Browse entries in the PDBbind-CN Database
HEADER DNA BINDING PROTEIN/DNA 08-SEP-09 3JRF TITLE CRYSTAL STRUCTURE OF FIS BOUND TO 27 BP DNA F27 CONTAINING A C/G AT TITLE 2 CENTER COMPND MOL_ID: 1; COMPND 2 MOLECULE: DNA-BINDING PROTEIN FIS; COMPND 3 CHAIN: A, B; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: DNA (27-MER); COMPND 7 CHAIN: C; COMPND 8 ENGINEERED: YES; COMPND 9 MOL_ID: 3; COMPND 10 MOLECULE: DNA (27-MER); COMPND 11 CHAIN: D; COMPND 12 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; SOURCE 3 ORGANISM_TAXID: 83333; SOURCE 4 STRAIN: K-12; SOURCE 5 GENE: FIS, B3261, JW3229; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PET11A; SOURCE 11 MOL_ID: 2; SOURCE 12 SYNTHETIC: YES; SOURCE 13 MOL_ID: 3; SOURCE 14 SYNTHETIC: YES KEYWDS HTH DOMAIN, PROTEIN-DNA COMPLEX, MINOR GROOVE COMPRESSION, DNA KEYWDS 2 BENDING, INDIRECT RECOGNITION, ACTIVATOR, DNA-BINDING, KEYWDS 3 TRANSCRIPTION, TRANSCRIPTION REGULATION, DNA BINDING PROTEIN-DNA KEYWDS 4 COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR S.STELLA,D.CASCIO,R.C.JOHNSON REVDAT 3 01-NOV-17 3JRF 1 REMARK REVDAT 2 13-JUL-11 3JRF 1 VERSN REVDAT 1 28-APR-10 3JRF 0 JRNL AUTH S.STELLA,D.CASCIO,R.C.JOHNSON JRNL TITL THE SHAPE OF THE DNA MINOR GROOVE DIRECTS BINDING BY THE JRNL TITL 2 DNA-BENDING PROTEIN FIS. JRNL REF GENES DEV. V. 24 814 2010 JRNL REFN ISSN 0890-9369 JRNL PMID 20395367 JRNL DOI 10.1101/GAD.1900610 REMARK 2 REMARK 2 RESOLUTION. 3.05 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) : 3.05 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 79.31 REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL REMARK 3 COMPLETENESS FOR RANGE (%) : 97.3 REMARK 3 NUMBER OF REFLECTIONS : 11995 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : NULL REMARK 3 FREE R VALUE TEST SET SELECTION : NULL REMARK 3 R VALUE (WORKING + TEST SET) : 0.223 REMARK 3 R VALUE (WORKING SET) : 0.221 REMARK 3 FREE R VALUE : 0.252 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.800 REMARK 3 FREE R VALUE TEST SET COUNT : 580 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : NULL REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 3.05 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 3.13 REMARK 3 REFLECTION IN BIN (WORKING SET) : 537 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 65.86 REMARK 3 BIN R VALUE (WORKING SET) : 0.3230 REMARK 3 BIN FREE R VALUE SET COUNT : 32 REMARK 3 BIN FREE R VALUE : 0.4420 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1505 REMARK 3 NUCLEIC ACID ATOMS : 1101 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 6 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) : 75.38 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): NULL REMARK 3 ESU BASED ON FREE R VALUE (A): NULL REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.271 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): NULL REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.927 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.909 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2752 ; 0.015 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): 1523 ; 0.001 ; 0.020 REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 3942 ; 1.896 ; 2.470 REMARK 3 BOND ANGLES OTHERS (DEGREES): 3785 ; 1.182 ; 3.000 REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 187 ; 5.977 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 75 ;40.111 ;25.600 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 303 ;20.705 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 11 ;17.862 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): NULL ; NULL ; NULL REMARK 3 GENERAL PLANES REFINED ATOMS (A): 2232 ; 0.006 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): 274 ; 0.001 ; 0.020 REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 573 ; 0.220 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): 1639 ; 0.216 ; 0.200 REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): 1188 ; 0.221 ; 0.200 REMARK 3 NON-BONDED TORSION OTHERS (A): 1163 ; 0.093 ; 0.200 REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 63 ; 0.170 ; 0.200 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): 18 ; 0.186 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): 34 ; 0.213 ; 0.200 REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 5 ; 0.120 ; 0.200 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): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B OTHER ATOMS (A**2): NULL ; NULL ; NULL 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 : 4 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 : A 8 A 98 REMARK 3 ORIGIN FOR THE GROUP (A): 12.7272 10.3186 8.9461 REMARK 3 T TENSOR REMARK 3 T11: -0.1045 T22: -0.0991 REMARK 3 T33: 0.0268 T12: 0.0456 REMARK 3 T13: 0.0039 T23: -0.0198 REMARK 3 L TENSOR REMARK 3 L11: 0.6758 L22: 1.9302 REMARK 3 L33: 1.6435 L12: -0.2089 REMARK 3 L13: 0.3521 L23: 0.4014 REMARK 3 S TENSOR REMARK 3 S11: -0.1022 S12: -0.0223 S13: 0.0361 REMARK 3 S21: 0.3170 S22: 0.2066 S23: 0.0121 REMARK 3 S31: 0.3214 S32: 0.0289 S33: -0.1045 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 : B 1 B 98 REMARK 3 ORIGIN FOR THE GROUP (A): 9.8199 10.7488 2.2014 REMARK 3 T TENSOR REMARK 3 T11: -0.2028 T22: -0.1196 REMARK 3 T33: 0.0244 T12: 0.0538 REMARK 3 T13: -0.0049 T23: -0.0396 REMARK 3 L TENSOR REMARK 3 L11: 1.9477 L22: 2.1042 REMARK 3 L33: 1.9012 L12: 0.7361 REMARK 3 L13: -0.0127 L23: -0.7277 REMARK 3 S TENSOR REMARK 3 S11: -0.1548 S12: -0.1733 S13: 0.0373 REMARK 3 S21: -0.0820 S22: 0.2201 S23: -0.0034 REMARK 3 S31: 0.3013 S32: 0.1566 S33: -0.0653 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 : C 1 C 27 REMARK 3 ORIGIN FOR THE GROUP (A): 11.5551 -10.5345 5.3651 REMARK 3 T TENSOR REMARK 3 T11: 0.1199 T22: -0.4338 REMARK 3 T33: 0.0188 T12: 0.0912 REMARK 3 T13: -0.1018 T23: -0.0051 REMARK 3 L TENSOR REMARK 3 L11: 1.3977 L22: 0.5518 REMARK 3 L33: 8.0284 L12: -0.0281 REMARK 3 L13: 2.2302 L23: 0.7718 REMARK 3 S TENSOR REMARK 3 S11: 0.4856 S12: 0.0831 S13: -0.6021 REMARK 3 S21: 0.1233 S22: 0.2889 S23: 0.0938 REMARK 3 S31: 1.1701 S32: 0.5122 S33: -0.7745 REMARK 3 REMARK 3 TLS GROUP : 4 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : D 1 D 27 REMARK 3 ORIGIN FOR THE GROUP (A): 10.5762 -10.4961 6.1044 REMARK 3 T TENSOR REMARK 3 T11: 0.1122 T22: -0.5211 REMARK 3 T33: -0.0060 T12: -0.0098 REMARK 3 T13: -0.1158 T23: -0.0211 REMARK 3 L TENSOR REMARK 3 L11: 1.6910 L22: 0.3361 REMARK 3 L33: 9.2278 L12: 0.2746 REMARK 3 L13: 2.5637 L23: 0.6797 REMARK 3 S TENSOR REMARK 3 S11: 0.4240 S12: -0.0310 S13: -0.5621 REMARK 3 S21: 0.1628 S22: 0.2566 S23: 0.0157 REMARK 3 S31: 1.0981 S32: -0.2263 S33: -0.6806 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : NULL REMARK 3 ION PROBE RADIUS : NULL REMARK 3 SHRINKAGE RADIUS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE RIDING REMARK 3 POSITIONS REMARK 4 REMARK 4 3JRF COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 22-SEP-09. REMARK 100 THE DEPOSITION ID IS D_1000055064. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : NULL REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 8.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 24-ID-C REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : NULL REMARK 200 WAVELENGTH OR RANGE (A) : 1.000 REMARK 200 MONOCHROMATOR : SI (111) REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 315 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 12039 REMARK 200 RESOLUTION RANGE HIGH (A) : 3.050 REMARK 200 RESOLUTION RANGE LOW (A) : 90.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.7 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) : 3.05 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 3.21 REMARK 200 COMPLETENESS FOR SHELL (%) : 99.9 REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : 0.59900 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: 3IV5 REMARK 200 SOFTWARE USED: PHASER REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 68.70 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.93 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.2 M SODIUM CITRATE, 0.1 M TRIS-HCL REMARK 280 PH 8.5, 36% PEG 400, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE REMARK 280 277K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X+1/2,-Y,Z+1/2 REMARK 290 3555 -X,Y+1/2,-Z+1/2 REMARK 290 4555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 21.54050 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 77.36300 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 46.08650 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 77.36300 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 21.54050 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 46.08650 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TETRAMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TETRAMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 8856 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 19308 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -62.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B, C, D REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 MET A 1 REMARK 465 PHE A 2 REMARK 465 GLU A 3 REMARK 465 GLN A 4 REMARK 465 ARG A 5 REMARK 465 VAL A 6 REMARK 465 ASN A 7 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 DC C 14 O3' DC C 14 C3' -0.039 REMARK 500 DT D 9 O3' DT D 9 C3' -0.038 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 DA C 1 O4' - C1' - N9 ANGL. DEV. = 5.3 DEGREES REMARK 500 DA C 2 O4' - C1' - N9 ANGL. DEV. = 3.0 DEGREES REMARK 500 DT C 4 O4' - C1' - N1 ANGL. DEV. = 2.3 DEGREES REMARK 500 DT C 8 O4' - C1' - N1 ANGL. DEV. = 4.2 DEGREES REMARK 500 DC C 14 O4' - C1' - C2' ANGL. DEV. = -5.0 DEGREES REMARK 500 DT C 15 N1 - C2 - N3 ANGL. DEV. = 4.5 DEGREES REMARK 500 DT C 17 N3 - C4 - O4 ANGL. DEV. = 4.1 DEGREES REMARK 500 DT C 17 C5 - C4 - O4 ANGL. DEV. = -5.5 DEGREES REMARK 500 DA C 19 O4' - C1' - N9 ANGL. DEV. = 4.9 DEGREES REMARK 500 DG C 20 O4' - C1' - N9 ANGL. DEV. = 3.1 DEGREES REMARK 500 DA C 24 O4' - C1' - N9 ANGL. DEV. = -5.7 DEGREES REMARK 500 DT C 26 O4' - C1' - N1 ANGL. DEV. = -6.6 DEGREES REMARK 500 DT C 26 C5 - C4 - O4 ANGL. DEV. = -5.3 DEGREES REMARK 500 DA D 2 C3' - O3' - P ANGL. DEV. = 7.3 DEGREES REMARK 500 DA D 3 O4' - C1' - N9 ANGL. DEV. = 2.6 DEGREES REMARK 500 DC D 8 O4' - C4' - C3' ANGL. DEV. = -5.4 DEGREES REMARK 500 DC D 8 O4' - C1' - N1 ANGL. DEV. = 4.5 DEGREES REMARK 500 DT D 9 O4' - C1' - C2' ANGL. DEV. = -5.2 DEGREES REMARK 500 DT D 9 O4' - C1' - N1 ANGL. DEV. = 2.1 DEGREES REMARK 500 DT D 9 C5 - C4 - O4 ANGL. DEV. = -4.4 DEGREES REMARK 500 DC D 10 C5' - C4' - O4' ANGL. DEV. = 6.7 DEGREES REMARK 500 DC D 10 O4' - C1' - N1 ANGL. DEV. = 3.4 DEGREES REMARK 500 DT D 15 O4' - C1' - N1 ANGL. DEV. = -7.4 DEGREES REMARK 500 DC D 17 O4' - C4' - C3' ANGL. DEV. = -3.5 DEGREES REMARK 500 DA D 20 O4' - C1' - N9 ANGL. DEV. = 9.0 DEGREES REMARK 500 DC D 21 O4' - C1' - C2' ANGL. DEV. = -4.8 DEGREES REMARK 500 DC D 21 O4' - C1' - N1 ANGL. DEV. = 8.6 DEGREES REMARK 500 DA D 24 O4' - C1' - N9 ANGL. DEV. = -6.6 DEGREES REMARK 500 DT D 25 O4' - C1' - N1 ANGL. DEV. = -6.1 DEGREES REMARK 500 DT D 25 C5 - C4 - O4 ANGL. DEV. = -5.1 DEGREES REMARK 500 DT D 26 O4' - C1' - N1 ANGL. DEV. = -5.5 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 THR A 23 137.03 -179.06 REMARK 500 VAL A 58 -47.63 -130.53 REMARK 500 ARG B 28 -54.83 -28.60 REMARK 500 ASN B 48 29.77 -149.72 REMARK 500 ASP B 49 51.44 -157.81 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 3IV5 RELATED DB: PDB REMARK 900 RELATED ID: 3JR9 RELATED DB: PDB REMARK 900 RELATED ID: 3JRA RELATED DB: PDB REMARK 900 RELATED ID: 3JRB RELATED DB: PDB REMARK 900 RELATED ID: 3JRC RELATED DB: PDB REMARK 900 RELATED ID: 3JRD RELATED DB: PDB REMARK 900 RELATED ID: 3JRE RELATED DB: PDB REMARK 900 RELATED ID: 3JRG RELATED DB: PDB REMARK 900 RELATED ID: 3JRH RELATED DB: PDB REMARK 900 RELATED ID: 3JRI RELATED DB: PDB DBREF 3JRF A 1 98 UNP P0A6R3 FIS_ECOLI 1 98 DBREF 3JRF B 1 98 UNP P0A6R3 FIS_ECOLI 1 98 DBREF 3JRF C 1 27 PDB 3JRF 3JRF 1 27 DBREF 3JRF D 1 27 PDB 3JRF 3JRF 1 27 SEQRES 1 A 98 MET PHE GLU GLN ARG VAL ASN SER ASP VAL LEU THR VAL SEQRES 2 A 98 SER THR VAL ASN SER GLN ASP GLN VAL THR GLN LYS PRO SEQRES 3 A 98 LEU ARG ASP SER VAL LYS GLN ALA LEU LYS ASN TYR PHE SEQRES 4 A 98 ALA GLN LEU ASN GLY GLN ASP VAL ASN ASP LEU TYR GLU SEQRES 5 A 98 LEU VAL LEU ALA GLU VAL GLU GLN PRO LEU LEU ASP MET SEQRES 6 A 98 VAL MET GLN TYR THR ARG GLY ASN GLN THR ARG ALA ALA SEQRES 7 A 98 LEU MET MET GLY ILE ASN ARG GLY THR LEU ARG LYS LYS SEQRES 8 A 98 LEU LYS LYS TYR GLY MET ASN SEQRES 1 B 98 MET PHE GLU GLN ARG VAL ASN SER ASP VAL LEU THR VAL SEQRES 2 B 98 SER THR VAL ASN SER GLN ASP GLN VAL THR GLN LYS PRO SEQRES 3 B 98 LEU ARG ASP SER VAL LYS GLN ALA LEU LYS ASN TYR PHE SEQRES 4 B 98 ALA GLN LEU ASN GLY GLN ASP VAL ASN ASP LEU TYR GLU SEQRES 5 B 98 LEU VAL LEU ALA GLU VAL GLU GLN PRO LEU LEU ASP MET SEQRES 6 B 98 VAL MET GLN TYR THR ARG GLY ASN GLN THR ARG ALA ALA SEQRES 7 B 98 LEU MET MET GLY ILE ASN ARG GLY THR LEU ARG LYS LYS SEQRES 8 B 98 LEU LYS LYS TYR GLY MET ASN SEQRES 1 C 27 DA DA DA DT DT DT DG DT DT DT DG DA DA SEQRES 2 C 27 DC DT DT DT DG DA DG DC DA DA DA DT DT SEQRES 3 C 27 DT SEQRES 1 D 27 DA DA DA DT DT DT DG DC DT DC DA DA DA SEQRES 2 D 27 DG DT DT DC DA DA DA DC DA DA DA DT DT SEQRES 3 D 27 DT FORMUL 5 HOH *6(H2 O) HELIX 1 1 LEU A 27 LEU A 42 1 16 HELIX 2 2 LEU A 50 THR A 70 1 21 HELIX 3 3 ASN A 73 GLY A 82 1 10 HELIX 4 4 ASN A 84 TYR A 95 1 12 HELIX 5 5 VAL B 6 VAL B 10 5 5 HELIX 6 6 LEU B 27 GLN B 41 1 15 HELIX 7 7 ASP B 49 THR B 70 1 22 HELIX 8 8 ASN B 73 GLY B 82 1 10 HELIX 9 9 ASN B 84 TYR B 95 1 12 SHEET 1 A 2 THR A 12 VAL A 16 0 SHEET 2 A 2 VAL A 22 PRO A 26 -1 O LYS A 25 N VAL A 13 SHEET 1 B 2 THR B 12 VAL B 16 0 SHEET 2 B 2 VAL B 22 PRO B 26 -1 O THR B 23 N THR B 15 CRYST1 43.081 92.173 154.726 90.00 90.00 90.00 P 21 21 21 8 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.023212 0.000000 0.000000 0.00000 SCALE2 0.000000 0.010849 0.000000 0.00000 SCALE3 0.000000 0.000000 0.006463 0.00000 ATOM 1 N SER A 8 -5.594 17.180 13.794 1.00 97.81 N ATOM 2 CA SER A 8 -5.947 15.832 13.240 1.00 99.07 C ATOM 3 C SER A 8 -4.773 15.103 12.563 1.00 99.72 C ATOM 4 O SER A 8 -4.838 13.890 12.380 1.00101.74 O ATOM 5 CB SER A 8 -7.115 15.932 12.244 1.00100.23 C ATOM 6 OG SER A 8 -8.374 15.900 12.897 1.00100.38 O ATOM 7 N ASP A 9 -3.725 15.825 12.160 1.00 99.32 N ATOM 8 CA ASP A 9 -2.505 15.181 11.635 1.00 95.61 C ATOM 9 C ASP A 9 -1.369 15.422 12.617 1.00 91.59 C ATOM 10 O ASP A 9 -1.018 16.575 12.885 1.00 90.80 O ATOM 11 CB ASP A 9 -2.109 15.711 10.243 1.00 98.61 C ATOM 12 CG ASP A 9 -0.959 14.906 9.624 1.00101.62 C ATOM 13 OD1 ASP A 9 0.043 15.513 9.165 1.00103.86 O ATOM 14 OD2 ASP A 9 -1.049 13.649 9.622 1.00103.85 O ATOM 15 N VAL A 10 -0.783 14.338 13.127 1.00 85.49 N ATOM 16 CA VAL A 10 0.197 14.438 14.215 1.00 82.48 C ATOM 17 C VAL A 10 1.622 14.833 13.798 1.00 80.05 C ATOM 18 O VAL A 10 2.315 15.509 14.552 1.00 81.85 O ATOM 19 CB VAL A 10 0.252 13.147 15.026 1.00 80.32 C ATOM 20 CG1 VAL A 10 -1.132 12.837 15.610 1.00 80.98 C ATOM 21 CG2 VAL A 10 0.766 11.999 14.175 1.00 80.53 C ATOM 22 N LEU A 11 2.065 14.431 12.610 1.00 77.50 N ATOM 23 CA LEU A 11 3.423 14.749 12.155 1.00 73.49 C ATOM 24 C LEU A 11 3.397 15.973 11.262 1.00 70.56 C ATOM 25 O LEU A 11 2.865 15.911 10.146 1.00 67.56 O ATOM 26 CB LEU A 11 3.995 13.572 11.394 1.00 72.13 C ATOM 27 CG LEU A 11 4.341 12.356 12.243 1.00 70.44 C ATOM 28 CD1 LEU A 11 4.363 11.066 11.426 1.00 70.74 C ATOM 29 CD2 LEU A 11 5.679 12.598 12.875 1.00 70.08 C ATOM 30 N THR A 12 3.958 17.078 11.766 1.00 67.72 N ATOM 31 CA THR A 12 3.859 18.387 11.108 1.00 65.54 C ATOM 32 C THR A 12 5.075 19.283 11.348 1.00 61.34 C ATOM 33 O THR A 12 5.855 19.050 12.223 1.00 62.58 O ATOM 34 CB THR A 12 2.597 19.171 11.564 1.00 67.19 C ATOM 35 OG1 THR A 12 2.925 20.038 12.664 1.00 67.64 O ATOM 36 CG2 THR A 12 1.446 18.216 11.951 1.00 67.94 C ATOM 37 N VAL A 13 5.215 20.329 10.557 1.00 60.34 N ATOM 38 CA VAL A 13 6.352 21.225 10.642 1.00 58.97 C ATOM 39 C VAL A 13 5.930 22.676 10.470 1.00 57.00 C ATOM 40 O VAL A 13 4.875 22.975 9.931 1.00 59.05 O ATOM 41 CB VAL A 13 7.419 20.867 9.568 1.00 58.34 C ATOM 42 CG1 VAL A 13 7.612 19.364 9.505 1.00 57.56 C ATOM 43 CG2 VAL A 13 7.058 21.433 8.205 1.00 56.49 C ATOM 44 N SER A 14 6.778 23.589 10.888 1.00 56.94 N ATOM 45 CA SER A 14 6.369 24.980 10.968 1.00 59.79 C ATOM 46 C SER A 14 6.757 25.724 9.717 1.00 58.73 C ATOM 47 O SER A 14 7.746 25.374 9.106 1.00 64.98 O ATOM 48 CB SER A 14 6.995 25.618 12.203 1.00 61.00 C ATOM 49 OG SER A 14 6.512 24.940 13.349 1.00 63.21 O ATOM 50 N THR A 15 5.986 26.740 9.345 1.00 54.98 N ATOM 51 CA THR A 15 6.229 27.488 8.140 1.00 57.72 C ATOM 52 C THR A 15 5.942 28.967 8.369 1.00 59.56 C ATOM 53 O THR A 15 5.096 29.311 9.191 1.00 60.67 O ATOM 54 CB THR A 15 5.286 27.026 7.025 1.00 59.60 C ATOM 55 OG1 THR A 15 3.955 27.475 7.320 1.00 64.45 O ATOM 56 CG2 THR A 15 5.260 25.523 6.888 1.00 58.44 C ATOM 57 N VAL A 16 6.604 29.836 7.609 1.00 60.92 N ATOM 58 CA VAL A 16 6.374 31.285 7.707 1.00 63.76 C ATOM 59 C VAL A 16 5.898 31.795 6.400 1.00 61.95 C ATOM 60 O VAL A 16 6.524 31.508 5.401 1.00 61.48 O ATOM 61 CB VAL A 16 7.664 32.101 7.973 1.00 66.82 C ATOM 62 CG1 VAL A 16 7.982 32.153 9.425 1.00 69.28 C ATOM 63 CG2 VAL A 16 8.841 31.521 7.198 1.00 69.80 C ATOM 64 N ASN A 17 4.825 32.572 6.402 1.00 62.31 N ATOM 65 CA ASN A 17 4.387 33.235 5.177 1.00 64.70 C ATOM 66 C ASN A 17 4.990 34.608 5.100 1.00 64.79 C ATOM 67 O ASN A 17 5.624 35.058 6.043 1.00 61.21 O ATOM 68 CB ASN A 17 2.860 33.299 5.049 1.00 64.61 C ATOM 69 CG ASN A 17 2.176 33.990 6.231 1.00 63.01 C ATOM 70 OD1 ASN A 17 2.676 34.948 6.804 1.00 59.13 O ATOM 71 ND2 ASN A 17 1.008 33.499 6.576 1.00 65.82 N ATOM 72 N SER A 18 4.795 35.254 3.955 1.00 68.42 N ATOM 73 CA SER A 18 5.321 36.590 3.718 1.00 69.77 C ATOM 74 C SER A 18 4.854 37.567 4.760 1.00 70.29 C ATOM 75 O SER A 18 5.606 38.437 5.126 1.00 72.21 O ATOM 76 CB SER A 18 4.918 37.114 2.334 1.00 72.21 C ATOM 77 OG SER A 18 3.516 37.369 2.236 1.00 75.01 O ATOM 78 N GLN A 19 3.617 37.430 5.232 1.00 75.03 N ATOM 79 CA GLN A 19 3.059 38.338 6.251 1.00 75.36 C ATOM 80 C GLN A 19 3.462 37.896 7.680 1.00 71.90 C ATOM 81 O GLN A 19 2.773 38.178 8.645 1.00 71.76 O ATOM 82 CB GLN A 19 1.523 38.460 6.106 1.00 77.41 C ATOM 83 CG GLN A 19 0.941 39.729 6.769 1.00 81.17 C ATOM 84 CD GLN A 19 -0.214 39.440 7.776 1.00 84.73 C ATOM 85 OE1 GLN A 19 -1.280 38.917 7.387 1.00 91.27 O ATOM 86 NE2 GLN A 19 -0.007 39.804 9.066 1.00 83.46 N ATOM 87 N ASP A 20 4.584 37.195 7.790 1.00 71.03 N ATOM 88 CA ASP A 20 5.211 36.797 9.080 1.00 71.13 C ATOM 89 C ASP A 20 4.367 35.956 10.066 1.00 66.90 C ATOM 90 O ASP A 20 4.561 36.031 11.261 1.00 66.11 O ATOM 91 CB ASP A 20 5.830 38.023 9.793 1.00 75.29 C ATOM 92 CG ASP A 20 7.301 38.304 9.370 1.00 79.75 C ATOM 93 OD1 ASP A 20 8.122 37.353 9.272 1.00 81.01 O ATOM 94 OD2 ASP A 20 7.639 39.501 9.156 1.00 84.23 O ATOM 95 N GLN A 21 3.487 35.109 9.562 1.00 62.34 N ATOM 96 CA GLN A 21 2.728 34.235 10.413 1.00 60.06 C ATOM 97 C GLN A 21 3.276 32.812 10.360 1.00 57.98 C ATOM 98 O GLN A 21 3.508 32.275 9.299 1.00 62.21 O ATOM 99 CB GLN A 21 1.290 34.262 9.956 1.00 59.51 C ATOM 100 CG GLN A 21 0.745 35.655 9.807 1.00 58.35 C ATOM 101 CD GLN A 21 -0.536 35.710 8.999 1.00 59.51 C ATOM 102 OE1 GLN A 21 -1.307 36.654 9.138 1.00 62.86 O ATOM 103 NE2 GLN A 21 -0.778 34.702 8.159 1.00 54.38 N ATOM 104 N VAL A 22 3.492 32.199 11.509 1.00 56.16 N ATOM 105 CA VAL A 22 3.825 30.784 11.549 1.00 55.43 C ATOM 106 C VAL A 22 2.563 29.937 11.470 1.00 53.92 C ATOM 107 O VAL A 22 1.464 30.411 11.726 1.00 49.07 O ATOM 108 CB VAL A 22 4.578 30.436 12.813 1.00 55.00 C ATOM 109 CG1 VAL A 22 4.770 28.913 12.947 1.00 51.94 C ATOM 110 CG2 VAL A 22 5.890 31.163 12.819 1.00 55.23 C ATOM 111 N THR A 23 2.733 28.672 11.110 1.00 54.95 N ATOM 112 CA THR A 23 1.609 27.852 10.697 1.00 56.73 C ATOM 113 C THR A 23 2.079 26.451 10.364 1.00 54.11 C ATOM 114 O THR A 23 3.095 26.305 9.722 1.00 54.60 O ATOM 115 CB THR A 23 0.943 28.467 9.435 1.00 59.51 C ATOM 116 OG1 THR A 23 0.115 27.480 8.813 1.00 62.14 O ATOM 117 CG2 THR A 23 2.013 29.037 8.393 1.00 57.09 C ATOM 118 N GLN A 24 1.361 25.417 10.787 1.00 55.03 N ATOM 119 CA GLN A 24 1.844 24.045 10.520 1.00 60.11 C ATOM 120 C GLN A 24 1.498 23.544 9.111 1.00 59.82 C ATOM 121 O GLN A 24 0.572 24.042 8.465 1.00 62.43 O ATOM 122 CB GLN A 24 1.327 23.001 11.555 1.00 62.13 C ATOM 123 CG GLN A 24 1.757 23.177 13.025 1.00 61.68 C ATOM 124 CD GLN A 24 3.179 23.614 13.180 1.00 62.94 C ATOM 125 OE1 GLN A 24 3.469 24.820 13.218 1.00 63.33 O ATOM 126 NE2 GLN A 24 4.094 22.644 13.234 1.00 65.04 N ATOM 127 N LYS A 25 2.248 22.547 8.656 1.00 57.63 N ATOM 128 CA LYS A 25 1.864 21.771 7.489 1.00 60.66 C ATOM 129 C LYS A 25 2.373 20.368 7.699 1.00 59.09 C ATOM 130 O LYS A 25 3.386 20.188 8.335 1.00 58.45 O ATOM 131 CB LYS A 25 2.471 22.341 6.205 1.00 63.73 C ATOM 132 CG LYS A 25 3.862 21.806 5.882 1.00 65.90 C ATOM 133 CD LYS A 25 4.464 22.386 4.627 1.00 64.82 C ATOM 134 CE LYS A 25 5.964 22.107 4.613 1.00 66.75 C ATOM 135 NZ LYS A 25 6.599 22.246 3.260 1.00 71.13 N ATOM 136 N PRO A 26 1.711 19.371 7.112 1.00 58.45 N ATOM 137 CA PRO A 26 2.145 17.999 7.311 1.00 58.84 C ATOM 138 C PRO A 26 3.526 17.798 6.774 1.00 57.96 C ATOM 139 O PRO A 26 3.896 18.460 5.843 1.00 58.49 O ATOM 140 CB PRO A 26 1.179 17.196 6.461 1.00 58.49 C ATOM 141 CG PRO A 26 0.005 18.079 6.310 1.00 60.27 C ATOM 142 CD PRO A 26 0.542 19.451 6.233 1.00 58.75 C ATOM 143 N LEU A 27 4.275 16.878 7.365 1.00 61.05 N ATOM 144 CA LEU A 27 5.607 16.503 6.874 1.00 61.72 C ATOM 145 C LEU A 27 5.501 15.878 5.470 1.00 65.51 C ATOM 146 O LEU A 27 6.359 16.118 4.627 1.00 73.91 O ATOM 147 CB LEU A 27 6.322 15.534 7.877 1.00 61.16 C ATOM 148 CG LEU A 27 7.733 14.953 7.602 1.00 56.34 C ATOM 149 CD1 LEU A 27 8.788 16.036 7.604 1.00 53.63 C ATOM 150 CD2 LEU A 27 8.063 13.859 8.593 1.00 51.30 C ATOM 151 N ARG A 28 4.458 15.103 5.199 1.00 62.68 N ATOM 152 CA ARG A 28 4.293 14.587 3.858 1.00 62.67 C ATOM 153 C ARG A 28 4.415 15.689 2.775 1.00 61.74 C ATOM 154 O ARG A 28 4.977 15.430 1.736 1.00 62.92 O ATOM 155 CB ARG A 28 3.010 13.749 3.751 1.00 63.57 C ATOM 156 CG ARG A 28 1.715 14.491 3.615 1.00 65.62 C ATOM 157 CD ARG A 28 0.533 13.502 3.678 1.00 68.91 C ATOM 158 NE ARG A 28 -0.110 13.565 4.989 1.00 72.44 N ATOM 159 CZ ARG A 28 -1.073 14.429 5.333 1.00 72.91 C ATOM 160 NH1 ARG A 28 -1.575 15.309 4.470 1.00 72.38 N ATOM 161 NH2 ARG A 28 -1.556 14.404 6.563 1.00 74.03 N ATOM 162 N ASP A 29 3.959 16.918 3.042 1.00 63.30 N ATOM 163 CA ASP A 29 4.133 18.057 2.110 1.00 63.66 C ATOM 164 C ASP A 29 5.596 18.421 1.890 1.00 62.12 C ATOM 165 O ASP A 29 5.977 18.813 0.788 1.00 65.06 O ATOM 166 CB ASP A 29 3.344 19.307 2.554 1.00 68.52 C ATOM 167 CG ASP A 29 1.800 19.215 2.225 1.00 77.61 C ATOM 168 OD1 ASP A 29 1.120 20.287 2.088 1.00 81.64 O ATOM 169 OD2 ASP A 29 1.245 18.079 2.108 1.00 81.75 O ATOM 170 N SER A 30 6.415 18.309 2.924 1.00 59.89 N ATOM 171 CA SER A 30 7.878 18.462 2.769 1.00 62.03 C ATOM 172 C SER A 30 8.513 17.382 1.888 1.00 58.10 C ATOM 173 O SER A 30 9.340 17.658 1.029 1.00 55.89 O ATOM 174 CB SER A 30 8.581 18.414 4.135 1.00 62.94 C ATOM 175 OG SER A 30 8.535 19.670 4.752 1.00 65.66 O ATOM 176 N VAL A 31 8.137 16.143 2.140 1.00 54.57 N ATOM 177 CA VAL A 31 8.753 15.048 1.481 1.00 55.99 C ATOM 178 C VAL A 31 8.472 15.222 0.005 1.00 60.42 C ATOM 179 O VAL A 31 9.386 15.066 -0.817 1.00 62.65 O ATOM 180 CB VAL A 31 8.257 13.733 2.054 1.00 54.43 C ATOM 181 CG1 VAL A 31 8.923 12.521 1.406 1.00 51.26 C ATOM 182 CG2 VAL A 31 8.547 13.723 3.541 1.00 55.40 C ATOM 183 N LYS A 32 7.243 15.609 -0.344 1.00 62.73 N ATOM 184 CA LYS A 32 6.934 15.886 -1.747 1.00 63.40 C ATOM 185 C LYS A 32 7.942 16.892 -2.252 1.00 64.03 C ATOM 186 O LYS A 32 8.701 16.598 -3.166 1.00 68.57 O ATOM 187 CB LYS A 32 5.519 16.412 -1.961 1.00 65.55 C ATOM 188 CG LYS A 32 4.485 15.367 -2.392 1.00 69.14 C ATOM 189 CD LYS A 32 3.111 16.022 -2.925 1.00 71.89 C ATOM 190 CE LYS A 32 2.130 14.972 -3.632 1.00 73.96 C ATOM 191 NZ LYS A 32 0.670 15.364 -3.769 1.00 73.54 N ATOM 192 N GLN A 33 7.995 18.055 -1.624 1.00 62.84 N ATOM 193 CA GLN A 33 8.794 19.143 -2.151 1.00 64.71 C ATOM 194 C GLN A 33 10.183 18.663 -2.477 1.00 64.00 C ATOM 195 O GLN A 33 10.708 18.914 -3.548 1.00 65.75 O ATOM 196 CB GLN A 33 8.876 20.246 -1.135 1.00 66.75 C ATOM 197 CG GLN A 33 9.350 21.550 -1.701 1.00 72.50 C ATOM 198 CD GLN A 33 9.500 22.617 -0.617 1.00 77.71 C ATOM 199 OE1 GLN A 33 10.160 23.647 -0.820 1.00 82.07 O ATOM 200 NE2 GLN A 33 8.892 22.363 0.562 1.00 85.69 N ATOM 201 N ALA A 34 10.763 17.939 -1.532 1.00 64.66 N ATOM 202 CA ALA A 34 12.084 17.359 -1.681 1.00 61.86 C ATOM 203 C ALA A 34 12.153 16.547 -2.956 1.00 61.02 C ATOM 204 O ALA A 34 12.938 16.836 -3.820 1.00 66.66 O ATOM 205 CB ALA A 34 12.384 16.489 -0.497 1.00 60.29 C ATOM 206 N LEU A 35 11.311 15.542 -3.072 1.00 58.45 N ATOM 207 CA LEU A 35 11.255 14.745 -4.262 1.00 59.53 C ATOM 208 C LEU A 35 10.947 15.588 -5.511 1.00 60.21 C ATOM 209 O LEU A 35 11.497 15.370 -6.598 1.00 59.35 O ATOM 210 CB LEU A 35 10.191 13.651 -4.084 1.00 57.24 C ATOM 211 CG LEU A 35 10.584 12.531 -3.122 1.00 54.76 C ATOM 212 CD1 LEU A 35 9.402 11.623 -2.830 1.00 56.42 C ATOM 213 CD2 LEU A 35 11.710 11.733 -3.680 1.00 48.77 C ATOM 214 N LYS A 36 10.060 16.552 -5.371 1.00 62.59 N ATOM 215 CA LYS A 36 9.713 17.362 -6.509 1.00 65.58 C ATOM 216 C LYS A 36 10.991 18.019 -6.977 1.00 63.33 C ATOM 217 O LYS A 36 11.303 18.139 -8.159 1.00 62.99 O ATOM 218 CB LYS A 36 8.705 18.413 -6.110 1.00 68.40 C ATOM 219 CG LYS A 36 7.927 18.926 -7.303 1.00 75.80 C ATOM 220 CD LYS A 36 6.604 19.625 -6.924 1.00 77.90 C ATOM 221 CE LYS A 36 5.520 18.613 -6.443 1.00 82.32 C ATOM 222 NZ LYS A 36 4.592 19.228 -5.413 1.00 82.12 N ATOM 223 N ASN A 37 11.764 18.416 -6.006 1.00 61.43 N ATOM 224 CA ASN A 37 12.968 19.079 -6.296 1.00 62.71 C ATOM 225 C ASN A 37 14.054 18.150 -6.785 1.00 60.66 C ATOM 226 O ASN A 37 14.880 18.541 -7.569 1.00 63.34 O ATOM 227 CB ASN A 37 13.452 19.783 -5.047 1.00 67.11 C ATOM 228 CG ASN A 37 14.531 20.735 -5.352 1.00 70.46 C ATOM 229 OD1 ASN A 37 14.331 21.651 -6.159 1.00 74.27 O ATOM 230 ND2 ASN A 37 15.710 20.514 -4.775 1.00 69.07 N ATOM 231 N TYR A 38 14.097 16.935 -6.278 1.00 60.64 N ATOM 232 CA TYR A 38 15.137 15.971 -6.663 1.00 60.31 C ATOM 233 C TYR A 38 14.970 15.699 -8.139 1.00 62.54 C ATOM 234 O TYR A 38 15.942 15.774 -8.908 1.00 61.84 O ATOM 235 CB TYR A 38 14.970 14.680 -5.850 1.00 57.44 C ATOM 236 CG TYR A 38 15.949 13.560 -6.107 1.00 57.42 C ATOM 237 CD1 TYR A 38 17.324 13.785 -6.208 1.00 59.17 C ATOM 238 CD2 TYR A 38 15.505 12.253 -6.200 1.00 56.50 C ATOM 239 CE1 TYR A 38 18.233 12.704 -6.429 1.00 57.15 C ATOM 240 CE2 TYR A 38 16.383 11.189 -6.409 1.00 55.94 C ATOM 241 CZ TYR A 38 17.736 11.412 -6.519 1.00 56.72 C ATOM 242 OH TYR A 38 18.561 10.323 -6.754 1.00 58.35 O ATOM 243 N PHE A 39 13.717 15.434 -8.524 1.00 61.97 N ATOM 244 CA PHE A 39 13.391 15.074 -9.876 1.00 61.21 C ATOM 245 C PHE A 39 13.593 16.215 -10.804 1.00 63.37 C ATOM 246 O PHE A 39 14.063 16.020 -11.910 1.00 64.88 O ATOM 247 CB PHE A 39 11.958 14.660 -9.965 1.00 62.35 C ATOM 248 CG PHE A 39 11.660 13.368 -9.284 1.00 64.06 C ATOM 249 CD1 PHE A 39 10.446 13.176 -8.655 1.00 64.14 C ATOM 250 CD2 PHE A 39 12.578 12.335 -9.275 1.00 64.42 C ATOM 251 CE1 PHE A 39 10.153 11.988 -8.052 1.00 64.25 C ATOM 252 CE2 PHE A 39 12.287 11.149 -8.665 1.00 64.39 C ATOM 253 CZ PHE A 39 11.077 10.975 -8.055 1.00 64.60 C ATOM 254 N ALA A 40 13.223 17.411 -10.363 1.00 67.46 N ATOM 255 CA ALA A 40 13.467 18.631 -11.144 1.00 68.57 C ATOM 256 C ALA A 40 14.919 18.735 -11.608 1.00 69.17 C ATOM 257 O ALA A 40 15.178 19.046 -12.761 1.00 65.12 O ATOM 258 CB ALA A 40 13.080 19.868 -10.336 1.00 67.06 C ATOM 259 N GLN A 41 15.856 18.438 -10.712 1.00 75.55 N ATOM 260 CA GLN A 41 17.287 18.684 -10.963 1.00 81.34 C ATOM 261 C GLN A 41 18.015 17.526 -11.647 1.00 83.03 C ATOM 262 O GLN A 41 19.115 17.725 -12.163 1.00 86.14 O ATOM 263 CB GLN A 41 18.026 19.041 -9.674 1.00 84.73 C ATOM 264 CG GLN A 41 17.793 20.454 -9.152 1.00 88.13 C ATOM 265 CD GLN A 41 18.348 20.603 -7.720 1.00 91.85 C ATOM 266 OE1 GLN A 41 17.612 20.956 -6.780 1.00 97.17 O ATOM 267 NE2 GLN A 41 19.645 20.299 -7.547 1.00 94.01 N ATOM 268 N LEU A 42 17.437 16.325 -11.632 1.00 82.12 N ATOM 269 CA LEU A 42 17.850 15.290 -12.578 1.00 80.82 C ATOM 270 C LEU A 42 17.355 15.710 -13.951 1.00 81.99 C ATOM 271 O LEU A 42 16.346 16.419 -14.079 1.00 82.33 O ATOM 272 CB LEU A 42 17.192 13.950 -12.271 1.00 80.15 C ATOM 273 CG LEU A 42 17.496 13.166 -11.001 1.00 80.52 C ATOM 274 CD1 LEU A 42 16.782 11.806 -11.115 1.00 78.49 C ATOM 275 CD2 LEU A 42 19.014 13.008 -10.747 1.00 80.91 C ATOM 276 N ASN A 43 18.042 15.266 -14.988 1.00 81.78 N ATOM 277 CA ASN A 43 17.493 15.395 -16.326 1.00 81.94 C ATOM 278 C ASN A 43 17.613 14.083 -17.063 1.00 80.56 C ATOM 279 O ASN A 43 18.483 13.877 -17.917 1.00 81.06 O ATOM 280 CB ASN A 43 18.135 16.561 -17.064 1.00 84.17 C ATOM 281 CG ASN A 43 17.455 17.874 -16.741 1.00 86.44 C ATOM 282 OD1 ASN A 43 17.019 18.582 -17.644 1.00 87.74 O ATOM 283 ND2 ASN A 43 17.319 18.189 -15.445 1.00 86.38 N ATOM 284 N GLY A 44 16.720 13.181 -16.684 1.00 78.97 N ATOM 285 CA GLY A 44 16.672 11.844 -17.245 1.00 78.22 C ATOM 286 C GLY A 44 17.917 11.068 -16.922 1.00 77.82 C ATOM 287 O GLY A 44 18.291 10.160 -17.670 1.00 82.21 O ATOM 288 N GLN A 45 18.577 11.432 -15.826 1.00 73.84 N ATOM 289 CA GLN A 45 19.687 10.641 -15.343 1.00 75.30 C ATOM 290 C GLN A 45 19.040 9.521 -14.582 1.00 76.36 C ATOM 291 O GLN A 45 18.141 9.774 -13.785 1.00 76.19 O ATOM 292 CB GLN A 45 20.578 11.445 -14.423 1.00 74.16 C ATOM 293 CG GLN A 45 21.062 12.710 -15.024 1.00 71.97 C ATOM 294 CD GLN A 45 22.119 13.306 -14.189 1.00 71.88 C ATOM 295 OE1 GLN A 45 22.079 14.488 -13.889 1.00 74.42 O ATOM 296 NE2 GLN A 45 23.072 12.492 -13.774 1.00 67.63 N ATOM 297 N ASP A 46 19.447 8.282 -14.821 1.00 78.14 N ATOM 298 CA ASP A 46 18.666 7.194 -14.253 1.00 80.44 C ATOM 299 C ASP A 46 18.734 7.296 -12.722 1.00 78.09 C ATOM 300 O ASP A 46 19.757 7.732 -12.176 1.00 77.60 O ATOM 301 CB ASP A 46 19.043 5.795 -14.837 1.00 85.26 C ATOM 302 CG ASP A 46 20.470 5.319 -14.470 1.00 88.59 C ATOM 303 OD1 ASP A 46 21.399 6.167 -14.377 1.00 94.47 O ATOM 304 OD2 ASP A 46 20.651 4.084 -14.302 1.00 84.16 O ATOM 305 N VAL A 47 17.615 6.986 -12.061 1.00 74.68 N ATOM 306 CA VAL A 47 17.574 6.857 -10.617 1.00 77.81 C ATOM 307 C VAL A 47 17.403 5.400 -10.265 1.00 77.12 C ATOM 308 O VAL A 47 16.567 4.752 -10.819 1.00 78.35 O ATOM 309 CB VAL A 47 16.409 7.602 -10.017 1.00 78.96 C ATOM 310 CG1 VAL A 47 16.553 7.615 -8.473 1.00 81.24 C ATOM 311 CG2 VAL A 47 16.348 9.000 -10.589 1.00 79.03 C ATOM 312 N ASN A 48 18.167 4.877 -9.325 1.00 81.73 N ATOM 313 CA ASN A 48 18.201 3.432 -9.149 1.00 82.53 C ATOM 314 C ASN A 48 17.650 2.916 -7.793 1.00 84.17 C ATOM 315 O ASN A 48 16.890 1.930 -7.771 1.00 85.54 O ATOM 316 CB ASN A 48 19.632 2.923 -9.414 1.00 86.23 C ATOM 317 CG ASN A 48 19.698 1.398 -9.673 1.00 87.65 C ATOM 318 OD1 ASN A 48 20.756 0.774 -9.503 1.00 89.60 O ATOM 319 ND2 ASN A 48 18.572 0.802 -10.078 1.00 89.89 N ATOM 320 N ASP A 49 18.004 3.560 -6.674 1.00 81.14 N ATOM 321 CA ASP A 49 17.606 3.033 -5.357 1.00 78.11 C ATOM 322 C ASP A 49 16.965 4.057 -4.406 1.00 74.46 C ATOM 323 O ASP A 49 17.510 4.399 -3.351 1.00 72.28 O ATOM 324 CB ASP A 49 18.802 2.341 -4.717 1.00 82.88 C ATOM 325 CG ASP A 49 19.311 1.185 -5.558 1.00 87.21 C ATOM 326 OD1 ASP A 49 20.519 1.192 -5.902 1.00 92.15 O ATOM 327 OD2 ASP A 49 18.496 0.288 -5.897 1.00 89.50 O ATOM 328 N LEU A 50 15.761 4.489 -4.775 1.00 70.00 N ATOM 329 CA LEU A 50 15.126 5.642 -4.173 1.00 67.26 C ATOM 330 C LEU A 50 14.393 5.283 -2.907 1.00 67.94 C ATOM 331 O LEU A 50 14.226 6.148 -2.028 1.00 69.19 O ATOM 332 CB LEU A 50 14.160 6.281 -5.159 1.00 64.03 C ATOM 333 CG LEU A 50 13.614 7.652 -4.784 1.00 63.42 C ATOM 334 CD1 LEU A 50 14.720 8.604 -4.455 1.00 59.64 C ATOM 335 CD2 LEU A 50 12.772 8.202 -5.911 1.00 64.17 C ATOM 336 N TYR A 51 13.948 4.027 -2.791 1.00 67.22 N ATOM 337 CA TYR A 51 13.261 3.616 -1.573 1.00 67.18 C ATOM 338 C TYR A 51 14.232 3.516 -0.422 1.00 69.22 C ATOM 339 O TYR A 51 13.917 3.949 0.677 1.00 69.76 O ATOM 340 CB TYR A 51 12.522 2.306 -1.716 1.00 66.77 C ATOM 341 CG TYR A 51 11.774 1.978 -0.459 1.00 67.07 C ATOM 342 CD1 TYR A 51 10.527 2.529 -0.204 1.00 68.24 C ATOM 343 CD2 TYR A 51 12.337 1.157 0.508 1.00 68.57 C ATOM 344 CE1 TYR A 51 9.839 2.247 0.978 1.00 67.55 C ATOM 345 CE2 TYR A 51 11.664 0.861 1.689 1.00 68.89 C ATOM 346 CZ TYR A 51 10.415 1.411 1.920 1.00 68.52 C ATOM 347 OH TYR A 51 9.749 1.108 3.088 1.00 67.52 O ATOM 348 N GLU A 52 15.419 2.964 -0.667 1.00 71.73 N ATOM 349 CA GLU A 52 16.389 2.808 0.412 1.00 71.48 C ATOM 350 C GLU A 52 17.073 4.138 0.684 1.00 71.09 C ATOM 351 O GLU A 52 17.786 4.260 1.671 1.00 75.09 O ATOM 352 CB GLU A 52 17.381 1.653 0.157 1.00 74.61 C ATOM 353 CG GLU A 52 17.110 0.315 0.982 1.00 79.57 C ATOM 354 CD GLU A 52 15.711 -0.430 0.749 1.00 83.68 C ATOM 355 OE1 GLU A 52 15.389 -0.911 -0.384 1.00 84.57 O ATOM 356 OE2 GLU A 52 14.948 -0.591 1.740 1.00 82.91 O ATOM 357 N LEU A 53 16.809 5.148 -0.143 1.00 68.46 N ATOM 358 CA LEU A 53 17.387 6.489 0.049 1.00 67.92 C ATOM 359 C LEU A 53 16.568 7.313 0.983 1.00 67.76 C ATOM 360 O LEU A 53 17.087 7.937 1.888 1.00 71.08 O ATOM 361 CB LEU A 53 17.441 7.259 -1.260 1.00 67.12 C ATOM 362 CG LEU A 53 18.311 8.513 -1.269 1.00 66.70 C ATOM 363 CD1 LEU A 53 19.636 8.191 -1.960 1.00 68.02 C ATOM 364 CD2 LEU A 53 17.641 9.655 -1.985 1.00 65.75 C ATOM 365 N VAL A 54 15.275 7.368 0.724 1.00 68.19 N ATOM 366 CA VAL A 54 14.416 8.185 1.541 1.00 65.98 C ATOM 367 C VAL A 54 14.357 7.526 2.885 1.00 63.91 C ATOM 368 O VAL A 54 14.545 8.183 3.878 1.00 66.45 O ATOM 369 CB VAL A 54 13.023 8.319 0.948 1.00 66.67 C ATOM 370 CG1 VAL A 54 12.105 8.990 1.927 1.00 67.68 C ATOM 371 CG2 VAL A 54 13.087 9.116 -0.312 1.00 66.86 C ATOM 372 N LEU A 55 14.137 6.220 2.910 1.00 62.30 N ATOM 373 CA LEU A 55 14.185 5.474 4.149 1.00 63.63 C ATOM 374 C LEU A 55 15.410 5.871 4.962 1.00 67.03 C ATOM 375 O LEU A 55 15.261 6.196 6.129 1.00 72.04 O ATOM 376 CB LEU A 55 14.234 3.970 3.874 1.00 65.84 C ATOM 377 CG LEU A 55 13.757 2.998 4.953 1.00 64.31 C ATOM 378 CD1 LEU A 55 12.281 3.279 5.220 1.00 65.20 C ATOM 379 CD2 LEU A 55 13.977 1.542 4.528 1.00 61.39 C ATOM 380 N ALA A 56 16.610 5.865 4.364 1.00 66.46 N ATOM 381 CA ALA A 56 17.836 6.269 5.089 1.00 64.80 C ATOM 382 C ALA A 56 17.734 7.674 5.588 1.00 64.51 C ATOM 383 O ALA A 56 18.314 8.002 6.580 1.00 70.47 O ATOM 384 CB ALA A 56 19.080 6.152 4.230 1.00 62.75 C ATOM 385 N GLU A 57 17.013 8.525 4.901 1.00 67.66 N ATOM 386 CA GLU A 57 16.922 9.913 5.312 1.00 68.70 C ATOM 387 C GLU A 57 15.797 10.119 6.307 1.00 66.50 C ATOM 388 O GLU A 57 15.445 11.233 6.615 1.00 67.47 O ATOM 389 CB GLU A 57 16.658 10.781 4.074 1.00 75.28 C ATOM 390 CG GLU A 57 17.137 12.229 4.190 1.00 78.61 C ATOM 391 CD GLU A 57 18.623 12.443 3.829 1.00 84.44 C ATOM 392 OE1 GLU A 57 19.383 11.449 3.661 1.00 84.45 O ATOM 393 OE2 GLU A 57 19.019 13.638 3.716 1.00 89.52 O ATOM 394 N VAL A 58 15.187 9.051 6.783 1.00 66.12 N ATOM 395 CA VAL A 58 14.033 9.184 7.675 1.00 66.13 C ATOM 396 C VAL A 58 14.247 8.299 8.899 1.00 65.04 C ATOM 397 O VAL A 58 14.114 8.768 10.020 1.00 66.50 O ATOM 398 CB VAL A 58 12.699 8.943 6.916 1.00 65.08 C ATOM 399 CG1 VAL A 58 11.553 8.707 7.855 1.00 63.57 C ATOM 400 CG2 VAL A 58 12.409 10.161 6.056 1.00 65.59 C ATOM 401 N GLU A 59 14.639 7.051 8.706 1.00 63.59 N ATOM 402 CA GLU A 59 15.131 6.267 9.828 1.00 66.42 C ATOM 403 C GLU A 59 16.148 7.038 10.687 1.00 66.91 C ATOM 404 O GLU A 59 15.981 7.126 11.897 1.00 71.23 O ATOM 405 CB GLU A 59 15.744 4.934 9.367 1.00 66.88 C ATOM 406 CG GLU A 59 14.719 3.863 9.064 1.00 68.30 C ATOM 407 CD GLU A 59 15.337 2.509 8.767 1.00 70.60 C ATOM 408 OE1 GLU A 59 16.592 2.372 8.742 1.00 72.60 O ATOM 409 OE2 GLU A 59 14.552 1.565 8.551 1.00 72.99 O ATOM 410 N GLN A 60 17.188 7.598 10.081 1.00 65.66 N ATOM 411 CA GLN A 60 18.286 8.156 10.865 1.00 66.53 C ATOM 412 C GLN A 60 17.786 9.141 11.937 1.00 66.72 C ATOM 413 O GLN A 60 17.931 8.873 13.121 1.00 71.88 O ATOM 414 CB GLN A 60 19.402 8.749 9.974 1.00 68.37 C ATOM 415 CG GLN A 60 20.359 7.662 9.427 1.00 69.38 C ATOM 416 CD GLN A 60 21.429 8.183 8.461 1.00 70.06 C ATOM 417 OE1 GLN A 60 21.104 8.684 7.388 1.00 71.56 O ATOM 418 NE2 GLN A 60 22.709 8.026 8.823 1.00 69.31 N ATOM 419 N PRO A 61 17.146 10.246 11.548 1.00 62.92 N ATOM 420 CA PRO A 61 16.732 11.174 12.586 1.00 62.52 C ATOM 421 C PRO A 61 15.550 10.696 13.434 1.00 60.86 C ATOM 422 O PRO A 61 15.222 11.322 14.435 1.00 58.59 O ATOM 423 CB PRO A 61 16.352 12.423 11.801 1.00 63.41 C ATOM 424 CG PRO A 61 15.862 11.902 10.516 1.00 63.55 C ATOM 425 CD PRO A 61 16.754 10.719 10.218 1.00 64.24 C ATOM 426 N LEU A 62 14.893 9.617 13.040 1.00 61.46 N ATOM 427 CA LEU A 62 13.880 9.032 13.914 1.00 61.86 C ATOM 428 C LEU A 62 14.577 8.259 15.008 1.00 60.33 C ATOM 429 O LEU A 62 14.120 8.253 16.131 1.00 65.05 O ATOM 430 CB LEU A 62 12.919 8.100 13.173 1.00 60.20 C ATOM 431 CG LEU A 62 12.043 7.316 14.136 1.00 59.03 C ATOM 432 CD1 LEU A 62 11.251 8.288 14.962 1.00 56.49 C ATOM 433 CD2 LEU A 62 11.171 6.411 13.349 1.00 60.26 C ATOM 434 N LEU A 63 15.662 7.586 14.688 1.00 56.00 N ATOM 435 CA LEU A 63 16.356 6.863 15.707 1.00 60.58 C ATOM 436 C LEU A 63 17.023 7.909 16.572 1.00 62.14 C ATOM 437 O LEU A 63 16.909 7.889 17.777 1.00 63.24 O ATOM 438 CB LEU A 63 17.392 5.914 15.097 1.00 60.10 C ATOM 439 CG LEU A 63 16.945 4.736 14.218 1.00 56.95 C ATOM 440 CD1 LEU A 63 18.114 4.368 13.292 1.00 52.21 C ATOM 441 CD2 LEU A 63 16.452 3.550 15.068 1.00 52.53 C ATOM 442 N ASP A 64 17.704 8.839 15.924 1.00 69.85 N ATOM 443 CA ASP A 64 18.366 9.972 16.577 1.00 69.90 C ATOM 444 C ASP A 64 17.485 10.617 17.650 1.00 67.40 C ATOM 445 O ASP A 64 17.940 10.886 18.725 1.00 67.70 O ATOM 446 CB ASP A 64 18.726 11.010 15.501 1.00 76.98 C ATOM 447 CG ASP A 64 19.827 11.973 15.919 1.00 81.87 C ATOM 448 OD1 ASP A 64 19.776 13.161 15.458 1.00 86.22 O ATOM 449 OD2 ASP A 64 20.750 11.541 16.670 1.00 89.70 O ATOM 450 N MET A 65 16.219 10.842 17.357 1.00 67.41 N ATOM 451 CA MET A 65 15.328 11.490 18.304 1.00 69.88 C ATOM 452 C MET A 65 14.705 10.579 19.335 1.00 70.36 C ATOM 453 O MET A 65 14.400 11.051 20.419 1.00 72.54 O ATOM 454 CB MET A 65 14.173 12.172 17.589 1.00 72.83 C ATOM 455 CG MET A 65 14.575 13.351 16.752 1.00 77.02 C ATOM 456 SD MET A 65 15.106 14.809 17.680 1.00 80.50 S ATOM 457 CE MET A 65 13.558 15.598 18.126 1.00 81.73 C ATOM 458 N VAL A 66 14.440 9.312 19.021 1.00 69.62 N ATOM 459 CA VAL A 66 13.750 8.482 20.012 1.00 69.50 C ATOM 460 C VAL A 66 14.703 7.993 21.085 1.00 70.57 C ATOM 461 O VAL A 66 14.266 7.705 22.192 1.00 74.71 O ATOM 462 CB VAL A 66 12.964 7.262 19.458 1.00 66.10 C ATOM 463 CG1 VAL A 66 12.377 7.562 18.102 1.00 65.29 C ATOM 464 CG2 VAL A 66 13.823 6.009 19.485 1.00 60.68 C ATOM 465 N MET A 67 15.987 7.897 20.771 1.00 70.96 N ATOM 466 CA MET A 67 16.967 7.509 21.768 1.00 71.03 C ATOM 467 C MET A 67 17.197 8.684 22.678 1.00 73.27 C ATOM 468 O MET A 67 17.111 8.541 23.886 1.00 78.52 O ATOM 469 CB MET A 67 18.265 7.087 21.123 1.00 71.76 C ATOM 470 CG MET A 67 18.129 5.826 20.282 1.00 72.77 C ATOM 471 SD MET A 67 17.716 4.388 21.275 1.00 73.68 S ATOM 472 CE MET A 67 19.350 3.718 21.655 1.00 71.05 C ATOM 473 N GLN A 68 17.464 9.852 22.104 1.00 73.27 N ATOM 474 CA GLN A 68 17.487 11.115 22.865 1.00 72.27 C ATOM 475 C GLN A 68 16.297 11.250 23.809 1.00 70.31 C ATOM 476 O GLN A 68 16.447 11.684 24.933 1.00 74.15 O ATOM 477 CB GLN A 68 17.454 12.296 21.905 1.00 74.64 C ATOM 478 CG GLN A 68 18.160 13.531 22.369 1.00 77.09 C ATOM 479 CD GLN A 68 18.899 14.198 21.222 1.00 78.51 C ATOM 480 OE1 GLN A 68 19.842 13.621 20.647 1.00 80.90 O ATOM 481 NE2 GLN A 68 18.467 15.410 20.867 1.00 79.27 N ATOM 482 N TYR A 69 15.111 10.891 23.345 1.00 68.27 N ATOM 483 CA TYR A 69 13.924 10.938 24.181 1.00 67.72 C ATOM 484 C TYR A 69 13.929 9.916 25.309 1.00 68.19 C ATOM 485 O TYR A 69 13.745 10.287 26.463 1.00 70.60 O ATOM 486 CB TYR A 69 12.711 10.668 23.341 1.00 67.59 C ATOM 487 CG TYR A 69 11.457 10.848 24.105 1.00 66.89 C ATOM 488 CD1 TYR A 69 11.014 12.121 24.426 1.00 65.92 C ATOM 489 CD2 TYR A 69 10.713 9.755 24.520 1.00 67.38 C ATOM 490 CE1 TYR A 69 9.856 12.316 25.131 1.00 66.70 C ATOM 491 CE2 TYR A 69 9.531 9.935 25.222 1.00 68.64 C ATOM 492 CZ TYR A 69 9.111 11.228 25.529 1.00 68.11 C ATOM 493 OH TYR A 69 7.952 11.435 26.232 1.00 67.48 O ATOM 494 N THR A 70 14.126 8.638 24.964 1.00 66.87 N ATOM 495 CA THR A 70 14.207 7.543 25.940 1.00 65.88 C ATOM 496 C THR A 70 15.583 7.437 26.609 1.00 66.90 C ATOM 497 O THR A 70 15.972 6.360 27.082 1.00 67.80 O ATOM 498 CB THR A 70 13.868 6.150 25.314 1.00 64.96 C ATOM 499 OG1 THR A 70 15.031 5.585 24.710 1.00 63.48 O ATOM 500 CG2 THR A 70 12.757 6.248 24.274 1.00 65.47 C ATOM 501 N ARG A 71 16.327 8.546 26.625 1.00 68.54 N ATOM 502 CA ARG A 71 17.577 8.682 27.393 1.00 67.99 C ATOM 503 C ARG A 71 18.580 7.535 27.132 1.00 63.42 C ATOM 504 O ARG A 71 19.371 7.188 27.976 1.00 61.57 O ATOM 505 CB ARG A 71 17.222 8.806 28.886 1.00 74.93 C ATOM 506 CG ARG A 71 17.772 10.052 29.624 1.00 82.28 C ATOM 507 CD ARG A 71 16.813 11.272 29.634 1.00 86.83 C ATOM 508 NE ARG A 71 15.526 11.032 30.304 1.00 89.08 N ATOM 509 CZ ARG A 71 14.562 11.953 30.464 1.00 90.38 C ATOM 510 NH1 ARG A 71 14.720 13.201 30.017 1.00 92.25 N ATOM 511 NH2 ARG A 71 13.423 11.629 31.083 1.00 92.39 N ATOM 512 N GLY A 72 18.543 6.965 25.938 1.00 63.11 N ATOM 513 CA GLY A 72 19.424 5.857 25.555 1.00 62.75 C ATOM 514 C GLY A 72 18.819 4.466 25.698 1.00 60.63 C ATOM 515 O GLY A 72 19.392 3.501 25.226 1.00 56.30 O ATOM 516 N ASN A 73 17.663 4.363 26.347 1.00 58.80 N ATOM 517 CA ASN A 73 17.106 3.073 26.693 1.00 57.83 C ATOM 518 C ASN A 73 16.600 2.305 25.482 1.00 57.11 C ATOM 519 O ASN A 73 15.438 2.415 25.090 1.00 57.78 O ATOM 520 CB ASN A 73 15.983 3.259 27.697 1.00 57.77 C ATOM 521 CG ASN A 73 15.500 1.954 28.279 1.00 59.83 C ATOM 522 OD1 ASN A 73 15.982 0.867 27.920 1.00 61.53 O ATOM 523 ND2 ASN A 73 14.535 2.047 29.196 1.00 61.88 N ATOM 524 N GLN A 74 17.479 1.497 24.912 1.00 56.81 N ATOM 525 CA GLN A 74 17.139 0.648 23.777 1.00 57.01 C ATOM 526 C GLN A 74 15.798 -0.041 23.931 1.00 54.57 C ATOM 527 O GLN A 74 15.036 -0.095 22.991 1.00 55.74 O ATOM 528 CB GLN A 74 18.226 -0.392 23.521 1.00 56.87 C ATOM 529 CG GLN A 74 19.362 0.106 22.649 1.00 59.92 C ATOM 530 CD GLN A 74 20.245 -1.025 22.099 1.00 64.82 C ATOM 531 OE1 GLN A 74 21.449 -0.847 21.917 1.00 72.82 O ATOM 532 NE2 GLN A 74 19.649 -2.187 21.822 1.00 66.78 N ATOM 533 N THR A 75 15.494 -0.556 25.107 1.00 56.53 N ATOM 534 CA THR A 75 14.235 -1.271 25.304 1.00 58.42 C ATOM 535 C THR A 75 13.008 -0.347 25.209 1.00 58.90 C ATOM 536 O THR A 75 12.059 -0.653 24.485 1.00 57.58 O ATOM 537 CB THR A 75 14.234 -2.027 26.642 1.00 57.47 C ATOM 538 OG1 THR A 75 15.399 -2.863 26.715 1.00 56.29 O ATOM 539 CG2 THR A 75 12.972 -2.877 26.774 1.00 56.54 C ATOM 540 N ARG A 76 13.025 0.770 25.933 1.00 60.46 N ATOM 541 CA ARG A 76 11.930 1.747 25.843 1.00 64.13 C ATOM 542 C ARG A 76 11.793 2.251 24.408 1.00 62.66 C ATOM 543 O ARG A 76 10.683 2.391 23.898 1.00 62.70 O ATOM 544 CB ARG A 76 12.119 2.939 26.815 1.00 68.73 C ATOM 545 CG ARG A 76 11.233 2.872 28.078 1.00 71.97 C ATOM 546 CD ARG A 76 11.674 3.813 29.251 1.00 73.55 C ATOM 547 NE ARG A 76 11.709 5.262 28.944 1.00 76.66 N ATOM 548 CZ ARG A 76 10.640 6.044 28.737 1.00 76.61 C ATOM 549 NH1 ARG A 76 9.416 5.522 28.753 1.00 78.07 N ATOM 550 NH2 ARG A 76 10.790 7.352 28.491 1.00 73.94 N ATOM 551 N ALA A 77 12.929 2.505 23.762 1.00 59.71 N ATOM 552 CA ALA A 77 12.950 2.947 22.367 1.00 56.88 C ATOM 553 C ALA A 77 12.241 1.979 21.408 1.00 52.21 C ATOM 554 O ALA A 77 11.366 2.384 20.660 1.00 47.28 O ATOM 555 CB ALA A 77 14.372 3.194 21.922 1.00 53.84 C ATOM 556 N ALA A 78 12.596 0.704 21.440 1.00 52.22 N ATOM 557 CA ALA A 78 11.949 -0.263 20.552 1.00 54.98 C ATOM 558 C ALA A 78 10.450 -0.330 20.791 1.00 57.01 C ATOM 559 O ALA A 78 9.669 -0.444 19.843 1.00 60.55 O ATOM 560 CB ALA A 78 12.559 -1.650 20.700 1.00 53.44 C ATOM 561 N LEU A 79 10.050 -0.269 22.057 1.00 58.03 N ATOM 562 CA LEU A 79 8.648 -0.472 22.426 1.00 57.59 C ATOM 563 C LEU A 79 7.855 0.732 21.967 1.00 60.47 C ATOM 564 O LEU A 79 6.711 0.630 21.517 1.00 59.14 O ATOM 565 CB LEU A 79 8.515 -0.671 23.941 1.00 56.97 C ATOM 566 CG LEU A 79 8.540 -2.107 24.490 1.00 55.88 C ATOM 567 CD1 LEU A 79 9.917 -2.866 24.465 1.00 53.14 C ATOM 568 CD2 LEU A 79 8.018 -1.979 25.886 1.00 55.87 C ATOM 569 N MET A 80 8.503 1.879 22.093 1.00 64.81 N ATOM 570 CA MET A 80 7.983 3.135 21.611 1.00 68.50 C ATOM 571 C MET A 80 7.738 3.097 20.087 1.00 68.75 C ATOM 572 O MET A 80 6.693 3.538 19.615 1.00 69.38 O ATOM 573 CB MET A 80 8.983 4.214 21.975 1.00 70.29 C ATOM 574 CG MET A 80 8.489 5.589 21.795 1.00 73.48 C ATOM 575 SD MET A 80 9.409 6.765 22.823 1.00 77.17 S ATOM 576 CE MET A 80 8.305 8.203 22.664 1.00 74.44 C ATOM 577 N MET A 81 8.678 2.536 19.329 1.00 67.38 N ATOM 578 CA MET A 81 8.558 2.473 17.870 1.00 65.33 C ATOM 579 C MET A 81 7.694 1.322 17.351 1.00 65.29 C ATOM 580 O MET A 81 7.336 1.284 16.168 1.00 69.05 O ATOM 581 CB MET A 81 9.936 2.389 17.242 1.00 63.33 C ATOM 582 CG MET A 81 10.612 3.714 17.199 1.00 64.92 C ATOM 583 SD MET A 81 12.353 3.534 16.844 1.00 70.29 S ATOM 584 CE MET A 81 12.416 3.341 15.069 1.00 72.25 C ATOM 585 N GLY A 82 7.357 0.372 18.203 1.00 62.13 N ATOM 586 CA GLY A 82 6.572 -0.763 17.743 1.00 61.41 C ATOM 587 C GLY A 82 7.342 -1.811 16.960 1.00 58.55 C ATOM 588 O GLY A 82 6.732 -2.652 16.281 1.00 57.99 O ATOM 589 N ILE A 83 8.669 -1.788 17.073 1.00 56.96 N ATOM 590 CA ILE A 83 9.522 -2.844 16.471 1.00 58.03 C ATOM 591 C ILE A 83 10.262 -3.663 17.521 1.00 55.48 C ATOM 592 O ILE A 83 10.405 -3.232 18.665 1.00 56.15 O ATOM 593 CB ILE A 83 10.564 -2.276 15.490 1.00 55.32 C ATOM 594 CG1 ILE A 83 11.483 -1.283 16.192 1.00 54.48 C ATOM 595 CG2 ILE A 83 9.856 -1.617 14.371 1.00 58.31 C ATOM 596 CD1 ILE A 83 12.586 -0.773 15.363 1.00 54.94 C ATOM 597 N ASN A 84 10.745 -4.823 17.102 1.00 53.64 N ATOM 598 CA ASN A 84 11.524 -5.709 17.960 1.00 59.06 C ATOM 599 C ASN A 84 12.771 -5.051 18.481 1.00 58.49 C ATOM 600 O ASN A 84 13.345 -4.190 17.825 1.00 56.55 O ATOM 601 CB ASN A 84 11.946 -6.989 17.217 1.00 62.69 C ATOM 602 CG ASN A 84 11.973 -8.218 18.122 1.00 64.36 C ATOM 603 OD1 ASN A 84 13.004 -8.898 18.253 1.00 65.83 O ATOM 604 ND2 ASN A 84 10.824 -8.519 18.737 1.00 63.17 N ATOM 605 N ARG A 85 13.191 -5.491 19.660 1.00 61.18 N ATOM 606 CA ARG A 85 14.386 -4.955 20.319 1.00 63.00 C ATOM 607 C ARG A 85 15.650 -5.264 19.505 1.00 66.78 C ATOM 608 O ARG A 85 16.653 -4.569 19.636 1.00 67.08 O ATOM 609 CB ARG A 85 14.519 -5.571 21.716 1.00 64.35 C ATOM 610 CG ARG A 85 15.332 -4.770 22.724 1.00 61.92 C ATOM 611 CD ARG A 85 15.335 -5.458 24.101 1.00 58.70 C ATOM 612 NE ARG A 85 16.548 -6.240 24.271 1.00 56.02 N ATOM 613 CZ ARG A 85 16.604 -7.559 24.452 1.00 59.90 C ATOM 614 NH1 ARG A 85 15.499 -8.304 24.522 1.00 62.92 N ATOM 615 NH2 ARG A 85 17.787 -8.144 24.590 1.00 58.16 N ATOM 616 N GLY A 86 15.594 -6.312 18.676 1.00 67.14 N ATOM 617 CA GLY A 86 16.729 -6.718 17.844 1.00 66.13 C ATOM 618 C GLY A 86 16.807 -5.967 16.530 1.00 65.19 C ATOM 619 O GLY A 86 17.886 -5.634 16.032 1.00 63.49 O ATOM 620 N THR A 87 15.648 -5.721 15.949 1.00 64.00 N ATOM 621 CA THR A 87 15.600 -4.912 14.774 1.00 63.07 C ATOM 622 C THR A 87 16.258 -3.586 15.105 1.00 63.31 C ATOM 623 O THR A 87 17.069 -3.091 14.337 1.00 63.91 O ATOM 624 CB THR A 87 14.152 -4.680 14.319 1.00 64.48 C ATOM 625 OG1 THR A 87 13.546 -5.936 13.967 1.00 65.98 O ATOM 626 CG2 THR A 87 14.105 -3.718 13.118 1.00 65.51 C ATOM 627 N LEU A 88 15.929 -3.023 16.266 1.00 63.43 N ATOM 628 CA LEU A 88 16.409 -1.689 16.619 1.00 62.95 C ATOM 629 C LEU A 88 17.921 -1.693 16.715 1.00 64.74 C ATOM 630 O LEU A 88 18.570 -0.746 16.301 1.00 64.07 O ATOM 631 CB LEU A 88 15.780 -1.214 17.929 1.00 61.60 C ATOM 632 CG LEU A 88 16.372 -0.018 18.689 1.00 61.48 C ATOM 633 CD1 LEU A 88 16.657 1.199 17.808 1.00 62.38 C ATOM 634 CD2 LEU A 88 15.418 0.358 19.806 1.00 60.45 C ATOM 635 N ARG A 89 18.490 -2.777 17.230 1.00 66.84 N ATOM 636 CA ARG A 89 19.941 -2.850 17.350 1.00 68.32 C ATOM 637 C ARG A 89 20.544 -2.776 15.977 1.00 66.29 C ATOM 638 O ARG A 89 21.463 -1.988 15.767 1.00 63.01 O ATOM 639 CB ARG A 89 20.399 -4.136 18.031 1.00 71.53 C ATOM 640 CG ARG A 89 19.532 -4.569 19.199 1.00 74.32 C ATOM 641 CD ARG A 89 20.260 -5.497 20.153 1.00 77.17 C ATOM 642 NE ARG A 89 21.011 -4.747 21.167 1.00 80.18 N ATOM 643 CZ ARG A 89 22.339 -4.621 21.220 1.00 82.05 C ATOM 644 NH1 ARG A 89 23.143 -5.198 20.319 1.00 83.46 N ATOM 645 NH2 ARG A 89 22.875 -3.914 22.201 1.00 81.48 N ATOM 646 N LYS A 90 19.998 -3.596 15.063 1.00 67.65 N ATOM 647 CA LYS A 90 20.437 -3.686 13.648 1.00 69.02 C ATOM 648 C LYS A 90 20.380 -2.361 12.913 1.00 65.20 C ATOM 649 O LYS A 90 21.331 -2.012 12.231 1.00 63.27 O ATOM 650 CB LYS A 90 19.640 -4.749 12.858 1.00 72.21 C ATOM 651 CG LYS A 90 20.070 -6.200 13.201 1.00 76.31 C ATOM 652 CD LYS A 90 18.976 -7.256 12.889 1.00 76.81 C ATOM 653 CE LYS A 90 19.359 -8.682 13.375 1.00 75.71 C ATOM 654 NZ LYS A 90 18.191 -9.625 13.339 1.00 75.25 N ATOM 655 N LYS A 91 19.283 -1.622 13.061 1.00 63.40 N ATOM 656 CA LYS A 91 19.170 -0.306 12.437 1.00 63.59 C ATOM 657 C LYS A 91 20.203 0.646 12.999 1.00 62.03 C ATOM 658 O LYS A 91 20.655 1.547 12.299 1.00 62.35 O ATOM 659 CB LYS A 91 17.765 0.292 12.594 1.00 63.48 C ATOM 660 CG LYS A 91 16.681 -0.577 11.985 1.00 65.48 C ATOM 661 CD LYS A 91 15.404 0.177 11.530 1.00 65.96 C ATOM 662 CE LYS A 91 14.606 -0.698 10.521 1.00 66.47 C ATOM 663 NZ LYS A 91 15.429 -1.007 9.273 1.00 67.83 N ATOM 664 N LEU A 92 20.582 0.453 14.259 1.00 62.46 N ATOM 665 CA LEU A 92 21.557 1.330 14.884 1.00 64.41 C ATOM 666 C LEU A 92 22.957 1.018 14.358 1.00 66.50 C ATOM 667 O LEU A 92 23.724 1.944 14.121 1.00 65.81 O ATOM 668 CB LEU A 92 21.479 1.271 16.417 1.00 62.81 C ATOM 669 CG LEU A 92 20.224 1.836 17.124 1.00 61.00 C ATOM 670 CD1 LEU A 92 20.021 1.158 18.477 1.00 59.76 C ATOM 671 CD2 LEU A 92 20.253 3.347 17.288 1.00 58.04 C ATOM 672 N LYS A 93 23.284 -0.262 14.149 1.00 71.60 N ATOM 673 CA LYS A 93 24.503 -0.630 13.396 1.00 75.56 C ATOM 674 C LYS A 93 24.473 0.006 11.983 1.00 76.61 C ATOM 675 O LYS A 93 25.465 0.601 11.554 1.00 75.92 O ATOM 676 CB LYS A 93 24.675 -2.162 13.285 1.00 79.60 C ATOM 677 CG LYS A 93 24.464 -2.751 11.835 1.00 83.98 C ATOM 678 CD LYS A 93 24.208 -4.282 11.809 1.00 85.75 C ATOM 679 CE LYS A 93 25.314 -5.122 12.516 1.00 86.61 C ATOM 680 NZ LYS A 93 25.217 -6.571 12.116 1.00 85.24 N ATOM 681 N LYS A 94 23.323 -0.083 11.295 1.00 76.65 N ATOM 682 CA LYS A 94 23.203 0.316 9.876 1.00 75.38 C ATOM 683 C LYS A 94 23.706 1.712 9.680 1.00 73.15 C ATOM 684 O LYS A 94 24.393 1.982 8.716 1.00 74.82 O ATOM 685 CB LYS A 94 21.759 0.232 9.337 1.00 74.54 C ATOM 686 CG LYS A 94 21.662 0.175 7.787 1.00 75.78 C ATOM 687 CD LYS A 94 20.351 0.806 7.174 1.00 77.57 C ATOM 688 CE LYS A 94 19.268 -0.223 6.700 1.00 79.73 C ATOM 689 NZ LYS A 94 17.945 -0.188 7.480 1.00 80.18 N ATOM 690 N TYR A 95 23.357 2.604 10.591 1.00 73.61 N ATOM 691 CA TYR A 95 23.799 3.993 10.481 1.00 75.69 C ATOM 692 C TYR A 95 24.904 4.295 11.444 1.00 74.34 C ATOM 693 O TYR A 95 25.318 5.443 11.550 1.00 72.38 O ATOM 694 CB TYR A 95 22.639 4.965 10.697 1.00 73.94 C ATOM 695 CG TYR A 95 21.494 4.640 9.797 1.00 73.05 C ATOM 696 CD1 TYR A 95 21.552 4.913 8.444 1.00 72.45 C ATOM 697 CD2 TYR A 95 20.372 4.014 10.296 1.00 73.70 C ATOM 698 CE1 TYR A 95 20.503 4.597 7.622 1.00 73.83 C ATOM 699 CE2 TYR A 95 19.322 3.692 9.484 1.00 73.55 C ATOM 700 CZ TYR A 95 19.390 3.979 8.156 1.00 73.35 C ATOM 701 OH TYR A 95 18.333 3.635 7.374 1.00 73.56 O ATOM 702 N GLY A 96 25.378 3.263 12.132 1.00 75.54 N ATOM 703 CA GLY A 96 26.451 3.411 13.100 1.00 79.82 C ATOM 704 C GLY A 96 26.176 4.447 14.173 1.00 81.15 C ATOM 705 O GLY A 96 26.910 5.423 14.290 1.00 79.64 O ATOM 706 N MET A 97 25.113 4.231 14.945 1.00 85.03 N ATOM 707 CA MET A 97 24.768 5.084 16.083 1.00 87.97 C ATOM 708 C MET A 97 24.982 4.313 17.375 1.00 88.63 C ATOM 709 O MET A 97 24.228 4.455 18.325 1.00 87.35 O ATOM 710 CB MET A 97 23.320 5.563 15.978 1.00 88.14 C ATOM 711 CG MET A 97 23.057 6.323 14.710 1.00 89.41 C ATOM 712 SD MET A 97 21.360 6.875 14.506 1.00 91.72 S ATOM 713 CE MET A 97 21.640 8.136 13.245 1.00 89.97 C ATOM 714 N ASN A 98 26.020 3.489 17.404 1.00 92.74 N ATOM 715 CA ASN A 98 26.473 2.889 18.657 1.00 96.57 C ATOM 716 C ASN A 98 27.195 3.982 19.473 1.00 99.46 C ATOM 717 O ASN A 98 27.791 3.716 20.525 1.00103.39 O ATOM 718 CB ASN A 98 27.400 1.676 18.409 1.00 97.82 C ATOM 719 CG ASN A 98 26.799 0.655 17.443 1.00 97.48 C ATOM 720 OD1 ASN A 98 25.618 0.719 17.104 1.00 97.50 O ATOM 721 ND2 ASN A 98 27.621 -0.287 16.998 1.00 97.34 N TER 722 ASN A 98 ATOM 723 N MET B 1 36.869 20.033 -10.905 1.00 93.65 N ATOM 724 CA MET B 1 36.048 18.794 -10.754 1.00 92.84 C ATOM 725 C MET B 1 34.574 19.187 -10.629 1.00 91.26 C ATOM 726 O MET B 1 34.175 20.293 -11.018 1.00 91.44 O ATOM 727 CB MET B 1 36.463 17.968 -9.509 1.00 97.25 C ATOM 728 CG MET B 1 37.910 18.110 -8.999 1.00100.44 C ATOM 729 SD MET B 1 39.205 17.683 -10.186 1.00106.53 S ATOM 730 CE MET B 1 38.688 16.052 -10.760 1.00105.19 C ATOM 731 N PHE B 2 33.776 18.258 -10.103 1.00 86.55 N ATOM 732 CA PHE B 2 32.438 18.556 -9.617 1.00 82.34 C ATOM 733 C PHE B 2 32.562 18.817 -8.145 1.00 73.57 C ATOM 734 O PHE B 2 33.513 18.384 -7.512 1.00 73.09 O ATOM 735 CB PHE B 2 31.500 17.360 -9.769 1.00 83.82 C ATOM 736 CG PHE B 2 31.614 16.652 -11.078 1.00 84.03 C ATOM 737 CD1 PHE B 2 32.280 15.438 -11.163 1.00 84.99 C ATOM 738 CD2 PHE B 2 31.037 17.187 -12.220 1.00 84.46 C ATOM 739 CE1 PHE B 2 32.376 14.775 -12.362 1.00 85.47 C ATOM 740 CE2 PHE B 2 31.133 16.539 -13.428 1.00 84.01 C ATOM 741 CZ PHE B 2 31.803 15.334 -13.504 1.00 85.34 C ATOM 742 N GLU B 3 31.568 19.472 -7.585 1.00 65.20 N ATOM 743 CA GLU B 3 31.547 19.688 -6.167 1.00 62.11 C ATOM 744 C GLU B 3 30.716 18.646 -5.458 1.00 61.58 C ATOM 745 O GLU B 3 29.624 18.302 -5.906 1.00 60.04 O ATOM 746 CB GLU B 3 30.982 21.050 -5.865 1.00 62.63 C ATOM 747 CG GLU B 3 31.835 22.155 -6.368 1.00 63.59 C ATOM 748 CD GLU B 3 31.307 23.496 -5.962 1.00 65.62 C ATOM 749 OE1 GLU B 3 30.728 23.609 -4.844 1.00 66.86 O ATOM 750 OE2 GLU B 3 31.476 24.438 -6.771 1.00 69.32 O ATOM 751 N GLN B 4 31.229 18.172 -4.322 1.00 60.95 N ATOM 752 CA GLN B 4 30.515 17.216 -3.476 1.00 59.20 C ATOM 753 C GLN B 4 29.138 17.678 -3.103 1.00 56.72 C ATOM 754 O GLN B 4 28.929 18.869 -2.856 1.00 54.05 O ATOM 755 CB GLN B 4 31.258 16.969 -2.168 1.00 59.87 C ATOM 756 CG GLN B 4 30.584 15.898 -1.299 1.00 60.04 C ATOM 757 CD GLN B 4 31.463 15.449 -0.170 1.00 59.92 C ATOM 758 OE1 GLN B 4 31.950 16.280 0.599 1.00 61.10 O ATOM 759 NE2 GLN B 4 31.680 14.132 -0.056 1.00 59.10 N ATOM 760 N ARG B 5 28.223 16.711 -3.045 1.00 56.81 N ATOM 761 CA ARG B 5 26.865 16.915 -2.566 1.00 58.70 C ATOM 762 C ARG B 5 26.517 15.751 -1.651 1.00 59.34 C ATOM 763 O ARG B 5 26.194 14.612 -2.078 1.00 59.81 O ATOM 764 CB ARG B 5 25.867 17.038 -3.715 1.00 58.04 C ATOM 765 CG ARG B 5 24.409 16.982 -3.278 1.00 59.17 C ATOM 766 CD ARG B 5 23.502 17.635 -4.294 1.00 63.15 C ATOM 767 NE ARG B 5 23.345 19.074 -4.091 1.00 65.00 N ATOM 768 CZ ARG B 5 22.948 19.946 -5.030 1.00 69.82 C ATOM 769 NH1 ARG B 5 22.711 19.562 -6.281 1.00 71.96 N ATOM 770 NH2 ARG B 5 22.807 21.239 -4.732 1.00 71.33 N ATOM 771 N VAL B 6 26.584 16.059 -0.369 1.00 59.43 N ATOM 772 CA VAL B 6 26.432 15.051 0.657 1.00 60.86 C ATOM 773 C VAL B 6 24.990 14.580 0.696 1.00 62.14 C ATOM 774 O VAL B 6 24.078 15.332 0.334 1.00 63.55 O ATOM 775 CB VAL B 6 26.902 15.585 2.037 1.00 59.61 C ATOM 776 CG1 VAL B 6 28.398 15.455 2.157 1.00 55.17 C ATOM 777 CG2 VAL B 6 26.475 17.039 2.244 1.00 59.23 C ATOM 778 N ASN B 7 24.777 13.346 1.142 1.00 62.76 N ATOM 779 CA ASN B 7 23.432 12.746 1.068 1.00 64.43 C ATOM 780 C ASN B 7 22.404 13.465 1.907 1.00 61.28 C ATOM 781 O ASN B 7 21.223 13.443 1.616 1.00 58.49 O ATOM 782 CB ASN B 7 23.514 11.279 1.428 1.00 68.13 C ATOM 783 CG ASN B 7 24.624 10.590 0.680 1.00 69.18 C ATOM 784 OD1 ASN B 7 25.392 9.849 1.266 1.00 68.94 O ATOM 785 ND2 ASN B 7 24.755 10.896 -0.622 1.00 70.51 N ATOM 786 N SER B 8 22.911 14.100 2.948 1.00 63.21 N ATOM 787 CA SER B 8 22.221 15.119 3.706 1.00 65.14 C ATOM 788 C SER B 8 21.518 16.082 2.785 1.00 64.96 C ATOM 789 O SER B 8 20.338 16.336 2.961 1.00 66.92 O ATOM 790 CB SER B 8 23.237 15.888 4.574 1.00 66.88 C ATOM 791 OG SER B 8 24.375 15.065 4.888 1.00 68.98 O ATOM 792 N ASP B 9 22.229 16.627 1.802 1.00 66.70 N ATOM 793 CA ASP B 9 21.641 17.683 0.975 1.00 67.86 C ATOM 794 C ASP B 9 21.176 17.192 -0.429 1.00 64.09 C ATOM 795 O ASP B 9 20.858 17.982 -1.299 1.00 66.10 O ATOM 796 CB ASP B 9 22.481 19.012 1.050 1.00 75.20 C ATOM 797 CG ASP B 9 23.649 19.103 0.037 1.00 84.70 C ATOM 798 OD1 ASP B 9 23.366 19.324 -1.154 1.00 93.22 O ATOM 799 OD2 ASP B 9 24.863 19.060 0.411 1.00 91.10 O ATOM 800 N VAL B 10 21.030 15.886 -0.610 1.00 59.64 N ATOM 801 CA VAL B 10 20.377 15.379 -1.815 1.00 58.86 C ATOM 802 C VAL B 10 18.880 15.695 -1.865 1.00 61.61 C ATOM 803 O VAL B 10 18.354 16.036 -2.925 1.00 63.33 O ATOM 804 CB VAL B 10 20.527 13.878 -1.973 1.00 52.79 C ATOM 805 CG1 VAL B 10 19.822 13.417 -3.208 1.00 48.23 C ATOM 806 CG2 VAL B 10 21.947 13.547 -2.088 1.00 53.16 C ATOM 807 N LEU B 11 18.193 15.545 -0.733 1.00 64.06 N ATOM 808 CA LEU B 11 16.751 15.831 -0.637 1.00 61.17 C ATOM 809 C LEU B 11 16.559 16.990 0.301 1.00 58.91 C ATOM 810 O LEU B 11 16.879 16.856 1.465 1.00 61.19 O ATOM 811 CB LEU B 11 16.029 14.632 -0.045 1.00 60.71 C ATOM 812 CG LEU B 11 16.060 13.319 -0.819 1.00 60.50 C ATOM 813 CD1 LEU B 11 16.682 12.178 0.008 1.00 62.90 C ATOM 814 CD2 LEU B 11 14.669 12.969 -1.216 1.00 59.73 C ATOM 815 N THR B 12 16.024 18.109 -0.169 1.00 57.86 N ATOM 816 CA THR B 12 16.045 19.313 0.632 1.00 60.48 C ATOM 817 C THR B 12 14.857 20.237 0.467 1.00 60.58 C ATOM 818 O THR B 12 14.353 20.419 -0.613 1.00 66.17 O ATOM 819 CB THR B 12 17.269 20.137 0.273 1.00 64.93 C ATOM 820 OG1 THR B 12 16.959 20.969 -0.849 1.00 69.61 O ATOM 821 CG2 THR B 12 18.482 19.234 -0.049 1.00 65.73 C ATOM 822 N VAL B 13 14.482 20.898 1.547 1.00 61.47 N ATOM 823 CA VAL B 13 13.320 21.766 1.604 1.00 60.20 C ATOM 824 C VAL B 13 13.731 23.246 1.633 1.00 61.33 C ATOM 825 O VAL B 13 14.837 23.576 1.992 1.00 65.58 O ATOM 826 CB VAL B 13 12.602 21.445 2.880 1.00 61.04 C ATOM 827 CG1 VAL B 13 11.330 22.219 2.977 1.00 69.58 C ATOM 828 CG2 VAL B 13 12.298 19.980 2.914 1.00 64.69 C ATOM 829 N SER B 14 12.857 24.160 1.265 1.00 61.89 N ATOM 830 CA SER B 14 13.186 25.573 1.402 1.00 61.39 C ATOM 831 C SER B 14 12.800 26.123 2.748 1.00 61.91 C ATOM 832 O SER B 14 11.676 25.945 3.186 1.00 62.86 O ATOM 833 CB SER B 14 12.458 26.379 0.350 1.00 62.54 C ATOM 834 OG SER B 14 12.924 26.001 -0.924 1.00 64.36 O ATOM 835 N THR B 15 13.721 26.845 3.371 1.00 63.95 N ATOM 836 CA THR B 15 13.495 27.465 4.673 1.00 64.59 C ATOM 837 C THR B 15 13.758 28.975 4.588 1.00 64.01 C ATOM 838 O THR B 15 14.312 29.449 3.620 1.00 65.74 O ATOM 839 CB THR B 15 14.434 26.824 5.720 1.00 65.06 C ATOM 840 OG1 THR B 15 15.780 27.183 5.411 1.00 70.03 O ATOM 841 CG2 THR B 15 14.327 25.293 5.712 1.00 59.65 C ATOM 842 N VAL B 16 13.342 29.729 5.591 1.00 65.73 N ATOM 843 CA VAL B 16 13.656 31.151 5.679 1.00 67.35 C ATOM 844 C VAL B 16 14.564 31.272 6.878 1.00 70.92 C ATOM 845 O VAL B 16 14.372 30.561 7.856 1.00 74.77 O ATOM 846 CB VAL B 16 12.404 31.990 5.961 1.00 65.90 C ATOM 847 CG1 VAL B 16 12.794 33.399 6.342 1.00 67.22 C ATOM 848 CG2 VAL B 16 11.473 32.006 4.773 1.00 63.66 C ATOM 849 N ASN B 17 15.557 32.151 6.827 1.00 74.72 N ATOM 850 CA ASN B 17 16.471 32.292 7.959 1.00 75.83 C ATOM 851 C ASN B 17 16.278 33.619 8.694 1.00 78.90 C ATOM 852 O ASN B 17 15.329 34.373 8.398 1.00 78.89 O ATOM 853 CB ASN B 17 17.927 32.057 7.520 1.00 75.78 C ATOM 854 CG ASN B 17 18.507 33.207 6.726 1.00 76.89 C ATOM 855 OD1 ASN B 17 17.828 34.214 6.472 1.00 77.11 O ATOM 856 ND2 ASN B 17 19.789 33.070 6.331 1.00 76.32 N ATOM 857 N SER B 18 17.171 33.877 9.657 1.00 81.18 N ATOM 858 CA SER B 18 17.146 35.080 10.504 1.00 82.16 C ATOM 859 C SER B 18 17.195 36.395 9.730 1.00 84.14 C ATOM 860 O SER B 18 16.748 37.434 10.245 1.00 84.09 O ATOM 861 CB SER B 18 18.318 35.046 11.480 1.00 82.95 C ATOM 862 OG SER B 18 18.303 33.852 12.235 1.00 84.65 O ATOM 863 N GLN B 19 17.749 36.349 8.512 1.00 84.10 N ATOM 864 CA GLN B 19 17.828 37.516 7.637 1.00 84.70 C ATOM 865 C GLN B 19 16.773 37.439 6.546 1.00 84.27 C ATOM 866 O GLN B 19 16.909 38.070 5.499 1.00 83.51 O ATOM 867 CB GLN B 19 19.225 37.628 7.017 1.00 85.95 C ATOM 868 CG GLN B 19 20.367 37.825 8.037 1.00 87.58 C ATOM 869 CD GLN B 19 20.713 36.557 8.831 1.00 88.59 C ATOM 870 OE1 GLN B 19 20.860 36.601 10.049 1.00 90.16 O ATOM 871 NE2 GLN B 19 20.843 35.429 8.139 1.00 89.78 N ATOM 872 N ASP B 20 15.712 36.674 6.799 1.00 86.03 N ATOM 873 CA ASP B 20 14.646 36.481 5.817 1.00 86.88 C ATOM 874 C ASP B 20 15.240 36.163 4.432 1.00 85.20 C ATOM 875 O ASP B 20 14.863 36.773 3.436 1.00 86.34 O ATOM 876 CB ASP B 20 13.729 37.740 5.747 1.00 92.94 C ATOM 877 CG ASP B 20 12.357 37.559 6.459 1.00 96.40 C ATOM 878 OD1 ASP B 20 11.858 36.411 6.582 1.00 98.61 O ATOM 879 OD2 ASP B 20 11.763 38.593 6.869 1.00 97.76 O ATOM 880 N GLN B 21 16.182 35.222 4.375 1.00 80.78 N ATOM 881 CA GLN B 21 16.780 34.809 3.100 1.00 77.34 C ATOM 882 C GLN B 21 16.549 33.300 2.876 1.00 74.69 C ATOM 883 O GLN B 21 16.642 32.512 3.816 1.00 74.47 O ATOM 884 CB GLN B 21 18.263 35.197 3.066 1.00 75.78 C ATOM 885 CG GLN B 21 18.927 35.002 1.706 1.00 76.80 C ATOM 886 CD GLN B 21 19.833 36.153 1.314 1.00 76.68 C ATOM 887 OE1 GLN B 21 19.400 37.310 1.320 1.00 76.05 O ATOM 888 NE2 GLN B 21 21.093 35.845 0.952 1.00 76.19 N ATOM 889 N VAL B 22 16.222 32.910 1.638 1.00 72.35 N ATOM 890 CA VAL B 22 15.820 31.532 1.334 1.00 70.09 C ATOM 891 C VAL B 22 17.016 30.617 1.147 1.00 67.05 C ATOM 892 O VAL B 22 17.863 30.845 0.293 1.00 63.35 O ATOM 893 CB VAL B 22 14.942 31.412 0.076 1.00 69.92 C ATOM 894 CG1 VAL B 22 14.416 29.981 -0.059 1.00 69.06 C ATOM 895 CG2 VAL B 22 13.768 32.384 0.109 1.00 71.11 C ATOM 896 N THR B 23 17.050 29.569 1.957 1.00 67.71 N ATOM 897 CA THR B 23 18.150 28.638 1.996 1.00 70.22 C ATOM 898 C THR B 23 17.525 27.253 1.913 1.00 67.76 C ATOM 899 O THR B 23 16.328 27.143 2.061 1.00 66.31 O ATOM 900 CB THR B 23 18.972 28.836 3.302 1.00 73.39 C ATOM 901 OG1 THR B 23 20.379 28.704 3.019 1.00 77.69 O ATOM 902 CG2 THR B 23 18.551 27.834 4.398 1.00 74.32 C ATOM 903 N GLN B 24 18.323 26.213 1.680 1.00 67.83 N ATOM 904 CA GLN B 24 17.811 24.845 1.514 1.00 69.45 C ATOM 905 C GLN B 24 18.316 23.896 2.601 1.00 68.78 C ATOM 906 O GLN B 24 19.387 23.315 2.443 1.00 72.17 O ATOM 907 CB GLN B 24 18.256 24.246 0.156 1.00 70.39 C ATOM 908 CG GLN B 24 17.745 24.910 -1.095 1.00 70.33 C ATOM 909 CD GLN B 24 16.311 24.555 -1.425 1.00 71.47 C ATOM 910 OE1 GLN B 24 15.456 25.439 -1.482 1.00 72.20 O ATOM 911 NE2 GLN B 24 16.035 23.269 -1.648 1.00 68.47 N ATOM 912 N LYS B 25 17.565 23.700 3.680 1.00 68.47 N ATOM 913 CA LYS B 25 17.982 22.739 4.727 1.00 70.59 C ATOM 914 C LYS B 25 17.587 21.314 4.296 1.00 64.54 C ATOM 915 O LYS B 25 16.706 21.168 3.468 1.00 58.70 O ATOM 916 CB LYS B 25 17.452 23.132 6.148 1.00 75.50 C ATOM 917 CG LYS B 25 16.051 22.502 6.608 1.00 79.56 C ATOM 918 CD LYS B 25 15.561 23.035 8.028 1.00 80.00 C ATOM 919 CE LYS B 25 14.127 22.574 8.445 1.00 78.27 C ATOM 920 NZ LYS B 25 13.826 22.965 9.865 1.00 75.55 N ATOM 921 N PRO B 26 18.289 20.274 4.790 1.00 63.74 N ATOM 922 CA PRO B 26 17.959 18.862 4.553 1.00 65.58 C ATOM 923 C PRO B 26 16.620 18.391 5.047 1.00 65.90 C ATOM 924 O PRO B 26 16.065 18.956 5.988 1.00 71.71 O ATOM 925 CB PRO B 26 19.034 18.123 5.333 1.00 64.34 C ATOM 926 CG PRO B 26 20.180 19.015 5.259 1.00 65.63 C ATOM 927 CD PRO B 26 19.563 20.374 5.507 1.00 64.60 C ATOM 928 N LEU B 27 16.128 17.320 4.434 1.00 65.98 N ATOM 929 CA LEU B 27 14.839 16.741 4.821 1.00 67.36 C ATOM 930 C LEU B 27 14.904 16.155 6.220 1.00 70.02 C ATOM 931 O LEU B 27 13.931 16.275 6.967 1.00 74.27 O ATOM 932 CB LEU B 27 14.399 15.640 3.851 1.00 66.15 C ATOM 933 CG LEU B 27 12.936 15.250 3.977 1.00 61.89 C ATOM 934 CD1 LEU B 27 12.139 16.454 3.594 1.00 62.15 C ATOM 935 CD2 LEU B 27 12.645 14.078 3.089 1.00 59.16 C ATOM 936 N ARG B 28 16.021 15.481 6.526 1.00 68.75 N ATOM 937 CA ARG B 28 16.414 15.154 7.893 1.00 70.32 C ATOM 938 C ARG B 28 15.871 16.192 8.849 1.00 69.44 C ATOM 939 O ARG B 28 15.174 15.855 9.803 1.00 73.72 O ATOM 940 CB ARG B 28 17.944 15.164 8.043 1.00 72.88 C ATOM 941 CG ARG B 28 18.662 13.857 7.681 1.00 75.86 C ATOM 942 CD ARG B 28 20.148 14.101 7.406 1.00 78.14 C ATOM 943 NE ARG B 28 21.042 12.991 7.764 1.00 78.64 N ATOM 944 CZ ARG B 28 21.651 12.174 6.902 1.00 83.02 C ATOM 945 NH1 ARG B 28 21.456 12.290 5.588 1.00 84.69 N ATOM 946 NH2 ARG B 28 22.468 11.216 7.358 1.00 84.36 N ATOM 947 N ASP B 29 16.179 17.457 8.598 1.00 65.34 N ATOM 948 CA ASP B 29 15.854 18.470 9.562 1.00 66.30 C ATOM 949 C ASP B 29 14.358 18.657 9.682 1.00 63.72 C ATOM 950 O ASP B 29 13.853 18.889 10.776 1.00 61.96 O ATOM 951 CB ASP B 29 16.601 19.760 9.259 1.00 72.26 C ATOM 952 CG ASP B 29 18.114 19.623 9.517 1.00 80.74 C ATOM 953 OD1 ASP B 29 18.525 18.637 10.187 1.00 86.93 O ATOM 954 OD2 ASP B 29 18.913 20.488 9.066 1.00 85.92 O ATOM 955 N SER B 30 13.635 18.516 8.585 1.00 61.28 N ATOM 956 CA SER B 30 12.189 18.547 8.685 1.00 63.26 C ATOM 957 C SER B 30 11.719 17.398 9.556 1.00 61.06 C ATOM 958 O SER B 30 10.890 17.579 10.421 1.00 61.55 O ATOM 959 CB SER B 30 11.512 18.479 7.308 1.00 66.70 C ATOM 960 OG SER B 30 11.644 19.694 6.581 1.00 68.88 O ATOM 961 N VAL B 31 12.242 16.207 9.334 1.00 60.93 N ATOM 962 CA VAL B 31 11.825 15.080 10.139 1.00 61.65 C ATOM 963 C VAL B 31 12.129 15.330 11.592 1.00 59.92 C ATOM 964 O VAL B 31 11.267 15.205 12.418 1.00 59.35 O ATOM 965 CB VAL B 31 12.475 13.786 9.707 1.00 61.48 C ATOM 966 CG1 VAL B 31 12.351 12.755 10.811 1.00 61.53 C ATOM 967 CG2 VAL B 31 11.829 13.298 8.417 1.00 61.71 C ATOM 968 N LYS B 32 13.353 15.707 11.898 1.00 63.41 N ATOM 969 CA LYS B 32 13.715 16.058 13.278 1.00 66.54 C ATOM 970 C LYS B 32 12.654 17.005 13.861 1.00 65.19 C ATOM 971 O LYS B 32 11.988 16.667 14.823 1.00 65.43 O ATOM 972 CB LYS B 32 15.117 16.690 13.329 1.00 68.09 C ATOM 973 CG LYS B 32 16.097 16.061 14.308 1.00 71.22 C ATOM 974 CD LYS B 32 17.643 16.229 13.862 1.00 74.21 C ATOM 975 CE LYS B 32 18.641 16.458 15.107 1.00 74.24 C ATOM 976 NZ LYS B 32 20.028 15.860 14.987 1.00 73.43 N ATOM 977 N GLN B 33 12.480 18.171 13.262 1.00 64.98 N ATOM 978 CA GLN B 33 11.472 19.114 13.713 1.00 67.39 C ATOM 979 C GLN B 33 10.163 18.463 14.089 1.00 66.54 C ATOM 980 O GLN B 33 9.678 18.617 15.199 1.00 70.47 O ATOM 981 CB GLN B 33 11.174 20.118 12.607 1.00 74.43 C ATOM 982 CG GLN B 33 12.068 21.319 12.657 1.00 79.46 C ATOM 983 CD GLN B 33 11.735 22.173 13.839 1.00 82.54 C ATOM 984 OE1 GLN B 33 12.586 22.418 14.717 1.00 82.54 O ATOM 985 NE2 GLN B 33 10.463 22.603 13.904 1.00 83.92 N ATOM 986 N ALA B 34 9.585 17.744 13.146 1.00 65.37 N ATOM 987 CA ALA B 34 8.283 17.120 13.334 1.00 64.23 C ATOM 988 C ALA B 34 8.219 16.226 14.549 1.00 63.16 C ATOM 989 O ALA B 34 7.202 16.175 15.219 1.00 66.52 O ATOM 990 CB ALA B 34 7.919 16.311 12.115 1.00 65.19 C ATOM 991 N LEU B 35 9.286 15.484 14.793 1.00 63.58 N ATOM 992 CA LEU B 35 9.372 14.608 15.944 1.00 63.76 C ATOM 993 C LEU B 35 9.497 15.439 17.206 1.00 65.98 C ATOM 994 O LEU B 35 8.784 15.196 18.168 1.00 68.14 O ATOM 995 CB LEU B 35 10.557 13.655 15.806 1.00 60.00 C ATOM 996 CG LEU B 35 10.313 12.559 14.775 1.00 58.80 C ATOM 997 CD1 LEU B 35 11.598 11.830 14.392 1.00 58.41 C ATOM 998 CD2 LEU B 35 9.294 11.593 15.314 1.00 58.40 C ATOM 999 N LYS B 36 10.381 16.429 17.208 1.00 68.67 N ATOM 1000 CA LYS B 36 10.490 17.307 18.361 1.00 70.36 C ATOM 1001 C LYS B 36 9.103 17.853 18.706 1.00 70.36 C ATOM 1002 O LYS B 36 8.684 17.874 19.872 1.00 72.11 O ATOM 1003 CB LYS B 36 11.477 18.453 18.103 1.00 73.84 C ATOM 1004 CG LYS B 36 11.146 19.722 18.902 1.00 76.60 C ATOM 1005 CD LYS B 36 12.244 20.803 18.876 1.00 78.16 C ATOM 1006 CE LYS B 36 11.810 22.040 19.714 1.00 78.94 C ATOM 1007 NZ LYS B 36 12.909 23.035 19.898 1.00 79.04 N ATOM 1008 N ASN B 37 8.398 18.290 17.675 1.00 68.49 N ATOM 1009 CA ASN B 37 7.056 18.821 17.826 1.00 69.17 C ATOM 1010 C ASN B 37 6.013 17.799 18.293 1.00 66.87 C ATOM 1011 O ASN B 37 5.007 18.157 18.879 1.00 64.30 O ATOM 1012 CB ASN B 37 6.604 19.399 16.493 1.00 72.37 C ATOM 1013 CG ASN B 37 5.785 20.640 16.654 1.00 77.27 C ATOM 1014 OD1 ASN B 37 5.159 20.866 17.697 1.00 79.86 O ATOM 1015 ND2 ASN B 37 5.794 21.483 15.621 1.00 81.49 N ATOM 1016 N TYR B 38 6.253 16.531 17.998 1.00 67.39 N ATOM 1017 CA TYR B 38 5.313 15.467 18.297 1.00 67.53 C ATOM 1018 C TYR B 38 5.468 15.022 19.730 1.00 68.64 C ATOM 1019 O TYR B 38 4.489 14.701 20.382 1.00 72.80 O ATOM 1020 CB TYR B 38 5.548 14.288 17.363 1.00 65.84 C ATOM 1021 CG TYR B 38 4.835 13.008 17.750 1.00 65.47 C ATOM 1022 CD1 TYR B 38 5.525 11.951 18.328 1.00 65.26 C ATOM 1023 CD2 TYR B 38 3.482 12.849 17.527 1.00 65.49 C ATOM 1024 CE1 TYR B 38 4.891 10.765 18.671 1.00 65.07 C ATOM 1025 CE2 TYR B 38 2.830 11.662 17.873 1.00 66.98 C ATOM 1026 CZ TYR B 38 3.544 10.623 18.443 1.00 66.50 C ATOM 1027 OH TYR B 38 2.904 9.452 18.799 1.00 66.30 O ATOM 1028 N PHE B 39 6.703 14.987 20.212 1.00 69.40 N ATOM 1029 CA PHE B 39 6.980 14.679 21.607 1.00 69.76 C ATOM 1030 C PHE B 39 6.455 15.772 22.534 1.00 73.28 C ATOM 1031 O PHE B 39 5.638 15.494 23.409 1.00 75.28 O ATOM 1032 CB PHE B 39 8.476 14.489 21.804 1.00 65.81 C ATOM 1033 CG PHE B 39 9.019 13.268 21.110 1.00 66.94 C ATOM 1034 CD1 PHE B 39 8.379 12.034 21.227 1.00 66.15 C ATOM 1035 CD2 PHE B 39 10.158 13.336 20.345 1.00 65.91 C ATOM 1036 CE1 PHE B 39 8.870 10.915 20.609 1.00 63.82 C ATOM 1037 CE2 PHE B 39 10.643 12.199 19.722 1.00 65.21 C ATOM 1038 CZ PHE B 39 9.996 10.997 19.859 1.00 63.85 C ATOM 1039 N ALA B 40 6.893 17.011 22.330 1.00 75.85 N ATOM 1040 CA ALA B 40 6.372 18.144 23.100 1.00 78.58 C ATOM 1041 C ALA B 40 4.840 18.144 23.239 1.00 81.87 C ATOM 1042 O ALA B 40 4.318 18.386 24.318 1.00 84.16 O ATOM 1043 CB ALA B 40 6.834 19.440 22.484 1.00 79.76 C ATOM 1044 N GLN B 41 4.123 17.854 22.159 1.00 86.15 N ATOM 1045 CA GLN B 41 2.656 17.830 22.192 1.00 87.76 C ATOM 1046 C GLN B 41 2.089 16.510 22.736 1.00 89.98 C ATOM 1047 O GLN B 41 0.891 16.277 22.617 1.00 91.54 O ATOM 1048 CB GLN B 41 2.084 18.077 20.781 1.00 89.76 C ATOM 1049 CG GLN B 41 0.714 18.785 20.730 1.00 90.28 C ATOM 1050 CD GLN B 41 0.793 20.292 21.058 1.00 93.86 C ATOM 1051 OE1 GLN B 41 1.849 20.922 20.923 1.00 96.83 O ATOM 1052 NE2 GLN B 41 -0.333 20.869 21.494 1.00 92.87 N ATOM 1053 N LEU B 42 2.919 15.655 23.332 1.00 91.65 N ATOM 1054 CA LEU B 42 2.489 14.298 23.680 1.00 93.52 C ATOM 1055 C LEU B 42 1.983 14.208 25.116 1.00 96.72 C ATOM 1056 O LEU B 42 0.964 13.554 25.386 1.00 97.59 O ATOM 1057 CB LEU B 42 3.636 13.311 23.469 1.00 93.15 C ATOM 1058 CG LEU B 42 3.293 11.826 23.561 1.00 93.32 C ATOM 1059 CD1 LEU B 42 2.043 11.462 22.729 1.00 94.27 C ATOM 1060 CD2 LEU B 42 4.507 11.012 23.142 1.00 92.23 C ATOM 1061 N ASN B 43 2.717 14.847 26.029 1.00 99.14 N ATOM 1062 CA ASN B 43 2.301 15.012 27.433 1.00101.45 C ATOM 1063 C ASN B 43 2.093 13.709 28.214 1.00102.37 C ATOM 1064 O ASN B 43 1.011 13.470 28.783 1.00102.79 O ATOM 1065 CB ASN B 43 1.046 15.907 27.521 1.00103.73 C ATOM 1066 CG ASN B 43 1.297 17.325 27.003 1.00105.01 C ATOM 1067 OD1 ASN B 43 2.377 17.634 26.484 1.00105.76 O ATOM 1068 ND2 ASN B 43 0.294 18.193 27.145 1.00103.93 N ATOM 1069 N GLY B 44 3.147 12.885 28.242 1.00101.84 N ATOM 1070 CA GLY B 44 3.155 11.607 28.968 1.00102.07 C ATOM 1071 C GLY B 44 2.034 10.651 28.579 1.00103.46 C ATOM 1072 O GLY B 44 1.536 9.896 29.419 1.00105.36 O ATOM 1073 N GLN B 45 1.621 10.703 27.314 1.00102.41 N ATOM 1074 CA GLN B 45 0.613 9.801 26.781 1.00100.10 C ATOM 1075 C GLN B 45 1.396 8.709 26.079 1.00 97.59 C ATOM 1076 O GLN B 45 2.402 9.004 25.449 1.00 97.62 O ATOM 1077 CB GLN B 45 -0.314 10.548 25.807 1.00102.27 C ATOM 1078 CG GLN B 45 -1.283 9.648 25.037 1.00104.12 C ATOM 1079 CD GLN B 45 -1.966 8.609 25.933 1.00105.90 C ATOM 1080 OE1 GLN B 45 -1.607 7.423 25.922 1.00104.83 O ATOM 1081 NE2 GLN B 45 -2.937 9.059 26.730 1.00106.60 N ATOM 1082 N ASP B 46 0.963 7.455 26.190 1.00 95.08 N ATOM 1083 CA ASP B 46 1.770 6.344 25.663 1.00 93.79 C ATOM 1084 C ASP B 46 1.669 6.181 24.122 1.00 92.65 C ATOM 1085 O ASP B 46 0.621 6.445 23.502 1.00 91.40 O ATOM 1086 CB ASP B 46 1.530 5.023 26.453 1.00 93.35 C ATOM 1087 CG ASP B 46 0.817 3.946 25.644 1.00 93.64 C ATOM 1088 OD1 ASP B 46 -0.376 4.121 25.334 1.00 96.12 O ATOM 1089 OD2 ASP B 46 1.443 2.906 25.342 1.00 91.97 O ATOM 1090 N VAL B 47 2.799 5.753 23.547 1.00 89.80 N ATOM 1091 CA VAL B 47 3.026 5.616 22.111 1.00 87.11 C ATOM 1092 C VAL B 47 3.531 4.203 21.828 1.00 84.62 C ATOM 1093 O VAL B 47 4.395 3.723 22.548 1.00 84.59 O ATOM 1094 CB VAL B 47 4.146 6.581 21.682 1.00 85.93 C ATOM 1095 CG1 VAL B 47 4.093 6.839 20.179 1.00 87.37 C ATOM 1096 CG2 VAL B 47 4.054 7.878 22.466 1.00 84.76 C ATOM 1097 N ASN B 48 3.040 3.515 20.803 1.00 83.49 N ATOM 1098 CA ASN B 48 3.658 2.208 20.489 1.00 84.29 C ATOM 1099 C ASN B 48 3.638 1.768 19.014 1.00 84.52 C ATOM 1100 O ASN B 48 3.640 0.562 18.690 1.00 84.71 O ATOM 1101 CB ASN B 48 3.141 1.112 21.449 1.00 82.03 C ATOM 1102 CG ASN B 48 1.875 0.442 20.977 1.00 78.62 C ATOM 1103 OD1 ASN B 48 1.089 0.997 20.207 1.00 74.41 O ATOM 1104 ND2 ASN B 48 1.678 -0.782 21.444 1.00 77.65 N ATOM 1105 N ASP B 49 3.661 2.758 18.128 1.00 82.94 N ATOM 1106 CA ASP B 49 3.687 2.495 16.693 1.00 82.82 C ATOM 1107 C ASP B 49 4.249 3.695 15.926 1.00 79.00 C ATOM 1108 O ASP B 49 3.662 4.163 14.963 1.00 78.68 O ATOM 1109 CB ASP B 49 2.292 2.054 16.171 1.00 89.82 C ATOM 1110 CG ASP B 49 1.131 2.487 17.086 1.00 95.75 C ATOM 1111 OD1 ASP B 49 1.197 3.616 17.642 1.00101.46 O ATOM 1112 OD2 ASP B 49 0.156 1.692 17.238 1.00 97.61 O ATOM 1113 N LEU B 50 5.417 4.163 16.361 1.00 75.15 N ATOM 1114 CA LEU B 50 6.040 5.361 15.819 1.00 71.76 C ATOM 1115 C LEU B 50 6.682 5.062 14.497 1.00 70.11 C ATOM 1116 O LEU B 50 6.682 5.907 13.609 1.00 71.78 O ATOM 1117 CB LEU B 50 7.095 5.913 16.787 1.00 70.85 C ATOM 1118 CG LEU B 50 7.544 7.370 16.597 1.00 71.37 C ATOM 1119 CD1 LEU B 50 6.348 8.296 16.586 1.00 71.86 C ATOM 1120 CD2 LEU B 50 8.531 7.814 17.671 1.00 69.10 C ATOM 1121 N TYR B 51 7.247 3.866 14.360 1.00 70.45 N ATOM 1122 CA TYR B 51 7.886 3.489 13.112 1.00 69.23 C ATOM 1123 C TYR B 51 6.847 3.500 12.004 1.00 70.62 C ATOM 1124 O TYR B 51 7.018 4.184 11.015 1.00 74.39 O ATOM 1125 CB TYR B 51 8.555 2.132 13.206 1.00 70.22 C ATOM 1126 CG TYR B 51 9.497 1.909 12.054 1.00 71.75 C ATOM 1127 CD1 TYR B 51 10.767 2.470 12.050 1.00 73.45 C ATOM 1128 CD2 TYR B 51 9.110 1.176 10.944 1.00 72.19 C ATOM 1129 CE1 TYR B 51 11.634 2.288 10.975 1.00 72.04 C ATOM 1130 CE2 TYR B 51 9.958 0.994 9.872 1.00 70.98 C ATOM 1131 CZ TYR B 51 11.216 1.548 9.888 1.00 71.80 C ATOM 1132 OH TYR B 51 12.061 1.355 8.812 1.00 72.53 O ATOM 1133 N GLU B 52 5.742 2.790 12.188 1.00 70.77 N ATOM 1134 CA GLU B 52 4.732 2.705 11.143 1.00 70.90 C ATOM 1135 C GLU B 52 4.089 4.051 10.892 1.00 70.97 C ATOM 1136 O GLU B 52 3.694 4.346 9.782 1.00 75.07 O ATOM 1137 CB GLU B 52 3.680 1.632 11.452 1.00 75.14 C ATOM 1138 CG GLU B 52 3.832 0.316 10.622 1.00 80.41 C ATOM 1139 CD GLU B 52 5.244 -0.354 10.691 1.00 85.23 C ATOM 1140 OE1 GLU B 52 5.943 -0.328 9.641 1.00 85.95 O ATOM 1141 OE2 GLU B 52 5.648 -0.914 11.764 1.00 87.28 O ATOM 1142 N LEU B 53 3.998 4.889 11.911 1.00 71.72 N ATOM 1143 CA LEU B 53 3.397 6.226 11.743 1.00 69.08 C ATOM 1144 C LEU B 53 4.223 7.076 10.794 1.00 66.45 C ATOM 1145 O LEU B 53 3.668 7.676 9.875 1.00 66.64 O ATOM 1146 CB LEU B 53 3.288 6.952 13.079 1.00 67.82 C ATOM 1147 CG LEU B 53 2.329 8.120 13.037 1.00 69.25 C ATOM 1148 CD1 LEU B 53 0.944 7.658 13.519 1.00 70.29 C ATOM 1149 CD2 LEU B 53 2.859 9.257 13.866 1.00 68.86 C ATOM 1150 N VAL B 54 5.537 7.107 11.035 1.00 62.63 N ATOM 1151 CA VAL B 54 6.468 7.894 10.247 1.00 63.06 C ATOM 1152 C VAL B 54 6.501 7.325 8.856 1.00 62.86 C ATOM 1153 O VAL B 54 6.180 8.015 7.903 1.00 66.67 O ATOM 1154 CB VAL B 54 7.885 7.849 10.834 1.00 62.69 C ATOM 1155 CG1 VAL B 54 8.912 8.426 9.861 1.00 60.74 C ATOM 1156 CG2 VAL B 54 7.939 8.579 12.156 1.00 63.37 C ATOM 1157 N LEU B 55 6.856 6.053 8.751 1.00 62.66 N ATOM 1158 CA LEU B 55 6.851 5.314 7.480 1.00 63.55 C ATOM 1159 C LEU B 55 5.620 5.615 6.610 1.00 64.09 C ATOM 1160 O LEU B 55 5.733 5.880 5.429 1.00 66.87 O ATOM 1161 CB LEU B 55 6.910 3.808 7.773 1.00 63.63 C ATOM 1162 CG LEU B 55 7.316 2.788 6.702 1.00 63.64 C ATOM 1163 CD1 LEU B 55 8.853 2.568 6.609 1.00 61.69 C ATOM 1164 CD2 LEU B 55 6.606 1.466 7.001 1.00 64.11 C ATOM 1165 N ALA B 56 4.440 5.587 7.190 1.00 64.20 N ATOM 1166 CA ALA B 56 3.270 5.947 6.441 1.00 65.20 C ATOM 1167 C ALA B 56 3.407 7.361 5.939 1.00 64.80 C ATOM 1168 O ALA B 56 3.003 7.659 4.836 1.00 67.53 O ATOM 1169 CB ALA B 56 2.028 5.827 7.297 1.00 68.18 C ATOM 1170 N GLU B 57 3.956 8.250 6.746 1.00 66.48 N ATOM 1171 CA GLU B 57 3.944 9.665 6.378 1.00 68.66 C ATOM 1172 C GLU B 57 5.009 9.920 5.323 1.00 67.56 C ATOM 1173 O GLU B 57 5.051 10.978 4.743 1.00 70.59 O ATOM 1174 CB GLU B 57 4.114 10.588 7.611 1.00 71.33 C ATOM 1175 CG GLU B 57 3.674 12.073 7.422 1.00 71.52 C ATOM 1176 CD GLU B 57 2.167 12.322 7.671 1.00 78.00 C ATOM 1177 OE1 GLU B 57 1.385 11.329 7.723 1.00 81.74 O ATOM 1178 OE2 GLU B 57 1.759 13.520 7.810 1.00 77.26 O ATOM 1179 N VAL B 58 5.838 8.937 5.039 1.00 65.62 N ATOM 1180 CA VAL B 58 6.910 9.113 4.078 1.00 66.89 C ATOM 1181 C VAL B 58 6.702 8.256 2.823 1.00 67.31 C ATOM 1182 O VAL B 58 6.833 8.760 1.721 1.00 71.68 O ATOM 1183 CB VAL B 58 8.269 8.827 4.757 1.00 69.87 C ATOM 1184 CG1 VAL B 58 9.231 8.042 3.849 1.00 67.25 C ATOM 1185 CG2 VAL B 58 8.856 10.140 5.242 1.00 72.13 C ATOM 1186 N GLU B 59 6.375 6.978 2.963 1.00 63.76 N ATOM 1187 CA GLU B 59 6.033 6.167 1.795 1.00 62.43 C ATOM 1188 C GLU B 59 4.962 6.813 0.899 1.00 62.01 C ATOM 1189 O GLU B 59 5.096 6.807 -0.304 1.00 61.44 O ATOM 1190 CB GLU B 59 5.535 4.787 2.218 1.00 60.45 C ATOM 1191 CG GLU B 59 6.597 3.766 2.432 1.00 60.61 C ATOM 1192 CD GLU B 59 6.033 2.378 2.758 1.00 63.31 C ATOM 1193 OE1 GLU B 59 6.838 1.406 2.826 1.00 61.60 O ATOM 1194 OE2 GLU B 59 4.791 2.263 2.956 1.00 63.64 O ATOM 1195 N GLN B 60 3.896 7.356 1.473 1.00 63.67 N ATOM 1196 CA GLN B 60 2.791 7.840 0.663 1.00 67.26 C ATOM 1197 C GLN B 60 3.214 8.826 -0.404 1.00 68.02 C ATOM 1198 O GLN B 60 2.948 8.597 -1.564 1.00 69.65 O ATOM 1199 CB GLN B 60 1.681 8.412 1.525 1.00 70.13 C ATOM 1200 CG GLN B 60 0.908 7.292 2.208 1.00 73.96 C ATOM 1201 CD GLN B 60 -0.353 7.782 2.906 1.00 76.20 C ATOM 1202 OE1 GLN B 60 -1.178 8.485 2.312 1.00 78.54 O ATOM 1203 NE2 GLN B 60 -0.509 7.405 4.178 1.00 80.77 N ATOM 1204 N PRO B 61 3.904 9.906 -0.031 1.00 68.72 N ATOM 1205 CA PRO B 61 4.327 10.888 -1.018 1.00 68.01 C ATOM 1206 C PRO B 61 5.466 10.447 -1.907 1.00 67.72 C ATOM 1207 O PRO B 61 5.599 10.957 -3.011 1.00 73.93 O ATOM 1208 CB PRO B 61 4.802 12.069 -0.171 1.00 69.36 C ATOM 1209 CG PRO B 61 4.359 11.784 1.161 1.00 70.48 C ATOM 1210 CD PRO B 61 4.338 10.320 1.299 1.00 70.41 C ATOM 1211 N LEU B 62 6.310 9.551 -1.437 1.00 63.72 N ATOM 1212 CA LEU B 62 7.285 8.945 -2.328 1.00 61.21 C ATOM 1213 C LEU B 62 6.519 8.210 -3.414 1.00 57.67 C ATOM 1214 O LEU B 62 6.797 8.367 -4.568 1.00 58.68 O ATOM 1215 CB LEU B 62 8.195 7.979 -1.570 1.00 60.99 C ATOM 1216 CG LEU B 62 9.170 7.210 -2.431 1.00 60.32 C ATOM 1217 CD1 LEU B 62 10.076 8.218 -3.105 1.00 58.04 C ATOM 1218 CD2 LEU B 62 9.913 6.218 -1.567 1.00 57.03 C ATOM 1219 N LEU B 63 5.525 7.429 -3.051 1.00 56.61 N ATOM 1220 CA LEU B 63 4.780 6.702 -4.054 1.00 58.74 C ATOM 1221 C LEU B 63 4.031 7.677 -4.934 1.00 60.56 C ATOM 1222 O LEU B 63 4.063 7.561 -6.136 1.00 60.32 O ATOM 1223 CB LEU B 63 3.787 5.749 -3.412 1.00 55.31 C ATOM 1224 CG LEU B 63 4.338 4.647 -2.520 1.00 53.46 C ATOM 1225 CD1 LEU B 63 3.186 4.164 -1.587 1.00 51.92 C ATOM 1226 CD2 LEU B 63 4.958 3.535 -3.350 1.00 47.61 C ATOM 1227 N ASP B 64 3.331 8.615 -4.303 1.00 67.34 N ATOM 1228 CA ASP B 64 2.576 9.671 -4.983 1.00 65.17 C ATOM 1229 C ASP B 64 3.512 10.228 -6.027 1.00 62.40 C ATOM 1230 O ASP B 64 3.273 10.108 -7.206 1.00 63.24 O ATOM 1231 CB ASP B 64 2.191 10.763 -3.961 1.00 71.49 C ATOM 1232 CG ASP B 64 0.863 11.470 -4.260 1.00 76.00 C ATOM 1233 OD1 ASP B 64 0.548 11.846 -5.427 1.00 80.75 O ATOM 1234 OD2 ASP B 64 0.147 11.709 -3.259 1.00 82.39 O ATOM 1235 N MET B 65 4.625 10.777 -5.596 1.00 60.07 N ATOM 1236 CA MET B 65 5.467 11.480 -6.513 1.00 62.42 C ATOM 1237 C MET B 65 6.090 10.587 -7.598 1.00 61.88 C ATOM 1238 O MET B 65 6.188 10.990 -8.733 1.00 63.09 O ATOM 1239 CB MET B 65 6.555 12.189 -5.746 1.00 67.94 C ATOM 1240 CG MET B 65 6.869 13.532 -6.275 1.00 74.33 C ATOM 1241 SD MET B 65 5.441 14.565 -6.028 1.00 82.69 S ATOM 1242 CE MET B 65 4.709 14.527 -7.674 1.00 86.38 C ATOM 1243 N VAL B 66 6.502 9.378 -7.257 1.00 60.79 N ATOM 1244 CA VAL B 66 7.153 8.485 -8.220 1.00 59.03 C ATOM 1245 C VAL B 66 6.246 8.005 -9.360 1.00 59.20 C ATOM 1246 O VAL B 66 6.703 7.806 -10.477 1.00 59.25 O ATOM 1247 CB VAL B 66 7.781 7.283 -7.496 1.00 56.25 C ATOM 1248 CG1 VAL B 66 7.923 6.074 -8.417 1.00 53.63 C ATOM 1249 CG2 VAL B 66 9.131 7.709 -6.900 1.00 56.03 C ATOM 1250 N MET B 67 4.966 7.816 -9.075 1.00 63.28 N ATOM 1251 CA MET B 67 4.001 7.341 -10.069 1.00 63.00 C ATOM 1252 C MET B 67 3.669 8.452 -11.018 1.00 63.46 C ATOM 1253 O MET B 67 3.538 8.201 -12.198 1.00 67.66 O ATOM 1254 CB MET B 67 2.712 6.857 -9.404 1.00 65.93 C ATOM 1255 CG MET B 67 2.867 5.578 -8.589 1.00 67.41 C ATOM 1256 SD MET B 67 3.259 4.138 -9.612 1.00 68.78 S ATOM 1257 CE MET B 67 1.614 3.517 -10.023 1.00 70.12 C ATOM 1258 N GLN B 68 3.526 9.674 -10.514 1.00 62.35 N ATOM 1259 CA GLN B 68 3.516 10.854 -11.392 1.00 63.88 C ATOM 1260 C GLN B 68 4.698 10.920 -12.346 1.00 61.14 C ATOM 1261 O GLN B 68 4.515 11.157 -13.525 1.00 62.33 O ATOM 1262 CB GLN B 68 3.462 12.153 -10.595 1.00 66.57 C ATOM 1263 CG GLN B 68 2.060 12.485 -10.169 1.00 69.68 C ATOM 1264 CD GLN B 68 2.001 13.712 -9.339 1.00 71.16 C ATOM 1265 OE1 GLN B 68 1.395 13.692 -8.255 1.00 77.20 O ATOM 1266 NE2 GLN B 68 2.641 14.804 -9.815 1.00 70.12 N ATOM 1267 N TYR B 69 5.906 10.712 -11.843 1.00 59.47 N ATOM 1268 CA TYR B 69 7.068 10.705 -12.698 1.00 59.99 C ATOM 1269 C TYR B 69 7.041 9.635 -13.780 1.00 59.31 C ATOM 1270 O TYR B 69 7.475 9.901 -14.875 1.00 63.26 O ATOM 1271 CB TYR B 69 8.298 10.499 -11.879 1.00 66.30 C ATOM 1272 CG TYR B 69 9.575 10.748 -12.614 1.00 68.64 C ATOM 1273 CD1 TYR B 69 10.032 12.034 -12.807 1.00 70.95 C ATOM 1274 CD2 TYR B 69 10.343 9.704 -13.075 1.00 69.95 C ATOM 1275 CE1 TYR B 69 11.209 12.284 -13.452 1.00 70.57 C ATOM 1276 CE2 TYR B 69 11.523 9.935 -13.717 1.00 70.48 C ATOM 1277 CZ TYR B 69 11.958 11.235 -13.902 1.00 70.47 C ATOM 1278 OH TYR B 69 13.155 11.494 -14.548 1.00 71.47 O ATOM 1279 N THR B 70 6.563 8.432 -13.498 1.00 54.56 N ATOM 1280 CA THR B 70 6.599 7.402 -14.506 1.00 56.36 C ATOM 1281 C THR B 70 5.253 7.316 -15.202 1.00 58.21 C ATOM 1282 O THR B 70 4.852 6.262 -15.728 1.00 56.87 O ATOM 1283 CB THR B 70 7.022 6.059 -13.919 1.00 56.94 C ATOM 1284 OG1 THR B 70 6.054 5.628 -12.973 1.00 58.39 O ATOM 1285 CG2 THR B 70 8.372 6.184 -13.220 1.00 58.84 C ATOM 1286 N ARG B 71 4.550 8.448 -15.206 1.00 62.02 N ATOM 1287 CA ARG B 71 3.238 8.592 -15.861 1.00 61.89 C ATOM 1288 C ARG B 71 2.330 7.376 -15.571 1.00 58.82 C ATOM 1289 O ARG B 71 1.536 7.001 -16.398 1.00 61.49 O ATOM 1290 CB ARG B 71 3.424 8.838 -17.381 1.00 67.92 C ATOM 1291 CG ARG B 71 4.230 10.142 -17.859 1.00 74.85 C ATOM 1292 CD ARG B 71 5.818 10.133 -17.617 1.00 81.35 C ATOM 1293 NE ARG B 71 6.706 9.504 -18.642 1.00 83.84 N ATOM 1294 CZ ARG B 71 8.063 9.555 -18.666 1.00 82.67 C ATOM 1295 NH1 ARG B 71 8.777 10.199 -17.739 1.00 83.71 N ATOM 1296 NH2 ARG B 71 8.734 8.944 -19.638 1.00 84.89 N ATOM 1297 N GLY B 72 2.463 6.784 -14.384 1.00 57.45 N ATOM 1298 CA GLY B 72 1.731 5.582 -13.968 1.00 57.84 C ATOM 1299 C GLY B 72 2.329 4.193 -14.259 1.00 58.84 C ATOM 1300 O GLY B 72 1.659 3.173 -14.066 1.00 60.94 O ATOM 1301 N ASN B 73 3.568 4.115 -14.730 1.00 57.83 N ATOM 1302 CA ASN B 73 4.172 2.816 -15.042 1.00 56.86 C ATOM 1303 C ASN B 73 4.767 2.202 -13.802 1.00 56.67 C ATOM 1304 O ASN B 73 5.692 2.761 -13.220 1.00 61.14 O ATOM 1305 CB ASN B 73 5.276 2.995 -16.083 1.00 57.98 C ATOM 1306 CG ASN B 73 5.839 1.677 -16.594 1.00 57.97 C ATOM 1307 OD1 ASN B 73 5.807 0.642 -15.910 1.00 57.67 O ATOM 1308 ND2 ASN B 73 6.383 1.720 -17.810 1.00 57.56 N ATOM 1309 N GLN B 74 4.274 1.038 -13.413 1.00 56.69 N ATOM 1310 CA GLN B 74 4.775 0.350 -12.218 1.00 56.21 C ATOM 1311 C GLN B 74 6.172 -0.235 -12.430 1.00 57.06 C ATOM 1312 O GLN B 74 7.101 0.088 -11.696 1.00 59.52 O ATOM 1313 CB GLN B 74 3.793 -0.729 -11.762 1.00 54.56 C ATOM 1314 CG GLN B 74 2.465 -0.127 -11.376 1.00 55.32 C ATOM 1315 CD GLN B 74 1.436 -1.112 -10.873 1.00 56.35 C ATOM 1316 OE1 GLN B 74 1.597 -2.333 -10.945 1.00 58.64 O ATOM 1317 NE2 GLN B 74 0.359 -0.574 -10.346 1.00 57.20 N ATOM 1318 N THR B 75 6.337 -1.069 -13.441 1.00 56.14 N ATOM 1319 CA THR B 75 7.636 -1.642 -13.696 1.00 56.74 C ATOM 1320 C THR B 75 8.725 -0.565 -13.549 1.00 57.38 C ATOM 1321 O THR B 75 9.726 -0.772 -12.857 1.00 57.05 O ATOM 1322 CB THR B 75 7.670 -2.277 -15.086 1.00 57.09 C ATOM 1323 OG1 THR B 75 6.688 -3.320 -15.153 1.00 58.37 O ATOM 1324 CG2 THR B 75 9.039 -2.869 -15.376 1.00 57.36 C ATOM 1325 N ARG B 76 8.515 0.592 -14.172 1.00 57.15 N ATOM 1326 CA ARG B 76 9.481 1.679 -14.072 1.00 60.78 C ATOM 1327 C ARG B 76 9.596 2.152 -12.632 1.00 53.89 C ATOM 1328 O ARG B 76 10.671 2.228 -12.060 1.00 50.74 O ATOM 1329 CB ARG B 76 9.082 2.873 -14.957 1.00 65.84 C ATOM 1330 CG ARG B 76 9.150 2.625 -16.477 1.00 70.10 C ATOM 1331 CD ARG B 76 9.948 3.739 -17.210 1.00 73.39 C ATOM 1332 NE ARG B 76 9.355 5.084 -17.102 1.00 76.59 N ATOM 1333 CZ ARG B 76 10.054 6.227 -17.045 1.00 79.68 C ATOM 1334 NH1 ARG B 76 11.388 6.212 -17.061 1.00 81.40 N ATOM 1335 NH2 ARG B 76 9.427 7.404 -16.952 1.00 78.46 N ATOM 1336 N ALA B 77 8.459 2.480 -12.057 1.00 49.60 N ATOM 1337 CA ALA B 77 8.421 2.915 -10.693 1.00 47.19 C ATOM 1338 C ALA B 77 9.146 1.935 -9.764 1.00 46.11 C ATOM 1339 O ALA B 77 9.995 2.336 -8.985 1.00 46.83 O ATOM 1340 CB ALA B 77 7.016 3.100 -10.281 1.00 43.95 C ATOM 1341 N ALA B 78 8.850 0.648 -9.855 1.00 46.34 N ATOM 1342 CA ALA B 78 9.486 -0.310 -8.942 1.00 48.88 C ATOM 1343 C ALA B 78 10.983 -0.396 -9.190 1.00 51.38 C ATOM 1344 O ALA B 78 11.768 -0.446 -8.245 1.00 52.01 O ATOM 1345 CB ALA B 78 8.844 -1.682 -9.029 1.00 43.86 C ATOM 1346 N LEU B 79 11.375 -0.407 -10.462 1.00 56.09 N ATOM 1347 CA LEU B 79 12.791 -0.420 -10.818 1.00 57.43 C ATOM 1348 C LEU B 79 13.443 0.811 -10.271 1.00 60.28 C ATOM 1349 O LEU B 79 14.561 0.769 -9.775 1.00 61.94 O ATOM 1350 CB LEU B 79 12.979 -0.396 -12.329 1.00 60.31 C ATOM 1351 CG LEU B 79 12.966 -1.735 -13.051 1.00 63.41 C ATOM 1352 CD1 LEU B 79 13.389 -1.490 -14.498 1.00 64.60 C ATOM 1353 CD2 LEU B 79 13.884 -2.755 -12.367 1.00 63.81 C ATOM 1354 N MET B 80 12.722 1.914 -10.399 1.00 61.48 N ATOM 1355 CA MET B 80 13.196 3.205 -10.010 1.00 63.25 C ATOM 1356 C MET B 80 13.423 3.296 -8.483 1.00 61.57 C ATOM 1357 O MET B 80 14.382 3.885 -8.026 1.00 61.71 O ATOM 1358 CB MET B 80 12.190 4.219 -10.516 1.00 66.42 C ATOM 1359 CG MET B 80 12.490 5.629 -10.198 1.00 69.96 C ATOM 1360 SD MET B 80 11.626 6.718 -11.357 1.00 76.08 S ATOM 1361 CE MET B 80 12.029 8.316 -10.604 1.00 76.65 C ATOM 1362 N MET B 81 12.578 2.677 -7.685 1.00 59.74 N ATOM 1363 CA MET B 81 12.793 2.704 -6.252 1.00 59.35 C ATOM 1364 C MET B 81 13.770 1.632 -5.766 1.00 61.09 C ATOM 1365 O MET B 81 14.359 1.735 -4.681 1.00 65.50 O ATOM 1366 CB MET B 81 11.463 2.517 -5.582 1.00 56.77 C ATOM 1367 CG MET B 81 10.676 3.733 -5.702 1.00 58.45 C ATOM 1368 SD MET B 81 9.020 3.398 -5.222 1.00 64.33 S ATOM 1369 CE MET B 81 9.137 3.342 -3.427 1.00 66.18 C ATOM 1370 N GLY B 82 13.921 0.578 -6.546 1.00 58.93 N ATOM 1371 CA GLY B 82 14.779 -0.506 -6.159 1.00 57.59 C ATOM 1372 C GLY B 82 14.047 -1.590 -5.407 1.00 57.69 C ATOM 1373 O GLY B 82 14.679 -2.400 -4.721 1.00 63.54 O ATOM 1374 N ILE B 83 12.732 -1.661 -5.577 1.00 54.24 N ATOM 1375 CA ILE B 83 11.931 -2.698 -4.900 1.00 52.50 C ATOM 1376 C ILE B 83 11.184 -3.607 -5.893 1.00 48.13 C ATOM 1377 O ILE B 83 10.797 -3.137 -6.949 1.00 48.03 O ATOM 1378 CB ILE B 83 10.944 -2.040 -3.875 1.00 51.34 C ATOM 1379 CG1 ILE B 83 9.863 -1.200 -4.574 1.00 49.14 C ATOM 1380 CG2 ILE B 83 11.727 -1.200 -2.871 1.00 50.75 C ATOM 1381 CD1 ILE B 83 9.070 -0.346 -3.652 1.00 49.45 C ATOM 1382 N ASN B 84 10.986 -4.883 -5.546 1.00 47.14 N ATOM 1383 CA ASN B 84 10.233 -5.860 -6.382 1.00 49.33 C ATOM 1384 C ASN B 84 8.975 -5.225 -6.891 1.00 48.49 C ATOM 1385 O ASN B 84 8.393 -4.397 -6.197 1.00 50.35 O ATOM 1386 CB ASN B 84 9.827 -7.105 -5.564 1.00 52.21 C ATOM 1387 CG ASN B 84 9.530 -8.351 -6.430 1.00 52.74 C ATOM 1388 OD1 ASN B 84 10.452 -8.971 -6.946 1.00 56.48 O ATOM 1389 ND2 ASN B 84 8.254 -8.759 -6.518 1.00 52.04 N ATOM 1390 N ARG B 85 8.541 -5.600 -8.089 1.00 49.45 N ATOM 1391 CA ARG B 85 7.309 -5.013 -8.660 1.00 50.54 C ATOM 1392 C ARG B 85 6.076 -5.345 -7.815 1.00 49.53 C ATOM 1393 O ARG B 85 5.133 -4.573 -7.745 1.00 48.25 O ATOM 1394 CB ARG B 85 7.107 -5.482 -10.118 1.00 51.86 C ATOM 1395 CG ARG B 85 5.796 -5.009 -10.793 1.00 51.59 C ATOM 1396 CD ARG B 85 5.837 -5.181 -12.309 1.00 51.59 C ATOM 1397 NE ARG B 85 6.149 -6.547 -12.695 1.00 52.34 N ATOM 1398 CZ ARG B 85 5.247 -7.521 -12.837 1.00 54.96 C ATOM 1399 NH1 ARG B 85 3.959 -7.267 -12.630 1.00 55.26 N ATOM 1400 NH2 ARG B 85 5.628 -8.756 -13.203 1.00 53.75 N ATOM 1401 N GLY B 86 6.098 -6.504 -7.172 1.00 50.53 N ATOM 1402 CA GLY B 86 4.958 -6.980 -6.413 1.00 51.55 C ATOM 1403 C GLY B 86 4.765 -6.271 -5.097 1.00 52.87 C ATOM 1404 O GLY B 86 3.637 -6.105 -4.630 1.00 54.20 O ATOM 1405 N THR B 87 5.859 -5.850 -4.481 1.00 53.64 N ATOM 1406 CA THR B 87 5.728 -5.185 -3.206 1.00 54.16 C ATOM 1407 C THR B 87 5.329 -3.745 -3.444 1.00 52.65 C ATOM 1408 O THR B 87 4.743 -3.118 -2.575 1.00 51.70 O ATOM 1409 CB THR B 87 7.003 -5.237 -2.322 1.00 57.01 C ATOM 1410 OG1 THR B 87 7.626 -3.952 -2.304 1.00 57.85 O ATOM 1411 CG2 THR B 87 7.999 -6.350 -2.752 1.00 58.21 C ATOM 1412 N LEU B 88 5.657 -3.214 -4.616 1.00 52.59 N ATOM 1413 CA LEU B 88 5.253 -1.857 -4.950 1.00 53.47 C ATOM 1414 C LEU B 88 3.789 -1.862 -5.071 1.00 56.43 C ATOM 1415 O LEU B 88 3.124 -0.923 -4.711 1.00 59.57 O ATOM 1416 CB LEU B 88 5.794 -1.425 -6.297 1.00 53.60 C ATOM 1417 CG LEU B 88 5.144 -0.203 -6.946 1.00 51.10 C ATOM 1418 CD1 LEU B 88 5.273 0.980 -6.070 1.00 52.20 C ATOM 1419 CD2 LEU B 88 5.851 0.067 -8.218 1.00 52.73 C ATOM 1420 N ARG B 89 3.282 -2.939 -5.621 1.00 60.59 N ATOM 1421 CA ARG B 89 1.897 -2.997 -5.937 1.00 64.16 C ATOM 1422 C ARG B 89 1.156 -3.239 -4.636 1.00 61.20 C ATOM 1423 O ARG B 89 0.065 -2.723 -4.428 1.00 59.85 O ATOM 1424 CB ARG B 89 1.727 -4.042 -7.025 1.00 66.62 C ATOM 1425 CG ARG B 89 0.507 -4.904 -6.977 1.00 72.71 C ATOM 1426 CD ARG B 89 0.659 -5.967 -8.072 1.00 73.78 C ATOM 1427 NE ARG B 89 0.667 -5.284 -9.350 1.00 74.12 N ATOM 1428 CZ ARG B 89 -0.407 -5.147 -10.111 1.00 76.40 C ATOM 1429 NH1 ARG B 89 -1.568 -5.702 -9.755 1.00 76.38 N ATOM 1430 NH2 ARG B 89 -0.312 -4.472 -11.252 1.00 77.40 N ATOM 1431 N LYS B 90 1.799 -3.957 -3.727 1.00 62.61 N ATOM 1432 CA LYS B 90 1.255 -4.173 -2.385 1.00 64.33 C ATOM 1433 C LYS B 90 1.193 -2.890 -1.564 1.00 62.43 C ATOM 1434 O LYS B 90 0.173 -2.599 -0.953 1.00 61.41 O ATOM 1435 CB LYS B 90 2.093 -5.217 -1.658 1.00 66.57 C ATOM 1436 CG LYS B 90 1.868 -5.348 -0.161 1.00 67.26 C ATOM 1437 CD LYS B 90 3.081 -6.088 0.435 1.00 69.83 C ATOM 1438 CE LYS B 90 2.858 -6.748 1.822 1.00 70.45 C ATOM 1439 NZ LYS B 90 4.035 -7.644 2.180 1.00 70.52 N ATOM 1440 N LYS B 91 2.296 -2.148 -1.532 1.00 61.45 N ATOM 1441 CA LYS B 91 2.330 -0.824 -0.904 1.00 61.45 C ATOM 1442 C LYS B 91 1.268 0.089 -1.474 1.00 60.61 C ATOM 1443 O LYS B 91 0.683 0.875 -0.745 1.00 60.41 O ATOM 1444 CB LYS B 91 3.696 -0.140 -1.094 1.00 61.77 C ATOM 1445 CG LYS B 91 4.730 -0.456 -0.010 1.00 63.40 C ATOM 1446 CD LYS B 91 6.143 -0.551 -0.595 1.00 64.69 C ATOM 1447 CE LYS B 91 7.264 -0.484 0.456 1.00 65.45 C ATOM 1448 NZ LYS B 91 6.986 -1.224 1.718 1.00 67.06 N ATOM 1449 N LEU B 92 1.044 0.006 -2.781 1.00 61.24 N ATOM 1450 CA LEU B 92 0.159 0.941 -3.458 1.00 62.38 C ATOM 1451 C LEU B 92 -1.257 0.684 -3.032 1.00 63.88 C ATOM 1452 O LEU B 92 -2.029 1.621 -2.863 1.00 62.16 O ATOM 1453 CB LEU B 92 0.246 0.789 -4.975 1.00 61.85 C ATOM 1454 CG LEU B 92 1.331 1.511 -5.777 1.00 61.22 C ATOM 1455 CD1 LEU B 92 1.209 1.050 -7.233 1.00 58.61 C ATOM 1456 CD2 LEU B 92 1.240 3.024 -5.639 1.00 56.95 C ATOM 1457 N LYS B 93 -1.586 -0.601 -2.895 1.00 69.42 N ATOM 1458 CA LYS B 93 -2.896 -1.046 -2.441 1.00 70.66 C ATOM 1459 C LYS B 93 -3.196 -0.499 -1.035 1.00 70.82 C ATOM 1460 O LYS B 93 -4.229 0.128 -0.804 1.00 67.26 O ATOM 1461 CB LYS B 93 -2.957 -2.586 -2.467 1.00 74.86 C ATOM 1462 CG LYS B 93 -4.403 -3.158 -2.463 1.00 77.12 C ATOM 1463 CD LYS B 93 -4.472 -4.695 -2.406 1.00 76.90 C ATOM 1464 CE LYS B 93 -5.913 -5.155 -2.225 1.00 78.44 C ATOM 1465 NZ LYS B 93 -5.995 -6.465 -1.509 1.00 80.32 N ATOM 1466 N LYS B 94 -2.253 -0.738 -0.124 1.00 72.58 N ATOM 1467 CA LYS B 94 -2.259 -0.231 1.252 1.00 70.73 C ATOM 1468 C LYS B 94 -2.663 1.204 1.405 1.00 66.20 C ATOM 1469 O LYS B 94 -3.379 1.514 2.312 1.00 69.42 O ATOM 1470 CB LYS B 94 -0.862 -0.371 1.858 1.00 73.43 C ATOM 1471 CG LYS B 94 -0.720 0.160 3.270 1.00 74.56 C ATOM 1472 CD LYS B 94 0.713 0.061 3.779 1.00 74.13 C ATOM 1473 CE LYS B 94 0.820 0.710 5.141 1.00 74.74 C ATOM 1474 NZ LYS B 94 2.160 1.256 5.379 1.00 77.43 N ATOM 1475 N TYR B 95 -2.166 2.090 0.569 1.00 65.21 N ATOM 1476 CA TYR B 95 -2.557 3.494 0.659 1.00 67.69 C ATOM 1477 C TYR B 95 -3.628 3.901 -0.351 1.00 66.54 C ATOM 1478 O TYR B 95 -3.964 5.079 -0.448 1.00 66.14 O ATOM 1479 CB TYR B 95 -1.350 4.417 0.499 1.00 67.26 C ATOM 1480 CG TYR B 95 -0.234 4.145 1.468 1.00 66.96 C ATOM 1481 CD1 TYR B 95 -0.349 4.479 2.797 1.00 67.66 C ATOM 1482 CD2 TYR B 95 0.951 3.569 1.043 1.00 68.21 C ATOM 1483 CE1 TYR B 95 0.692 4.249 3.685 1.00 68.43 C ATOM 1484 CE2 TYR B 95 1.995 3.330 1.927 1.00 67.78 C ATOM 1485 CZ TYR B 95 1.860 3.670 3.242 1.00 67.05 C ATOM 1486 OH TYR B 95 2.891 3.424 4.107 1.00 65.24 O ATOM 1487 N GLY B 96 -4.161 2.941 -1.094 1.00 67.44 N ATOM 1488 CA GLY B 96 -5.211 3.218 -2.074 1.00 70.21 C ATOM 1489 C GLY B 96 -4.795 4.102 -3.242 1.00 71.31 C ATOM 1490 O GLY B 96 -5.530 5.015 -3.613 1.00 72.28 O ATOM 1491 N MET B 97 -3.626 3.837 -3.823 1.00 72.80 N ATOM 1492 CA MET B 97 -3.124 4.640 -4.937 1.00 77.43 C ATOM 1493 C MET B 97 -3.247 3.887 -6.249 1.00 80.29 C ATOM 1494 O MET B 97 -2.756 4.322 -7.287 1.00 82.92 O ATOM 1495 CB MET B 97 -1.666 5.040 -4.695 1.00 78.05 C ATOM 1496 CG MET B 97 -1.427 5.689 -3.345 1.00 78.70 C ATOM 1497 SD MET B 97 0.212 6.401 -3.170 1.00 77.49 S ATOM 1498 CE MET B 97 -0.009 7.951 -4.046 1.00 79.39 C ATOM 1499 N ASN B 98 -3.921 2.755 -6.200 1.00 84.43 N ATOM 1500 CA ASN B 98 -4.156 1.954 -7.382 1.00 87.35 C ATOM 1501 C ASN B 98 -5.623 2.073 -7.846 1.00 90.76 C ATOM 1502 O ASN B 98 -5.954 2.881 -8.729 1.00 93.03 O ATOM 1503 CB ASN B 98 -3.809 0.496 -7.092 1.00 89.35 C ATOM 1504 CG ASN B 98 -4.775 -0.146 -6.121 1.00 89.59 C ATOM 1505 OD1 ASN B 98 -5.660 -0.902 -6.516 1.00 90.94 O ATOM 1506 ND2 ASN B 98 -4.623 0.171 -4.850 1.00 90.44 N TER 1507 ASN B 98 ATOM 1508 O5' DA C 1 0.734 -6.753 -38.528 1.00 85.86 O ATOM 1509 C5' DA C 1 2.146 -6.516 -38.444 1.00 87.83 C ATOM 1510 C4' DA C 1 2.871 -6.955 -37.163 1.00 85.31 C ATOM 1511 O4' DA C 1 2.657 -5.971 -36.109 1.00 84.67 O ATOM 1512 C3' DA C 1 2.469 -8.327 -36.607 1.00 83.62 C ATOM 1513 O3' DA C 1 3.563 -9.106 -35.962 1.00 82.54 O ATOM 1514 C2' DA C 1 1.324 -7.875 -35.679 1.00 83.15 C ATOM 1515 C1' DA C 1 1.858 -6.549 -35.084 1.00 81.03 C ATOM 1516 N9 DA C 1 0.887 -5.586 -34.465 1.00 78.82 N ATOM 1517 C8 DA C 1 -0.477 -5.689 -34.310 1.00 76.73 C ATOM 1518 N7 DA C 1 -1.039 -4.685 -33.667 1.00 74.48 N ATOM 1519 C5 DA C 1 0.022 -3.862 -33.364 1.00 74.59 C ATOM 1520 C6 DA C 1 0.111 -2.633 -32.684 1.00 75.97 C ATOM 1521 N6 DA C 1 -0.925 -1.998 -32.179 1.00 76.74 N ATOM 1522 N1 DA C 1 1.308 -2.053 -32.540 1.00 77.60 N ATOM 1523 C2 DA C 1 2.368 -2.706 -33.042 1.00 77.98 C ATOM 1524 N3 DA C 1 2.425 -3.871 -33.701 1.00 76.17 N ATOM 1525 C4 DA C 1 1.204 -4.400 -33.836 1.00 75.88 C ATOM 1526 P DA C 2 5.154 -8.764 -36.023 1.00 84.80 P ATOM 1527 OP1 DA C 2 5.992 -9.957 -35.743 1.00 81.75 O ATOM 1528 OP2 DA C 2 5.439 -8.035 -37.280 1.00 86.02 O ATOM 1529 O5' DA C 2 5.347 -7.718 -34.830 1.00 83.55 O ATOM 1530 C5' DA C 2 5.955 -6.465 -35.159 1.00 82.91 C ATOM 1531 C4' DA C 2 6.729 -5.867 -34.005 1.00 81.55 C ATOM 1532 O4' DA C 2 5.803 -5.098 -33.185 1.00 80.07 O ATOM 1533 C3' DA C 2 7.409 -6.888 -33.091 1.00 80.51 C ATOM 1534 O3' DA C 2 8.689 -6.380 -32.667 1.00 81.61 O ATOM 1535 C2' DA C 2 6.369 -7.084 -31.985 1.00 78.57 C ATOM 1536 C1' DA C 2 5.617 -5.747 -31.937 1.00 74.29 C ATOM 1537 N9 DA C 2 4.185 -5.882 -31.613 1.00 71.91 N ATOM 1538 C8 DA C 2 3.350 -6.920 -31.899 1.00 69.48 C ATOM 1539 N7 DA C 2 2.138 -6.730 -31.429 1.00 71.29 N ATOM 1540 C5 DA C 2 2.178 -5.502 -30.777 1.00 69.06 C ATOM 1541 C6 DA C 2 1.234 -4.719 -30.083 1.00 67.59 C ATOM 1542 N6 DA C 2 -0.029 -5.015 -29.864 1.00 67.85 N ATOM 1543 N1 DA C 2 1.631 -3.553 -29.603 1.00 69.13 N ATOM 1544 C2 DA C 2 2.888 -3.175 -29.770 1.00 69.22 C ATOM 1545 N3 DA C 2 3.857 -3.813 -30.396 1.00 68.70 N ATOM 1546 C4 DA C 2 3.438 -4.977 -30.887 1.00 69.32 C ATOM 1547 P DA C 3 9.515 -6.919 -31.398 1.00 83.74 P ATOM 1548 OP1 DA C 3 9.211 -8.334 -31.056 1.00 82.74 O ATOM 1549 OP2 DA C 3 10.932 -6.547 -31.618 1.00 82.54 O ATOM 1550 O5' DA C 3 8.860 -5.984 -30.282 1.00 83.58 O ATOM 1551 C5' DA C 3 9.110 -4.590 -30.354 1.00 83.67 C ATOM 1552 C4' DA C 3 8.610 -3.909 -29.101 1.00 84.14 C ATOM 1553 O4' DA C 3 7.173 -4.086 -28.893 1.00 81.86 O ATOM 1554 C3' DA C 3 9.284 -4.459 -27.856 1.00 85.16 C ATOM 1555 O3' DA C 3 9.719 -3.339 -27.095 1.00 90.37 O ATOM 1556 C2' DA C 3 8.188 -5.285 -27.176 1.00 82.20 C ATOM 1557 C1' DA C 3 6.946 -4.503 -27.562 1.00 78.34 C ATOM 1558 N9 DA C 3 5.729 -5.270 -27.579 1.00 75.64 N ATOM 1559 C8 DA C 3 5.571 -6.523 -28.055 1.00 76.29 C ATOM 1560 N7 DA C 3 4.343 -6.965 -27.958 1.00 76.42 N ATOM 1561 C5 DA C 3 3.665 -5.935 -27.395 1.00 74.41 C ATOM 1562 C6 DA C 3 2.325 -5.797 -27.045 1.00 75.85 C ATOM 1563 N6 DA C 3 1.434 -6.743 -27.238 1.00 75.30 N ATOM 1564 N1 DA C 3 1.938 -4.627 -26.498 1.00 77.55 N ATOM 1565 C2 DA C 3 2.867 -3.662 -26.326 1.00 77.64 C ATOM 1566 N3 DA C 3 4.176 -3.690 -26.622 1.00 76.70 N ATOM 1567 C4 DA C 3 4.505 -4.874 -27.156 1.00 75.15 C ATOM 1568 P DT C 4 10.341 -3.606 -25.652 1.00 91.75 P ATOM 1569 OP1 DT C 4 10.632 -5.089 -25.550 1.00 88.30 O ATOM 1570 OP2 DT C 4 11.385 -2.567 -25.476 1.00 87.67 O ATOM 1571 O5' DT C 4 9.109 -3.240 -24.701 1.00 89.50 O ATOM 1572 C5' DT C 4 8.372 -2.033 -24.852 1.00 88.68 C ATOM 1573 C4' DT C 4 7.239 -2.048 -23.843 1.00 87.89 C ATOM 1574 O4' DT C 4 6.234 -3.045 -24.193 1.00 88.50 O ATOM 1575 C3' DT C 4 7.692 -2.429 -22.442 1.00 86.34 C ATOM 1576 O3' DT C 4 7.050 -1.563 -21.543 1.00 86.51 O ATOM 1577 C2' DT C 4 7.246 -3.889 -22.316 1.00 86.00 C ATOM 1578 C1' DT C 4 5.933 -3.850 -23.066 1.00 84.61 C ATOM 1579 N1 DT C 4 5.326 -5.176 -23.501 1.00 83.56 N ATOM 1580 C2 DT C 4 3.964 -5.350 -23.335 1.00 83.12 C ATOM 1581 O2 DT C 4 3.240 -4.513 -22.846 1.00 83.02 O ATOM 1582 N3 DT C 4 3.435 -6.549 -23.736 1.00 84.26 N ATOM 1583 C4 DT C 4 4.126 -7.587 -24.313 1.00 83.89 C ATOM 1584 O4 DT C 4 3.550 -8.612 -24.631 1.00 82.60 O ATOM 1585 C5 DT C 4 5.546 -7.378 -24.472 1.00 83.91 C ATOM 1586 C7 DT C 4 6.368 -8.470 -25.080 1.00 82.54 C ATOM 1587 C6 DT C 4 6.080 -6.194 -24.070 1.00 84.73 C ATOM 1588 P DT C 5 7.552 -1.324 -20.038 1.00 86.12 P ATOM 1589 OP1 DT C 5 8.536 -2.351 -19.588 1.00 80.99 O ATOM 1590 OP2 DT C 5 7.797 0.140 -19.909 1.00 84.65 O ATOM 1591 O5' DT C 5 6.164 -1.650 -19.320 1.00 83.14 O ATOM 1592 C5' DT C 5 4.970 -0.957 -19.711 1.00 77.69 C ATOM 1593 C4' DT C 5 3.813 -1.814 -19.263 1.00 75.36 C ATOM 1594 O4' DT C 5 3.872 -3.118 -19.888 1.00 71.63 O ATOM 1595 C3' DT C 5 3.845 -2.113 -17.771 1.00 74.12 C ATOM 1596 O3' DT C 5 2.839 -1.311 -17.181 1.00 74.52 O ATOM 1597 C2' DT C 5 3.676 -3.645 -17.660 1.00 71.12 C ATOM 1598 C1' DT C 5 3.184 -3.999 -19.044 1.00 67.92 C ATOM 1599 N1 DT C 5 3.470 -5.355 -19.535 1.00 66.91 N ATOM 1600 C2 DT C 5 2.413 -6.155 -19.816 1.00 67.51 C ATOM 1601 O2 DT C 5 1.267 -5.788 -19.633 1.00 68.92 O ATOM 1602 N3 DT C 5 2.720 -7.410 -20.275 1.00 67.04 N ATOM 1603 C4 DT C 5 3.971 -7.913 -20.535 1.00 66.19 C ATOM 1604 O4 DT C 5 4.109 -9.058 -20.971 1.00 68.32 O ATOM 1605 C5 DT C 5 5.052 -7.026 -20.241 1.00 64.40 C ATOM 1606 C7 DT C 5 6.470 -7.444 -20.453 1.00 65.66 C ATOM 1607 C6 DT C 5 4.750 -5.808 -19.772 1.00 67.22 C ATOM 1608 P DT C 6 2.561 -1.385 -15.608 1.00 75.74 P ATOM 1609 OP1 DT C 6 3.793 -1.885 -14.938 1.00 71.80 O ATOM 1610 OP2 DT C 6 1.953 -0.051 -15.248 1.00 72.87 O ATOM 1611 O5' DT C 6 1.497 -2.590 -15.530 1.00 72.06 O ATOM 1612 C5' DT C 6 0.176 -2.371 -16.019 1.00 71.00 C ATOM 1613 C4' DT C 6 -0.604 -3.658 -16.008 1.00 70.50 C ATOM 1614 O4' DT C 6 0.243 -4.689 -16.546 1.00 68.88 O ATOM 1615 C3' DT C 6 -1.045 -4.170 -14.637 1.00 73.50 C ATOM 1616 O3' DT C 6 -2.498 -4.150 -14.583 1.00 79.52 O ATOM 1617 C2' DT C 6 -0.435 -5.583 -14.543 1.00 71.31 C ATOM 1618 C1' DT C 6 -0.153 -5.925 -15.993 1.00 67.50 C ATOM 1619 N1 DT C 6 0.941 -6.862 -16.301 1.00 63.83 N ATOM 1620 C2 DT C 6 0.663 -8.103 -16.792 1.00 63.16 C ATOM 1621 O2 DT C 6 -0.458 -8.508 -16.940 1.00 63.31 O ATOM 1622 N3 DT C 6 1.737 -8.889 -17.082 1.00 64.45 N ATOM 1623 C4 DT C 6 3.058 -8.522 -16.955 1.00 66.35 C ATOM 1624 O4 DT C 6 3.996 -9.269 -17.234 1.00 66.87 O ATOM 1625 C5 DT C 6 3.271 -7.195 -16.462 1.00 64.81 C ATOM 1626 C7 DT C 6 4.672 -6.707 -16.284 1.00 65.79 C ATOM 1627 C6 DT C 6 2.225 -6.430 -16.167 1.00 63.42 C ATOM 1628 P DG C 7 -3.367 -4.175 -13.231 1.00 81.41 P ATOM 1629 OP1 DG C 7 -2.649 -3.394 -12.206 1.00 79.86 O ATOM 1630 OP2 DG C 7 -4.748 -3.779 -13.586 1.00 81.93 O ATOM 1631 O5' DG C 7 -3.344 -5.724 -12.851 1.00 80.94 O ATOM 1632 C5' DG C 7 -4.297 -6.582 -13.439 1.00 82.04 C ATOM 1633 C4' DG C 7 -3.837 -8.003 -13.226 1.00 84.26 C ATOM 1634 O4' DG C 7 -2.504 -8.217 -13.757 1.00 83.85 O ATOM 1635 C3' DG C 7 -3.704 -8.416 -11.766 1.00 86.61 C ATOM 1636 O3' DG C 7 -4.497 -9.550 -11.570 1.00 92.54 O ATOM 1637 C2' DG C 7 -2.240 -8.800 -11.584 1.00 83.68 C ATOM 1638 C1' DG C 7 -1.918 -9.250 -12.991 1.00 80.83 C ATOM 1639 N9 DG C 7 -0.497 -9.343 -13.290 1.00 79.51 N ATOM 1640 C8 DG C 7 0.460 -8.388 -13.052 1.00 79.22 C ATOM 1641 N7 DG C 7 1.656 -8.721 -13.433 1.00 78.08 N ATOM 1642 C5 DG C 7 1.471 -9.973 -13.949 1.00 77.40 C ATOM 1643 C6 DG C 7 2.434 -10.801 -14.509 1.00 78.67 C ATOM 1644 O6 DG C 7 3.634 -10.536 -14.609 1.00 79.22 O ATOM 1645 N1 DG C 7 1.880 -12.011 -14.928 1.00 79.02 N ATOM 1646 C2 DG C 7 0.531 -12.308 -14.820 1.00 78.69 C ATOM 1647 N2 DG C 7 0.154 -13.505 -15.282 1.00 78.99 N ATOM 1648 N3 DG C 7 -0.395 -11.522 -14.292 1.00 75.95 N ATOM 1649 C4 DG C 7 0.161 -10.377 -13.881 1.00 76.54 C ATOM 1650 P DT C 8 -5.411 -9.727 -10.281 1.00 95.88 P ATOM 1651 OP1 DT C 8 -4.705 -9.171 -9.085 1.00 93.26 O ATOM 1652 OP2 DT C 8 -6.774 -9.249 -10.639 1.00 93.84 O ATOM 1653 O5' DT C 8 -5.321 -11.328 -10.207 1.00 92.19 O ATOM 1654 C5' DT C 8 -4.211 -11.813 -9.482 1.00 91.00 C ATOM 1655 C4' DT C 8 -3.408 -12.841 -10.230 1.00 91.00 C ATOM 1656 O4' DT C 8 -2.333 -12.244 -10.990 1.00 90.77 O ATOM 1657 C3' DT C 8 -2.687 -13.746 -9.262 1.00 91.09 C ATOM 1658 O3' DT C 8 -3.551 -14.792 -8.872 1.00 94.85 O ATOM 1659 C2' DT C 8 -1.483 -14.231 -10.054 1.00 89.56 C ATOM 1660 C1' DT C 8 -1.280 -13.191 -11.138 1.00 87.48 C ATOM 1661 N1 DT C 8 0.085 -12.549 -11.092 1.00 85.59 N ATOM 1662 C2 DT C 8 1.146 -13.282 -11.552 1.00 84.62 C ATOM 1663 O2 DT C 8 1.069 -14.418 -11.960 1.00 85.64 O ATOM 1664 N3 DT C 8 2.357 -12.669 -11.484 1.00 85.52 N ATOM 1665 C4 DT C 8 2.607 -11.388 -11.059 1.00 87.25 C ATOM 1666 O4 DT C 8 3.747 -10.920 -11.059 1.00 88.43 O ATOM 1667 C5 DT C 8 1.464 -10.656 -10.587 1.00 86.33 C ATOM 1668 C7 DT C 8 1.688 -9.254 -10.087 1.00 86.88 C ATOM 1669 C6 DT C 8 0.267 -11.260 -10.616 1.00 84.76 C ATOM 1670 P DT C 9 -3.199 -15.668 -7.577 1.00 98.52 P ATOM 1671 OP1 DT C 9 -2.644 -14.762 -6.530 1.00 93.68 O ATOM 1672 OP2 DT C 9 -4.401 -16.533 -7.371 1.00 98.15 O ATOM 1673 O5' DT C 9 -1.998 -16.619 -8.040 1.00 94.05 O ATOM 1674 C5' DT C 9 -2.212 -17.596 -9.036 1.00 90.90 C ATOM 1675 C4' DT C 9 -0.887 -18.278 -9.229 1.00 89.66 C ATOM 1676 O4' DT C 9 0.069 -17.273 -9.603 1.00 88.98 O ATOM 1677 C3' DT C 9 -0.350 -18.891 -7.950 1.00 88.78 C ATOM 1678 O3' DT C 9 -0.165 -20.261 -8.124 1.00 89.51 O ATOM 1679 C2' DT C 9 0.979 -18.202 -7.683 1.00 88.85 C ATOM 1680 C1' DT C 9 1.310 -17.591 -9.026 1.00 88.92 C ATOM 1681 N1 DT C 9 2.131 -16.355 -8.922 1.00 88.03 N ATOM 1682 C2 DT C 9 3.464 -16.399 -9.258 1.00 87.64 C ATOM 1683 O2 DT C 9 4.031 -17.413 -9.623 1.00 88.67 O ATOM 1684 N3 DT C 9 4.145 -15.225 -9.095 1.00 88.06 N ATOM 1685 C4 DT C 9 3.607 -14.022 -8.672 1.00 89.27 C ATOM 1686 O4 DT C 9 4.272 -12.992 -8.567 1.00 90.19 O ATOM 1687 C5 DT C 9 2.210 -14.039 -8.336 1.00 88.95 C ATOM 1688 C7 DT C 9 1.562 -12.764 -7.870 1.00 88.11 C ATOM 1689 C6 DT C 9 1.541 -15.196 -8.464 1.00 88.32 C ATOM 1690 P DT C 10 0.088 -21.124 -6.812 1.00 90.01 P ATOM 1691 OP1 DT C 10 -0.221 -20.250 -5.652 1.00 88.59 O ATOM 1692 OP2 DT C 10 -0.531 -22.457 -7.005 1.00 88.52 O ATOM 1693 O5' DT C 10 1.668 -21.319 -6.855 1.00 90.43 O ATOM 1694 C5' DT C 10 2.256 -21.919 -7.987 1.00 90.94 C ATOM 1695 C4' DT C 10 3.743 -21.780 -7.853 1.00 90.53 C ATOM 1696 O4' DT C 10 4.088 -20.387 -8.017 1.00 89.30 O ATOM 1697 C3' DT C 10 4.227 -22.194 -6.473 1.00 91.23 C ATOM 1698 O3' DT C 10 4.694 -23.549 -6.489 1.00 94.26 O ATOM 1699 C2' DT C 10 5.322 -21.181 -6.146 1.00 90.56 C ATOM 1700 C1' DT C 10 5.270 -20.176 -7.278 1.00 89.39 C ATOM 1701 N1 DT C 10 5.222 -18.805 -6.800 1.00 88.64 N ATOM 1702 C2 DT C 10 6.290 -17.961 -7.038 1.00 89.53 C ATOM 1703 O2 DT C 10 7.310 -18.287 -7.619 1.00 89.06 O ATOM 1704 N3 DT C 10 6.137 -16.684 -6.553 1.00 90.04 N ATOM 1705 C4 DT C 10 5.035 -16.183 -5.887 1.00 89.77 C ATOM 1706 O4 DT C 10 5.021 -15.008 -5.516 1.00 89.51 O ATOM 1707 C5 DT C 10 3.956 -17.132 -5.663 1.00 89.06 C ATOM 1708 C7 DT C 10 2.706 -16.715 -4.948 1.00 89.71 C ATOM 1709 C6 DT C 10 4.095 -18.380 -6.127 1.00 88.41 C ATOM 1710 P DG C 11 5.226 -24.244 -5.134 1.00 97.41 P ATOM 1711 OP1 DG C 11 4.470 -23.634 -4.008 1.00 97.24 O ATOM 1712 OP2 DG C 11 5.260 -25.723 -5.339 1.00 96.19 O ATOM 1713 O5' DG C 11 6.723 -23.688 -4.941 1.00 96.02 O ATOM 1714 C5' DG C 11 7.754 -23.809 -5.939 1.00 94.55 C ATOM 1715 C4' DG C 11 9.014 -23.046 -5.533 1.00 93.13 C ATOM 1716 O4' DG C 11 8.741 -21.611 -5.446 1.00 91.59 O ATOM 1717 C3' DG C 11 9.592 -23.458 -4.174 1.00 91.84 C ATOM 1718 O3' DG C 11 11.015 -23.511 -4.243 1.00 91.41 O ATOM 1719 C2' DG C 11 9.038 -22.360 -3.265 1.00 91.24 C ATOM 1720 C1' DG C 11 9.164 -21.151 -4.179 1.00 89.72 C ATOM 1721 N9 DG C 11 8.352 -20.009 -3.801 1.00 89.16 N ATOM 1722 C8 DG C 11 7.124 -20.002 -3.189 1.00 89.20 C ATOM 1723 N7 DG C 11 6.649 -18.794 -2.987 1.00 89.50 N ATOM 1724 C5 DG C 11 7.623 -17.950 -3.490 1.00 88.42 C ATOM 1725 C6 DG C 11 7.666 -16.540 -3.539 1.00 87.47 C ATOM 1726 O6 DG C 11 6.842 -15.709 -3.153 1.00 87.72 O ATOM 1727 N1 DG C 11 8.821 -16.089 -4.148 1.00 88.75 N ATOM 1728 C2 DG C 11 9.827 -16.920 -4.605 1.00 89.60 C ATOM 1729 N2 DG C 11 10.875 -16.277 -5.142 1.00 90.39 N ATOM 1730 N3 DG C 11 9.818 -18.248 -4.573 1.00 88.15 N ATOM 1731 C4 DG C 11 8.679 -18.689 -3.996 1.00 89.07 C ATOM 1732 P DA C 12 11.924 -23.772 -2.947 1.00 94.00 P ATOM 1733 OP1 DA C 12 11.761 -22.656 -2.011 1.00 93.79 O ATOM 1734 OP2 DA C 12 11.691 -25.156 -2.468 1.00 94.62 O ATOM 1735 O5' DA C 12 13.431 -23.646 -3.481 1.00 92.89 O ATOM 1736 C5' DA C 12 13.790 -22.709 -4.488 1.00 90.20 C ATOM 1737 C4' DA C 12 14.061 -21.314 -3.944 1.00 87.52 C ATOM 1738 O4' DA C 12 12.854 -20.595 -3.578 1.00 85.14 O ATOM 1739 C3' DA C 12 14.959 -21.262 -2.718 1.00 85.83 C ATOM 1740 O3' DA C 12 16.075 -20.508 -3.106 1.00 87.30 O ATOM 1741 C2' DA C 12 14.132 -20.555 -1.646 1.00 84.05 C ATOM 1742 C1' DA C 12 13.207 -19.725 -2.522 1.00 80.91 C ATOM 1743 N9 DA C 12 11.994 -19.214 -1.889 1.00 77.99 N ATOM 1744 C8 DA C 12 10.953 -19.909 -1.339 1.00 76.89 C ATOM 1745 N7 DA C 12 10.006 -19.138 -0.876 1.00 76.29 N ATOM 1746 C5 DA C 12 10.462 -17.852 -1.123 1.00 76.21 C ATOM 1747 C6 DA C 12 9.937 -16.562 -0.858 1.00 77.73 C ATOM 1748 N6 DA C 12 8.763 -16.348 -0.260 1.00 77.24 N ATOM 1749 N1 DA C 12 10.662 -15.478 -1.242 1.00 78.13 N ATOM 1750 C2 DA C 12 11.841 -15.681 -1.851 1.00 78.56 C ATOM 1751 N3 DA C 12 12.436 -16.847 -2.147 1.00 77.63 N ATOM 1752 C4 DA C 12 11.687 -17.892 -1.754 1.00 76.52 C ATOM 1753 P DA C 13 17.410 -20.524 -2.246 1.00 89.89 P ATOM 1754 OP1 DA C 13 17.231 -21.480 -1.123 1.00 89.44 O ATOM 1755 OP2 DA C 13 18.516 -20.726 -3.224 1.00 88.51 O ATOM 1756 O5' DA C 13 17.402 -19.033 -1.641 1.00 87.45 O ATOM 1757 C5' DA C 13 17.216 -17.961 -2.559 1.00 86.71 C ATOM 1758 C4' DA C 13 17.162 -16.604 -1.895 1.00 86.21 C ATOM 1759 O4' DA C 13 15.858 -16.368 -1.302 1.00 85.74 O ATOM 1760 C3' DA C 13 18.167 -16.378 -0.772 1.00 86.15 C ATOM 1761 O3' DA C 13 18.674 -15.047 -0.917 1.00 85.79 O ATOM 1762 C2' DA C 13 17.329 -16.600 0.495 1.00 86.02 C ATOM 1763 C1' DA C 13 16.008 -15.979 0.064 1.00 84.92 C ATOM 1764 N9 DA C 13 14.795 -16.455 0.722 1.00 84.17 N ATOM 1765 C8 DA C 13 14.480 -17.749 1.030 1.00 84.50 C ATOM 1766 N7 DA C 13 13.302 -17.893 1.585 1.00 83.87 N ATOM 1767 C5 DA C 13 12.796 -16.612 1.619 1.00 81.74 C ATOM 1768 C6 DA C 13 11.582 -16.086 2.092 1.00 82.59 C ATOM 1769 N6 DA C 13 10.619 -16.828 2.631 1.00 82.21 N ATOM 1770 N1 DA C 13 11.394 -14.745 2.006 1.00 84.69 N ATOM 1771 C2 DA C 13 12.357 -13.980 1.461 1.00 85.07 C ATOM 1772 N3 DA C 13 13.543 -14.370 0.974 1.00 85.60 N ATOM 1773 C4 DA C 13 13.702 -15.710 1.090 1.00 83.74 C ATOM 1774 P DC C 14 19.659 -14.431 0.178 1.00 85.06 P ATOM 1775 OP1 DC C 14 20.300 -15.580 0.862 1.00 85.08 O ATOM 1776 OP2 DC C 14 20.489 -13.355 -0.401 1.00 84.50 O ATOM 1777 O5' DC C 14 18.626 -13.731 1.152 1.00 80.89 O ATOM 1778 C5' DC C 14 18.400 -12.388 0.936 1.00 79.56 C ATOM 1779 C4' DC C 14 17.331 -11.968 1.902 1.00 80.11 C ATOM 1780 O4' DC C 14 16.378 -13.031 2.181 1.00 80.01 O ATOM 1781 C3' DC C 14 17.888 -11.578 3.248 1.00 79.08 C ATOM 1782 O3' DC C 14 17.505 -10.255 3.326 1.00 84.54 O ATOM 1783 C2' DC C 14 17.172 -12.498 4.228 1.00 76.85 C ATOM 1784 C1' DC C 14 15.880 -12.770 3.472 1.00 74.36 C ATOM 1785 N1 DC C 14 15.065 -13.939 3.952 1.00 71.24 N ATOM 1786 C2 DC C 14 13.791 -13.750 4.529 1.00 69.19 C ATOM 1787 O2 DC C 14 13.308 -12.629 4.677 1.00 71.14 O ATOM 1788 N3 DC C 14 13.091 -14.810 4.960 1.00 67.03 N ATOM 1789 C4 DC C 14 13.602 -16.029 4.833 1.00 69.69 C ATOM 1790 N4 DC C 14 12.839 -17.036 5.265 1.00 69.83 N ATOM 1791 C5 DC C 14 14.887 -16.265 4.243 1.00 69.68 C ATOM 1792 C6 DC C 14 15.580 -15.197 3.824 1.00 69.70 C ATOM 1793 P DT C 15 17.988 -9.268 4.487 1.00 90.99 P ATOM 1794 OP1 DT C 15 19.238 -9.840 5.098 1.00 86.24 O ATOM 1795 OP2 DT C 15 17.943 -7.900 3.893 1.00 89.15 O ATOM 1796 O5' DT C 15 16.766 -9.334 5.540 1.00 87.18 O ATOM 1797 C5' DT C 15 15.420 -9.618 5.125 1.00 84.81 C ATOM 1798 C4' DT C 15 14.417 -8.873 5.970 1.00 82.02 C ATOM 1799 O4' DT C 15 13.521 -9.808 6.619 1.00 80.45 O ATOM 1800 C3' DT C 15 15.041 -8.133 7.125 1.00 81.06 C ATOM 1801 O3' DT C 15 14.163 -7.109 7.501 1.00 83.57 O ATOM 1802 C2' DT C 15 15.208 -9.255 8.159 1.00 79.63 C ATOM 1803 C1' DT C 15 13.988 -10.122 7.916 1.00 74.90 C ATOM 1804 N1 DT C 15 14.176 -11.600 7.953 1.00 70.65 N ATOM 1805 C2 DT C 15 13.103 -12.308 8.395 1.00 71.75 C ATOM 1806 O2 DT C 15 12.097 -11.736 8.727 1.00 75.35 O ATOM 1807 N3 DT C 15 13.179 -13.670 8.441 1.00 70.50 N ATOM 1808 C4 DT C 15 14.295 -14.388 8.093 1.00 72.45 C ATOM 1809 O4 DT C 15 14.340 -15.613 8.143 1.00 71.03 O ATOM 1810 C5 DT C 15 15.418 -13.607 7.628 1.00 74.01 C ATOM 1811 C7 DT C 15 16.652 -14.380 7.214 1.00 72.68 C ATOM 1812 C6 DT C 15 15.312 -12.251 7.572 1.00 70.67 C ATOM 1813 P DT C 16 14.466 -6.312 8.845 1.00 85.00 P ATOM 1814 OP1 DT C 16 15.878 -6.718 9.186 1.00 81.19 O ATOM 1815 OP2 DT C 16 14.064 -4.881 8.714 1.00 81.33 O ATOM 1816 O5' DT C 16 13.380 -7.034 9.805 1.00 82.07 O ATOM 1817 C5' DT C 16 12.004 -6.921 9.452 1.00 78.40 C ATOM 1818 C4' DT C 16 11.108 -7.687 10.396 1.00 77.36 C ATOM 1819 O4' DT C 16 11.381 -9.124 10.403 1.00 73.55 O ATOM 1820 C3' DT C 16 11.244 -7.183 11.827 1.00 77.61 C ATOM 1821 O3' DT C 16 9.927 -6.891 12.360 1.00 81.25 O ATOM 1822 C2' DT C 16 11.959 -8.332 12.522 1.00 75.84 C ATOM 1823 C1' DT C 16 11.482 -9.552 11.743 1.00 71.44 C ATOM 1824 N1 DT C 16 12.424 -10.678 11.758 1.00 69.52 N ATOM 1825 C2 DT C 16 11.963 -11.938 12.027 1.00 70.91 C ATOM 1826 O2 DT C 16 10.799 -12.189 12.292 1.00 72.23 O ATOM 1827 N3 DT C 16 12.916 -12.926 11.994 1.00 70.85 N ATOM 1828 C4 DT C 16 14.257 -12.770 11.700 1.00 70.80 C ATOM 1829 O4 DT C 16 15.025 -13.729 11.694 1.00 70.77 O ATOM 1830 C5 DT C 16 14.675 -11.426 11.424 1.00 69.21 C ATOM 1831 C7 DT C 16 16.102 -11.131 11.095 1.00 69.73 C ATOM 1832 C6 DT C 16 13.751 -10.462 11.453 1.00 69.50 C ATOM 1833 P DT C 17 9.724 -6.207 13.782 1.00 78.96 P ATOM 1834 OP1 DT C 17 10.956 -5.426 14.013 1.00 79.41 O ATOM 1835 OP2 DT C 17 8.439 -5.498 13.917 1.00 79.66 O ATOM 1836 O5' DT C 17 9.596 -7.572 14.616 1.00 80.41 O ATOM 1837 C5' DT C 17 8.422 -8.373 14.388 1.00 82.01 C ATOM 1838 C4' DT C 17 8.455 -9.719 15.097 1.00 84.57 C ATOM 1839 O4' DT C 17 9.550 -10.537 14.634 1.00 85.34 O ATOM 1840 C3' DT C 17 8.678 -9.664 16.598 1.00 87.36 C ATOM 1841 O3' DT C 17 7.418 -9.736 17.246 1.00 93.23 O ATOM 1842 C2' DT C 17 9.520 -10.892 16.944 1.00 85.22 C ATOM 1843 C1' DT C 17 9.853 -11.507 15.610 1.00 81.20 C ATOM 1844 N1 DT C 17 11.277 -11.830 15.477 1.00 78.32 N ATOM 1845 C2 DT C 17 11.657 -13.157 15.522 1.00 79.46 C ATOM 1846 O2 DT C 17 10.868 -14.081 15.693 1.00 77.72 O ATOM 1847 N3 DT C 17 13.017 -13.363 15.403 1.00 79.21 N ATOM 1848 C4 DT C 17 13.967 -12.378 15.186 1.00 78.73 C ATOM 1849 O4 DT C 17 15.160 -12.596 15.064 1.00 77.69 O ATOM 1850 C5 DT C 17 13.495 -11.038 15.146 1.00 77.73 C ATOM 1851 C7 DT C 17 14.534 -9.975 14.944 1.00 79.91 C ATOM 1852 C6 DT C 17 12.184 -10.814 15.289 1.00 76.04 C ATOM 1853 P DG C 18 7.233 -9.327 18.787 1.00 96.86 P ATOM 1854 OP1 DG C 18 8.327 -8.403 19.222 1.00 90.70 O ATOM 1855 OP2 DG C 18 5.799 -8.972 18.930 1.00 94.25 O ATOM 1856 O5' DG C 18 7.412 -10.761 19.474 1.00 96.29 O ATOM 1857 C5' DG C 18 6.527 -11.805 19.099 1.00 95.69 C ATOM 1858 C4' DG C 18 6.988 -13.058 19.800 1.00 95.64 C ATOM 1859 O4' DG C 18 8.306 -13.406 19.287 1.00 95.62 O ATOM 1860 C3' DG C 18 7.129 -12.908 21.310 1.00 94.82 C ATOM 1861 O3' DG C 18 6.713 -14.122 21.933 1.00 96.84 O ATOM 1862 C2' DG C 18 8.619 -12.654 21.493 1.00 93.85 C ATOM 1863 C1' DG C 18 9.226 -13.482 20.353 1.00 92.29 C ATOM 1864 N9 DG C 18 10.540 -13.015 19.911 1.00 91.03 N ATOM 1865 C8 DG C 18 10.956 -11.712 19.758 1.00 90.60 C ATOM 1866 N7 DG C 18 12.199 -11.590 19.370 1.00 90.21 N ATOM 1867 C5 DG C 18 12.632 -12.902 19.269 1.00 90.14 C ATOM 1868 C6 DG C 18 13.896 -13.401 18.891 1.00 90.67 C ATOM 1869 O6 DG C 18 14.907 -12.780 18.556 1.00 91.96 O ATOM 1870 N1 DG C 18 13.948 -14.773 18.925 1.00 89.42 N ATOM 1871 C2 DG C 18 12.875 -15.549 19.265 1.00 89.68 C ATOM 1872 N2 DG C 18 13.123 -16.860 19.228 1.00 90.81 N ATOM 1873 N3 DG C 18 11.672 -15.115 19.614 1.00 87.78 N ATOM 1874 C4 DG C 18 11.628 -13.781 19.597 1.00 88.51 C ATOM 1875 P DA C 19 6.421 -14.222 23.507 1.00 94.83 P ATOM 1876 OP1 DA C 19 6.472 -12.839 24.030 1.00 94.01 O ATOM 1877 OP2 DA C 19 5.211 -15.061 23.655 1.00 93.30 O ATOM 1878 O5' DA C 19 7.681 -15.018 24.089 1.00 91.63 O ATOM 1879 C5' DA C 19 8.007 -16.290 23.558 1.00 90.06 C ATOM 1880 C4' DA C 19 9.416 -16.719 23.944 1.00 89.99 C ATOM 1881 O4' DA C 19 10.382 -15.963 23.163 1.00 89.22 O ATOM 1882 C3' DA C 19 9.836 -16.546 25.420 1.00 90.61 C ATOM 1883 O3' DA C 19 10.112 -17.840 26.038 1.00 92.21 O ATOM 1884 C2' DA C 19 11.073 -15.653 25.333 1.00 89.55 C ATOM 1885 C1' DA C 19 11.581 -15.914 23.918 1.00 87.53 C ATOM 1886 N9 DA C 19 12.521 -14.887 23.446 1.00 86.08 N ATOM 1887 C8 DA C 19 12.338 -13.532 23.513 1.00 85.88 C ATOM 1888 N7 DA C 19 13.336 -12.828 23.037 1.00 86.14 N ATOM 1889 C5 DA C 19 14.235 -13.785 22.636 1.00 85.20 C ATOM 1890 C6 DA C 19 15.494 -13.665 22.046 1.00 85.34 C ATOM 1891 N6 DA C 19 16.023 -12.481 21.780 1.00 85.60 N ATOM 1892 N1 DA C 19 16.174 -14.795 21.770 1.00 86.15 N ATOM 1893 C2 DA C 19 15.607 -15.981 22.057 1.00 86.00 C ATOM 1894 N3 DA C 19 14.413 -16.213 22.618 1.00 85.07 N ATOM 1895 C4 DA C 19 13.767 -15.062 22.885 1.00 85.02 C ATOM 1896 P DG C 20 10.685 -18.077 27.524 1.00 90.28 P ATOM 1897 OP1 DG C 20 11.597 -16.965 27.905 1.00 89.52 O ATOM 1898 OP2 DG C 20 9.484 -18.360 28.335 1.00 89.37 O ATOM 1899 O5' DG C 20 11.600 -19.397 27.349 1.00 90.37 O ATOM 1900 C5' DG C 20 12.565 -19.496 26.270 1.00 91.29 C ATOM 1901 C4' DG C 20 14.038 -19.262 26.634 1.00 91.81 C ATOM 1902 O4' DG C 20 14.567 -18.109 25.912 1.00 90.86 O ATOM 1903 C3' DG C 20 14.374 -19.031 28.109 1.00 92.75 C ATOM 1904 O3' DG C 20 15.170 -20.134 28.577 1.00 95.74 O ATOM 1905 C2' DG C 20 15.113 -17.693 28.150 1.00 91.61 C ATOM 1906 C1' DG C 20 15.490 -17.383 26.702 1.00 90.45 C ATOM 1907 N9 DG C 20 15.452 -15.936 26.384 1.00 90.66 N ATOM 1908 C8 DG C 20 14.460 -15.041 26.727 1.00 90.35 C ATOM 1909 N7 DG C 20 14.689 -13.806 26.336 1.00 90.66 N ATOM 1910 C5 DG C 20 15.912 -13.857 25.689 1.00 90.11 C ATOM 1911 C6 DG C 20 16.648 -12.812 25.058 1.00 90.91 C ATOM 1912 O6 DG C 20 16.365 -11.586 24.937 1.00 89.80 O ATOM 1913 N1 DG C 20 17.846 -13.319 24.546 1.00 90.11 N ATOM 1914 C2 DG C 20 18.238 -14.639 24.619 1.00 88.87 C ATOM 1915 N2 DG C 20 19.408 -14.952 24.068 1.00 89.39 N ATOM 1916 N3 DG C 20 17.562 -15.605 25.201 1.00 87.82 N ATOM 1917 C4 DG C 20 16.397 -15.158 25.714 1.00 89.59 C ATOM 1918 P DC C 21 15.579 -20.355 30.116 1.00 97.68 P ATOM 1919 OP1 DC C 21 14.576 -19.695 30.998 1.00 96.15 O ATOM 1920 OP2 DC C 21 15.919 -21.797 30.252 1.00 94.95 O ATOM 1921 O5' DC C 21 16.921 -19.491 30.237 1.00 96.95 O ATOM 1922 C5' DC C 21 18.107 -19.932 29.583 1.00 96.16 C ATOM 1923 C4' DC C 21 19.157 -18.841 29.649 1.00 96.04 C ATOM 1924 O4' DC C 21 18.679 -17.640 28.995 1.00 96.18 O ATOM 1925 C3' DC C 21 19.515 -18.361 31.052 1.00 96.19 C ATOM 1926 O3' DC C 21 20.783 -18.893 31.429 1.00 97.12 O ATOM 1927 C2' DC C 21 19.524 -16.829 30.954 1.00 95.14 C ATOM 1928 C1' DC C 21 19.476 -16.567 29.455 1.00 93.45 C ATOM 1929 N1 DC C 21 18.868 -15.244 29.016 1.00 92.35 N ATOM 1930 C2 DC C 21 19.613 -14.297 28.280 1.00 92.34 C ATOM 1931 O2 DC C 21 20.793 -14.523 27.981 1.00 92.02 O ATOM 1932 N3 DC C 21 19.021 -13.131 27.911 1.00 91.62 N ATOM 1933 C4 DC C 21 17.755 -12.892 28.229 1.00 91.23 C ATOM 1934 N4 DC C 21 17.225 -11.737 27.839 1.00 91.65 N ATOM 1935 C5 DC C 21 16.977 -13.831 28.962 1.00 90.64 C ATOM 1936 C6 DC C 21 17.564 -14.974 29.330 1.00 90.53 C ATOM 1937 P DA C 22 21.344 -18.690 32.912 1.00 96.65 P ATOM 1938 OP1 DA C 22 21.843 -20.024 33.317 1.00 95.61 O ATOM 1939 OP2 DA C 22 20.333 -17.946 33.717 1.00 94.56 O ATOM 1940 O5' DA C 22 22.608 -17.721 32.690 1.00 96.92 O ATOM 1941 C5' DA C 22 23.795 -18.157 31.998 1.00 96.72 C ATOM 1942 C4' DA C 22 24.656 -16.955 31.638 1.00 96.72 C ATOM 1943 O4' DA C 22 23.795 -15.962 31.024 1.00 96.25 O ATOM 1944 C3' DA C 22 25.340 -16.244 32.811 1.00 97.23 C ATOM 1945 O3' DA C 22 26.705 -15.888 32.479 1.00 99.60 O ATOM 1946 C2' DA C 22 24.431 -15.038 33.076 1.00 95.10 C ATOM 1947 C1' DA C 22 23.909 -14.714 31.686 1.00 93.40 C ATOM 1948 N9 DA C 22 22.604 -14.047 31.615 1.00 92.74 N ATOM 1949 C8 DA C 22 21.446 -14.406 32.248 1.00 91.93 C ATOM 1950 N7 DA C 22 20.427 -13.618 31.982 1.00 91.32 N ATOM 1951 C5 DA C 22 20.941 -12.675 31.118 1.00 90.85 C ATOM 1952 C6 DA C 22 20.360 -11.569 30.468 1.00 91.00 C ATOM 1953 N6 DA C 22 19.088 -11.198 30.587 1.00 90.52 N ATOM 1954 N1 DA C 22 21.161 -10.846 29.673 1.00 91.68 N ATOM 1955 C2 DA C 22 22.448 -11.206 29.536 1.00 91.80 C ATOM 1956 N3 DA C 22 23.111 -12.226 30.081 1.00 90.31 N ATOM 1957 C4 DA C 22 22.285 -12.927 30.875 1.00 91.52 C ATOM 1958 P DA C 23 27.774 -15.308 33.546 1.00100.59 P ATOM 1959 OP1 DA C 23 27.076 -14.492 34.577 1.00 97.68 O ATOM 1960 OP2 DA C 23 28.645 -16.449 33.939 1.00 99.29 O ATOM 1961 O5' DA C 23 28.631 -14.285 32.646 1.00 98.88 O ATOM 1962 C5' DA C 23 28.153 -13.762 31.378 1.00 95.91 C ATOM 1963 C4' DA C 23 27.762 -12.294 31.471 1.00 93.15 C ATOM 1964 O4' DA C 23 26.339 -12.157 31.698 1.00 90.98 O ATOM 1965 C3' DA C 23 28.436 -11.500 32.591 1.00 92.16 C ATOM 1966 O3' DA C 23 29.206 -10.467 32.004 1.00 92.00 O ATOM 1967 C2' DA C 23 27.273 -10.979 33.441 1.00 91.85 C ATOM 1968 C1' DA C 23 26.144 -10.963 32.436 1.00 90.74 C ATOM 1969 N9 DA C 23 24.784 -10.945 32.986 1.00 90.25 N ATOM 1970 C8 DA C 23 24.194 -11.816 33.865 1.00 89.64 C ATOM 1971 N7 DA C 23 22.939 -11.536 34.130 1.00 88.65 N ATOM 1972 C5 DA C 23 22.685 -10.403 33.385 1.00 89.63 C ATOM 1973 C6 DA C 23 21.542 -9.589 33.219 1.00 90.11 C ATOM 1974 N6 DA C 23 20.375 -9.788 33.823 1.00 89.77 N ATOM 1975 N1 DA C 23 21.640 -8.525 32.395 1.00 90.45 N ATOM 1976 C2 DA C 23 22.803 -8.293 31.763 1.00 90.35 C ATOM 1977 N3 DA C 23 23.946 -8.981 31.833 1.00 90.24 N ATOM 1978 C4 DA C 23 23.815 -10.030 32.671 1.00 90.46 C ATOM 1979 P DA C 24 29.942 -9.333 32.866 1.00 92.23 P ATOM 1980 OP1 DA C 24 31.168 -9.035 32.096 1.00 93.21 O ATOM 1981 OP2 DA C 24 30.069 -9.792 34.259 1.00 92.33 O ATOM 1982 O5' DA C 24 28.946 -8.064 32.839 1.00 88.26 O ATOM 1983 C5' DA C 24 28.524 -7.558 31.578 1.00 85.28 C ATOM 1984 C4' DA C 24 27.874 -6.195 31.651 1.00 83.29 C ATOM 1985 O4' DA C 24 26.523 -6.311 32.159 1.00 82.49 O ATOM 1986 C3' DA C 24 28.558 -5.187 32.544 1.00 82.64 C ATOM 1987 O3' DA C 24 28.586 -3.968 31.826 1.00 83.60 O ATOM 1988 C2' DA C 24 27.677 -5.196 33.803 1.00 83.30 C ATOM 1989 C1' DA C 24 26.282 -5.467 33.269 1.00 81.46 C ATOM 1990 N9 DA C 24 25.344 -6.259 34.066 1.00 81.66 N ATOM 1991 C8 DA C 24 25.596 -7.431 34.744 1.00 82.01 C ATOM 1992 N7 DA C 24 24.544 -7.964 35.330 1.00 81.32 N ATOM 1993 C5 DA C 24 23.529 -7.091 34.999 1.00 80.77 C ATOM 1994 C6 DA C 24 22.161 -7.082 35.300 1.00 80.65 C ATOM 1995 N6 DA C 24 21.580 -8.021 36.032 1.00 79.72 N ATOM 1996 N1 DA C 24 21.413 -6.064 34.817 1.00 81.52 N ATOM 1997 C2 DA C 24 22.003 -5.129 34.071 1.00 80.93 C ATOM 1998 N3 DA C 24 23.288 -5.031 33.721 1.00 80.99 N ATOM 1999 C4 DA C 24 24.000 -6.047 34.217 1.00 81.08 C ATOM 2000 P DT C 25 28.747 -2.545 32.554 1.00 85.90 P ATOM 2001 OP1 DT C 25 29.121 -1.554 31.516 1.00 85.24 O ATOM 2002 OP2 DT C 25 29.574 -2.718 33.772 1.00 82.78 O ATOM 2003 O5' DT C 25 27.247 -2.208 32.996 1.00 83.84 O ATOM 2004 C5' DT C 25 26.263 -2.051 31.998 1.00 82.08 C ATOM 2005 C4' DT C 25 25.091 -1.344 32.605 1.00 79.19 C ATOM 2006 O4' DT C 25 24.453 -2.258 33.502 1.00 77.60 O ATOM 2007 C3' DT C 25 25.499 -0.163 33.448 1.00 78.63 C ATOM 2008 O3' DT C 25 24.767 0.893 32.931 1.00 82.72 O ATOM 2009 C2' DT C 25 25.158 -0.576 34.885 1.00 76.51 C ATOM 2010 C1' DT C 25 24.048 -1.565 34.657 1.00 73.49 C ATOM 2011 N1 DT C 25 23.829 -2.633 35.664 1.00 71.51 N ATOM 2012 C2 DT C 25 22.542 -2.883 36.104 1.00 70.81 C ATOM 2013 O2 DT C 25 21.559 -2.252 35.759 1.00 71.30 O ATOM 2014 N3 DT C 25 22.413 -3.885 37.011 1.00 69.30 N ATOM 2015 C4 DT C 25 23.428 -4.672 37.467 1.00 70.12 C ATOM 2016 O4 DT C 25 23.220 -5.556 38.272 1.00 70.60 O ATOM 2017 C5 DT C 25 24.736 -4.384 36.968 1.00 70.79 C ATOM 2018 C7 DT C 25 25.876 -5.216 37.455 1.00 71.98 C ATOM 2019 C6 DT C 25 24.888 -3.395 36.085 1.00 70.58 C ATOM 2020 P DT C 26 24.630 2.268 33.721 1.00 86.09 P ATOM 2021 OP1 DT C 26 24.358 3.286 32.684 1.00 87.25 O ATOM 2022 OP2 DT C 26 25.789 2.443 34.631 1.00 82.41 O ATOM 2023 O5' DT C 26 23.255 2.006 34.525 1.00 84.89 O ATOM 2024 C5' DT C 26 22.082 1.604 33.775 1.00 82.97 C ATOM 2025 C4' DT C 26 20.720 1.811 34.443 1.00 80.36 C ATOM 2026 O4' DT C 26 20.537 0.831 35.489 1.00 78.36 O ATOM 2027 C3' DT C 26 20.454 3.154 35.122 1.00 78.64 C ATOM 2028 O3' DT C 26 19.048 3.406 35.100 1.00 77.29 O ATOM 2029 C2' DT C 26 21.010 2.927 36.529 1.00 77.85 C ATOM 2030 C1' DT C 26 20.453 1.520 36.746 1.00 77.57 C ATOM 2031 N1 DT C 26 21.131 0.573 37.641 1.00 74.95 N ATOM 2032 C2 DT C 26 20.339 -0.210 38.435 1.00 73.14 C ATOM 2033 O2 DT C 26 19.135 -0.116 38.496 1.00 73.29 O ATOM 2034 N3 DT C 26 21.018 -1.106 39.195 1.00 74.93 N ATOM 2035 C4 DT C 26 22.390 -1.294 39.196 1.00 76.29 C ATOM 2036 O4 DT C 26 22.943 -2.127 39.888 1.00 77.07 O ATOM 2037 C5 DT C 26 23.169 -0.461 38.340 1.00 75.49 C ATOM 2038 C7 DT C 26 24.652 -0.663 38.333 1.00 74.02 C ATOM 2039 C6 DT C 26 22.506 0.425 37.581 1.00 76.07 C ATOM 2040 P DT C 27 18.523 4.769 35.746 1.00 80.40 P ATOM 2041 OP1 DT C 27 19.667 5.607 36.172 1.00 79.63 O ATOM 2042 OP2 DT C 27 17.502 5.347 34.854 1.00 81.02 O ATOM 2043 O5' DT C 27 17.765 4.281 37.063 1.00 82.71 O ATOM 2044 C5' DT C 27 16.872 3.182 36.964 1.00 83.59 C ATOM 2045 C4' DT C 27 16.344 2.707 38.305 1.00 81.26 C ATOM 2046 O4' DT C 27 17.348 1.921 38.983 1.00 77.92 O ATOM 2047 C3' DT C 27 15.941 3.809 39.265 1.00 81.61 C ATOM 2048 O3' DT C 27 14.592 3.546 39.611 1.00 86.43 O ATOM 2049 C2' DT C 27 16.907 3.656 40.441 1.00 79.21 C ATOM 2050 C1' DT C 27 17.266 2.182 40.359 1.00 75.67 C ATOM 2051 N1 DT C 27 18.579 1.762 40.880 1.00 73.88 N ATOM 2052 C2 DT C 27 18.686 0.637 41.697 1.00 73.82 C ATOM 2053 O2 DT C 27 17.735 -0.043 42.065 1.00 74.05 O ATOM 2054 N3 DT C 27 19.958 0.329 42.116 1.00 72.82 N ATOM 2055 C4 DT C 27 21.105 1.008 41.753 1.00 74.37 C ATOM 2056 O4 DT C 27 22.209 0.655 42.161 1.00 74.09 O ATOM 2057 C5 DT C 27 20.917 2.162 40.890 1.00 74.35 C ATOM 2058 C7 DT C 27 22.082 2.992 40.449 1.00 73.81 C ATOM 2059 C6 DT C 27 19.684 2.478 40.490 1.00 73.44 C TER 2060 DT C 27 ATOM 2061 O5' DA D 1 21.593 -5.655 50.803 1.00 85.54 O ATOM 2062 C5' DA D 1 21.359 -6.698 49.851 1.00 87.54 C ATOM 2063 C4' DA D 1 19.986 -6.571 49.192 1.00 87.80 C ATOM 2064 O4' DA D 1 19.899 -5.504 48.185 1.00 86.44 O ATOM 2065 C3' DA D 1 19.529 -7.801 48.415 1.00 86.58 C ATOM 2066 O3' DA D 1 18.119 -7.671 48.363 1.00 86.81 O ATOM 2067 C2' DA D 1 20.238 -7.581 47.080 1.00 85.23 C ATOM 2068 C1' DA D 1 19.925 -6.093 46.884 1.00 83.40 C ATOM 2069 N9 DA D 1 20.862 -5.280 46.116 1.00 81.77 N ATOM 2070 C8 DA D 1 22.207 -5.426 45.901 1.00 80.34 C ATOM 2071 N7 DA D 1 22.727 -4.465 45.170 1.00 79.42 N ATOM 2072 C5 DA D 1 21.644 -3.640 44.891 1.00 80.42 C ATOM 2073 C6 DA D 1 21.485 -2.448 44.153 1.00 80.12 C ATOM 2074 N6 DA D 1 22.462 -1.822 43.529 1.00 79.45 N ATOM 2075 N1 DA D 1 20.259 -1.896 44.081 1.00 82.05 N ATOM 2076 C2 DA D 1 19.231 -2.504 44.704 1.00 81.84 C ATOM 2077 N3 DA D 1 19.242 -3.627 45.422 1.00 80.79 N ATOM 2078 C4 DA D 1 20.489 -4.134 45.477 1.00 81.46 C ATOM 2079 P DA D 2 17.172 -8.709 47.641 1.00 86.07 P ATOM 2080 OP1 DA D 2 15.964 -8.882 48.489 1.00 85.52 O ATOM 2081 OP2 DA D 2 18.037 -9.856 47.279 1.00 85.28 O ATOM 2082 O5' DA D 2 16.675 -7.839 46.390 1.00 84.30 O ATOM 2083 C5' DA D 2 15.963 -6.624 46.689 1.00 83.41 C ATOM 2084 C4' DA D 2 15.202 -6.043 45.505 1.00 82.43 C ATOM 2085 O4' DA D 2 16.107 -5.207 44.708 1.00 80.84 O ATOM 2086 C3' DA D 2 14.567 -7.068 44.558 1.00 80.48 C ATOM 2087 O3' DA D 2 13.277 -6.564 44.110 1.00 81.92 O ATOM 2088 C2' DA D 2 15.665 -7.200 43.499 1.00 78.72 C ATOM 2089 C1' DA D 2 16.277 -5.795 43.434 1.00 76.28 C ATOM 2090 N9 DA D 2 17.687 -5.737 43.059 1.00 74.93 N ATOM 2091 C8 DA D 2 18.648 -6.666 43.314 1.00 73.72 C ATOM 2092 N7 DA D 2 19.825 -6.331 42.827 1.00 75.09 N ATOM 2093 C5 DA D 2 19.623 -5.111 42.204 1.00 74.18 C ATOM 2094 C6 DA D 2 20.472 -4.236 41.508 1.00 71.65 C ATOM 2095 N6 DA D 2 21.750 -4.460 41.307 1.00 72.53 N ATOM 2096 N1 DA D 2 19.969 -3.109 41.015 1.00 72.15 N ATOM 2097 C2 DA D 2 18.673 -2.856 41.191 1.00 73.93 C ATOM 2098 N3 DA D 2 17.768 -3.593 41.836 1.00 75.30 N ATOM 2099 C4 DA D 2 18.307 -4.727 42.335 1.00 75.61 C ATOM 2100 P DA D 3 12.473 -6.995 42.775 1.00 83.86 P ATOM 2101 OP1 DA D 3 12.782 -8.417 42.444 1.00 82.54 O ATOM 2102 OP2 DA D 3 11.056 -6.544 42.911 1.00 80.56 O ATOM 2103 O5' DA D 3 13.181 -6.058 41.691 1.00 82.88 O ATOM 2104 C5' DA D 3 13.153 -4.647 41.908 1.00 83.37 C ATOM 2105 C4' DA D 3 13.262 -3.882 40.607 1.00 83.03 C ATOM 2106 O4' DA D 3 14.658 -3.764 40.208 1.00 81.24 O ATOM 2107 C3' DA D 3 12.526 -4.540 39.448 1.00 83.32 C ATOM 2108 O3' DA D 3 11.949 -3.506 38.630 1.00 88.36 O ATOM 2109 C2' DA D 3 13.639 -5.349 38.784 1.00 81.23 C ATOM 2110 C1' DA D 3 14.880 -4.487 39.009 1.00 77.38 C ATOM 2111 N9 DA D 3 16.142 -5.240 39.075 1.00 75.25 N ATOM 2112 C8 DA D 3 16.345 -6.518 39.509 1.00 74.02 C ATOM 2113 N7 DA D 3 17.594 -6.910 39.427 1.00 73.44 N ATOM 2114 C5 DA D 3 18.247 -5.830 38.909 1.00 72.29 C ATOM 2115 C6 DA D 3 19.582 -5.622 38.587 1.00 73.07 C ATOM 2116 N6 DA D 3 20.504 -6.539 38.770 1.00 73.15 N ATOM 2117 N1 DA D 3 19.934 -4.424 38.076 1.00 75.65 N ATOM 2118 C2 DA D 3 18.998 -3.471 37.900 1.00 74.99 C ATOM 2119 N3 DA D 3 17.689 -3.556 38.167 1.00 75.26 N ATOM 2120 C4 DA D 3 17.379 -4.782 38.675 1.00 74.93 C ATOM 2121 P DT D 4 11.325 -3.817 37.184 1.00 88.38 P ATOM 2122 OP1 DT D 4 11.097 -5.293 37.115 1.00 84.63 O ATOM 2123 OP2 DT D 4 10.245 -2.824 36.956 1.00 83.20 O ATOM 2124 O5' DT D 4 12.557 -3.448 36.233 1.00 85.85 O ATOM 2125 C5' DT D 4 13.151 -2.173 36.353 1.00 85.75 C ATOM 2126 C4' DT D 4 14.282 -2.064 35.355 1.00 85.97 C ATOM 2127 O4' DT D 4 15.360 -2.971 35.684 1.00 84.96 O ATOM 2128 C3' DT D 4 13.885 -2.412 33.925 1.00 86.81 C ATOM 2129 O3' DT D 4 14.263 -1.314 33.101 1.00 88.93 O ATOM 2130 C2' DT D 4 14.624 -3.716 33.608 1.00 85.41 C ATOM 2131 C1' DT D 4 15.838 -3.595 34.506 1.00 82.91 C ATOM 2132 N1 DT D 4 16.503 -4.871 34.944 1.00 82.30 N ATOM 2133 C2 DT D 4 17.865 -4.954 34.794 1.00 82.27 C ATOM 2134 O2 DT D 4 18.520 -4.056 34.298 1.00 82.55 O ATOM 2135 N3 DT D 4 18.437 -6.122 35.236 1.00 82.19 N ATOM 2136 C4 DT D 4 17.784 -7.182 35.829 1.00 81.44 C ATOM 2137 O4 DT D 4 18.387 -8.179 36.186 1.00 80.94 O ATOM 2138 C5 DT D 4 16.360 -7.045 35.972 1.00 81.52 C ATOM 2139 C7 DT D 4 15.579 -8.161 36.601 1.00 81.90 C ATOM 2140 C6 DT D 4 15.787 -5.907 35.534 1.00 81.71 C ATOM 2141 P DT D 5 14.030 -1.329 31.523 1.00 88.48 P ATOM 2142 OP1 DT D 5 13.799 0.110 31.222 1.00 88.30 O ATOM 2143 OP2 DT D 5 13.080 -2.427 31.164 1.00 81.79 O ATOM 2144 O5' DT D 5 15.496 -1.684 30.981 1.00 86.94 O ATOM 2145 C5' DT D 5 16.594 -0.851 31.391 1.00 84.25 C ATOM 2146 C4' DT D 5 17.887 -1.421 30.856 1.00 83.48 C ATOM 2147 O4' DT D 5 18.230 -2.701 31.451 1.00 80.64 O ATOM 2148 C3' DT D 5 17.793 -1.717 29.371 1.00 84.69 C ATOM 2149 O3' DT D 5 18.952 -1.167 28.795 1.00 87.10 O ATOM 2150 C2' DT D 5 17.683 -3.252 29.272 1.00 81.19 C ATOM 2151 C1' DT D 5 18.525 -3.651 30.454 1.00 74.78 C ATOM 2152 N1 DT D 5 18.264 -4.997 31.005 1.00 72.48 N ATOM 2153 C2 DT D 5 19.373 -5.754 31.264 1.00 72.48 C ATOM 2154 O2 DT D 5 20.489 -5.328 31.026 1.00 74.61 O ATOM 2155 N3 DT D 5 19.172 -7.007 31.774 1.00 69.72 N ATOM 2156 C4 DT D 5 17.958 -7.567 32.078 1.00 71.39 C ATOM 2157 O4 DT D 5 17.857 -8.704 32.545 1.00 72.35 O ATOM 2158 C5 DT D 5 16.822 -6.737 31.805 1.00 72.27 C ATOM 2159 C7 DT D 5 15.465 -7.315 32.106 1.00 72.62 C ATOM 2160 C6 DT D 5 17.016 -5.493 31.295 1.00 71.80 C ATOM 2161 P DT D 6 19.049 -0.991 27.225 1.00 86.72 P ATOM 2162 OP1 DT D 6 17.828 -1.546 26.573 1.00 84.61 O ATOM 2163 OP2 DT D 6 19.563 0.414 27.047 1.00 82.36 O ATOM 2164 O5' DT D 6 20.174 -2.099 26.955 1.00 85.84 O ATOM 2165 C5' DT D 6 21.518 -1.825 27.437 1.00 85.70 C ATOM 2166 C4' DT D 6 22.341 -3.092 27.493 1.00 84.00 C ATOM 2167 O4' DT D 6 21.472 -4.140 27.985 1.00 83.87 O ATOM 2168 C3' DT D 6 22.862 -3.613 26.158 1.00 84.83 C ATOM 2169 O3' DT D 6 24.251 -3.265 26.025 1.00 88.25 O ATOM 2170 C2' DT D 6 22.554 -5.130 26.196 1.00 83.32 C ATOM 2171 C1' DT D 6 22.015 -5.385 27.602 1.00 79.66 C ATOM 2172 N1 DT D 6 20.923 -6.379 27.853 1.00 76.44 N ATOM 2173 C2 DT D 6 21.248 -7.637 28.289 1.00 76.86 C ATOM 2174 O2 DT D 6 22.397 -8.017 28.427 1.00 76.41 O ATOM 2175 N3 DT D 6 20.182 -8.471 28.535 1.00 77.26 N ATOM 2176 C4 DT D 6 18.843 -8.160 28.431 1.00 76.84 C ATOM 2177 O4 DT D 6 17.947 -8.965 28.680 1.00 76.33 O ATOM 2178 C5 DT D 6 18.579 -6.820 28.002 1.00 75.80 C ATOM 2179 C7 DT D 6 17.155 -6.381 27.857 1.00 77.08 C ATOM 2180 C6 DT D 6 19.606 -5.999 27.742 1.00 75.66 C ATOM 2181 P DG D 7 25.003 -3.227 24.601 1.00 92.39 P ATOM 2182 OP1 DG D 7 24.191 -2.420 23.667 1.00 88.38 O ATOM 2183 OP2 DG D 7 26.425 -2.848 24.786 1.00 93.90 O ATOM 2184 O5' DG D 7 24.995 -4.788 24.252 1.00 91.93 O ATOM 2185 C5' DG D 7 25.937 -5.578 24.950 1.00 91.72 C ATOM 2186 C4' DG D 7 25.744 -7.042 24.658 1.00 93.36 C ATOM 2187 O4' DG D 7 24.472 -7.476 25.176 1.00 92.01 O ATOM 2188 C3' DG D 7 25.742 -7.449 23.182 1.00 95.61 C ATOM 2189 O3' DG D 7 26.838 -8.357 22.997 1.00100.49 O ATOM 2190 C2' DG D 7 24.365 -8.094 22.965 1.00 93.11 C ATOM 2191 C1' DG D 7 24.044 -8.559 24.375 1.00 90.14 C ATOM 2192 N9 DG D 7 22.644 -8.762 24.685 1.00 88.71 N ATOM 2193 C8 DG D 7 21.631 -7.861 24.472 1.00 88.80 C ATOM 2194 N7 DG D 7 20.472 -8.276 24.892 1.00 88.72 N ATOM 2195 C5 DG D 7 20.743 -9.537 25.411 1.00 87.91 C ATOM 2196 C6 DG D 7 19.870 -10.475 25.993 1.00 88.22 C ATOM 2197 O6 DG D 7 18.648 -10.365 26.151 1.00 88.55 O ATOM 2198 N1 DG D 7 20.529 -11.634 26.390 1.00 88.34 N ATOM 2199 C2 DG D 7 21.884 -11.826 26.257 1.00 88.57 C ATOM 2200 N2 DG D 7 22.358 -13.003 26.705 1.00 88.14 N ATOM 2201 N3 DG D 7 22.717 -10.946 25.709 1.00 87.10 N ATOM 2202 C4 DG D 7 22.076 -9.839 25.306 1.00 86.72 C ATOM 2203 P DC D 8 27.356 -8.846 21.562 1.00104.79 P ATOM 2204 OP1 DC D 8 27.146 -7.736 20.585 1.00105.47 O ATOM 2205 OP2 DC D 8 28.707 -9.431 21.785 1.00102.43 O ATOM 2206 O5' DC D 8 26.301 -9.997 21.184 1.00102.95 O ATOM 2207 C5' DC D 8 26.680 -11.367 21.077 1.00100.97 C ATOM 2208 C4' DC D 8 25.637 -12.251 21.725 1.00 98.93 C ATOM 2209 O4' DC D 8 24.516 -11.491 22.218 1.00 96.81 O ATOM 2210 C3' DC D 8 24.904 -13.175 20.785 1.00 98.84 C ATOM 2211 O3' DC D 8 25.747 -14.231 20.351 1.00102.20 O ATOM 2212 C2' DC D 8 23.759 -13.645 21.669 1.00 96.07 C ATOM 2213 C1' DC D 8 23.532 -12.447 22.578 1.00 93.84 C ATOM 2214 N1 DC D 8 22.128 -11.887 22.540 1.00 91.60 N ATOM 2215 C2 DC D 8 21.095 -12.723 22.957 1.00 89.84 C ATOM 2216 O2 DC D 8 21.371 -13.875 23.312 1.00 90.50 O ATOM 2217 N3 DC D 8 19.825 -12.264 22.955 1.00 88.53 N ATOM 2218 C4 DC D 8 19.560 -11.024 22.574 1.00 90.24 C ATOM 2219 N4 DC D 8 18.282 -10.628 22.605 1.00 91.08 N ATOM 2220 C5 DC D 8 20.599 -10.140 22.154 1.00 90.44 C ATOM 2221 C6 DC D 8 21.856 -10.602 22.155 1.00 90.84 C ATOM 2222 P DT D 9 25.562 -14.845 18.880 1.00103.37 P ATOM 2223 OP1 DT D 9 24.465 -14.129 18.167 1.00 99.91 O ATOM 2224 OP2 DT D 9 26.924 -14.877 18.306 1.00104.57 O ATOM 2225 O5' DT D 9 25.149 -16.363 19.167 1.00100.50 O ATOM 2226 C5' DT D 9 24.906 -16.870 20.478 1.00 98.96 C ATOM 2227 C4' DT D 9 23.540 -17.525 20.498 1.00 97.68 C ATOM 2228 O4' DT D 9 22.510 -16.573 20.866 1.00 95.88 O ATOM 2229 C3' DT D 9 23.098 -18.073 19.151 1.00 96.62 C ATOM 2230 O3' DT D 9 22.529 -19.321 19.310 1.00 96.87 O ATOM 2231 C2' DT D 9 22.040 -17.084 18.727 1.00 96.81 C ATOM 2232 C1' DT D 9 21.384 -16.828 20.070 1.00 96.30 C ATOM 2233 N1 DT D 9 20.450 -15.656 20.094 1.00 97.11 N ATOM 2234 C2 DT D 9 19.135 -15.783 20.546 1.00 96.99 C ATOM 2235 O2 DT D 9 18.627 -16.831 20.940 1.00 96.21 O ATOM 2236 N3 DT D 9 18.398 -14.621 20.483 1.00 96.13 N ATOM 2237 C4 DT D 9 18.854 -13.390 20.054 1.00 96.59 C ATOM 2238 O4 DT D 9 18.147 -12.391 20.036 1.00 98.38 O ATOM 2239 C5 DT D 9 20.211 -13.329 19.601 1.00 96.08 C ATOM 2240 C7 DT D 9 20.776 -12.029 19.119 1.00 96.42 C ATOM 2241 C6 DT D 9 20.936 -14.444 19.638 1.00 96.17 C ATOM 2242 P DC D 10 22.449 -20.298 18.058 1.00 97.36 P ATOM 2243 OP1 DC D 10 21.397 -19.808 17.136 1.00 97.09 O ATOM 2244 OP2 DC D 10 23.835 -20.526 17.579 1.00 95.49 O ATOM 2245 O5' DC D 10 21.898 -21.615 18.779 1.00 96.66 O ATOM 2246 C5' DC D 10 20.794 -22.332 18.257 1.00 95.20 C ATOM 2247 C4' DC D 10 19.419 -21.790 18.652 1.00 93.20 C ATOM 2248 O4' DC D 10 19.311 -20.363 18.808 1.00 89.55 O ATOM 2249 C3' DC D 10 18.396 -22.103 17.578 1.00 93.47 C ATOM 2250 O3' DC D 10 17.912 -23.436 17.805 1.00 96.92 O ATOM 2251 C2' DC D 10 17.321 -21.035 17.694 1.00 90.97 C ATOM 2252 C1' DC D 10 17.933 -20.038 18.660 1.00 89.33 C ATOM 2253 N1 DC D 10 17.735 -18.569 18.261 1.00 88.34 N ATOM 2254 C2 DC D 10 16.479 -17.973 18.444 1.00 87.28 C ATOM 2255 O2 DC D 10 15.542 -18.633 18.899 1.00 87.67 O ATOM 2256 N3 DC D 10 16.304 -16.676 18.115 1.00 88.35 N ATOM 2257 C4 DC D 10 17.310 -15.954 17.621 1.00 88.61 C ATOM 2258 N4 DC D 10 17.073 -14.663 17.330 1.00 86.77 N ATOM 2259 C5 DC D 10 18.596 -16.546 17.420 1.00 87.65 C ATOM 2260 C6 DC D 10 18.763 -17.833 17.741 1.00 86.78 C ATOM 2261 P DA D 11 17.255 -24.172 16.552 1.00100.14 P ATOM 2262 OP1 DA D 11 17.992 -23.681 15.360 1.00101.03 O ATOM 2263 OP2 DA D 11 17.084 -25.631 16.826 1.00 98.67 O ATOM 2264 O5' DA D 11 15.847 -23.421 16.451 1.00 98.09 O ATOM 2265 C5' DA D 11 14.715 -23.861 17.188 1.00 94.86 C ATOM 2266 C4' DA D 11 13.566 -22.938 16.853 1.00 92.23 C ATOM 2267 O4' DA D 11 14.092 -21.582 16.836 1.00 87.50 O ATOM 2268 C3' DA D 11 12.930 -23.218 15.488 1.00 91.35 C ATOM 2269 O3' DA D 11 11.622 -23.802 15.655 1.00 94.42 O ATOM 2270 C2' DA D 11 12.928 -21.855 14.794 1.00 88.46 C ATOM 2271 C1' DA D 11 13.376 -20.865 15.863 1.00 85.14 C ATOM 2272 N9 DA D 11 14.236 -19.782 15.398 1.00 83.90 N ATOM 2273 C8 DA D 11 15.469 -19.895 14.816 1.00 82.63 C ATOM 2274 N7 DA D 11 16.005 -18.722 14.529 1.00 82.68 N ATOM 2275 C5 DA D 11 15.067 -17.793 14.945 1.00 81.23 C ATOM 2276 C6 DA D 11 15.048 -16.390 14.897 1.00 81.73 C ATOM 2277 N6 DA D 11 16.053 -15.668 14.394 1.00 81.32 N ATOM 2278 N1 DA D 11 13.946 -15.774 15.382 1.00 82.04 N ATOM 2279 C2 DA D 11 12.939 -16.518 15.885 1.00 81.87 C ATOM 2280 N3 DA D 11 12.845 -17.845 15.977 1.00 79.47 N ATOM 2281 C4 DA D 11 13.958 -18.427 15.483 1.00 81.76 C ATOM 2282 P DA D 12 10.607 -24.114 14.435 1.00 98.94 P ATOM 2283 OP1 DA D 12 10.945 -23.290 13.246 1.00 98.56 O ATOM 2284 OP2 DA D 12 10.508 -25.584 14.304 1.00 98.00 O ATOM 2285 O5' DA D 12 9.197 -23.619 15.010 1.00 97.24 O ATOM 2286 C5' DA D 12 9.093 -22.655 16.066 1.00 94.12 C ATOM 2287 C4' DA D 12 8.574 -21.337 15.535 1.00 91.51 C ATOM 2288 O4' DA D 12 9.687 -20.500 15.135 1.00 89.50 O ATOM 2289 C3' DA D 12 7.661 -21.445 14.315 1.00 90.29 C ATOM 2290 O3' DA D 12 6.462 -20.776 14.635 1.00 91.40 O ATOM 2291 C2' DA D 12 8.486 -20.797 13.195 1.00 89.04 C ATOM 2292 C1' DA D 12 9.279 -19.775 13.996 1.00 87.74 C ATOM 2293 N9 DA D 12 10.470 -19.177 13.392 1.00 86.55 N ATOM 2294 C8 DA D 12 11.549 -19.798 12.822 1.00 86.45 C ATOM 2295 N7 DA D 12 12.476 -18.961 12.398 1.00 85.30 N ATOM 2296 C5 DA D 12 11.967 -17.718 12.691 1.00 83.44 C ATOM 2297 C6 DA D 12 12.463 -16.412 12.493 1.00 85.39 C ATOM 2298 N6 DA D 12 13.637 -16.139 11.917 1.00 84.64 N ATOM 2299 N1 DA D 12 11.694 -15.374 12.926 1.00 87.03 N ATOM 2300 C2 DA D 12 10.506 -15.639 13.511 1.00 87.39 C ATOM 2301 N3 DA D 12 9.946 -16.841 13.749 1.00 86.56 N ATOM 2302 C4 DA D 12 10.735 -17.837 13.310 1.00 84.98 C ATOM 2303 P DA D 13 5.202 -20.828 13.667 1.00 94.83 P ATOM 2304 OP1 DA D 13 5.609 -21.500 12.413 1.00 94.37 O ATOM 2305 OP2 DA D 13 4.072 -21.341 14.478 1.00 93.41 O ATOM 2306 O5' DA D 13 4.956 -19.291 13.289 1.00 95.01 O ATOM 2307 C5' DA D 13 5.300 -18.253 14.219 1.00 95.89 C ATOM 2308 C4' DA D 13 5.225 -16.878 13.573 1.00 97.01 C ATOM 2309 O4' DA D 13 6.517 -16.498 13.010 1.00 95.48 O ATOM 2310 C3' DA D 13 4.225 -16.749 12.419 1.00 97.79 C ATOM 2311 O3' DA D 13 3.633 -15.432 12.441 1.00 98.58 O ATOM 2312 C2' DA D 13 5.106 -17.009 11.193 1.00 96.96 C ATOM 2313 C1' DA D 13 6.382 -16.272 11.606 1.00 93.92 C ATOM 2314 N9 DA D 13 7.624 -16.689 10.937 1.00 92.10 N ATOM 2315 C8 DA D 13 8.031 -17.951 10.586 1.00 91.06 C ATOM 2316 N7 DA D 13 9.211 -17.995 10.014 1.00 89.71 N ATOM 2317 C5 DA D 13 9.609 -16.672 9.982 1.00 90.72 C ATOM 2318 C6 DA D 13 10.769 -16.017 9.499 1.00 91.66 C ATOM 2319 N6 DA D 13 11.784 -16.661 8.931 1.00 91.43 N ATOM 2320 N1 DA D 13 10.866 -14.666 9.624 1.00 91.55 N ATOM 2321 C2 DA D 13 9.851 -13.998 10.197 1.00 91.75 C ATOM 2322 N3 DA D 13 8.709 -14.499 10.688 1.00 92.31 N ATOM 2323 C4 DA D 13 8.644 -15.851 10.546 1.00 92.02 C ATOM 2324 P DG D 14 2.549 -15.000 11.340 1.00 99.00 P ATOM 2325 OP1 DG D 14 2.046 -16.220 10.647 1.00 96.75 O ATOM 2326 OP2 DG D 14 1.610 -14.005 11.924 1.00 98.09 O ATOM 2327 O5' DG D 14 3.523 -14.186 10.383 1.00 94.45 O ATOM 2328 C5' DG D 14 3.947 -12.940 10.871 1.00 90.65 C ATOM 2329 C4' DG D 14 4.808 -12.301 9.821 1.00 88.28 C ATOM 2330 O4' DG D 14 5.897 -13.189 9.473 1.00 86.75 O ATOM 2331 C3' DG D 14 4.071 -12.006 8.529 1.00 86.26 C ATOM 2332 O3' DG D 14 4.296 -10.655 8.265 1.00 87.38 O ATOM 2333 C2' DG D 14 4.720 -12.949 7.523 1.00 84.79 C ATOM 2334 C1' DG D 14 6.118 -13.057 8.103 1.00 81.69 C ATOM 2335 N9 DG D 14 6.832 -14.242 7.689 1.00 80.06 N ATOM 2336 C8 DG D 14 6.405 -15.546 7.783 1.00 79.32 C ATOM 2337 N7 DG D 14 7.268 -16.411 7.322 1.00 78.72 N ATOM 2338 C5 DG D 14 8.328 -15.616 6.913 1.00 78.63 C ATOM 2339 C6 DG D 14 9.559 -15.998 6.333 1.00 79.50 C ATOM 2340 O6 DG D 14 9.916 -17.165 6.065 1.00 77.94 O ATOM 2341 N1 DG D 14 10.377 -14.872 6.046 1.00 80.46 N ATOM 2342 C2 DG D 14 10.036 -13.543 6.313 1.00 80.00 C ATOM 2343 N2 DG D 14 10.938 -12.604 5.978 1.00 78.52 N ATOM 2344 N3 DG D 14 8.871 -13.174 6.866 1.00 79.68 N ATOM 2345 C4 DG D 14 8.081 -14.268 7.130 1.00 79.96 C ATOM 2346 P DT D 15 3.696 -9.960 6.957 1.00 90.37 P ATOM 2347 OP1 DT D 15 3.291 -8.579 7.355 1.00 85.02 O ATOM 2348 OP2 DT D 15 2.804 -10.937 6.254 1.00 85.72 O ATOM 2349 O5' DT D 15 5.032 -9.820 6.076 1.00 89.45 O ATOM 2350 C5' DT D 15 6.083 -8.990 6.559 1.00 84.96 C ATOM 2351 C4' DT D 15 7.164 -8.893 5.515 1.00 82.05 C ATOM 2352 O4' DT D 15 7.716 -10.186 5.209 1.00 78.51 O ATOM 2353 C3' DT D 15 6.652 -8.312 4.211 1.00 81.24 C ATOM 2354 O3' DT D 15 7.472 -7.203 4.058 1.00 84.02 O ATOM 2355 C2' DT D 15 6.796 -9.446 3.197 1.00 79.81 C ATOM 2356 C1' DT D 15 7.890 -10.275 3.830 1.00 75.27 C ATOM 2357 N1 DT D 15 7.845 -11.719 3.647 1.00 73.48 N ATOM 2358 C2 DT D 15 8.999 -12.315 3.172 1.00 73.88 C ATOM 2359 O2 DT D 15 9.991 -11.671 2.859 1.00 74.60 O ATOM 2360 N3 DT D 15 8.961 -13.677 3.034 1.00 69.78 N ATOM 2361 C4 DT D 15 7.886 -14.457 3.364 1.00 70.51 C ATOM 2362 O4 DT D 15 7.933 -15.664 3.214 1.00 72.57 O ATOM 2363 C5 DT D 15 6.720 -13.793 3.871 1.00 70.54 C ATOM 2364 C7 DT D 15 5.539 -14.636 4.224 1.00 72.08 C ATOM 2365 C6 DT D 15 6.740 -12.456 4.007 1.00 70.65 C ATOM 2366 P DT D 16 7.563 -6.323 2.753 1.00 86.04 P ATOM 2367 OP1 DT D 16 6.283 -6.485 2.004 1.00 80.24 O ATOM 2368 OP2 DT D 16 8.162 -4.975 3.114 1.00 78.87 O ATOM 2369 O5' DT D 16 8.667 -7.277 2.067 1.00 82.29 O ATOM 2370 C5' DT D 16 10.043 -6.945 2.188 1.00 78.77 C ATOM 2371 C4' DT D 16 10.795 -7.745 1.142 1.00 78.19 C ATOM 2372 O4' DT D 16 10.329 -9.125 1.149 1.00 76.15 O ATOM 2373 C3' DT D 16 10.643 -7.236 -0.297 1.00 76.03 C ATOM 2374 O3' DT D 16 11.964 -6.897 -0.816 1.00 76.48 O ATOM 2375 C2' DT D 16 9.958 -8.407 -0.985 1.00 74.06 C ATOM 2376 C1' DT D 16 10.423 -9.608 -0.158 1.00 70.45 C ATOM 2377 N1 DT D 16 9.571 -10.839 -0.170 1.00 67.54 N ATOM 2378 C2 DT D 16 10.143 -12.029 -0.506 1.00 67.71 C ATOM 2379 O2 DT D 16 11.328 -12.102 -0.794 1.00 68.04 O ATOM 2380 N3 DT D 16 9.285 -13.113 -0.501 1.00 66.71 N ATOM 2381 C4 DT D 16 7.931 -13.106 -0.154 1.00 68.17 C ATOM 2382 O4 DT D 16 7.215 -14.133 -0.148 1.00 67.82 O ATOM 2383 C5 DT D 16 7.408 -11.807 0.176 1.00 64.81 C ATOM 2384 C7 DT D 16 5.973 -11.649 0.546 1.00 65.93 C ATOM 2385 C6 DT D 16 8.238 -10.771 0.167 1.00 65.33 C ATOM 2386 P DC D 17 12.172 -6.227 -2.245 1.00 73.02 P ATOM 2387 OP1 DC D 17 10.890 -5.491 -2.423 1.00 67.70 O ATOM 2388 OP2 DC D 17 13.487 -5.558 -2.438 1.00 68.55 O ATOM 2389 O5' DC D 17 12.310 -7.592 -3.087 1.00 72.37 O ATOM 2390 C5' DC D 17 13.512 -8.334 -2.893 1.00 74.05 C ATOM 2391 C4' DC D 17 13.473 -9.671 -3.578 1.00 76.30 C ATOM 2392 O4' DC D 17 12.348 -10.432 -3.107 1.00 75.67 O ATOM 2393 C3' DC D 17 13.182 -9.614 -5.056 1.00 79.94 C ATOM 2394 O3' DC D 17 14.375 -9.310 -5.800 1.00 88.24 O ATOM 2395 C2' DC D 17 12.622 -11.012 -5.351 1.00 76.75 C ATOM 2396 C1' DC D 17 12.115 -11.490 -4.017 1.00 71.28 C ATOM 2397 N1 DC D 17 10.687 -11.794 -3.905 1.00 67.08 N ATOM 2398 C2 DC D 17 10.262 -13.120 -3.943 1.00 66.92 C ATOM 2399 O2 DC D 17 11.083 -14.022 -4.135 1.00 65.74 O ATOM 2400 N3 DC D 17 8.943 -13.374 -3.793 1.00 67.60 N ATOM 2401 C4 DC D 17 8.078 -12.372 -3.574 1.00 69.77 C ATOM 2402 N4 DC D 17 6.788 -12.687 -3.429 1.00 69.27 N ATOM 2403 C5 DC D 17 8.490 -11.011 -3.504 1.00 67.20 C ATOM 2404 C6 DC D 17 9.798 -10.784 -3.687 1.00 67.19 C ATOM 2405 P DA D 18 14.315 -8.820 -7.348 1.00 92.88 P ATOM 2406 OP1 DA D 18 12.966 -8.282 -7.666 1.00 88.76 O ATOM 2407 OP2 DA D 18 15.511 -7.979 -7.588 1.00 93.54 O ATOM 2408 O5' DA D 18 14.529 -10.203 -8.124 1.00 91.32 O ATOM 2409 C5' DA D 18 15.456 -11.173 -7.632 1.00 89.67 C ATOM 2410 C4' DA D 18 15.111 -12.489 -8.302 1.00 88.63 C ATOM 2411 O4' DA D 18 13.839 -13.000 -7.802 1.00 85.48 O ATOM 2412 C3' DA D 18 14.974 -12.374 -9.816 1.00 87.45 C ATOM 2413 O3' DA D 18 15.537 -13.558 -10.378 1.00 92.00 O ATOM 2414 C2' DA D 18 13.464 -12.245 -10.008 1.00 85.87 C ATOM 2415 C1' DA D 18 12.941 -13.146 -8.887 1.00 83.32 C ATOM 2416 N9 DA D 18 11.571 -12.913 -8.394 1.00 82.09 N ATOM 2417 C8 DA D 18 10.931 -11.739 -8.089 1.00 80.18 C ATOM 2418 N7 DA D 18 9.699 -11.898 -7.653 1.00 78.67 N ATOM 2419 C5 DA D 18 9.516 -13.266 -7.691 1.00 78.60 C ATOM 2420 C6 DA D 18 8.433 -14.103 -7.368 1.00 80.12 C ATOM 2421 N6 DA D 18 7.256 -13.672 -6.911 1.00 80.26 N ATOM 2422 N1 DA D 18 8.603 -15.440 -7.538 1.00 81.97 N ATOM 2423 C2 DA D 18 9.773 -15.935 -7.985 1.00 80.88 C ATOM 2424 N3 DA D 18 10.863 -15.241 -8.311 1.00 80.59 N ATOM 2425 C4 DA D 18 10.659 -13.909 -8.140 1.00 80.54 C ATOM 2426 P DA D 19 15.809 -13.754 -11.951 1.00 94.99 P ATOM 2427 OP1 DA D 19 15.440 -12.467 -12.624 1.00 94.84 O ATOM 2428 OP2 DA D 19 17.137 -14.416 -12.085 1.00 90.64 O ATOM 2429 O5' DA D 19 14.696 -14.794 -12.424 1.00 93.21 O ATOM 2430 C5' DA D 19 14.339 -15.933 -11.668 1.00 92.75 C ATOM 2431 C4' DA D 19 13.087 -16.590 -12.252 1.00 94.09 C ATOM 2432 O4' DA D 19 11.903 -16.145 -11.532 1.00 94.06 O ATOM 2433 C3' DA D 19 12.755 -16.391 -13.744 1.00 94.41 C ATOM 2434 O3' DA D 19 12.381 -17.640 -14.278 1.00 98.99 O ATOM 2435 C2' DA D 19 11.548 -15.475 -13.744 1.00 93.11 C ATOM 2436 C1' DA D 19 10.854 -15.886 -12.450 1.00 91.13 C ATOM 2437 N9 DA D 19 9.974 -14.855 -11.886 1.00 91.34 N ATOM 2438 C8 DA D 19 10.201 -13.495 -11.764 1.00 90.59 C ATOM 2439 N7 DA D 19 9.212 -12.831 -11.203 1.00 89.96 N ATOM 2440 C5 DA D 19 8.285 -13.822 -10.946 1.00 89.03 C ATOM 2441 C6 DA D 19 7.022 -13.797 -10.368 1.00 88.57 C ATOM 2442 N6 DA D 19 6.442 -12.695 -9.946 1.00 89.42 N ATOM 2443 N1 DA D 19 6.362 -14.954 -10.251 1.00 90.12 N ATOM 2444 C2 DA D 19 6.924 -16.080 -10.686 1.00 89.25 C ATOM 2445 N3 DA D 19 8.110 -16.235 -11.252 1.00 88.05 N ATOM 2446 C4 DA D 19 8.735 -15.064 -11.351 1.00 89.29 C ATOM 2447 P DA D 20 12.408 -18.064 -15.824 1.00102.33 P ATOM 2448 OP1 DA D 20 12.539 -16.820 -16.642 1.00100.59 O ATOM 2449 OP2 DA D 20 13.357 -19.219 -15.876 1.00101.30 O ATOM 2450 O5' DA D 20 10.944 -18.672 -16.103 1.00 97.39 O ATOM 2451 C5' DA D 20 9.843 -18.009 -15.535 1.00 93.75 C ATOM 2452 C4' DA D 20 8.656 -18.932 -15.502 1.00 89.82 C ATOM 2453 O4' DA D 20 7.725 -18.483 -14.482 1.00 88.59 O ATOM 2454 C3' DA D 20 7.927 -18.823 -16.812 1.00 87.73 C ATOM 2455 O3' DA D 20 7.366 -20.040 -17.163 1.00 86.42 O ATOM 2456 C2' DA D 20 6.878 -17.743 -16.561 1.00 86.20 C ATOM 2457 C1' DA D 20 6.744 -17.618 -15.041 1.00 82.64 C ATOM 2458 N9 DA D 20 6.788 -16.196 -14.644 1.00 79.83 N ATOM 2459 C8 DA D 20 7.735 -15.264 -14.953 1.00 79.07 C ATOM 2460 N7 DA D 20 7.452 -14.053 -14.492 1.00 80.26 N ATOM 2461 C5 DA D 20 6.230 -14.185 -13.854 1.00 79.03 C ATOM 2462 C6 DA D 20 5.385 -13.282 -13.165 1.00 78.23 C ATOM 2463 N6 DA D 20 5.624 -11.991 -12.970 1.00 77.10 N ATOM 2464 N1 DA D 20 4.243 -13.780 -12.665 1.00 79.56 N ATOM 2465 C2 DA D 20 3.936 -15.081 -12.815 1.00 78.88 C ATOM 2466 N3 DA D 20 4.652 -16.002 -13.446 1.00 77.53 N ATOM 2467 C4 DA D 20 5.803 -15.504 -13.948 1.00 78.86 C ATOM 2468 P DC D 21 7.136 -20.291 -18.711 1.00 86.28 P ATOM 2469 OP1 DC D 21 8.159 -19.524 -19.471 1.00 83.55 O ATOM 2470 OP2 DC D 21 6.963 -21.762 -18.850 1.00 86.54 O ATOM 2471 O5' DC D 21 5.742 -19.578 -19.001 1.00 85.37 O ATOM 2472 C5' DC D 21 4.566 -19.990 -18.339 1.00 85.89 C ATOM 2473 C4' DC D 21 3.518 -18.927 -18.544 1.00 87.10 C ATOM 2474 O4' DC D 21 3.710 -17.827 -17.594 1.00 88.27 O ATOM 2475 C3' DC D 21 3.593 -18.276 -19.924 1.00 88.70 C ATOM 2476 O3' DC D 21 2.301 -17.991 -20.436 1.00 90.82 O ATOM 2477 C2' DC D 21 4.309 -16.971 -19.612 1.00 87.69 C ATOM 2478 C1' DC D 21 3.587 -16.615 -18.314 1.00 85.05 C ATOM 2479 N1 DC D 21 4.092 -15.368 -17.639 1.00 81.93 N ATOM 2480 C2 DC D 21 3.213 -14.575 -16.893 1.00 81.60 C ATOM 2481 O2 DC D 21 2.046 -14.930 -16.748 1.00 81.07 O ATOM 2482 N3 DC D 21 3.662 -13.426 -16.331 1.00 82.66 N ATOM 2483 C4 DC D 21 4.927 -13.052 -16.489 1.00 82.55 C ATOM 2484 N4 DC D 21 5.338 -11.931 -15.904 1.00 82.22 N ATOM 2485 C5 DC D 21 5.835 -13.833 -17.252 1.00 81.99 C ATOM 2486 C6 DC D 21 5.382 -14.959 -17.807 1.00 81.50 C ATOM 2487 P DA D 22 1.762 -18.634 -21.785 1.00 90.75 P ATOM 2488 OP1 DA D 22 1.513 -17.479 -22.700 1.00 85.74 O ATOM 2489 OP2 DA D 22 2.624 -19.789 -22.161 1.00 89.05 O ATOM 2490 O5' DA D 22 0.397 -19.277 -21.217 1.00 91.51 O ATOM 2491 C5' DA D 22 -0.893 -18.838 -21.632 1.00 92.62 C ATOM 2492 C4' DA D 22 -1.538 -17.769 -20.750 1.00 91.80 C ATOM 2493 O4' DA D 22 -0.552 -16.858 -20.185 1.00 91.48 O ATOM 2494 C3' DA D 22 -2.500 -16.895 -21.557 1.00 93.07 C ATOM 2495 O3' DA D 22 -3.813 -16.792 -20.971 1.00 94.15 O ATOM 2496 C2' DA D 22 -1.774 -15.548 -21.647 1.00 92.58 C ATOM 2497 C1' DA D 22 -1.011 -15.521 -20.337 1.00 89.60 C ATOM 2498 N9 DA D 22 0.123 -14.607 -20.271 1.00 87.18 N ATOM 2499 C8 DA D 22 1.332 -14.751 -20.878 1.00 87.32 C ATOM 2500 N7 DA D 22 2.172 -13.778 -20.620 1.00 87.44 N ATOM 2501 C5 DA D 22 1.464 -12.944 -19.780 1.00 87.21 C ATOM 2502 C6 DA D 22 1.799 -11.728 -19.136 1.00 88.21 C ATOM 2503 N6 DA D 22 2.982 -11.112 -19.252 1.00 86.70 N ATOM 2504 N1 DA D 22 0.843 -11.158 -18.374 1.00 87.85 N ATOM 2505 C2 DA D 22 -0.341 -11.771 -18.256 1.00 87.08 C ATOM 2506 N3 DA D 22 -0.754 -12.911 -18.807 1.00 85.91 N ATOM 2507 C4 DA D 22 0.200 -13.447 -19.563 1.00 85.47 C ATOM 2508 P DA D 23 -5.037 -16.265 -21.894 1.00 96.63 P ATOM 2509 OP1 DA D 23 -4.484 -15.689 -23.155 1.00 91.92 O ATOM 2510 OP2 DA D 23 -6.065 -17.340 -21.930 1.00 94.44 O ATOM 2511 O5' DA D 23 -5.653 -15.047 -21.040 1.00 96.50 O ATOM 2512 C5' DA D 23 -4.933 -14.341 -20.015 1.00 93.99 C ATOM 2513 C4' DA D 23 -5.288 -12.863 -19.967 1.00 91.79 C ATOM 2514 O4' DA D 23 -4.074 -12.068 -20.037 1.00 91.75 O ATOM 2515 C3' DA D 23 -6.134 -12.289 -21.088 1.00 90.75 C ATOM 2516 O3' DA D 23 -6.884 -11.217 -20.516 1.00 90.93 O ATOM 2517 C2' DA D 23 -5.065 -11.877 -22.105 1.00 90.14 C ATOM 2518 C1' DA D 23 -3.966 -11.288 -21.229 1.00 88.61 C ATOM 2519 N9 DA D 23 -2.549 -11.366 -21.661 1.00 87.56 N ATOM 2520 C8 DA D 23 -1.934 -12.351 -22.377 1.00 86.80 C ATOM 2521 N7 DA D 23 -0.647 -12.166 -22.559 1.00 86.10 N ATOM 2522 C5 DA D 23 -0.382 -10.983 -21.930 1.00 85.97 C ATOM 2523 C6 DA D 23 0.802 -10.236 -21.767 1.00 87.08 C ATOM 2524 N6 DA D 23 1.982 -10.604 -22.256 1.00 87.75 N ATOM 2525 N1 DA D 23 0.745 -9.090 -21.065 1.00 86.69 N ATOM 2526 C2 DA D 23 -0.433 -8.720 -20.561 1.00 87.00 C ATOM 2527 N3 DA D 23 -1.616 -9.341 -20.653 1.00 87.86 N ATOM 2528 C4 DA D 23 -1.531 -10.481 -21.361 1.00 87.10 C ATOM 2529 P DA D 24 -7.881 -10.250 -21.325 1.00 90.77 P ATOM 2530 OP1 DA D 24 -8.060 -10.765 -22.695 1.00 89.88 O ATOM 2531 OP2 DA D 24 -9.074 -10.058 -20.462 1.00 91.51 O ATOM 2532 O5' DA D 24 -7.046 -8.883 -21.381 1.00 87.33 O ATOM 2533 C5' DA D 24 -6.519 -8.388 -20.141 1.00 84.51 C ATOM 2534 C4' DA D 24 -5.837 -7.038 -20.257 1.00 80.99 C ATOM 2535 O4' DA D 24 -4.517 -7.207 -20.833 1.00 78.16 O ATOM 2536 C3' DA D 24 -6.558 -6.019 -21.116 1.00 77.79 C ATOM 2537 O3' DA D 24 -6.781 -4.888 -20.306 1.00 77.62 O ATOM 2538 C2' DA D 24 -5.606 -5.836 -22.319 1.00 77.33 C ATOM 2539 C1' DA D 24 -4.228 -6.217 -21.806 1.00 74.56 C ATOM 2540 N9 DA D 24 -3.258 -6.922 -22.660 1.00 72.97 N ATOM 2541 C8 DA D 24 -3.446 -8.040 -23.426 1.00 73.08 C ATOM 2542 N7 DA D 24 -2.374 -8.489 -24.039 1.00 71.67 N ATOM 2543 C5 DA D 24 -1.405 -7.625 -23.635 1.00 70.49 C ATOM 2544 C6 DA D 24 -0.036 -7.559 -23.924 1.00 72.90 C ATOM 2545 N6 DA D 24 0.617 -8.403 -24.716 1.00 71.67 N ATOM 2546 N1 DA D 24 0.654 -6.559 -23.342 1.00 74.12 N ATOM 2547 C2 DA D 24 0.004 -5.711 -22.532 1.00 72.73 C ATOM 2548 N3 DA D 24 -1.281 -5.673 -22.193 1.00 70.55 N ATOM 2549 C4 DA D 24 -1.928 -6.668 -22.783 1.00 70.77 C ATOM 2550 P DT D 25 -7.148 -3.510 -21.018 1.00 79.90 P ATOM 2551 OP1 DT D 25 -7.843 -3.788 -22.298 1.00 79.85 O ATOM 2552 OP2 DT D 25 -7.750 -2.601 -20.025 1.00 78.81 O ATOM 2553 O5' DT D 25 -5.694 -3.010 -21.447 1.00 77.58 O ATOM 2554 C5' DT D 25 -4.754 -2.625 -20.500 1.00 74.26 C ATOM 2555 C4' DT D 25 -3.647 -1.892 -21.210 1.00 71.78 C ATOM 2556 O4' DT D 25 -2.988 -2.856 -22.034 1.00 70.58 O ATOM 2557 C3' DT D 25 -4.078 -0.749 -22.128 1.00 69.50 C ATOM 2558 O3' DT D 25 -3.634 0.438 -21.519 1.00 71.54 O ATOM 2559 C2' DT D 25 -3.453 -1.096 -23.473 1.00 68.42 C ATOM 2560 C1' DT D 25 -2.429 -2.150 -23.109 1.00 68.69 C ATOM 2561 N1 DT D 25 -2.209 -3.225 -24.099 1.00 68.71 N ATOM 2562 C2 DT D 25 -0.942 -3.471 -24.574 1.00 68.03 C ATOM 2563 O2 DT D 25 0.031 -2.826 -24.229 1.00 67.48 O ATOM 2564 N3 DT D 25 -0.867 -4.506 -25.475 1.00 68.46 N ATOM 2565 C4 DT D 25 -1.933 -5.278 -25.915 1.00 68.25 C ATOM 2566 O4 DT D 25 -1.807 -6.193 -26.700 1.00 68.14 O ATOM 2567 C5 DT D 25 -3.222 -4.972 -25.385 1.00 68.18 C ATOM 2568 C7 DT D 25 -4.406 -5.775 -25.815 1.00 67.63 C ATOM 2569 C6 DT D 25 -3.302 -3.976 -24.502 1.00 69.19 C ATOM 2570 P DT D 26 -3.092 1.732 -22.268 1.00 72.23 P ATOM 2571 OP1 DT D 26 -3.959 1.977 -23.447 1.00 71.12 O ATOM 2572 OP2 DT D 26 -2.874 2.783 -21.249 1.00 69.80 O ATOM 2573 O5' DT D 26 -1.704 1.172 -22.846 1.00 74.70 O ATOM 2574 C5' DT D 26 -0.465 1.296 -22.170 1.00 76.08 C ATOM 2575 C4' DT D 26 0.731 1.439 -23.116 1.00 75.39 C ATOM 2576 O4' DT D 26 0.743 0.402 -24.141 1.00 75.42 O ATOM 2577 C3' DT D 26 0.813 2.748 -23.883 1.00 73.68 C ATOM 2578 O3' DT D 26 2.188 3.052 -23.963 1.00 72.67 O ATOM 2579 C2' DT D 26 0.150 2.357 -25.209 1.00 73.80 C ATOM 2580 C1' DT D 26 0.778 0.992 -25.426 1.00 73.65 C ATOM 2581 N1 DT D 26 0.145 -0.050 -26.275 1.00 72.57 N ATOM 2582 C2 DT D 26 0.995 -0.861 -26.993 1.00 74.07 C ATOM 2583 O2 DT D 26 2.215 -0.729 -27.035 1.00 73.89 O ATOM 2584 N3 DT D 26 0.376 -1.834 -27.729 1.00 75.44 N ATOM 2585 C4 DT D 26 -0.973 -2.120 -27.786 1.00 74.95 C ATOM 2586 O4 DT D 26 -1.420 -3.038 -28.484 1.00 74.82 O ATOM 2587 C5 DT D 26 -1.805 -1.255 -26.997 1.00 73.64 C ATOM 2588 C7 DT D 26 -3.285 -1.499 -27.010 1.00 72.06 C ATOM 2589 C6 DT D 26 -1.212 -0.281 -26.277 1.00 72.80 C ATOM 2590 P DT D 27 2.761 4.498 -24.332 1.00 73.35 P ATOM 2591 OP1 DT D 27 1.618 5.389 -24.609 1.00 71.75 O ATOM 2592 OP2 DT D 27 3.802 4.853 -23.345 1.00 70.87 O ATOM 2593 O5' DT D 27 3.583 4.205 -25.682 1.00 74.24 O ATOM 2594 C5' DT D 27 4.915 3.644 -25.584 1.00 72.20 C ATOM 2595 C4' DT D 27 5.338 2.919 -26.843 1.00 71.04 C ATOM 2596 O4' DT D 27 4.274 2.050 -27.335 1.00 66.78 O ATOM 2597 C3' DT D 27 5.672 3.890 -27.977 1.00 73.12 C ATOM 2598 O3' DT D 27 6.959 3.592 -28.511 1.00 78.17 O ATOM 2599 C2' DT D 27 4.561 3.646 -28.989 1.00 70.90 C ATOM 2600 C1' DT D 27 4.315 2.163 -28.743 1.00 67.36 C ATOM 2601 N1 DT D 27 3.067 1.597 -29.301 1.00 65.29 N ATOM 2602 C2 DT D 27 3.128 0.457 -30.097 1.00 67.14 C ATOM 2603 O2 DT D 27 4.169 -0.126 -30.386 1.00 67.98 O ATOM 2604 N3 DT D 27 1.925 -0.011 -30.563 1.00 65.97 N ATOM 2605 C4 DT D 27 0.701 0.558 -30.300 1.00 66.27 C ATOM 2606 O4 DT D 27 -0.346 0.092 -30.725 1.00 67.30 O ATOM 2607 C5 DT D 27 0.721 1.733 -29.485 1.00 65.08 C ATOM 2608 C7 DT D 27 -0.576 2.383 -29.177 1.00 67.14 C ATOM 2609 C6 DT D 27 1.875 2.209 -29.029 1.00 63.88 C TER 2610 DT D 27 HETATM 2611 O HOH A 99 21.370 10.671 13.504 1.00 80.51 O HETATM 2612 O HOH A 100 13.332 13.587 27.277 1.00 60.78 O HETATM 2613 O HOH A 101 0.976 12.521 10.509 1.00 63.63 O HETATM 2614 O HOH A 102 5.536 25.117 3.708 1.00 68.04 O HETATM 2615 O HOH A 103 21.256 13.635 18.339 1.00 74.94 O HETATM 2616 O HOH B 99 11.400 21.620 8.895 1.00 66.46 O MASTER 429 0 0 9 4 0 0 6 2612 4 0 22 END
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Related entries of code: 3jrf
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3iv5
RCSB PDB
PDBbind
27aa, >3IV5_3|Chain... *
3jr9
RCSB PDB
PDBbind
27aa, >3JR9_3|Chain... at 96%
3jrb
RCSB PDB
PDBbind
27aa, >3JRB_3|Chain... at 92%
4ihx
RCSB PDB
PDBbind
27aa, >4IHX_3|Chain... at 92%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
3jr9
RCSB PDB
PDBbind
27 -mer
3jra
RCSB PDB
PDBbind
27 -mer
3jrb
RCSB PDB
PDBbind
27 -mer
3jrd
RCSB PDB
PDBbind
27 -mer
3jre
RCSB PDB
PDBbind
27 -mer
3jrg
RCSB PDB
PDBbind
27 -mer
3jrh
RCSB PDB
PDBbind
27 -mer
3jri
RCSB PDB
PDBbind
27 -mer
Entry Information
PDB ID
3jrf
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
DNA-binding protein fis
Ligand Name
27 -mer
EC.Number
E.C.-.-.-.-
Resolution
3.05(Å)
Affinity (Kd/Ki/IC50)
Kd=0.6nM
Release Year
2010
Protein/NA Sequence
Check fasta file
Primary Reference
(2010) Genes Dev. Vol. 24: pp. 814-826
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):
P0A6R3
Entrez Gene ID
NCBI Entrez Gene ID:
8911232
947697
ASD
Information of known allosteric effects of PDB entries
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