51 16.844 -12.649 11.620 1.00 94.17 C ATOM 411 CD GLU X 51 15.512 -13.394 11.585 1.00 98.94 C ATOM 412 OE1 GLU X 51 15.468 -14.558 12.046 1.00101.72 O ATOM 413 OE2 GLU X 51 14.507 -12.820 11.100 1.00 99.94 O ATOM 414 N THR X 52 19.933 -12.812 9.493 1.00 90.78 N ATOM 415 CA THR X 52 21.387 -12.648 9.580 1.00 91.01 C ATOM 416 C THR X 52 21.938 -11.791 8.451 1.00 90.68 C ATOM 417 O THR X 52 21.461 -11.862 7.318 1.00 91.06 O ATOM 418 CB THR X 52 22.099 -14.008 9.529 1.00 91.31 C ATOM 419 OG1 THR X 52 23.461 -13.856 9.952 1.00 94.36 O ATOM 420 CG2 THR X 52 22.073 -14.558 8.114 1.00 91.32 C ATOM 421 N HIS X 53 22.944 -10.982 8.766 1.00 89.76 N ATOM 422 CA HIS X 53 23.574 -10.137 7.768 1.00 89.02 C ATOM 423 C HIS X 53 24.925 -10.738 7.401 1.00 88.05 C ATOM 424 O HIS X 53 25.940 -10.044 7.351 1.00 88.87 O ATOM 425 CB HIS X 53 23.709 -8.693 8.276 1.00 89.24 C ATOM 426 CG HIS X 53 22.456 -7.876 8.134 1.00 90.35 C ATOM 427 ND1 HIS X 53 22.070 -7.301 6.940 1.00 91.66 N ATOM 428 CD2 HIS X 53 21.508 -7.530 9.039 1.00 91.62 C ATOM 429 CE1 HIS X 53 20.937 -6.640 7.114 1.00 90.19 C ATOM 430 NE2 HIS X 53 20.575 -6.764 8.379 1.00 91.72 N ATOM 431 N VAL X 54 24.920 -12.045 7.149 1.00 86.69 N ATOM 432 CA VAL X 54 26.147 -12.819 6.923 1.00 84.36 C ATOM 433 C VAL X 54 26.035 -13.586 5.618 1.00 82.50 C ATOM 434 O VAL X 54 25.003 -14.191 5.333 1.00 82.66 O ATOM 435 CB VAL X 54 26.396 -13.847 8.056 1.00 84.35 C ATOM 436 CG1 VAL X 54 27.603 -14.716 7.739 1.00 83.78 C ATOM 437 CG2 VAL X 54 26.572 -13.145 9.390 1.00 83.23 C ATOM 438 N PRO X 55 27.112 -13.586 4.833 1.00 80.70 N ATOM 439 CA PRO X 55 27.063 -14.022 3.454 1.00 79.04 C ATOM 440 C PRO X 55 27.017 -15.537 3.385 1.00 77.46 C ATOM 441 O PRO X 55 27.798 -16.153 2.675 1.00 76.43 O ATOM 442 CB PRO X 55 28.388 -13.518 2.885 1.00 79.51 C ATOM 443 CG PRO X 55 29.213 -13.048 4.069 1.00 79.70 C ATOM 444 CD PRO X 55 28.490 -13.402 5.304 1.00 80.42 C ATOM 445 N TRP X 56 26.099 -16.129 4.128 1.00 77.12 N ATOM 446 CA TRP X 56 25.993 -17.571 4.173 1.00 78.62 C ATOM 447 C TRP X 56 25.878 -18.175 2.775 1.00 78.07 C ATOM 448 O TRP X 56 26.206 -19.345 2.564 1.00 77.31 O ATOM 449 CB TRP X 56 24.818 -18.006 5.052 1.00 78.65 C ATOM 450 CG TRP X 56 23.509 -17.550 4.539 1.00 84.92 C ATOM 451 CD1 TRP X 56 22.855 -16.398 4.870 1.00 89.05 C ATOM 452 CD2 TRP X 56 22.678 -18.225 3.582 1.00 89.74 C ATOM 453 NE1 TRP X 56 21.662 -16.317 4.185 1.00 90.70 N ATOM 454 CE2 TRP X 56 21.531 -17.424 3.386 1.00 90.00 C ATOM 455 CE3 TRP X 56 22.789 -19.429 2.874 1.00 90.25 C ATOM 456 CZ2 TRP X 56 20.501 -17.788 2.512 1.00 89.93 C ATOM 457 CZ3 TRP X 56 21.760 -19.788 2.004 1.00 89.61 C ATOM 458 CH2 TRP X 56 20.634 -18.968 1.833 1.00 88.27 C ATOM 459 N HIS X 57 25.413 -17.380 1.815 1.00 77.78 N ATOM 460 CA HIS X 57 25.218 -17.896 0.461 1.00 77.26 C ATOM 461 C HIS X 57 26.542 -18.096 -0.255 1.00 75.79 C ATOM 462 O HIS X 57 26.606 -18.806 -1.247 1.00 75.39 O ATOM 463 CB HIS X 57 24.306 -16.987 -0.358 1.00 77.71 C ATOM 464 CG HIS X 57 24.642 -15.536 -0.242 1.00 81.69 C ATOM 465 ND1 HIS X 57 24.260 -14.768 0.838 1.00 84.95 N ATOM 466 CD2 HIS X 57 25.329 -14.711 -1.069 1.00 84.97 C ATOM 467 CE1 HIS X 57 24.696 -13.531 0.670 1.00 87.80 C ATOM 468 NE2 HIS X 57 25.351 -13.470 -0.477 1.00 85.96 N ATOM 469 N ARG X 58 27.591 -17.467 0.255 1.00 74.26 N ATOM 470 CA ARG X 58 28.864 -17.446 -0.436 1.00 74.69 C ATOM 471 C ARG X 58 29.727 -18.641 -0.050 1.00 74.27 C ATOM 472 O ARG X 58 30.955 -18.596 -0.141 1.00 73.73 O ATOM 473 CB ARG X 58 29.602 -16.144 -0.144 1.00 75.15 C ATOM 474 CG ARG X 58 29.119 -14.996 -0.979 1.00 76.55 C ATOM 475 CD ARG X 58 29.382 -13.702 -0.269 1.00 80.54 C ATOM 476 NE ARG X 58 28.540 -12.634 -0.791 1.00 83.90 N ATOM 477 CZ ARG X 58 28.540 -11.391 -0.327 1.00 84.20 C ATOM 478 NH1 ARG X 58 29.343 -11.061 0.679 1.00 84.68 N ATOM 479 NH2 ARG X 58 27.741 -10.480 -0.873 1.00 85.56 N ATOM 480 N VAL X 59 29.077 -19.715 0.375 1.00 73.57 N ATOM 481 CA VAL X 59 29.786 -20.865 0.909 1.00 72.66 C ATOM 482 C VAL X 59 29.191 -22.167 0.370 1.00 73.33 C ATOM 483 O VAL X 59 28.236 -22.698 0.941 1.00 73.55 O ATOM 484 CB VAL X 59 29.742 -20.854 2.439 1.00 71.80 C ATOM 485 CG1 VAL X 59 30.891 -21.622 3.001 1.00 71.48 C ATOM 486 CG2 VAL X 59 29.762 -19.425 2.954 1.00 71.01 C ATOM 487 N ILE X 60 29.746 -22.658 -0.739 1.00 73.68 N ATOM 488 CA ILE X 60 29.306 -23.915 -1.349 1.00 74.29 C ATOM 489 C ILE X 60 30.292 -25.038 -1.031 1.00 74.56 C ATOM 490 O ILE X 60 31.105 -24.906 -0.122 1.00 75.37 O ATOM 491 CB ILE X 60 29.181 -23.798 -2.873 1.00 74.15 C ATOM 492 CG1 ILE X 60 30.557 -23.594 -3.497 1.00 75.27 C ATOM 493 CG2 ILE X 60 28.237 -22.675 -3.258 1.00 74.05 C ATOM 494 CD1 ILE X 60 30.785 -24.459 -4.708 1.00 77.30 C ATOM 495 N ASN X 61 30.223 -26.140 -1.771 1.00 73.78 N ATOM 496 CA ASN X 61 31.094 -27.268 -1.485 1.00 74.69 C ATOM 497 C ASN X 61 32.302 -27.377 -2.410 1.00 75.51 C ATOM 498 O ASN X 61 32.313 -26.834 -3.519 1.00 75.52 O ATOM 499 CB ASN X 61 30.312 -28.572 -1.505 1.00 75.24 C ATOM 500 CG ASN X 61 29.719 -28.868 -2.858 1.00 76.64 C ATOM 501 OD1 ASN X 61 30.406 -28.794 -3.879 1.00 76.54 O ATOM 502 ND2 ASN X 61 28.430 -29.208 -2.878 1.00 78.92 N ATOM 503 N SER X 62 33.319 -28.096 -1.952 1.00 75.62 N ATOM 504 CA SER X 62 34.597 -28.117 -2.649 1.00 76.24 C ATOM 505 C SER X 62 34.444 -28.764 -4.016 1.00 76.53 C ATOM 506 O SER X 62 35.243 -28.534 -4.917 1.00 77.63 O ATOM 507 CB SER X 62 35.641 -28.852 -1.814 1.00 76.40 C ATOM 508 OG SER X 62 35.525 -28.492 -0.443 1.00 76.99 O ATOM 509 N ARG X 63 33.400 -29.568 -4.169 1.00 76.55 N ATOM 510 CA ARG X 63 33.039 -30.121 -5.462 1.00 75.20 C ATOM 511 C ARG X 63 32.413 -29.044 -6.335 1.00 74.65 C ATOM 512 O ARG X 63 31.774 -29.351 -7.339 1.00 74.95 O ATOM 513 CB ARG X 63 32.065 -31.279 -5.284 1.00 74.50 C ATOM 514 CG ARG X 63 32.371 -32.472 -6.146 1.00 78.69 C ATOM 515 CD ARG X 63 31.154 -33.367 -6.313 1.00 88.31 C ATOM 516 NE ARG X 63 29.912 -32.599 -6.395 1.00 97.77 N ATOM 517 CZ ARG X 63 29.143 -32.304 -5.346 1.00102.33 C ATOM 518 NH1 ARG X 63 29.484 -32.712 -4.126 1.00104.65 N ATOM 519 NH2 ARG X 63 28.031 -31.599 -5.511 1.00102.70 N ATOM 520 N GLY X 64 32.594 -27.783 -5.944 1.00 74.31 N ATOM 521 CA GLY X 64 32.130 -26.646 -6.745 1.00 73.01 C ATOM 522 C GLY X 64 30.627 -26.421 -6.838 1.00 72.14 C ATOM 523 O GLY X 64 30.182 -25.562 -7.584 1.00 73.00 O ATOM 524 N THR X 65 29.828 -27.171 -6.091 1.00 71.26 N ATOM 525 CA THR X 65 28.379 -27.031 -6.213 1.00 71.85 C ATOM 526 C THR X 65 27.649 -26.628 -4.931 1.00 72.82 C ATOM 527 O THR X 65 28.220 -26.602 -3.838 1.00 73.88 O ATOM 528 CB THR X 65 27.713 -28.296 -6.782 1.00 71.58 C ATOM 529 OG1 THR X 65 26.931 -28.915 -5.761 1.00 71.24 O ATOM 530 CG2 THR X 65 28.744 -29.284 -7.287 1.00 70.97 C ATOM 531 N ILE X 66 26.369 -26.317 -5.075 1.00 73.74 N ATOM 532 CA ILE X 66 25.543 -25.969 -3.939 1.00 74.37 C ATOM 533 C ILE X 66 25.001 -27.234 -3.302 1.00 75.82 C ATOM 534 O ILE X 66 24.509 -28.126 -3.996 1.00 74.64 O ATOM 535 CB ILE X 66 24.378 -25.095 -4.364 1.00 74.51 C ATOM 536 CG1 ILE X 66 24.891 -23.749 -4.862 1.00 74.73 C ATOM 537 CG2 ILE X 66 23.416 -24.893 -3.202 1.00 74.84 C ATOM 538 CD1 ILE X 66 23.794 -22.751 -5.088 1.00 77.44 C ATOM 539 N SER X 67 25.095 -27.319 -1.980 1.00 77.06 N ATOM 540 CA SER X 67 24.890 -28.590 -1.316 1.00 78.59 C ATOM 541 C SER X 67 23.411 -28.876 -1.114 1.00 79.18 C ATOM 542 O SER X 67 22.646 -27.987 -0.770 1.00 78.93 O ATOM 543 CB SER X 67 25.644 -28.610 0.005 1.00 79.08 C ATOM 544 OG SER X 67 26.985 -28.183 -0.186 1.00 81.39 O ATOM 545 N LYS X 68 23.000 -30.115 -1.344 1.00 81.40 N ATOM 546 CA LYS X 68 21.596 -30.464 -1.159 1.00 84.74 C ATOM 547 C LYS X 68 21.228 -30.435 0.326 1.00 86.80 C ATOM 548 O LYS X 68 22.098 -30.515 1.197 1.00 87.25 O ATOM 549 CB LYS X 68 21.258 -31.812 -1.805 1.00 83.75 C ATOM 550 CG LYS X 68 21.164 -31.756 -3.340 1.00 86.71 C ATOM 551 CD LYS X 68 19.717 -31.896 -3.883 1.00 88.31 C ATOM 552 CE LYS X 68 19.609 -31.443 -5.359 1.00 86.44 C ATOM 553 NZ LYS X 68 19.125 -32.498 -6.309 1.00 82.41 N ATOM 554 N ARG X 69 19.938 -30.293 0.612 1.00 88.68 N ATOM 555 CA ARG X 69 19.511 -29.982 1.959 1.00 91.16 C ATOM 556 C ARG X 69 18.344 -30.832 2.401 1.00 93.64 C ATOM 557 O ARG X 69 17.307 -30.891 1.743 1.00 94.44 O ATOM 558 CB ARG X 69 19.170 -28.504 2.101 1.00 90.58 C ATOM 559 CG ARG X 69 20.111 -27.766 3.033 1.00 89.65 C ATOM 560 CD ARG X 69 20.397 -26.352 2.539 1.00 86.46 C ATOM 561 NE ARG X 69 21.351 -26.336 1.436 1.00 78.79 N ATOM 562 CZ ARG X 69 22.193 -25.338 1.185 1.00 78.10 C ATOM 563 NH1 ARG X 69 22.211 -24.262 1.955 1.00 76.81 N ATOM 564 NH2 ARG X 69 23.022 -25.417 0.152 1.00 80.85 N ATOM 565 N ASP X 70 18.535 -31.495 3.532 1.00 96.77 N ATOM 566 CA ASP X 70 17.493 -32.297 4.154 1.00 99.11 C ATOM 567 C ASP X 70 16.642 -31.374 5.040 1.00100.36 C ATOM 568 O ASP X 70 15.721 -31.816 5.740 1.00 99.61 O ATOM 569 CB ASP X 70 18.128 -33.433 4.976 1.00 99.43 C ATOM 570 CG ASP X 70 19.225 -34.193 4.203 1.00100.52 C ATOM 571 OD1 ASP X 70 19.062 -35.416 3.992 1.00102.86 O ATOM 572 OD2 ASP X 70 20.253 -33.582 3.817 1.00 98.32 O ATOM 573 N ILE X 71 16.988 -30.087 5.008 1.00101.95 N ATOM 574 CA ILE X 71 16.050 -29.006 5.296 1.00103.17 C ATOM 575 C ILE X 71 15.492 -28.477 3.965 1.00103.94 C ATOM 576 O ILE X 71 15.440 -27.263 3.717 1.00104.21 O ATOM 577 CB ILE X 71 16.723 -27.883 6.146 1.00103.46 C ATOM 578 CG1 ILE X 71 15.916 -27.591 7.426 1.00102.10 C ATOM 579 CG2 ILE X 71 17.026 -26.631 5.305 1.00103.04 C ATOM 580 CD1 ILE X 71 14.419 -27.450 7.206 1.00102.03 C ATOM 581 N SER X 72 15.092 -29.423 3.113 1.00104.51 N ATOM 582 CA SER X 72 14.459 -29.149 1.816 1.00104.96 C ATOM 583 C SER X 72 15.023 -27.985 0.986 1.00104.90 C ATOM 584 O SER X 72 15.743 -27.111 1.496 1.00104.79 O ATOM 585 CB SER X 72 12.930 -29.061 1.939 1.00104.81 C ATOM 586 OG SER X 72 12.510 -29.061 3.295 1.00104.78 O ATOM 587 N ALA X 73 14.671 -27.984 -0.299 1.00104.53 N ATOM 588 CA ALA X 73 15.418 -27.247 -1.311 1.00103.88 C ATOM 589 C ALA X 73 15.201 -25.739 -1.207 1.00103.21 C ATOM 590 O ALA X 73 15.510 -24.997 -2.138 1.00102.88 O ATOM 591 CB ALA X 73 15.063 -27.751 -2.707 1.00103.89 C ATOM 592 N GLY X 74 14.679 -25.289 -0.070 1.00102.57 N ATOM 593 CA GLY X 74 14.645 -23.866 0.246 1.00101.72 C ATOM 594 C GLY X 74 15.969 -23.166 -0.012 1.00101.31 C ATOM 595 O GLY X 74 16.004 -21.964 -0.270 1.00101.24 O ATOM 596 N GLU X 75 17.063 -23.920 0.056 1.00100.31 N ATOM 597 CA GLU X 75 18.369 -23.427 -0.373 1.00 99.38 C ATOM 598 C GLU X 75 18.402 -22.845 -1.795 1.00100.00 C ATOM 599 O GLU X 75 19.380 -22.185 -2.183 1.00100.53 O ATOM 600 CB GLU X 75 19.388 -24.551 -0.291 1.00 99.26 C ATOM 601 CG GLU X 75 20.112 -24.804 -1.607 1.00 97.27 C ATOM 602 CD GLU X 75 19.229 -25.467 -2.638 1.00 95.22 C ATOM 603 OE1 GLU X 75 18.626 -26.514 -2.318 1.00 98.14 O ATOM 604 OE2 GLU X 75 19.134 -24.938 -3.766 1.00 95.06 O ATOM 605 N GLN X 76 17.359 -23.116 -2.583 1.00 98.94 N ATOM 606 CA GLN X 76 17.218 -22.488 -3.892 1.00 97.02 C ATOM 607 C GLN X 76 17.533 -21.008 -3.719 1.00 96.83 C ATOM 608 O GLN X 76 18.033 -20.357 -4.636 1.00 97.20 O ATOM 609 CB GLN X 76 15.802 -22.685 -4.440 1.00 96.51 C ATOM 610 CG GLN X 76 15.479 -21.875 -5.684 1.00 93.97 C ATOM 611 CD GLN X 76 15.487 -22.705 -6.946 1.00 91.19 C ATOM 612 OE1 GLN X 76 15.526 -23.931 -6.894 1.00 90.03 O ATOM 613 NE2 GLN X 76 15.445 -22.038 -8.095 1.00 91.52 N ATOM 614 N ARG X 77 17.259 -20.491 -2.524 1.00 96.28 N ATOM 615 CA ARG X 77 17.788 -19.197 -2.103 1.00 96.09 C ATOM 616 C ARG X 77 19.254 -19.034 -2.507 1.00 94.95 C ATOM 617 O ARG X 77 19.602 -18.072 -3.193 1.00 94.36 O ATOM 618 CB ARG X 77 17.613 -18.996 -0.593 1.00 97.07 C ATOM 619 CG ARG X 77 16.176 -19.163 -0.093 1.00100.61 C ATOM 620 CD ARG X 77 15.394 -17.842 -0.078 1.00107.50 C ATOM 621 NE ARG X 77 15.822 -16.916 -1.132 1.00111.07 N ATOM 622 CZ ARG X 77 15.155 -16.696 -2.263 1.00110.66 C ATOM 623 NH1 ARG X 77 14.015 -17.333 -2.502 1.00109.72 N ATOM 624 NH2 ARG X 77 15.629 -15.838 -3.158 1.00109.74 N ATOM 625 N GLN X 78 20.105 -19.976 -2.103 1.00 93.26 N ATOM 626 CA GLN X 78 21.526 -19.859 -2.390 1.00 92.36 C ATOM 627 C GLN X 78 21.747 -19.487 -3.847 1.00 92.33 C ATOM 628 O GLN X 78 22.317 -18.431 -4.136 1.00 92.68 O ATOM 629 CB GLN X 78 22.309 -21.127 -2.009 1.00 92.31 C ATOM 630 CG GLN X 78 23.842 -20.902 -1.960 1.00 92.08 C ATOM 631 CD GLN X 78 24.586 -21.751 -0.924 1.00 89.01 C ATOM 632 OE1 GLN X 78 24.094 -22.783 -0.473 1.00 89.81 O ATOM 633 NE2 GLN X 78 25.788 -21.308 -0.551 1.00 86.16 N ATOM 634 N LYS X 79 21.276 -20.341 -4.756 1.00 92.10 N ATOM 635 CA LYS X 79 21.349 -20.068 -6.197 1.00 92.08 C ATOM 636 C LYS X 79 21.020 -18.615 -6.484 1.00 92.30 C ATOM 637 O LYS X 79 21.846 -17.870 -7.015 1.00 91.91 O ATOM 638 CB LYS X 79 20.386 -20.968 -6.986 1.00 92.02 C ATOM 639 CG LYS X 79 20.353 -20.693 -8.505 1.00 93.14 C ATOM 640 CD LYS X 79 18.926 -20.818 -9.092 1.00 95.42 C ATOM 641 CE LYS X 79 18.878 -20.440 -10.584 1.00 96.51 C ATOM 642 NZ LYS X 79 17.621 -19.708 -10.992 1.00 95.04 N ATOM 643 N ASP X 80 19.803 -18.222 -6.125 1.00 92.57 N ATOM 644 CA ASP X 80 19.305 -16.900 -6.457 1.00 93.63 C ATOM 645 C ASP X 80 20.257 -15.846 -5.900 1.00 93.48 C ATOM 646 O ASP X 80 20.836 -15.057 -6.650 1.00 94.00 O ATOM 647 CB ASP X 80 17.879 -16.699 -5.918 1.00 94.29 C ATOM 648 CG ASP X 80 16.892 -17.757 -6.435 1.00 96.83 C ATOM 649 OD1 ASP X 80 17.294 -18.580 -7.289 1.00 99.10 O ATOM 650 OD2 ASP X 80 15.715 -17.764 -5.988 1.00 96.80 O ATOM 651 N ARG X 81 20.432 -15.845 -4.583 1.00 92.86 N ATOM 652 CA ARG X 81 21.269 -14.844 -3.939 1.00 91.73 C ATOM 653 C ARG X 81 22.571 -14.726 -4.707 1.00 90.75 C ATOM 654 O ARG X 81 23.066 -13.627 -4.955 1.00 89.41 O ATOM 655 CB ARG X 81 21.534 -15.229 -2.489 1.00 91.90 C ATOM 656 CG ARG X 81 20.289 -15.685 -1.749 1.00 93.46 C ATOM 657 CD ARG X 81 19.693 -14.583 -0.907 1.00 96.14 C ATOM 658 NE ARG X 81 19.249 -15.106 0.380 1.00102.15 N ATOM 659 CZ ARG X 81 18.295 -14.555 1.127 1.00104.82 C ATOM 660 NH1 ARG X 81 17.677 -13.452 0.714 1.00106.28 N ATOM 661 NH2 ARG X 81 17.957 -15.107 2.288 1.00104.32 N ATOM 662 N LEU X 82 23.108 -15.872 -5.104 1.00 90.36 N ATOM 663 CA LEU X 82 24.314 -15.898 -5.906 1.00 90.28 C ATOM 664 C LEU X 82 24.119 -15.250 -7.272 1.00 90.60 C ATOM 665 O LEU X 82 24.941 -14.442 -7.694 1.00 90.40 O ATOM 666 CB LEU X 82 24.833 -17.324 -6.041 1.00 90.16 C ATOM 667 CG LEU X 82 25.531 -17.856 -4.788 1.00 89.38 C ATOM 668 CD1 LEU X 82 25.921 -19.316 -4.973 1.00 87.50 C ATOM 669 CD2 LEU X 82 26.747 -16.998 -4.431 1.00 88.18 C ATOM 670 N GLU X 83 23.026 -15.593 -7.953 1.00 91.73 N ATOM 671 CA GLU X 83 22.686 -14.959 -9.233 1.00 92.86 C ATOM 672 C GLU X 83 22.673 -13.424 -9.158 1.00 93.42 C ATOM 673 O GLU X 83 23.247 -12.755 -10.019 1.00 93.06 O ATOM 674 CB GLU X 83 21.363 -15.502 -9.793 1.00 92.72 C ATOM 675 CG GLU X 83 21.403 -16.983 -10.192 1.00 94.63 C ATOM 676 CD GLU X 83 20.637 -17.292 -11.484 1.00 98.84 C ATOM 677 OE1 GLU X 83 21.235 -17.182 -12.577 1.00101.15 O ATOM 678 OE2 GLU X 83 19.443 -17.662 -11.412 1.00100.38 O ATOM 679 N GLU X 84 22.033 -12.876 -8.124 1.00 94.45 N ATOM 680 CA GLU X 84 22.092 -11.439 -7.839 1.00 95.89 C ATOM 681 C GLU X 84 23.518 -10.941 -7.619 1.00 96.31 C ATOM 682 O GLU X 84 23.871 -9.845 -8.055 1.00 96.43 O ATOM 683 CB GLU X 84 21.252 -11.091 -6.612 1.00 96.06 C ATOM 684 CG GLU X 84 19.753 -11.120 -6.845 1.00100.17 C ATOM 685 CD GLU X 84 18.972 -11.434 -5.573 1.00106.49 C ATOM 686 OE1 GLU X 84 17.737 -11.207 -5.549 1.00108.03 O ATOM 687 OE2 GLU X 84 19.597 -11.908 -4.593 1.00107.77 O ATOM 688 N GLU X 85 24.327 -11.740 -6.928 1.00 96.85 N ATOM 689 CA GLU X 85 25.729 -11.401 -6.695 1.00 97.16 C ATOM 690 C GLU X 85 26.467 -11.269 -8.013 1.00 97.49 C ATOM 691 O GLU X 85 27.461 -10.548 -8.109 1.00 97.62 O ATOM 692 CB GLU X 85 26.413 -12.474 -5.848 1.00 97.65 C ATOM 693 CG GLU X 85 25.734 -12.751 -4.521 1.00 97.64 C ATOM 694 CD GLU X 85 26.401 -12.045 -3.360 1.00 96.34 C ATOM 695 OE1 GLU X 85 25.692 -11.729 -2.385 1.00 96.92 O ATOM 696 OE2 GLU X 85 27.629 -11.809 -3.419 1.00 95.34 O ATOM 697 N GLY X 86 25.980 -11.985 -9.023 1.00 98.02 N ATOM 698 CA GLY X 86 26.535 -11.902 -10.374 1.00 98.96 C ATOM 699 C GLY X 86 27.224 -13.180 -10.832 1.00 99.29 C ATOM 700 O GLY X 86 28.246 -13.134 -11.531 1.00 99.26 O ATOM 701 N VAL X 87 26.654 -14.321 -10.450 1.00 98.99 N ATOM 702 CA VAL X 87 27.369 -15.595 -10.485 1.00 98.17 C ATOM 703 C VAL X 87 26.738 -16.558 -11.481 1.00 98.00 C ATOM 704 O VAL X 87 25.628 -17.045 -11.271 1.00 97.98 O ATOM 705 CB VAL X 87 27.404 -16.253 -9.089 1.00 97.89 C ATOM 706 CG1 VAL X 87 27.932 -17.681 -9.181 1.00 98.27 C ATOM 707 CG2 VAL X 87 28.240 -15.414 -8.130 1.00 96.22 C ATOM 708 N GLU X 88 27.445 -16.827 -12.570 1.00 97.79 N ATOM 709 CA GLU X 88 26.956 -17.784 -13.543 1.00 98.17 C ATOM 710 C GLU X 88 26.898 -19.171 -12.914 1.00 97.35 C ATOM 711 O GLU X 88 27.920 -19.742 -12.533 1.00 97.90 O ATOM 712 CB GLU X 88 27.837 -17.791 -14.796 1.00 98.90 C ATOM 713 CG GLU X 88 27.634 -16.590 -15.717 1.00102.58 C ATOM 714 CD GLU X 88 28.925 -16.151 -16.416 1.00108.49 C ATOM 715 OE1 GLU X 88 29.039 -14.957 -16.781 1.00109.51 O ATOM 716 OE2 GLU X 88 29.829 -16.998 -16.601 1.00112.21 O ATOM 717 N ILE X 89 25.686 -19.699 -12.797 1.00 96.72 N ATOM 718 CA ILE X 89 25.467 -21.065 -12.331 1.00 95.64 C ATOM 719 C ILE X 89 24.717 -21.851 -13.407 1.00 95.29 C ATOM 720 O ILE X 89 23.925 -21.280 -14.156 1.00 95.30 O ATOM 721 CB ILE X 89 24.638 -21.071 -11.024 1.00 95.69 C ATOM 722 CG1 ILE X 89 25.163 -20.005 -10.054 1.00 93.81 C ATOM 723 CG2 ILE X 89 24.647 -22.459 -10.370 1.00 95.47 C ATOM 724 CD1 ILE X 89 24.279 -19.788 -8.834 1.00 90.57 C ATOM 725 N TYR X 90 24.966 -23.153 -13.486 1.00 94.61 N ATOM 726 CA TYR X 90 24.205 -24.010 -14.388 1.00 94.88 C ATOM 727 C TYR X 90 23.764 -25.304 -13.712 1.00 95.09 C ATOM 728 O TYR X 90 24.357 -25.727 -12.722 1.00 95.22 O ATOM 729 CB TYR X 90 25.029 -24.329 -15.627 1.00 94.76 C ATOM 730 CG TYR X 90 26.346 -24.981 -15.315 1.00 95.29 C ATOM 731 CD1 TYR X 90 27.487 -24.211 -15.077 1.00 96.90 C ATOM 732 CD2 TYR X 90 26.458 -26.367 -15.255 1.00 94.44 C ATOM 733 CE1 TYR X 90 28.708 -24.804 -14.793 1.00 96.32 C ATOM 734 CE2 TYR X 90 27.670 -26.972 -14.974 1.00 97.14 C ATOM 735 CZ TYR X 90 28.792 -26.187 -14.743 1.00 97.92 C ATOM 736 OH TYR X 90 29.996 -26.791 -14.462 1.00 98.92 O ATOM 737 N GLN X 91 22.722 -25.931 -14.251 1.00 95.36 N ATOM 738 CA GLN X 91 22.254 -27.213 -13.730 1.00 96.11 C ATOM 739 C GLN X 91 23.031 -28.355 -14.375 1.00 96.24 C ATOM 740 O GLN X 91 23.518 -28.218 -15.493 1.00 96.61 O ATOM 741 CB GLN X 91 20.749 -27.377 -13.967 1.00 96.19 C ATOM 742 CG GLN X 91 19.892 -26.554 -13.015 1.00 97.57 C ATOM 743 CD GLN X 91 18.461 -26.358 -13.501 1.00100.16 C ATOM 744 OE1 GLN X 91 17.810 -27.301 -13.960 1.00102.57 O ATOM 745 NE2 GLN X 91 17.960 -25.128 -13.389 1.00 99.35 N ATOM 746 N THR X 92 23.164 -29.470 -13.665 1.00 96.73 N ATOM 747 CA THR X 92 23.761 -30.668 -14.248 1.00 97.70 C ATOM 748 C THR X 92 22.691 -31.698 -14.581 1.00 98.80 C ATOM 749 O THR X 92 21.581 -31.353 -14.987 1.00 98.47 O ATOM 750 CB THR X 92 24.800 -31.318 -13.309 1.00 97.35 C ATOM 751 OG1 THR X 92 24.168 -31.688 -12.078 1.00 96.11 O ATOM 752 CG2 THR X 92 25.955 -30.364 -13.036 1.00 96.46 C ATOM 753 N SER X 93 23.033 -32.968 -14.403 1.00100.32 N ATOM 754 CA SER X 93 22.072 -34.044 -14.597 1.00101.37 C ATOM 755 C SER X 93 21.713 -34.757 -13.292 1.00101.73 C ATOM 756 O SER X 93 21.439 -35.954 -13.293 1.00102.17 O ATOM 757 CB SER X 93 22.571 -35.037 -15.649 1.00101.20 C ATOM 758 OG SER X 93 23.915 -34.756 -16.005 1.00103.18 O ATOM 759 N LEU X 94 21.731 -34.019 -12.183 1.00101.82 N ATOM 760 CA LEU X 94 20.551 -33.913 -11.321 1.00102.11 C ATOM 761 C LEU X 94 20.429 -32.476 -10.832 1.00101.97 C ATOM 762 O LEU X 94 20.329 -32.214 -9.631 1.00101.96 O ATOM 763 CB LEU X 94 20.574 -34.916 -10.151 1.00102.36 C ATOM 764 CG LEU X 94 19.226 -35.529 -9.702 1.00102.85 C ATOM 765 CD1 LEU X 94 19.361 -36.998 -9.274 1.00100.44 C ATOM 766 CD2 LEU X 94 18.533 -34.707 -8.599 1.00102.54 C ATOM 767 N GLY X 95 20.451 -31.548 -11.786 1.00102.09 N ATOM 768 CA GLY X 95 20.338 -30.124 -11.488 1.00102.45 C ATOM 769 C GLY X 95 21.509 -29.604 -10.675 1.00102.38 C ATOM 770 O GLY X 95 21.941 -28.464 -10.848 1.00102.21 O ATOM 771 N GLU X 96 22.021 -30.448 -9.785 1.00102.32 N ATOM 772 CA GLU X 96 23.145 -30.089 -8.930 1.00102.63 C ATOM 773 C GLU X 96 23.743 -28.738 -9.304 1.00101.66 C ATOM 774 O GLU X 96 24.794 -28.663 -9.933 1.00102.08 O ATOM 775 CB GLU X 96 24.217 -31.177 -8.971 1.00102.64 C ATOM 776 CG GLU X 96 24.143 -32.151 -7.817 1.00106.52 C ATOM 777 CD GLU X 96 25.514 -32.633 -7.375 1.00111.33 C ATOM 778 OE1 GLU X 96 25.716 -32.826 -6.154 1.00114.19 O ATOM 779 OE2 GLU X 96 26.391 -32.820 -8.248 1.00112.74 O ATOM 780 N TYR X 97 23.058 -27.671 -8.916 1.00100.56 N ATOM 781 CA TYR X 97 23.508 -26.321 -9.210 1.00 99.60 C ATOM 782 C TYR X 97 25.036 -26.175 -9.089 1.00 98.32 C ATOM 783 O TYR X 97 25.638 -26.570 -8.090 1.00 97.69 O ATOM 784 CB TYR X 97 22.773 -25.325 -8.308 1.00100.23 C ATOM 785 CG TYR X 97 21.267 -25.232 -8.567 1.00104.08 C ATOM 786 CD1 TYR X 97 20.344 -25.436 -7.540 1.00106.02 C ATOM 787 CD2 TYR X 97 20.769 -24.932 -9.838 1.00105.42 C ATOM 788 CE1 TYR X 97 18.971 -25.346 -7.775 1.00106.26 C ATOM 789 CE2 TYR X 97 19.401 -24.842 -10.078 1.00105.21 C ATOM 790 CZ TYR X 97 18.508 -25.050 -9.046 1.00105.66 C ATOM 791 OH TYR X 97 17.152 -24.954 -9.288 1.00105.93 O ATOM 792 N LYS X 98 25.658 -25.617 -10.121 1.00 96.66 N ATOM 793 CA LYS X 98 27.104 -25.703 -10.267 1.00 95.90 C ATOM 794 C LYS X 98 27.699 -24.408 -10.805 1.00 95.56 C ATOM 795 O LYS X 98 27.121 -23.760 -11.675 1.00 94.86 O ATOM 796 CB LYS X 98 27.480 -26.877 -11.176 1.00 95.87 C ATOM 797 CG LYS X 98 28.918 -27.366 -11.029 1.00 96.30 C ATOM 798 CD LYS X 98 29.094 -28.772 -11.604 1.00 95.91 C ATOM 799 CE LYS X 98 30.471 -29.345 -11.295 1.00 95.28 C ATOM 800 NZ LYS X 98 30.779 -30.489 -12.195 1.00 96.88 N ATOM 801 N LEU X 99 28.861 -24.038 -10.279 1.00 95.57 N ATOM 802 CA LEU X 99 29.578 -22.870 -10.768 1.00 95.86 C ATOM 803 C LEU X 99 31.077 -23.150 -10.899 1.00 95.89 C ATOM 804 O LEU X 99 31.597 -24.085 -10.281 1.00 95.42 O ATOM 805 CB LEU X 99 29.314 -21.652 -9.873 1.00 95.87 C ATOM 806 CG LEU X 99 29.950 -21.574 -8.475 1.00 96.78 C ATOM 807 CD1 LEU X 99 29.750 -22.859 -7.679 1.00 97.98 C ATOM 808 CD2 LEU X 99 31.426 -21.216 -8.548 1.00 95.97 C ATOM 809 N ASN X 100 31.758 -22.343 -11.714 1.00 95.85 N ATOM 810 CA ASN X 100 33.185 -22.524 -11.955 1.00 95.42 C ATOM 811 C ASN X 100 34.007 -22.122 -10.746 1.00 94.87 C ATOM 812 O ASN X 100 34.322 -20.945 -10.553 1.00 94.28 O ATOM 813 CB ASN X 100 33.645 -21.746 -13.186 1.00 95.91 C ATOM 814 CG ASN X 100 35.055 -22.106 -13.596 1.00 96.85 C ATOM 815 OD1 ASN X 100 36.004 -21.378 -13.308 1.00 99.43 O ATOM 816 ND2 ASN X 100 35.204 -23.246 -14.256 1.00 98.43 N ATOM 817 N LEU X 101 34.343 -23.112 -9.927 1.00 94.35 N ATOM 818 CA LEU X 101 35.037 -22.853 -8.678 1.00 94.76 C ATOM 819 C LEU X 101 36.242 -21.942 -8.892 1.00 95.26 C ATOM 820 O LEU X 101 36.344 -20.895 -8.264 1.00 95.43 O ATOM 821 CB LEU X 101 35.464 -24.163 -8.012 1.00 94.79 C ATOM 822 CG LEU X 101 35.570 -24.203 -6.477 1.00 94.52 C ATOM 823 CD1 LEU X 101 35.887 -22.834 -5.880 1.00 94.18 C ATOM 824 CD2 LEU X 101 34.328 -24.793 -5.832 1.00 92.94 C ATOM 825 N PRO X 102 37.157 -22.331 -9.793 1.00 95.42 N ATOM 826 CA PRO X 102 38.380 -21.556 -9.964 1.00 95.51 C ATOM 827 C PRO X 102 38.058 -20.107 -10.267 1.00 95.60 C ATOM 828 O PRO X 102 38.635 -19.207 -9.662 1.00 94.68 O ATOM 829 CB PRO X 102 39.037 -22.207 -11.180 1.00 95.89 C ATOM 830 CG PRO X 102 38.479 -23.592 -11.216 1.00 96.10 C ATOM 831 CD PRO X 102 37.069 -23.445 -10.750 1.00 95.34 C ATOM 832 N GLU X 103 37.129 -19.888 -11.192 1.00 97.25 N ATOM 833 CA GLU X 103 36.707 -18.536 -11.534 1.00 99.25 C ATOM 834 C GLU X 103 36.260 -17.780 -10.293 1.00 99.84 C ATOM 835 O GLU X 103 37.036 -17.022 -9.712 1.00100.42 O ATOM 836 CB GLU X 103 35.600 -18.541 -12.586 1.00 99.12 C ATOM 837 CG GLU X 103 35.867 -17.582 -13.738 1.00102.49 C ATOM 838 CD GLU X 103 34.596 -17.101 -14.399 1.00105.99 C ATOM 839 OE1 GLU X 103 34.389 -17.435 -15.601 1.00107.79 O ATOM 840 OE2 GLU X 103 33.805 -16.391 -13.718 1.00107.64 O ATOM 841 N TYR X 104 35.015 -18.002 -9.881 1.00100.91 N ATOM 842 CA TYR X 104 34.480 -17.371 -8.675 1.00101.75 C ATOM 843 C TYR X 104 34.975 -18.107 -7.430 1.00102.43 C ATOM 844 O TYR X 104 34.404 -19.129 -7.070 1.00103.60 O ATOM 845 CB TYR X 104 32.947 -17.410 -8.697 1.00101.34 C ATOM 846 CG TYR X 104 32.306 -16.944 -9.990 1.00101.79 C ATOM 847 CD1 TYR X 104 31.766 -17.860 -10.890 1.00100.55 C ATOM 848 CD2 TYR X 104 32.224 -15.587 -10.303 1.00102.57 C ATOM 849 CE1 TYR X 104 31.171 -17.439 -12.069 1.00101.03 C ATOM 850 CE2 TYR X 104 31.632 -15.157 -11.479 1.00102.41 C ATOM 851 CZ TYR X 104 31.108 -16.089 -12.356 1.00102.75 C ATOM 852 OH TYR X 104 30.524 -15.667 -13.526 1.00104.26 O ATOM 853 N MET X 105 36.031 -17.607 -6.784 1.00102.71 N ATOM 854 CA MET X 105 36.603 -18.276 -5.608 1.00102.29 C ATOM 855 C MET X 105 37.541 -17.383 -4.832 1.00102.26 C ATOM 856 O MET X 105 38.466 -16.813 -5.392 1.00102.09 O ATOM 857 CB MET X 105 37.357 -19.547 -5.995 1.00102.42 C ATOM 858 CG MET X 105 38.435 -19.962 -4.992 1.00104.10 C ATOM 859 SD MET X 105 37.810 -20.279 -3.318 1.00111.68 S ATOM 860 CE MET X 105 38.068 -22.050 -3.138 1.00104.70 C ATOM 861 N TRP X 106 37.315 -17.300 -3.528 1.00103.02 N ATOM 862 CA TRP X 106 38.062 -16.395 -2.672 1.00104.24 C ATOM 863 C TRP X 106 39.468 -16.887 -2.347 1.00103.85 C ATOM 864 O TRP X 106 39.691 -18.076 -2.124 1.00103.54 O ATOM 865 CB TRP X 106 37.293 -16.134 -1.381 1.00104.85 C ATOM 866 CG TRP X 106 37.842 -14.993 -0.594 1.00109.20 C ATOM 867 CD1 TRP X 106 38.249 -13.786 -1.083 1.00112.09 C ATOM 868 CD2 TRP X 106 38.049 -14.942 0.826 1.00113.48 C ATOM 869 NE1 TRP X 106 38.696 -12.986 -0.057 1.00114.15 N ATOM 870 CE2 TRP X 106 38.582 -13.671 1.125 1.00114.86 C ATOM 871 CE3 TRP X 106 37.833 -15.845 1.873 1.00115.67 C ATOM 872 CZ2 TRP X 106 38.902 -13.281 2.428 1.00116.64 C ATOM 873 CZ3 TRP X 106 38.150 -15.454 3.167 1.00116.52 C ATOM 874 CH2 TRP X 106 38.679 -14.185 3.431 1.00117.19 C ATOM 875 N LYS X 107 40.410 -15.951 -2.306 1.00104.21 N ATOM 876 CA LYS X 107 41.821 -16.278 -2.154 1.00104.51 C ATOM 877 C LYS X 107 42.580 -15.090 -1.567 1.00104.37 C ATOM 878 O LYS X 107 43.138 -14.276 -2.302 1.00104.30 O ATOM 879 CB LYS X 107 42.421 -16.677 -3.507 1.00104.67 C ATOM 880 CG LYS X 107 41.780 -17.907 -4.152 1.00105.63 C ATOM 881 CD LYS X 107 42.177 -18.034 -5.617 1.00108.65 C ATOM 882 CE LYS X 107 42.259 -19.493 -6.051 1.00110.50 C ATOM 883 NZ LYS X 107 42.856 -19.625 -7.411 1.00111.78 N ATOM 884 N PRO X 108 42.590 -14.980 -0.232 1.00104.71 N ATOM 885 CA PRO X 108 43.308 -13.904 0.462 1.00104.71 C ATOM 886 C PRO X 108 44.799 -13.880 0.135 1.00104.38 C ATOM 887 O PRO X 108 45.626 -14.177 1.013 1.00104.25 O ATOM 888 CB PRO X 108 43.087 -14.220 1.950 1.00105.01 C ATOM 889 CG PRO X 108 42.499 -15.611 1.995 1.00105.37 C ATOM 890 CD PRO X 108 41.813 -15.827 0.688 1.00104.58 C TER 891 PRO X 108 ATOM 892 O5' DG Y 201 32.519 -44.086 26.331 1.00 97.21 O ATOM 893 C5' DG Y 201 31.136 -44.213 26.654 1.00 94.92 C ATOM 894 C4' DG Y 201 30.562 -45.540 26.175 1.00 94.07 C ATOM 895 O4' DG Y 201 29.250 -45.681 26.776 1.00 92.02 O ATOM 896 C3' DG Y 201 30.362 -45.627 24.664 1.00 92.99 C ATOM 897 O3' DG Y 201 30.527 -46.911 24.106 1.00 95.09 O ATOM 898 C2' DG Y 201 28.907 -45.262 24.447 1.00 92.27 C ATOM 899 C1' DG Y 201 28.254 -45.449 25.806 1.00 90.40 C ATOM 900 N9 DG Y 201 27.629 -44.175 26.057 1.00 87.08 N ATOM 901 C8 DG Y 201 28.204 -43.034 26.553 1.00 85.79 C ATOM 902 N7 DG Y 201 27.368 -42.041 26.619 1.00 85.98 N ATOM 903 C5 DG Y 201 26.184 -42.565 26.114 1.00 85.29 C ATOM 904 C6 DG Y 201 24.923 -41.959 25.940 1.00 85.26 C ATOM 905 O6 DG Y 201 24.602 -40.791 26.209 1.00 86.61 O ATOM 906 N1 DG Y 201 23.999 -42.857 25.399 1.00 82.36 N ATOM 907 C2 DG Y 201 24.267 -44.167 25.068 1.00 83.05 C ATOM 908 N2 DG Y 201 23.252 -44.879 24.556 1.00 83.23 N ATOM 909 N3 DG Y 201 25.446 -44.745 25.228 1.00 82.62 N ATOM 910 C4 DG Y 201 26.338 -43.878 25.752 1.00 84.61 C ATOM 911 P DC Y 202 29.998 -47.076 22.593 1.00 98.13 P ATOM 912 OP1 DC Y 202 30.540 -48.336 22.040 1.00 99.03 O ATOM 913 OP2 DC Y 202 30.253 -45.801 21.888 1.00 96.22 O ATOM 914 O5' DC Y 202 28.408 -47.244 22.741 1.00 99.39 O ATOM 915 C5' DC Y 202 27.805 -48.535 22.586 1.00 98.01 C ATOM 916 C4' DC Y 202 26.569 -48.496 21.698 1.00 97.14 C ATOM 917 O4' DC Y 202 25.671 -47.439 22.124 1.00 95.30 O ATOM 918 C3' DC Y 202 26.819 -48.273 20.209 1.00 97.61 C ATOM 919 O3' DC Y 202 25.936 -49.071 19.447 1.00101.19 O ATOM 920 C2' DC Y 202 26.468 -46.807 20.014 1.00 95.52 C ATOM 921 C1' DC Y 202 25.337 -46.628 21.017 1.00 92.18 C ATOM 922 N1 DC Y 202 25.288 -45.228 21.479 1.00 88.46 N ATOM 923 C2 DC Y 202 24.124 -44.477 21.300 1.00 86.15 C ATOM 924 O2 DC Y 202 23.139 -45.007 20.768 1.00 86.04 O ATOM 925 N3 DC Y 202 24.117 -43.191 21.723 1.00 82.64 N ATOM 926 C4 DC Y 202 25.207 -42.677 22.291 1.00 81.12 C ATOM 927 N4 DC Y 202 25.157 -41.414 22.699 1.00 79.83 N ATOM 928 C5 DC Y 202 26.402 -43.425 22.480 1.00 83.32 C ATOM 929 C6 DC Y 202 26.397 -44.689 22.059 1.00 85.84 C ATOM 930 P DC Y 203 25.868 -48.858 17.862 1.00106.17 P ATOM 931 OP1 DC Y 203 26.467 -50.066 17.239 1.00106.69 O ATOM 932 OP2 DC Y 203 26.392 -47.509 17.519 1.00103.07 O ATOM 933 O5' DC Y 203 24.292 -48.862 17.563 1.00104.93 O ATOM 934 C5' DC Y 203 23.406 -48.057 18.329 1.00102.12 C ATOM 935 C4' DC Y 203 22.719 -47.026 17.449 1.00 97.82 C ATOM 936 O4' DC Y 203 22.860 -45.722 18.073 1.00 96.90 O ATOM 937 C3' DC Y 203 23.270 -46.911 16.032 1.00 95.60 C ATOM 938 O3' DC Y 203 22.216 -47.013 15.071 1.00 94.95 O ATOM 939 C2' DC Y 203 23.943 -45.541 16.015 1.00 94.87 C ATOM 940 C1' DC Y 203 23.215 -44.763 17.106 1.00 92.33 C ATOM 941 N1 DC Y 203 24.098 -43.742 17.733 1.00 87.68 N ATOM 942 C2 DC Y 203 23.645 -42.435 17.968 1.00 85.17 C ATOM 943 O2 DC Y 203 22.488 -42.127 17.662 1.00 81.57 O ATOM 944 N3 DC Y 203 24.493 -41.539 18.533 1.00 84.59 N ATOM 945 C4 DC Y 203 25.737 -41.913 18.844 1.00 85.32 C ATOM 946 N4 DC Y 203 26.558 -41.015 19.392 1.00 84.72 N ATOM 947 C5 DC Y 203 26.211 -43.234 18.609 1.00 85.96 C ATOM 948 C6 DC Y 203 25.368 -44.106 18.057 1.00 86.26 C ATOM 949 P DA Y 204 22.430 -46.602 13.531 1.00 94.23 P ATOM 950 OP1 DA Y 204 21.724 -47.587 12.681 1.00 95.51 O ATOM 951 OP2 DA Y 204 23.856 -46.287 13.288 1.00 92.73 O ATOM 952 O5' DA Y 204 21.653 -45.223 13.394 1.00 92.85 O ATOM 953 C5' DA Y 204 20.678 -44.832 14.340 1.00 89.50 C ATOM 954 C4' DA Y 204 20.114 -43.538 13.811 1.00 85.92 C ATOM 955 O4' DA Y 204 20.823 -42.416 14.389 1.00 83.13 O ATOM 956 C3' DA Y 204 20.364 -43.370 12.327 1.00 84.92 C ATOM 957 O3' DA Y 204 19.531 -42.328 11.918 1.00 87.32 O ATOM 958 C2' DA Y 204 21.822 -42.918 12.320 1.00 84.08 C ATOM 959 C1' DA Y 204 21.791 -41.921 13.475 1.00 82.31 C ATOM 960 N9 DA Y 204 23.053 -41.747 14.204 1.00 79.11 N ATOM 961 C8 DA Y 204 24.054 -42.664 14.388 1.00 75.54 C ATOM 962 N7 DA Y 204 25.053 -42.219 15.114 1.00 73.75 N ATOM 963 C5 DA Y 204 24.686 -40.925 15.430 1.00 74.34 C ATOM 964 C6 DA Y 204 25.326 -39.914 16.176 1.00 75.29 C ATOM 965 N6 DA Y 204 26.520 -40.074 16.750 1.00 74.51 N ATOM 966 N1 DA Y 204 24.691 -38.730 16.304 1.00 74.58 N ATOM 967 C2 DA Y 204 23.495 -38.590 15.717 1.00 75.64 C ATOM 968 N3 DA Y 204 22.796 -39.462 14.982 1.00 72.83 N ATOM 969 C4 DA Y 204 23.457 -40.619 14.880 1.00 74.47 C ATOM 970 P DT Y 205 19.324 -42.019 10.366 1.00 92.58 P ATOM 971 OP1 DT Y 205 18.003 -42.600 10.021 1.00 94.42 O ATOM 972 OP2 DT Y 205 20.555 -42.391 9.614 1.00 90.52 O ATOM 973 O5' DT Y 205 19.204 -40.423 10.347 1.00 89.40 O ATOM 974 C5' DT Y 205 19.438 -39.702 11.546 1.00 84.43 C ATOM 975 C4' DT Y 205 19.981 -38.325 11.230 1.00 80.75 C ATOM 976 O4' DT Y 205 21.163 -38.058 12.020 1.00 79.24 O ATOM 977 C3' DT Y 205 20.358 -38.041 9.781 1.00 79.72 C ATOM 978 O3' DT Y 205 19.786 -36.777 9.510 1.00 81.21 O ATOM 979 C2' DT Y 205 21.888 -37.990 9.806 1.00 75.25 C ATOM 980 C1' DT Y 205 22.116 -37.428 11.200 1.00 73.91 C ATOM 981 N1 DT Y 205 23.390 -37.783 11.812 1.00 69.74 N ATOM 982 C2 DT Y 205 23.961 -36.881 12.671 1.00 68.19 C ATOM 983 O2 DT Y 205 23.457 -35.804 12.921 1.00 70.61 O ATOM 984 N3 DT Y 205 25.146 -37.275 13.215 1.00 70.04 N ATOM 985 C4 DT Y 205 25.795 -38.474 12.984 1.00 72.09 C ATOM 986 O4 DT Y 205 26.867 -38.750 13.518 1.00 75.76 O ATOM 987 C5 DT Y 205 25.129 -39.378 12.074 1.00 70.24 C ATOM 988 C7 DT Y 205 25.747 -40.706 11.753 1.00 63.00 C ATOM 989 C6 DT Y 205 23.964 -38.998 11.534 1.00 68.51 C ATOM 990 P DG Y 206 19.674 -36.150 8.046 1.00 81.43 P ATOM 991 OP1 DG Y 206 18.974 -34.845 8.231 1.00 80.04 O ATOM 992 OP2 DG Y 206 19.161 -37.184 7.122 1.00 80.23 O ATOM 993 O5' DG Y 206 21.192 -35.892 7.625 1.00 81.49 O ATOM 994 C5' DG Y 206 21.461 -34.734 6.854 1.00 79.06 C ATOM 995 C4' DG Y 206 21.957 -33.578 7.709 1.00 73.76 C ATOM 996 O4' DG Y 206 22.719 -34.125 8.819 1.00 73.06 O ATOM 997 C3' DG Y 206 22.915 -32.672 6.945 1.00 68.95 C ATOM 998 O3' DG Y 206 22.907 -31.334 7.426 1.00 67.94 O ATOM 999 C2' DG Y 206 24.254 -33.357 7.193 1.00 73.75 C ATOM 1000 C1' DG Y 206 24.102 -33.884 8.617 1.00 71.64 C ATOM 1001 N9 DG Y 206 24.828 -35.128 8.848 1.00 68.86 N ATOM 1002 C8 DG Y 206 24.561 -36.375 8.329 1.00 70.55 C ATOM 1003 N7 DG Y 206 25.402 -37.294 8.735 1.00 67.86 N ATOM 1004 C5 DG Y 206 26.273 -36.606 9.573 1.00 63.66 C ATOM 1005 C6 DG Y 206 27.389 -37.055 10.312 1.00 64.15 C ATOM 1006 O6 DG Y 206 27.868 -38.183 10.390 1.00 67.41 O ATOM 1007 N1 DG Y 206 28.000 -36.042 11.024 1.00 65.09 N ATOM 1008 C2 DG Y 206 27.576 -34.744 11.015 1.00 61.98 C ATOM 1009 N2 DG Y 206 28.292 -33.913 11.760 1.00 55.53 N ATOM 1010 N3 DG Y 206 26.525 -34.296 10.344 1.00 64.93 N ATOM 1011 C4 DG Y 206 25.930 -35.281 9.643 1.00 63.85 C ATOM 1012 P DG Y 207 22.004 -30.395 6.512 1.00 69.95 P ATOM 1013 OP1 DG Y 207 22.515 -29.433 7.548 1.00 66.83 O ATOM 1014 OP2 DG Y 207 20.569 -30.301 6.028 1.00 74.83 O ATOM 1015 O5' DG Y 207 22.871 -30.223 5.174 1.00 68.76 O ATOM 1016 C5' DG Y 207 24.274 -30.077 5.233 1.00 61.58 C ATOM 1017 C4' DG Y 207 24.749 -29.582 3.881 1.00 55.72 C ATOM 1018 O4' DG Y 207 23.962 -28.453 3.518 1.00 52.05 O ATOM 1019 C3' DG Y 207 26.161 -29.078 4.100 1.00 53.56 C ATOM 1020 O3' DG Y 207 26.890 -29.185 2.871 1.00 52.73 O ATOM 1021 C2' DG Y 207 25.961 -27.630 4.491 1.00 52.55 C ATOM 1022 C1' DG Y 207 24.725 -27.262 3.697 1.00 54.97 C ATOM 1023 N9 DG Y 207 23.918 -26.225 4.361 1.00 56.02 N ATOM 1024 C8 DG Y 207 22.858 -26.440 5.142 1.00 61.86 C ATOM 1025 N7 DG Y 207 22.364 -25.239 5.545 1.00 62.14 N ATOM 1026 C5 DG Y 207 23.136 -24.271 5.008 1.00 58.56 C ATOM 1027 C6 DG Y 207 23.110 -22.879 5.073 1.00 57.41 C ATOM 1028 O6 DG Y 207 22.143 -22.235 5.803 1.00 60.58 O ATOM 1029 N1 DG Y 207 24.040 -22.184 4.392 1.00 56.86 N ATOM 1030 C2 DG Y 207 24.981 -22.833 3.668 1.00 56.66 C ATOM 1031 N2 DG Y 207 25.909 -22.124 2.994 1.00 57.28 N ATOM 1032 N3 DG Y 207 25.024 -24.181 3.597 1.00 57.26 N ATOM 1033 C4 DG Y 207 24.109 -24.913 4.258 1.00 56.86 C ATOM 1034 P DC Y 208 27.478 -30.662 2.810 1.00 63.48 P ATOM 1035 OP1 DC Y 208 28.205 -30.301 1.573 1.00 67.51 O ATOM 1036 OP2 DC Y 208 26.706 -31.919 2.866 1.00 61.01 O ATOM 1037 O5' DC Y 208 28.536 -30.700 4.006 1.00 61.97 O ATOM 1038 C5' DC Y 208 29.406 -29.605 4.206 1.00 62.93 C ATOM 1039 C4' DC Y 208 30.839 -30.080 4.300 1.00 62.99 C ATOM 1040 O4' DC Y 208 30.887 -31.369 4.971 1.00 61.73 O ATOM 1041 C3' DC Y 208 31.502 -30.226 2.939 1.00 59.90 C ATOM 1042 O3' DC Y 208 32.742 -29.570 2.990 1.00 62.84 O ATOM 1043 C2' DC Y 208 31.688 -31.721 2.775 1.00 62.05 C ATOM 1044 C1' DC Y 208 31.719 -32.209 4.225 1.00 62.10 C ATOM 1045 N1 DC Y 208 31.235 -33.580 4.334 1.00 59.85 N ATOM 1046 C2 DC Y 208 32.129 -34.573 4.739 1.00 63.11 C ATOM 1047 O2 DC Y 208 33.290 -34.248 5.021 1.00 66.74 O ATOM 1048 N3 DC Y 208 31.704 -35.858 4.828 1.00 61.87 N ATOM 1049 C4 DC Y 208 30.450 -36.144 4.509 1.00 58.40 C ATOM 1050 N4 DC Y 208 30.080 -37.411 4.607 1.00 57.00 N ATOM 1051 C5 DC Y 208 29.524 -35.145 4.082 1.00 62.92 C ATOM 1052 C6 DC Y 208 29.953 -33.878 4.002 1.00 60.14 C ATOM 1053 P DT Y 209 33.623 -29.351 1.676 1.00 59.84 P ATOM 1054 OP1 DT Y 209 34.107 -27.953 1.696 1.00 61.02 O ATOM 1055 OP2 DT Y 209 32.916 -29.918 0.503 1.00 57.22 O ATOM 1056 O5' DT Y 209 34.893 -30.253 2.013 1.00 61.61 O ATOM 1057 C5' DT Y 209 34.828 -31.376 2.882 1.00 64.29 C ATOM 1058 C4' DT Y 209 36.080 -32.209 2.685 1.00 65.54 C ATOM 1059 O4' DT Y 209 35.784 -33.611 2.916 1.00 64.40 O ATOM 1060 C3' DT Y 209 36.613 -32.148 1.261 1.00 65.41 C ATOM 1061 O3' DT Y 209 38.011 -32.479 1.276 1.00 70.24 O ATOM 1062 C2' DT Y 209 35.742 -33.201 0.591 1.00 61.39 C ATOM 1063 C1' DT Y 209 35.801 -34.278 1.671 1.00 64.36 C ATOM 1064 N1 DT Y 209 34.681 -35.237 1.653 1.00 65.66 N ATOM 1065 C2 DT Y 209 34.911 -36.517 2.108 1.00 70.84 C ATOM 1066 O2 DT Y 209 35.988 -36.901 2.530 1.00 75.94 O ATOM 1067 N3 DT Y 209 33.819 -37.339 2.057 1.00 70.78 N ATOM 1068 C4 DT Y 209 32.556 -37.003 1.598 1.00 68.00 C ATOM 1069 O4 DT Y 209 31.635 -37.812 1.578 1.00 72.44 O ATOM 1070 C5 DT Y 209 32.383 -35.653 1.137 1.00 63.89 C ATOM 1071 C7 DT Y 209 31.045 -35.206 0.622 1.00 58.26 C ATOM 1072 C6 DT Y 209 33.446 -34.841 1.186 1.00 64.40 C ATOM 1073 P DA Y 210 39.007 -32.041 0.091 1.00 72.71 P ATOM 1074 OP1 DA Y 210 39.791 -30.884 0.593 1.00 70.49 O ATOM 1075 OP2 DA Y 210 38.273 -32.020 -1.201 1.00 66.64 O ATOM 1076 O5' DA Y 210 40.004 -33.275 0.009 1.00 74.45 O ATOM 1077 C5' DA Y 210 40.375 -33.896 1.225 1.00 77.52 C ATOM 1078 C4' DA Y 210 40.743 -35.327 0.907 1.00 78.60 C ATOM 1079 O4' DA Y 210 39.540 -36.143 0.830 1.00 80.89 O ATOM 1080 C3' DA Y 210 41.452 -35.469 -0.437 1.00 77.09 C ATOM 1081 O3' DA Y 210 42.421 -36.490 -0.288 1.00 78.30 O ATOM 1082 C2' DA Y 210 40.319 -35.872 -1.378 1.00 76.21 C ATOM 1083 C1' DA Y 210 39.494 -36.753 -0.448 1.00 76.56 C ATOM 1084 N9 DA Y 210 38.104 -36.832 -0.842 1.00 72.67 N ATOM 1085 C8 DA Y 210 37.337 -35.852 -1.404 1.00 72.02 C ATOM 1086 N7 DA Y 210 36.108 -36.234 -1.655 1.00 71.20 N ATOM 1087 C5 DA Y 210 36.086 -37.544 -1.216 1.00 72.07 C ATOM 1088 C6 DA Y 210 35.072 -38.506 -1.192 1.00 74.00 C ATOM 1089 N6 DA Y 210 33.838 -38.267 -1.646 1.00 74.49 N ATOM 1090 N1 DA Y 210 35.382 -39.719 -0.686 1.00 75.81 N ATOM 1091 C2 DA Y 210 36.624 -39.949 -0.231 1.00 73.15 C ATOM 1092 N3 DA Y 210 37.661 -39.120 -0.197 1.00 70.79 N ATOM 1093 C4 DA Y 210 37.310 -37.931 -0.710 1.00 72.31 C ATOM 1094 P DG Y 211 43.356 -36.970 -1.487 1.00 78.75 P ATOM 1095 OP1 DG Y 211 44.738 -36.940 -0.954 1.00 78.93 O ATOM 1096 OP2 DG Y 211 43.019 -36.229 -2.733 1.00 77.95 O ATOM 1097 O5' DG Y 211 42.895 -38.489 -1.660 1.00 75.20 O ATOM 1098 C5' DG Y 211 42.889 -39.370 -0.543 1.00 76.75 C ATOM 1099 C4' DG Y 211 42.182 -40.631 -0.991 1.00 79.10 C ATOM 1100 O4' DG Y 211 40.801 -40.278 -1.262 1.00 80.22 O ATOM 1101 C3' DG Y 211 42.708 -41.162 -2.323 1.00 83.12 C ATOM 1102 O3' DG Y 211 42.803 -42.582 -2.327 1.00 89.74 O ATOM 1103 C2' DG Y 211 41.694 -40.674 -3.355 1.00 78.90 C ATOM 1104 C1' DG Y 211 40.438 -40.813 -2.523 1.00 76.16 C ATOM 1105 N9 DG Y 211 39.282 -40.132 -3.098 1.00 72.34 N ATOM 1106 C8 DG Y 211 39.198 -38.851 -3.594 1.00 70.87 C ATOM 1107 N7 DG Y 211 38.014 -38.540 -4.047 1.00 68.14 N ATOM 1108 C5 DG Y 211 37.268 -39.694 -3.832 1.00 67.86 C ATOM 1109 C6 DG Y 211 35.913 -39.972 -4.119 1.00 67.15 C ATOM 1110 O6 DG Y 211 35.058 -39.247 -4.633 1.00 64.02 O ATOM 1111 N1 DG Y 211 35.564 -41.262 -3.744 1.00 72.31 N ATOM 1112 C2 DG Y 211 36.411 -42.181 -3.166 1.00 71.03 C ATOM 1113 N2 DG Y 211 35.866 -43.373 -2.880 1.00 66.87 N ATOM 1114 N3 DG Y 211 37.687 -41.938 -2.885 1.00 67.20 N ATOM 1115 C4 DG Y 211 38.035 -40.679 -3.250 1.00 68.87 C ATOM 1116 P DT Y 212 43.856 -43.296 -3.318 1.00 95.39 P ATOM 1117 OP1 DT Y 212 44.579 -44.322 -2.524 1.00 94.00 O ATOM 1118 OP2 DT Y 212 44.604 -42.251 -4.066 1.00 93.68 O ATOM 1119 O5' DT Y 212 42.907 -44.003 -4.390 1.00 91.75 O ATOM 1120 C5' DT Y 212 41.516 -43.779 -4.307 1.00 88.89 C ATOM 1121 C4' DT Y 212 40.790 -45.104 -4.257 1.00 87.55 C ATOM 1122 O4' DT Y 212 39.384 -44.805 -4.385 1.00 85.56 O ATOM 1123 C3' DT Y 212 41.072 -45.992 -5.462 1.00 89.23 C ATOM 1124 O3' DT Y 212 40.579 -47.321 -5.230 1.00 90.39 O ATOM 1125 C2' DT Y 212 40.282 -45.245 -6.535 1.00 88.31 C ATOM 1126 C1' DT Y 212 39.023 -44.869 -5.754 1.00 85.37 C ATOM 1127 N1 DT Y 212 38.393 -43.578 -6.153 1.00 83.01 N ATOM 1128 C2 DT Y 212 37.028 -43.566 -6.366 1.00 82.86 C ATOM 1129 O2 DT Y 212 36.329 -44.559 -6.252 1.00 83.21 O ATOM 1130 N3 DT Y 212 36.514 -42.344 -6.723 1.00 81.50 N ATOM 1131 C4 DT Y 212 37.222 -41.166 -6.890 1.00 80.64 C ATOM 1132 O4 DT Y 212 36.675 -40.116 -7.215 1.00 81.28 O ATOM 1133 C5 DT Y 212 38.645 -41.252 -6.653 1.00 78.58 C ATOM 1134 C7 DT Y 212 39.498 -40.029 -6.802 1.00 75.93 C ATOM 1135 C6 DT Y 212 39.163 -42.437 -6.297 1.00 78.80 C ATOM 1136 P DA Y 213 40.571 -48.455 -6.376 1.00 93.24 P ATOM 1137 OP1 DA Y 213 41.461 -49.549 -5.925 1.00 93.06 O ATOM 1138 OP2 DA Y 213 40.798 -47.865 -7.722 1.00 88.67 O ATOM 1139 O5' DA Y 213 39.061 -48.992 -6.279 1.00 93.80 O ATOM 1140 C5' DA Y 213 37.923 -48.130 -6.421 1.00 92.20 C ATOM 1141 C4' DA Y 213 37.109 -48.527 -7.644 1.00 89.85 C ATOM 1142 O4' DA Y 213 36.396 -47.376 -8.170 1.00 89.14 O ATOM 1143 C3' DA Y 213 37.937 -49.038 -8.816 1.00 88.50 C ATOM 1144 O3' DA Y 213 37.131 -49.864 -9.644 1.00 87.75 O ATOM 1145 C2' DA Y 213 38.288 -47.735 -9.519 1.00 87.61 C ATOM 1146 C1' DA Y 213 36.930 -47.053 -9.439 1.00 87.84 C ATOM 1147 N9 DA Y 213 37.004 -45.609 -9.546 1.00 87.46 N ATOM 1148 C8 DA Y 213 38.085 -44.805 -9.325 1.00 87.00 C ATOM 1149 N7 DA Y 213 37.835 -43.529 -9.510 1.00 86.43 N ATOM 1150 C5 DA Y 213 36.500 -43.502 -9.874 1.00 86.75 C ATOM 1151 C6 DA Y 213 35.622 -42.449 -10.206 1.00 86.29 C ATOM 1152 N6 DA Y 213 35.976 -41.160 -10.222 1.00 82.91 N ATOM 1153 N1 DA Y 213 34.352 -42.778 -10.519 1.00 86.96 N ATOM 1154 C2 DA Y 213 33.988 -44.070 -10.501 1.00 88.56 C ATOM 1155 N3 DA Y 213 34.719 -45.146 -10.207 1.00 88.81 N ATOM 1156 C4 DA Y 213 35.973 -44.781 -9.898 1.00 87.78 C TER 1157 DA Y 213 ATOM 1158 O5' DC Z 214 32.371 -33.771 -14.760 1.00103.46 O ATOM 1159 C5' DC Z 214 31.665 -34.042 -15.975 1.00102.25 C ATOM 1160 C4' DC Z 214 31.030 -35.421 -15.937 1.00 99.26 C ATOM 1161 O4' DC Z 214 32.009 -36.415 -16.343 1.00 97.12 O ATOM 1162 C3' DC Z 214 30.580 -35.854 -14.550 1.00 98.64 C ATOM 1163 O3' DC Z 214 29.223 -35.485 -14.346 1.00103.13 O ATOM 1164 C2' DC Z 214 30.683 -37.383 -14.614 1.00 97.26 C ATOM 1165 C1' DC Z 214 31.777 -37.637 -15.658 1.00 93.84 C ATOM 1166 N1 DC Z 214 33.023 -38.120 -14.999 1.00 87.81 N ATOM 1167 C2 DC Z 214 34.039 -37.219 -14.642 1.00 89.49 C ATOM 1168 O2 DC Z 214 33.907 -36.013 -14.888 1.00 95.39 O ATOM 1169 N3 DC Z 214 35.161 -37.681 -14.031 1.00 85.46 N ATOM 1170 C4 DC Z 214 35.286 -38.982 -13.779 1.00 82.98 C ATOM 1171 N4 DC Z 214 36.419 -39.363 -13.179 1.00 78.81 N ATOM 1172 C5 DC Z 214 34.263 -39.921 -14.132 1.00 81.26 C ATOM 1173 C6 DC Z 214 33.161 -39.451 -14.731 1.00 85.15 C ATOM 1174 P DT Z 215 28.549 -35.667 -12.896 1.00105.85 P ATOM 1175 OP1 DT Z 215 27.196 -35.058 -12.928 1.00105.13 O ATOM 1176 OP2 DT Z 215 29.548 -35.225 -11.894 1.00104.94 O ATOM 1177 O5' DT Z 215 28.346 -37.242 -12.733 1.00102.54 O ATOM 1178 C5' DT Z 215 27.560 -37.966 -13.653 1.00101.63 C ATOM 1179 C4' DT Z 215 27.659 -39.413 -13.242 1.00102.15 C ATOM 1180 O4' DT Z 215 29.066 -39.774 -13.181 1.00 98.73 O ATOM 1181 C3' DT Z 215 27.113 -39.640 -11.840 1.00104.60 C ATOM 1182 O3' DT Z 215 26.494 -40.908 -11.775 1.00112.79 O ATOM 1183 C2' DT Z 215 28.362 -39.584 -10.965 1.00100.03 C ATOM 1184 C1' DT Z 215 29.385 -40.232 -11.885 1.00 93.45 C ATOM 1185 N1 DT Z 215 30.775 -39.830 -11.585 1.00 86.70 N ATOM 1186 C2 DT Z 215 31.658 -40.789 -11.139 1.00 83.91 C ATOM 1187 O2 DT Z 215 31.354 -41.958 -10.981 1.00 83.36 O ATOM 1188 N3 DT Z 215 32.923 -40.333 -10.885 1.00 80.67 N ATOM 1189 C4 DT Z 215 33.382 -39.039 -11.027 1.00 79.21 C ATOM 1190 O4 DT Z 215 34.541 -38.726 -10.769 1.00 75.77 O ATOM 1191 C5 DT Z 215 32.406 -38.086 -11.490 1.00 80.98 C ATOM 1192 C7 DT Z 215 32.802 -36.651 -11.675 1.00 82.28 C ATOM 1193 C6 DT Z 215 31.162 -38.517 -11.746 1.00 83.03 C ATOM 1194 P DA Z 216 25.624 -41.321 -10.496 1.00119.86 P ATOM 1195 OP1 DA Z 216 24.203 -41.081 -10.836 1.00119.83 O ATOM 1196 OP2 DA Z 216 26.194 -40.715 -9.266 1.00118.87 O ATOM 1197 O5' DA Z 216 25.894 -42.900 -10.438 1.00120.16 O ATOM 1198 C5' DA Z 216 27.227 -43.402 -10.483 1.00116.62 C ATOM 1199 C4' DA Z 216 27.537 -44.216 -9.237 1.00112.47 C ATOM 1200 O4' DA Z 216 28.897 -43.967 -8.808 1.00110.15 O ATOM 1201 C3' DA Z 216 26.717 -43.907 -7.996 1.00111.38 C ATOM 1202 O3' DA Z 216 26.855 -45.025 -7.138 1.00113.43 O ATOM 1203 C2' DA Z 216 27.465 -42.707 -7.429 1.00107.72 C ATOM 1204 C1' DA Z 216 28.895 -43.204 -7.616 1.00105.72 C ATOM 1205 N9 DA Z 216 29.930 -42.179 -7.744 1.00100.48 N ATOM 1206 C8 DA Z 216 29.779 -40.879 -8.134 1.00 99.15 C ATOM 1207 N7 DA Z 216 30.905 -40.199 -8.164 1.00 98.56 N ATOM 1208 C5 DA Z 216 31.860 -41.118 -7.765 1.00 96.95 C ATOM 1209 C6 DA Z 216 33.254 -41.027 -7.590 1.00 95.31 C ATOM 1210 N6 DA Z 216 33.949 -39.912 -7.796 1.00 95.91 N ATOM 1211 N1 DA Z 216 33.917 -42.129 -7.187 1.00 95.56 N ATOM 1212 C2 DA Z 216 33.219 -43.251 -6.974 1.00 96.93 C ATOM 1213 N3 DA Z 216 31.907 -43.460 -7.104 1.00 96.67 N ATOM 1214 C4 DA Z 216 31.277 -42.343 -7.506 1.00 97.90 C ATOM 1215 P DC Z 217 25.592 -45.591 -6.341 1.00112.88 P ATOM 1216 OP1 DC Z 217 25.173 -46.843 -7.014 1.00113.43 O ATOM 1217 OP2 DC Z 217 24.643 -44.468 -6.149 1.00112.50 O ATOM 1218 O5' DC Z 217 26.215 -45.948 -4.916 1.00110.77 O ATOM 1219 C5' DC Z 217 27.320 -45.197 -4.483 1.00107.93 C ATOM 1220 C4' DC Z 217 28.511 -46.115 -4.361 1.00106.08 C ATOM 1221 O4' DC Z 217 29.662 -45.443 -4.925 1.00104.51 O ATOM 1222 C3' DC Z 217 28.831 -46.380 -2.906 1.00105.39 C ATOM 1223 O3' DC Z 217 29.347 -47.663 -2.680 1.00107.43 O ATOM 1224 C2' DC Z 217 29.873 -45.331 -2.573 1.00105.49 C ATOM 1225 C1' DC Z 217 30.579 -45.113 -3.905 1.00103.17 C ATOM 1226 N1 DC Z 217 30.958 -43.689 -4.025 1.00101.66 N ATOM 1227 C2 DC Z 217 32.282 -43.314 -3.777 1.00102.19 C ATOM 1228 O2 DC Z 217 33.112 -44.185 -3.489 1.00102.49 O ATOM 1229 N3 DC Z 217 32.624 -42.007 -3.872 1.00100.25 N ATOM 1230 C4 DC Z 217 31.699 -41.108 -4.189 1.00 99.44 C ATOM 1231 N4 DC Z 217 32.090 -39.838 -4.269 1.00101.30 N ATOM 1232 C5 DC Z 217 30.342 -41.464 -4.438 1.00 99.29 C ATOM 1233 C6 DC Z 217 30.015 -42.756 -4.341 1.00100.23 C ATOM 1234 P DT Z 218 29.389 -48.117 -1.141 1.00111.37 P ATOM 1235 OP1 DT Z 218 29.562 -49.588 -1.076 1.00111.22 O ATOM 1236 OP2 DT Z 218 28.239 -47.478 -0.459 1.00110.21 O ATOM 1237 O5' DT Z 218 30.701 -47.420 -0.563 1.00106.48 O ATOM 1238 C5' DT Z 218 31.526 -48.141 0.318 1.00102.54 C ATOM 1239 C4' DT Z 218 32.888 -47.502 0.253 1.00101.67 C ATOM 1240 O4' DT Z 218 32.762 -46.255 -0.477 1.00100.72 O ATOM 1241 C3' DT Z 218 33.388 -47.117 1.628 1.00103.48 C ATOM 1242 O3' DT Z 218 34.475 -47.929 1.973 1.00108.72 O ATOM 1243 C2' DT Z 218 33.827 -45.662 1.524 1.00102.14 C ATOM 1244 C1' DT Z 218 33.672 -45.310 0.055 1.00 96.94 C ATOM 1245 N1 DT Z 218 33.211 -43.884 -0.145 1.00 92.69 N ATOM 1246 C2 DT Z 218 34.150 -42.864 -0.092 1.00 92.62 C ATOM 1247 O2 DT Z 218 35.344 -43.036 0.095 1.00 89.44 O ATOM 1248 N3 DT Z 218 33.643 -41.602 -0.284 1.00 92.45 N ATOM 1249 C4 DT Z 218 32.330 -41.253 -0.512 1.00 90.21 C ATOM 1250 O4 DT Z 218 32.004 -40.083 -0.672 1.00 89.94 O ATOM 1251 C5 DT Z 218 31.400 -42.357 -0.551 1.00 88.85 C ATOM 1252 C7 DT Z 218 29.941 -42.105 -0.795 1.00 90.13 C ATOM 1253 C6 DT Z 218 31.876 -43.596 -0.369 1.00 89.10 C ATOM 1254 P DA Z 219 34.274 -48.925 3.199 1.00114.01 P ATOM 1255 OP1 DA Z 219 35.456 -49.820 3.236 1.00113.61 O ATOM 1256 OP2 DA Z 219 32.906 -49.477 3.051 1.00115.55 O ATOM 1257 O5' DA Z 219 34.281 -47.982 4.497 1.00111.78 O ATOM 1258 C5' DA Z 219 34.514 -46.580 4.370 1.00110.19 C ATOM 1259 C4' DA Z 219 35.998 -46.243 4.329 1.00106.89 C ATOM 1260 O4' DA Z 219 36.202 -45.034 3.545 1.00104.37 O ATOM 1261 C3' DA Z 219 36.563 -45.886 5.693 1.00104.87 C ATOM 1262 O3' DA Z 219 37.984 -46.030 5.668 1.00100.40 O ATOM 1263 C2' DA Z 219 36.091 -44.433 5.807 1.00103.60 C ATOM 1264 C1' DA Z 219 36.457 -43.941 4.411 1.00102.12 C ATOM 1265 N9 DA Z 219 35.765 -42.748 3.908 1.00100.44 N ATOM 1266 C8 DA Z 219 36.323 -41.508 3.693 1.00 99.93 C ATOM 1267 N7 DA Z 219 35.490 -40.606 3.214 1.00 95.15 N ATOM 1268 C5 DA Z 219 34.303 -41.307 3.102 1.00 94.56 C ATOM 1269 C6 DA Z 219 33.031 -40.920 2.655 1.00 93.76 C ATOM 1270 N6 DA Z 219 32.769 -39.687 2.235 1.00 93.83 N ATOM 1271 N1 DA Z 219 32.044 -41.837 2.656 1.00 93.32 N ATOM 1272 C2 DA Z 219 32.330 -43.071 3.090 1.00 94.45 C ATOM 1273 N3 DA Z 219 33.489 -43.561 3.534 1.00 94.79 N ATOM 1274 C4 DA Z 219 34.447 -42.621 3.517 1.00 96.40 C ATOM 1275 P DG Z 220 38.837 -45.918 7.028 1.00102.55 P ATOM 1276 OP1 DG Z 220 40.131 -46.621 6.856 1.00100.68 O ATOM 1277 OP2 DG Z 220 37.964 -46.229 8.189 1.00 98.98 O ATOM 1278 O5' DG Z 220 39.167 -44.368 7.096 1.00 94.50 O ATOM 1279 C5' DG Z 220 38.370 -43.667 7.961 1.00 90.45 C ATOM 1280 C4' DG Z 220 38.745 -42.226 7.868 1.00 88.59 C ATOM 1281 O4' DG Z 220 37.866 -41.565 6.928 1.00 88.43 O ATOM 1282 C3' DG Z 220 38.502 -41.600 9.214 1.00 85.90 C ATOM 1283 O3' DG Z 220 39.515 -40.695 9.487 1.00 83.72 O ATOM 1284 C2' DG Z 220 37.160 -40.909 9.061 1.00 86.83 C ATOM 1285 C1' DG Z 220 37.157 -40.541 7.585 1.00 85.02 C ATOM 1286 N9 DG Z 220 35.785 -40.551 7.117 1.00 84.07 N ATOM 1287 C8 DG Z 220 34.947 -41.641 7.129 1.00 83.43 C ATOM 1288 N7 DG Z 220 33.754 -41.375 6.671 1.00 81.45 N ATOM 1289 C5 DG Z 220 33.810 -40.023 6.350 1.00 78.51 C ATOM 1290 C6 DG Z 220 32.811 -39.189 5.812 1.00 74.39 C ATOM 1291 O6 DG Z 220 31.662 -39.497 5.521 1.00 72.08 O ATOM 1292 N1 DG Z 220 33.246 -37.887 5.618 1.00 75.98 N ATOM 1293 C2 DG Z 220 34.503 -37.440 5.923 1.00 78.54 C ATOM 1294 N2 DG Z 220 34.715 -36.141 5.666 1.00 76.36 N ATOM 1295 N3 DG Z 220 35.470 -38.212 6.432 1.00 81.04 N ATOM 1296 C4 DG Z 220 35.051 -39.492 6.620 1.00 81.02 C ATOM 1297 P DC Z 221 39.545 -40.255 11.005 1.00 88.24 P ATOM 1298 OP1 DC Z 221 40.957 -40.270 11.469 1.00 89.43 O ATOM 1299 OP2 DC Z 221 38.538 -41.106 11.684 1.00 85.11 O ATOM 1300 O5' DC Z 221 38.981 -38.747 10.943 1.00 90.74 O ATOM 1301 C5' DC Z 221 38.284 -38.283 9.778 1.00 87.49 C ATOM 1302 C4' DC Z 221 37.669 -36.911 9.973 1.00 83.37 C ATOM 1303 O4' DC Z 221 36.450 -36.834 9.185 1.00 80.45 O ATOM 1304 C3' DC Z 221 37.299 -36.636 11.417 1.00 80.64 C ATOM 1305 O3' DC Z 221 37.857 -35.419 11.880 1.00 77.51 O ATOM 1306 C2' DC Z 221 35.774 -36.603 11.433 1.00 82.44 C ATOM 1307 C1' DC Z 221 35.336 -36.505 9.975 1.00 77.49 C ATOM 1308 N1 DC Z 221 34.268 -37.503 9.692 1.00 77.37 N ATOM 1309 C2 DC Z 221 33.050 -37.110 9.123 1.00 78.09 C ATOM 1310 O2 DC Z 221 32.837 -35.930 8.841 1.00 83.91 O ATOM 1311 N3 DC Z 221 32.102 -38.041 8.886 1.00 81.02 N ATOM 1312 C4 DC Z 221 32.330 -39.322 9.200 1.00 83.56 C ATOM 1313 N4 DC Z 221 31.345 -40.196 8.945 1.00 82.16 N ATOM 1314 C5 DC Z 221 33.566 -39.756 9.781 1.00 78.78 C ATOM 1315 C6 DC Z 221 34.492 -38.817 10.005 1.00 79.17 C ATOM 1316 P DC Z 222 38.041 -35.309 13.461 1.00 79.08 P ATOM 1317 OP1 DC Z 222 39.395 -34.799 13.766 1.00 79.98 O ATOM 1318 OP2 DC Z 222 37.588 -36.618 13.983 1.00 79.26 O ATOM 1319 O5' DC Z 222 36.984 -34.208 13.926 1.00 80.43 O ATOM 1320 C5' DC Z 222 35.838 -34.087 13.141 1.00 77.07 C ATOM 1321 C4' DC Z 222 34.690 -33.421 13.843 1.00 74.07 C ATOM 1322 O4' DC Z 222 33.495 -33.940 13.200 1.00 73.79 O ATOM 1323 C3' DC Z 222 34.549 -33.741 15.313 1.00 73.45 C ATOM 1324 O3' DC Z 222 33.870 -32.665 15.958 1.00 73.66 O ATOM 1325 C2' DC Z 222 33.671 -34.987 15.248 1.00 76.38 C ATOM 1326 C1' DC Z 222 32.699 -34.614 14.135 1.00 71.40 C ATOM 1327 N1 DC Z 222 32.083 -35.770 13.431 1.00 67.77 N ATOM 1328 C2 DC Z 222 30.844 -35.623 12.785 1.00 66.93 C ATOM 1329 O2 DC Z 222 30.260 -34.536 12.808 1.00 65.63 O ATOM 1330 N3 DC Z 222 30.293 -36.691 12.149 1.00 66.29 N ATOM 1331 C4 DC Z 222 30.924 -37.862 12.163 1.00 64.96 C ATOM 1332 N4 DC Z 222 30.336 -38.877 11.531 1.00 68.69 N ATOM 1333 C5 DC Z 222 32.184 -38.035 12.807 1.00 64.61 C ATOM 1334 C6 DC Z 222 32.723 -36.974 13.423 1.00 66.45 C ATOM 1335 P DA Z 223 33.806 -32.629 17.564 1.00 73.87 P ATOM 1336 OP1 DA Z 223 35.049 -32.002 18.045 1.00 66.80 O ATOM 1337 OP2 DA Z 223 33.438 -33.992 18.012 1.00 72.36 O ATOM 1338 O5' DA Z 223 32.581 -31.686 17.960 1.00 70.03 O ATOM 1339 C5' DA Z 223 32.397 -30.398 17.422 1.00 65.15 C ATOM 1340 C4' DA Z 223 30.911 -30.230 17.132 1.00 70.80 C ATOM 1341 O4' DA Z 223 30.459 -31.292 16.262 1.00 69.73 O ATOM 1342 C3' DA Z 223 29.943 -30.253 18.319 1.00 70.84 C ATOM 1343 O3' DA Z 223 28.928 -29.322 18.087 1.00 77.88 O ATOM 1344 C2' DA Z 223 29.315 -31.630 18.255 1.00 70.15 C ATOM 1345 C1' DA Z 223 29.254 -31.844 16.757 1.00 67.50 C ATOM 1346 N9 DA Z 223 29.300 -33.257 16.438 1.00 67.33 N ATOM 1347 C8 DA Z 223 30.294 -34.118 16.811 1.00 72.56 C ATOM 1348 N7 DA Z 223 30.102 -35.356 16.389 1.00 73.27 N ATOM 1349 C5 DA Z 223 28.916 -35.279 15.697 1.00 64.35 C ATOM 1350 C6 DA Z 223 28.190 -36.253 15.025 1.00 63.48 C ATOM 1351 N6 DA Z 223 28.632 -37.503 14.969 1.00 59.49 N ATOM 1352 N1 DA Z 223 27.030 -35.897 14.421 1.00 66.61 N ATOM 1353 C2 DA Z 223 26.637 -34.621 14.508 1.00 68.14 C ATOM 1354 N3 DA Z 223 27.258 -33.604 15.131 1.00 73.09 N ATOM 1355 C4 DA Z 223 28.405 -34.002 15.709 1.00 66.62 C ATOM 1356 P DT Z 224 27.988 -28.801 19.271 1.00 82.64 P ATOM 1357 OP1 DT Z 224 28.018 -27.315 19.201 1.00 79.86 O ATOM 1358 OP2 DT Z 224 28.339 -29.542 20.511 1.00 77.26 O ATOM 1359 O5' DT Z 224 26.527 -29.259 18.805 1.00 79.53 O ATOM 1360 C5' DT Z 224 26.384 -30.130 17.703 1.00 79.98 C ATOM 1361 C4' DT Z 224 24.969 -30.644 17.657 1.00 77.99 C ATOM 1362 O4' DT Z 224 25.000 -32.016 17.195 1.00 78.22 O ATOM 1363 C3' DT Z 224 24.317 -30.670 19.028 1.00 80.79 C ATOM 1364 O3' DT Z 224 22.920 -30.353 18.880 1.00 85.58 O ATOM 1365 C2' DT Z 224 24.602 -32.092 19.513 1.00 76.43 C ATOM 1366 C1' DT Z 224 24.533 -32.885 18.210 1.00 73.32 C ATOM 1367 N1 DT Z 224 25.327 -34.162 18.195 1.00 67.02 N ATOM 1368 C2 DT Z 224 24.818 -35.262 17.539 1.00 63.30 C ATOM 1369 O2 DT Z 224 23.758 -35.227 16.957 1.00 59.59 O ATOM 1370 N3 DT Z 224 25.612 -36.393 17.566 1.00 65.61 N ATOM 1371 C4 DT Z 224 26.844 -36.519 18.209 1.00 65.58 C ATOM 1372 O4 DT Z 224 27.513 -37.557 18.222 1.00 61.50 O ATOM 1373 C5 DT Z 224 27.304 -35.331 18.889 1.00 64.33 C ATOM 1374 C7 DT Z 224 28.617 -35.365 19.607 1.00 66.82 C ATOM 1375 C6 DT Z 224 26.547 -34.224 18.848 1.00 65.57 C ATOM 1376 P DG Z 225 21.912 -30.241 20.128 1.00 87.29 P ATOM 1377 OP1 DG Z 225 21.019 -29.090 19.854 1.00 86.26 O ATOM 1378 OP2 DG Z 225 22.664 -30.328 21.412 1.00 81.86 O ATOM 1379 O5' DG Z 225 21.046 -31.571 19.926 1.00 87.52 O ATOM 1380 C5' DG Z 225 20.265 -31.687 18.732 1.00 87.75 C ATOM 1381 C4' DG Z 225 19.542 -33.009 18.783 1.00 87.48 C ATOM 1382 O4' DG Z 225 20.551 -34.053 18.716 1.00 87.49 O ATOM 1383 C3' DG Z 225 18.845 -33.207 20.125 1.00 88.03 C ATOM 1384 O3' DG Z 225 17.672 -34.001 19.964 1.00 89.52 O ATOM 1385 C2' DG Z 225 19.918 -33.912 20.954 1.00 85.63 C ATOM 1386 C1' DG Z 225 20.454 -34.848 19.881 1.00 86.04 C ATOM 1387 N9 DG Z 225 21.726 -35.505 20.176 1.00 83.85 N ATOM 1388 C8 DG Z 225 22.783 -35.021 20.910 1.00 82.41 C ATOM 1389 N7 DG Z 225 23.777 -35.868 21.002 1.00 81.79 N ATOM 1390 C5 DG Z 225 23.351 -36.983 20.286 1.00 80.75 C ATOM 1391 C6 DG Z 225 23.999 -38.223 20.027 1.00 79.96 C ATOM 1392 O6 DG Z 225 25.121 -38.604 20.387 1.00 74.39 O ATOM 1393 N1 DG Z 225 23.206 -39.080 19.266 1.00 81.13 N ATOM 1394 C2 DG Z 225 21.946 -38.768 18.811 1.00 81.49 C ATOM 1395 N2 DG Z 225 21.327 -39.713 18.090 1.00 83.62 N ATOM 1396 N3 DG Z 225 21.330 -37.615 19.042 1.00 81.28 N ATOM 1397 C4 DG Z 225 22.089 -36.772 19.780 1.00 81.26 C ATOM 1398 P DG Z 226 16.523 -33.968 21.080 1.00 92.37 P ATOM 1399 OP1 DG Z 226 15.273 -33.500 20.436 1.00 93.63 O ATOM 1400 OP2 DG Z 226 17.044 -33.251 22.268 1.00 92.91 O ATOM 1401 O5' DG Z 226 16.353 -35.506 21.481 1.00 91.53 O ATOM 1402 C5' DG Z 226 17.202 -36.460 20.888 1.00 92.29 C ATOM 1403 C4' DG Z 226 16.424 -37.666 20.398 1.00 93.66 C ATOM 1404 O4' DG Z 226 17.395 -38.712 20.187 1.00 93.60 O ATOM 1405 C3' DG Z 226 15.502 -38.304 21.429 1.00 96.77 C ATOM 1406 O3' DG Z 226 14.808 -39.421 20.858 1.00 99.89 O ATOM 1407 C2' DG Z 226 16.547 -38.798 22.415 1.00 95.67 C ATOM 1408 C1' DG Z 226 17.586 -39.345 21.436 1.00 94.01 C ATOM 1409 N9 DG Z 226 18.943 -39.083 21.870 1.00 90.56 N ATOM 1410 C8 DG Z 226 19.451 -37.948 22.455 1.00 89.67 C ATOM 1411 N7 DG Z 226 20.722 -38.039 22.732 1.00 88.22 N ATOM 1412 C5 DG Z 226 21.052 -39.316 22.297 1.00 87.94 C ATOM 1413 C6 DG Z 226 22.285 -39.985 22.332 1.00 87.89 C ATOM 1414 O6 DG Z 226 23.346 -39.530 22.782 1.00 88.19 O ATOM 1415 N1 DG Z 226 22.191 -41.276 21.787 1.00 87.25 N ATOM 1416 C2 DG Z 226 21.041 -41.842 21.273 1.00 84.42 C ATOM 1417 N2 DG Z 226 21.120 -43.088 20.783 1.00 82.53 N ATOM 1418 N3 DG Z 226 19.878 -41.216 21.235 1.00 86.25 N ATOM 1419 C4 DG Z 226 19.971 -39.972 21.766 1.00 88.45 C TER 1420 DG Z 226 HETATM 1421 C10 PBO Y 200 22.283 -20.898 6.299 1.00 61.98 C HETATM 1422 C11 PBO Y 200 21.203 -19.953 5.753 1.00 65.21 C HETATM 1423 C12 PBO Y 200 19.751 -20.446 5.865 1.00 65.77 C HETATM 1424 C13 PBO Y 200 18.805 -19.276 6.098 1.00 65.67 C HETATM 1425 C14 PBO Y 200 17.792 -18.827 5.081 1.00 67.52 C HETATM 1426 C15 PBO Y 200 17.261 -19.711 4.138 1.00 68.70 C HETATM 1427 C16 PBO Y 200 16.322 -19.229 3.225 1.00 69.54 C HETATM 1428 C17 PBO Y 200 15.934 -17.888 3.280 1.00 68.24 C HETATM 1429 N1' PBO Y 200 16.460 -17.062 4.205 1.00 65.90 N HETATM 1430 C18 PBO Y 200 17.364 -17.494 5.093 1.00 64.49 C HETATM 1431 O13 PBO Y 200 18.848 -18.661 7.151 1.00 67.66 O HETATM 1432 O HOH X 301 43.447 -25.607 20.217 1.00 87.99 O HETATM 1433 O HOH X 302 17.851 -20.025 -13.925 1.00 82.88 O CONECT 1028 1421 CONECT 1421 1028 1422 CONECT 1422 1421 1423 CONECT 1423 1422 1424 CONECT 1424 1423 1425 1431 CONECT 1425 1424 1426 1430 CONECT 1426 1425 1427 CONECT 1427 1426 1428 CONECT 1428 1427 1429 CONECT 1429 1428 1430 CONECT 1430 1425 1429 CONECT 1431 1424 MASTER 479 0 1 6 2 0 2 6 1430 3 12 11 END
Display Options:
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 3gyh
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3gx4
RCSB PDB
PDBbind
13aa, >3GX4_3|Chain... *
4hdu
RCSB PDB
PDBbind
13aa, >4HDU_3|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
2c2e
RCSB PDB
PDBbind
13-mer
3a46
RCSB PDB
PDBbind
13-mer
3gx4
RCSB PDB
PDBbind
13-mer
3hjw
RCSB PDB
PDBbind
13-mer
3l2c
RCSB PDB
PDBbind
13-mer
3lzi
RCSB PDB
PDBbind
13-mer
3lzj
RCSB PDB
PDBbind
13-mer
3nae
RCSB PDB
PDBbind
13-mer
6b0o
RCSB PDB
PDBbind
13-mer
Entry Information
PDB ID
3gyh
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
Alkyltransferase-like protein 1
Ligand Name
13-mer
EC.Number
E.C.-.-.-.-
Resolution
2.8(Å)
Affinity (Kd/Ki/IC50)
Kd=0.016nM
Release Year
2009
Protein/NA Sequence
Check fasta file
Primary Reference
(2009) Nature Vol. 459: pp. 808-813
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):
Q9UTN9
Entrez Gene ID
NCBI Entrez Gene ID:
2541704
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝e湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com