Browse entries in the PDBbind-CN Database
HEADER DNA BINDING PROTEIN/DNA 08-SEP-09 3JRA TITLE CRYSTAL STRUCTURE OF FIS BOUND TO 27BP NON CONSENSUS SEQUENCE DNA F6 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 PROTEIN-DNA COMPLEX, HTH DOMAIN, 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 3JRA 1 REMARK REVDAT 2 13-JUL-11 3JRA 1 VERSN REVDAT 1 28-APR-10 3JRA 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. 3.11 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) : 3.11 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 81.11 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 90.9 REMARK 3 NUMBER OF REFLECTIONS : 10999 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING + TEST SET) : 0.240 REMARK 3 R VALUE (WORKING SET) : 0.238 REMARK 3 FREE R VALUE : 0.278 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.800 REMARK 3 FREE R VALUE TEST SET COUNT : 527 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 3.11 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 3.19 REMARK 3 REFLECTION IN BIN (WORKING SET) : 142 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 17.60 REMARK 3 BIN R VALUE (WORKING SET) : 0.2980 REMARK 3 BIN FREE R VALUE SET COUNT : 9 REMARK 3 BIN FREE R VALUE : 0.4760 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 : 8 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) : 48.16 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): 9.911 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.453 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.384 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 : 0.922 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.889 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2752 ; 0.007 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): 1523 ; 0.001 ; 0.020 REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 3942 ; 1.331 ; 2.470 REMARK 3 BOND ANGLES OTHERS (DEGREES): 3785 ; 1.030 ; 3.000 REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 187 ; 5.082 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 75 ;38.110 ;25.600 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 303 ;18.414 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 11 ;17.989 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): NULL ; NULL ; NULL REMARK 3 GENERAL PLANES REFINED ATOMS (A): 2210 ; 0.003 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): 274 ; 0.001 ; 0.020 REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 640 ; 0.209 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): 1771 ; 0.192 ; 0.200 REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): 1207 ; 0.207 ; 0.200 REMARK 3 NON-BONDED TORSION OTHERS (A): 1175 ; 0.082 ; 0.200 REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 64 ; 0.137 ; 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 ; 0.189 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): 35 ; 0.172 ; 0.200 REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 7 ; 0.137 ; 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): 12.8437 11.1893 8.8456 REMARK 3 T TENSOR REMARK 3 T11: -0.3989 T22: -0.1690 REMARK 3 T33: -0.3426 T12: -0.0198 REMARK 3 T13: -0.0022 T23: 0.0078 REMARK 3 L TENSOR REMARK 3 L11: 1.9047 L22: 6.2782 REMARK 3 L33: 3.8274 L12: -1.3523 REMARK 3 L13: 0.8569 L23: -0.7249 REMARK 3 S TENSOR REMARK 3 S11: -0.1649 S12: -0.0400 S13: -0.0745 REMARK 3 S21: 0.5457 S22: 0.1713 S23: -0.2072 REMARK 3 S31: 0.4875 S32: 0.2801 S33: -0.0063 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): 9.7434 11.6706 2.1159 REMARK 3 T TENSOR REMARK 3 T11: -0.4578 T22: -0.1864 REMARK 3 T33: -0.3575 T12: 0.0623 REMARK 3 T13: -0.0219 T23: 0.0288 REMARK 3 L TENSOR REMARK 3 L11: 3.1166 L22: 5.5733 REMARK 3 L33: 3.2082 L12: 1.3736 REMARK 3 L13: -0.7219 L23: -0.2922 REMARK 3 S TENSOR REMARK 3 S11: -0.0450 S12: -0.2433 S13: -0.0275 REMARK 3 S21: 0.1191 S22: 0.0285 S23: 0.1909 REMARK 3 S31: 0.1481 S32: 0.0600 S33: 0.0164 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): 11.5215 -9.6247 5.2404 REMARK 3 T TENSOR REMARK 3 T11: 0.2824 T22: -0.0913 REMARK 3 T33: -0.0827 T12: 0.0936 REMARK 3 T13: -0.0194 T23: 0.0378 REMARK 3 L TENSOR REMARK 3 L11: 1.5913 L22: 1.1586 REMARK 3 L33: 10.8906 L12: 0.1439 REMARK 3 L13: 2.8625 L23: 0.9704 REMARK 3 S TENSOR REMARK 3 S11: 0.5533 S12: 0.0454 S13: -0.7232 REMARK 3 S21: 0.2655 S22: 0.2603 S23: 0.0876 REMARK 3 S31: 2.0869 S32: 0.4582 S33: -0.8136 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): 10.6129 -9.6921 6.0444 REMARK 3 T TENSOR REMARK 3 T11: 0.3169 T22: -0.2194 REMARK 3 T33: -0.0368 T12: -0.0275 REMARK 3 T13: -0.0750 T23: -0.0022 REMARK 3 L TENSOR REMARK 3 L11: 1.9763 L22: 0.6135 REMARK 3 L33: 15.7395 L12: -0.0986 REMARK 3 L13: 3.9242 L23: -0.2085 REMARK 3 S TENSOR REMARK 3 S11: 0.4779 S12: -0.0924 S13: -0.7339 REMARK 3 S21: 0.1735 S22: 0.2873 S23: -0.0401 REMARK 3 S31: 1.8512 S32: -0.1477 S33: -0.7652 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.40 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE RIDING REMARK 3 POSITIONS REMARK 4 REMARK 4 3JRA COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 18-SEP-09. REMARK 100 THE DEPOSITION ID IS D_1000055059. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 05-MAR-07 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 : ALS REMARK 200 BEAMLINE : 8.2.2 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.000 REMARK 200 MONOCHROMATOR : SI (111) REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 315 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 11963 REMARK 200 RESOLUTION RANGE HIGH (A) : 3.100 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 (%) : 97.8 REMARK 200 DATA REDUNDANCY : 6.800 REMARK 200 R MERGE (I) : 0.13900 REMARK 200 R SYM (I) : NULL REMARK 200
FOR THE DATA SET : 7.5000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 3.10 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 3.21 REMARK 200 COMPLETENESS FOR SHELL (%) : 84.2 REMARK 200 DATA REDUNDANCY IN SHELL : 4.50 REMARK 200 R MERGE FOR SHELL (I) : 0.45300 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 (%): 69.84 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 4.08 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 21.62000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 77.43500 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 47.61000 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 77.43500 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 21.62000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 47.61000 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: 8770 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 19040 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 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. = 2.1 DEGREES REMARK 500 DG C 7 O4' - C1' - N9 ANGL. DEV. = 4.2 DEGREES REMARK 500 DG C 8 O4' - C4' - C3' ANGL. DEV. = -5.2 DEGREES REMARK 500 DG C 8 C1' - O4' - C4' ANGL. DEV. = -6.3 DEGREES REMARK 500 DG C 8 O4' - C1' - N9 ANGL. DEV. = 5.4 DEGREES REMARK 500 DT C 9 O4' - C1' - N1 ANGL. DEV. = 4.6 DEGREES REMARK 500 DT C 13 O4' - C1' - N1 ANGL. DEV. = 4.5 DEGREES REMARK 500 DT C 14 C3' - O3' - P ANGL. DEV. = 7.8 DEGREES REMARK 500 DC C 20 O4' - C1' - N1 ANGL. DEV. = 3.5 DEGREES REMARK 500 DT C 21 O4' - C1' - N1 ANGL. DEV. = 2.0 DEGREES REMARK 500 DA C 22 O4' - C1' - N9 ANGL. DEV. = 2.3 DEGREES REMARK 500 DA D 1 C3' - C2' - C1' ANGL. DEV. = -5.0 DEGREES REMARK 500 DA D 1 O4' - C1' - N9 ANGL. DEV. = 3.7 DEGREES REMARK 500 DT D 5 O4' - C1' - N1 ANGL. DEV. = 2.4 DEGREES REMARK 500 DA D 7 O4' - C1' - N9 ANGL. DEV. = 3.4 DEGREES REMARK 500 DT D 9 O4' - C1' - N1 ANGL. DEV. = 3.6 DEGREES REMARK 500 DA D 12 C3' - C2' - C1' ANGL. DEV. = -5.1 DEGREES REMARK 500 DA D 19 O4' - C1' - N9 ANGL. DEV. = 2.0 DEGREES REMARK 500 DA D 19 C3' - O3' - P ANGL. DEV. = 8.6 DEGREES REMARK 500 DC D 21 O4' - C1' - N1 ANGL. DEV. = 3.4 DEGREES REMARK 500 DT D 25 O4' - C1' - N1 ANGL. DEV. = 3.0 DEGREES REMARK 500 DT D 25 C3' - O3' - P ANGL. DEV. = 7.4 DEGREES REMARK 500 DT D 26 O4' - C1' - N1 ANGL. DEV. = -4.4 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 ASN A 48 -77.82 -120.79 REMARK 500 ARG A 71 55.92 36.56 REMARK 500 GLN B 19 31.03 -99.89 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: 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: 3JRF 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 3JRA A 1 98 UNP P0A6R3 FIS_ECOLI 1 98 DBREF 3JRA B 1 98 UNP P0A6R3 FIS_ECOLI 1 98 DBREF 3JRA C 1 27 PDB 3JRA 3JRA 1 27 DBREF 3JRA D 1 27 PDB 3JRA 3JRA 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 DG DT DC DA DT DT SEQRES 2 C 27 DT DC DT DT DA DA DC DT DA DA DA DT DT SEQRES 3 C 27 DT SEQRES 1 D 27 DA DA DA DT DT DT DA DG DT DT DA DA DG SEQRES 2 D 27 DA DA DA DT DG DA DC DC DA DA DA DT DT SEQRES 3 D 27 DT FORMUL 5 HOH *8(H2 O) HELIX 1 1 LEU A 27 LEU A 42 1 16 HELIX 2 2 ASP A 49 THR A 70 1 22 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 ASN B 43 1 17 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 43.240 95.220 154.870 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 0.023127 0.000000 0.000000 0.00000 SCALE2 0.000000 0.010502 0.000000 0.00000 SCALE3 0.000000 0.000000 0.006457 0.00000 ATOM 1 N SER A 8 -6.092 17.472 14.018 1.00 53.80 N ATOM 2 CA SER A 8 -6.257 16.313 13.088 1.00 53.85 C ATOM 3 C SER A 8 -4.908 15.747 12.603 1.00 53.81 C ATOM 4 O SER A 8 -4.763 14.531 12.437 1.00 54.04 O ATOM 5 CB SER A 8 -7.112 16.722 11.878 1.00 53.94 C ATOM 6 OG SER A 8 -6.372 17.506 10.948 1.00 54.24 O ATOM 7 N ASP A 9 -3.934 16.634 12.396 1.00 53.52 N ATOM 8 CA ASP A 9 -2.694 16.313 11.690 1.00 53.32 C ATOM 9 C ASP A 9 -1.494 16.493 12.624 1.00 53.03 C ATOM 10 O ASP A 9 -1.174 17.617 13.018 1.00 53.13 O ATOM 11 CB ASP A 9 -2.566 17.250 10.477 1.00 53.60 C ATOM 12 CG ASP A 9 -2.205 16.522 9.194 1.00 54.30 C ATOM 13 OD1 ASP A 9 -2.779 15.442 8.920 1.00 55.50 O ATOM 14 OD2 ASP A 9 -1.364 17.055 8.443 1.00 54.94 O ATOM 15 N VAL A 10 -0.806 15.398 12.940 1.00 52.58 N ATOM 16 CA VAL A 10 0.129 15.367 14.077 1.00 52.24 C ATOM 17 C VAL A 10 1.611 15.645 13.738 1.00 51.92 C ATOM 18 O VAL A 10 2.334 16.232 14.545 1.00 51.94 O ATOM 19 CB VAL A 10 0.019 14.023 14.837 1.00 52.25 C ATOM 20 CG1 VAL A 10 -1.417 13.473 14.755 1.00 52.29 C ATOM 21 CG2 VAL A 10 1.023 13.006 14.301 1.00 52.26 C ATOM 22 N LEU A 11 2.069 15.217 12.565 1.00 51.55 N ATOM 23 CA LEU A 11 3.450 15.491 12.141 1.00 51.16 C ATOM 24 C LEU A 11 3.496 16.724 11.224 1.00 50.74 C ATOM 25 O LEU A 11 3.128 16.648 10.043 1.00 50.69 O ATOM 26 CB LEU A 11 4.058 14.264 11.450 1.00 51.30 C ATOM 27 CG LEU A 11 4.629 13.188 12.382 1.00 51.48 C ATOM 28 CD1 LEU A 11 4.925 11.892 11.627 1.00 51.39 C ATOM 29 CD2 LEU A 11 5.885 13.704 13.073 1.00 51.80 C ATOM 30 N THR A 12 3.939 17.855 11.782 1.00 50.05 N ATOM 31 CA THR A 12 3.886 19.142 11.085 1.00 49.51 C ATOM 32 C THR A 12 5.044 20.074 11.437 1.00 49.03 C ATOM 33 O THR A 12 5.683 19.924 12.470 1.00 48.88 O ATOM 34 CB THR A 12 2.609 19.882 11.423 1.00 49.29 C ATOM 35 OG1 THR A 12 2.684 20.338 12.775 1.00 49.31 O ATOM 36 CG2 THR A 12 1.400 18.979 11.261 1.00 49.50 C ATOM 37 N VAL A 13 5.274 21.055 10.569 1.00 48.69 N ATOM 38 CA VAL A 13 6.413 21.963 10.674 1.00 48.44 C ATOM 39 C VAL A 13 5.985 23.413 10.479 1.00 48.30 C ATOM 40 O VAL A 13 5.105 23.718 9.666 1.00 48.38 O ATOM 41 CB VAL A 13 7.473 21.629 9.637 1.00 48.22 C ATOM 42 CG1 VAL A 13 8.004 20.242 9.884 1.00 48.33 C ATOM 43 CG2 VAL A 13 6.896 21.732 8.238 1.00 48.20 C ATOM 44 N SER A 14 6.610 24.300 11.243 1.00 48.08 N ATOM 45 CA SER A 14 6.262 25.712 11.233 1.00 47.91 C ATOM 46 C SER A 14 6.755 26.349 9.955 1.00 47.69 C ATOM 47 O SER A 14 7.816 25.984 9.453 1.00 47.86 O ATOM 48 CB SER A 14 6.894 26.420 12.428 1.00 47.87 C ATOM 49 OG SER A 14 6.900 25.572 13.560 1.00 48.14 O ATOM 50 N THR A 15 5.983 27.299 9.441 1.00 47.38 N ATOM 51 CA THR A 15 6.332 28.007 8.224 1.00 47.40 C ATOM 52 C THR A 15 6.015 29.488 8.399 1.00 47.35 C ATOM 53 O THR A 15 5.028 29.822 9.030 1.00 47.43 O ATOM 54 CB THR A 15 5.540 27.457 7.021 1.00 47.37 C ATOM 55 OG1 THR A 15 4.186 27.922 7.075 1.00 47.65 O ATOM 56 CG2 THR A 15 5.541 25.936 7.016 1.00 47.12 C ATOM 57 N VAL A 16 6.852 30.367 7.848 1.00 47.42 N ATOM 58 CA VAL A 16 6.621 31.815 7.895 1.00 47.35 C ATOM 59 C VAL A 16 6.151 32.274 6.546 1.00 47.25 C ATOM 60 O VAL A 16 6.633 31.783 5.528 1.00 47.03 O ATOM 61 CB VAL A 16 7.904 32.609 8.186 1.00 47.33 C ATOM 62 CG1 VAL A 16 7.674 34.096 7.964 1.00 47.32 C ATOM 63 CG2 VAL A 16 8.365 32.372 9.592 1.00 47.84 C ATOM 64 N ASN A 17 5.224 33.228 6.542 1.00 47.36 N ATOM 65 CA ASN A 17 4.713 33.795 5.305 1.00 47.47 C ATOM 66 C ASN A 17 5.122 35.251 5.134 1.00 47.57 C ATOM 67 O ASN A 17 5.787 35.832 5.990 1.00 47.32 O ATOM 68 CB ASN A 17 3.189 33.627 5.216 1.00 47.30 C ATOM 69 CG ASN A 17 2.433 34.594 6.090 1.00 47.17 C ATOM 70 OD1 ASN A 17 2.980 35.593 6.556 1.00 46.83 O ATOM 71 ND2 ASN A 17 1.152 34.309 6.306 1.00 46.84 N ATOM 72 N SER A 18 4.719 35.815 3.999 1.00 47.98 N ATOM 73 CA SER A 18 4.992 37.207 3.641 1.00 48.13 C ATOM 74 C SER A 18 4.722 38.184 4.781 1.00 48.27 C ATOM 75 O SER A 18 5.524 39.080 5.026 1.00 48.29 O ATOM 76 CB SER A 18 4.165 37.594 2.407 1.00 48.22 C ATOM 77 OG SER A 18 2.962 36.827 2.331 1.00 48.41 O ATOM 78 N GLN A 19 3.606 37.995 5.485 1.00 48.44 N ATOM 79 CA GLN A 19 3.218 38.879 6.591 1.00 48.58 C ATOM 80 C GLN A 19 3.768 38.436 7.960 1.00 48.36 C ATOM 81 O GLN A 19 3.223 38.811 8.993 1.00 48.47 O ATOM 82 CB GLN A 19 1.686 39.003 6.657 1.00 48.69 C ATOM 83 CG GLN A 19 1.079 39.911 5.591 1.00 49.42 C ATOM 84 CD GLN A 19 -0.454 39.883 5.588 1.00 49.97 C ATOM 85 OE1 GLN A 19 -1.072 38.811 5.606 1.00 52.18 O ATOM 86 NE2 GLN A 19 -1.070 41.065 5.553 1.00 51.65 N ATOM 87 N ASP A 20 4.848 37.656 7.972 1.00 48.12 N ATOM 88 CA ASP A 20 5.464 37.176 9.223 1.00 47.81 C ATOM 89 C ASP A 20 4.475 36.484 10.163 1.00 47.43 C ATOM 90 O ASP A 20 4.482 36.726 11.364 1.00 47.41 O ATOM 91 CB ASP A 20 6.177 38.324 9.960 1.00 47.84 C ATOM 92 CG ASP A 20 7.472 38.744 9.288 1.00 48.16 C ATOM 93 OD1 ASP A 20 8.002 37.967 8.463 1.00 48.32 O ATOM 94 OD2 ASP A 20 7.967 39.854 9.600 1.00 48.55 O ATOM 95 N GLN A 21 3.629 35.625 9.606 1.00 47.07 N ATOM 96 CA GLN A 21 2.735 34.791 10.395 1.00 46.88 C ATOM 97 C GLN A 21 3.236 33.352 10.322 1.00 46.64 C ATOM 98 O GLN A 21 3.257 32.764 9.246 1.00 46.64 O ATOM 99 CB GLN A 21 1.310 34.878 9.852 1.00 46.80 C ATOM 100 CG GLN A 21 0.679 36.266 9.951 1.00 46.86 C ATOM 101 CD GLN A 21 -0.615 36.407 9.148 1.00 46.90 C ATOM 102 OE1 GLN A 21 -1.240 37.473 9.136 1.00 46.94 O ATOM 103 NE2 GLN A 21 -1.015 35.338 8.471 1.00 46.54 N ATOM 104 N VAL A 22 3.661 32.797 11.458 1.00 46.49 N ATOM 105 CA VAL A 22 4.100 31.401 11.517 1.00 46.29 C ATOM 106 C VAL A 22 2.884 30.494 11.584 1.00 46.15 C ATOM 107 O VAL A 22 1.938 30.772 12.302 1.00 46.05 O ATOM 108 CB VAL A 22 5.017 31.108 12.710 1.00 46.17 C ATOM 109 CG1 VAL A 22 5.110 29.613 12.937 1.00 46.17 C ATOM 110 CG2 VAL A 22 6.403 31.692 12.479 1.00 45.82 C ATOM 111 N THR A 23 2.933 29.401 10.834 1.00 46.24 N ATOM 112 CA THR A 23 1.755 28.592 10.550 1.00 46.29 C ATOM 113 C THR A 23 2.183 27.175 10.212 1.00 46.20 C ATOM 114 O THR A 23 3.183 26.964 9.530 1.00 46.29 O ATOM 115 CB THR A 23 0.937 29.191 9.373 1.00 46.39 C ATOM 116 OG1 THR A 23 0.115 28.179 8.782 1.00 46.91 O ATOM 117 CG2 THR A 23 1.850 29.754 8.299 1.00 46.11 C ATOM 118 N GLN A 24 1.411 26.205 10.674 1.00 46.20 N ATOM 119 CA GLN A 24 1.857 24.820 10.666 1.00 46.36 C ATOM 120 C GLN A 24 1.505 24.123 9.352 1.00 46.47 C ATOM 121 O GLN A 24 0.477 24.413 8.755 1.00 46.59 O ATOM 122 CB GLN A 24 1.249 24.083 11.869 1.00 46.23 C ATOM 123 CG GLN A 24 2.226 23.175 12.594 1.00 45.34 C ATOM 124 CD GLN A 24 3.408 23.913 13.192 1.00 43.92 C ATOM 125 OE1 GLN A 24 3.317 25.094 13.538 1.00 42.25 O ATOM 126 NE2 GLN A 24 4.530 23.214 13.315 1.00 43.37 N ATOM 127 N LYS A 25 2.362 23.207 8.912 1.00 46.76 N ATOM 128 CA LYS A 25 2.184 22.517 7.632 1.00 47.05 C ATOM 129 C LYS A 25 2.614 21.058 7.733 1.00 47.32 C ATOM 130 O LYS A 25 3.670 20.783 8.300 1.00 47.67 O ATOM 131 CB LYS A 25 3.035 23.199 6.571 1.00 47.17 C ATOM 132 CG LYS A 25 3.247 22.383 5.292 1.00 47.18 C ATOM 133 CD LYS A 25 4.221 23.064 4.351 1.00 47.21 C ATOM 134 CE LYS A 25 5.636 22.984 4.862 1.00 47.17 C ATOM 135 NZ LYS A 25 6.551 23.605 3.884 1.00 47.78 N ATOM 136 N PRO A 26 1.855 20.126 7.119 1.00 47.39 N ATOM 137 CA PRO A 26 2.113 18.696 7.303 1.00 47.60 C ATOM 138 C PRO A 26 3.479 18.327 6.786 1.00 47.91 C ATOM 139 O PRO A 26 3.880 18.833 5.746 1.00 48.38 O ATOM 140 CB PRO A 26 1.065 18.031 6.415 1.00 47.53 C ATOM 141 CG PRO A 26 0.056 19.059 6.164 1.00 47.52 C ATOM 142 CD PRO A 26 0.763 20.352 6.164 1.00 47.32 C ATOM 143 N LEU A 27 4.197 17.455 7.482 1.00 48.18 N ATOM 144 CA LEU A 27 5.552 17.109 7.045 1.00 48.39 C ATOM 145 C LEU A 27 5.540 16.610 5.605 1.00 48.81 C ATOM 146 O LEU A 27 6.451 16.916 4.830 1.00 49.09 O ATOM 147 CB LEU A 27 6.185 16.046 7.949 1.00 48.38 C ATOM 148 CG LEU A 27 7.622 15.654 7.592 1.00 48.02 C ATOM 149 CD1 LEU A 27 8.527 16.862 7.627 1.00 48.19 C ATOM 150 CD2 LEU A 27 8.133 14.588 8.528 1.00 48.04 C ATOM 151 N ARG A 28 4.506 15.847 5.253 1.00 48.91 N ATOM 152 CA ARG A 28 4.394 15.289 3.920 1.00 49.14 C ATOM 153 C ARG A 28 4.553 16.366 2.847 1.00 49.21 C ATOM 154 O ARG A 28 5.182 16.118 1.821 1.00 49.29 O ATOM 155 CB ARG A 28 3.065 14.553 3.761 1.00 49.17 C ATOM 156 CG ARG A 28 1.837 15.438 3.839 1.00 49.73 C ATOM 157 CD ARG A 28 0.617 14.734 3.288 1.00 50.18 C ATOM 158 NE ARG A 28 0.075 13.805 4.263 1.00 51.09 N ATOM 159 CZ ARG A 28 -0.649 14.159 5.324 1.00 51.87 C ATOM 160 NH1 ARG A 28 -0.938 15.436 5.574 1.00 51.60 N ATOM 161 NH2 ARG A 28 -1.090 13.219 6.150 1.00 52.74 N ATOM 162 N ASP A 29 4.006 17.559 3.101 1.00 49.36 N ATOM 163 CA ASP A 29 4.100 18.682 2.164 1.00 49.56 C ATOM 164 C ASP A 29 5.557 19.071 1.911 1.00 49.69 C ATOM 165 O ASP A 29 5.917 19.432 0.789 1.00 49.92 O ATOM 166 CB ASP A 29 3.313 19.904 2.667 1.00 49.65 C ATOM 167 CG ASP A 29 1.792 19.756 2.493 1.00 50.79 C ATOM 168 OD1 ASP A 29 1.089 20.796 2.453 1.00 51.81 O ATOM 169 OD2 ASP A 29 1.287 18.611 2.395 1.00 52.01 O ATOM 170 N SER A 30 6.396 18.998 2.941 1.00 49.69 N ATOM 171 CA SER A 30 7.829 19.243 2.761 1.00 49.82 C ATOM 172 C SER A 30 8.477 18.149 1.942 1.00 49.77 C ATOM 173 O SER A 30 9.280 18.425 1.058 1.00 49.80 O ATOM 174 CB SER A 30 8.549 19.331 4.102 1.00 49.92 C ATOM 175 OG SER A 30 8.105 20.458 4.823 1.00 50.91 O ATOM 176 N VAL A 31 8.139 16.902 2.253 1.00 49.77 N ATOM 177 CA VAL A 31 8.721 15.771 1.549 1.00 49.78 C ATOM 178 C VAL A 31 8.453 15.934 0.060 1.00 49.85 C ATOM 179 O VAL A 31 9.360 15.748 -0.752 1.00 49.93 O ATOM 180 CB VAL A 31 8.174 14.420 2.054 1.00 49.83 C ATOM 181 CG1 VAL A 31 8.844 13.261 1.319 1.00 49.37 C ATOM 182 CG2 VAL A 31 8.392 14.287 3.560 1.00 49.81 C ATOM 183 N LYS A 32 7.222 16.313 -0.292 1.00 49.85 N ATOM 184 CA LYS A 32 6.883 16.633 -1.684 1.00 49.84 C ATOM 185 C LYS A 32 7.866 17.634 -2.260 1.00 49.73 C ATOM 186 O LYS A 32 8.589 17.326 -3.202 1.00 49.85 O ATOM 187 CB LYS A 32 5.464 17.194 -1.817 1.00 49.77 C ATOM 188 CG LYS A 32 4.418 16.166 -2.206 1.00 50.05 C ATOM 189 CD LYS A 32 3.371 16.771 -3.157 1.00 50.48 C ATOM 190 CE LYS A 32 2.367 15.723 -3.668 1.00 50.95 C ATOM 191 NZ LYS A 32 1.627 16.166 -4.892 1.00 50.89 N ATOM 192 N GLN A 33 7.905 18.827 -1.682 1.00 49.67 N ATOM 193 CA GLN A 33 8.775 19.877 -2.193 1.00 49.64 C ATOM 194 C GLN A 33 10.184 19.355 -2.416 1.00 49.25 C ATOM 195 O GLN A 33 10.738 19.505 -3.496 1.00 49.15 O ATOM 196 CB GLN A 33 8.815 21.059 -1.232 1.00 49.69 C ATOM 197 CG GLN A 33 9.618 22.233 -1.763 1.00 50.16 C ATOM 198 CD GLN A 33 9.903 23.279 -0.704 1.00 50.81 C ATOM 199 OE1 GLN A 33 9.178 23.395 0.293 1.00 52.82 O ATOM 200 NE2 GLN A 33 10.968 24.053 -0.914 1.00 51.96 N ATOM 201 N ALA A 34 10.741 18.738 -1.379 1.00 49.11 N ATOM 202 CA ALA A 34 12.086 18.170 -1.407 1.00 48.96 C ATOM 203 C ALA A 34 12.361 17.409 -2.697 1.00 48.84 C ATOM 204 O ALA A 34 13.411 17.589 -3.316 1.00 48.94 O ATOM 205 CB ALA A 34 12.279 17.254 -0.216 1.00 48.90 C ATOM 206 N LEU A 35 11.412 16.565 -3.094 1.00 48.59 N ATOM 207 CA LEU A 35 11.522 15.789 -4.329 1.00 48.47 C ATOM 208 C LEU A 35 11.290 16.661 -5.560 1.00 48.42 C ATOM 209 O LEU A 35 12.132 16.722 -6.452 1.00 48.52 O ATOM 210 CB LEU A 35 10.514 14.644 -4.330 1.00 48.31 C ATOM 211 CG LEU A 35 10.659 13.606 -3.224 1.00 47.82 C ATOM 212 CD1 LEU A 35 9.417 12.741 -3.177 1.00 47.48 C ATOM 213 CD2 LEU A 35 11.899 12.767 -3.444 1.00 47.24 C ATOM 214 N LYS A 36 10.148 17.337 -5.611 1.00 48.37 N ATOM 215 CA LYS A 36 9.861 18.247 -6.710 1.00 48.52 C ATOM 216 C LYS A 36 11.121 18.982 -7.138 1.00 48.36 C ATOM 217 O LYS A 36 11.412 19.092 -8.329 1.00 48.54 O ATOM 218 CB LYS A 36 8.781 19.247 -6.316 1.00 48.50 C ATOM 219 CG LYS A 36 7.390 18.616 -6.232 1.00 49.24 C ATOM 220 CD LYS A 36 6.244 19.645 -6.257 1.00 49.60 C ATOM 221 CE LYS A 36 6.073 20.307 -7.634 1.00 50.64 C ATOM 222 NZ LYS A 36 7.036 21.440 -7.859 1.00 51.27 N ATOM 223 N ASN A 37 11.874 19.463 -6.155 1.00 48.23 N ATOM 224 CA ASN A 37 13.149 20.119 -6.408 1.00 48.08 C ATOM 225 C ASN A 37 14.189 19.166 -6.976 1.00 47.79 C ATOM 226 O ASN A 37 14.803 19.445 -7.996 1.00 47.84 O ATOM 227 CB ASN A 37 13.700 20.746 -5.127 1.00 48.12 C ATOM 228 CG ASN A 37 14.685 21.843 -5.416 1.00 48.63 C ATOM 229 OD1 ASN A 37 14.297 22.933 -5.836 1.00 49.37 O ATOM 230 ND2 ASN A 37 15.971 21.561 -5.225 1.00 49.05 N ATOM 231 N TYR A 38 14.385 18.046 -6.295 1.00 47.52 N ATOM 232 CA TYR A 38 15.355 17.032 -6.701 1.00 47.59 C ATOM 233 C TYR A 38 15.184 16.638 -8.159 1.00 47.65 C ATOM 234 O TYR A 38 16.168 16.462 -8.881 1.00 47.72 O ATOM 235 CB TYR A 38 15.195 15.804 -5.810 1.00 47.13 C ATOM 236 CG TYR A 38 16.110 14.647 -6.125 1.00 47.07 C ATOM 237 CD1 TYR A 38 17.486 14.823 -6.254 1.00 46.56 C ATOM 238 CD2 TYR A 38 15.600 13.362 -6.255 1.00 46.43 C ATOM 239 CE1 TYR A 38 18.318 13.742 -6.522 1.00 46.51 C ATOM 240 CE2 TYR A 38 16.421 12.285 -6.516 1.00 46.22 C ATOM 241 CZ TYR A 38 17.770 12.473 -6.648 1.00 46.25 C ATOM 242 OH TYR A 38 18.554 11.376 -6.913 1.00 46.72 O ATOM 243 N PHE A 39 13.931 16.506 -8.586 1.00 47.83 N ATOM 244 CA PHE A 39 13.621 16.166 -9.968 1.00 47.90 C ATOM 245 C PHE A 39 14.019 17.277 -10.925 1.00 47.99 C ATOM 246 O PHE A 39 14.621 17.008 -11.954 1.00 47.99 O ATOM 247 CB PHE A 39 12.138 15.852 -10.125 1.00 47.87 C ATOM 248 CG PHE A 39 11.699 14.605 -9.401 1.00 47.97 C ATOM 249 CD1 PHE A 39 10.552 14.605 -8.619 1.00 48.40 C ATOM 250 CD2 PHE A 39 12.429 13.429 -9.499 1.00 47.93 C ATOM 251 CE1 PHE A 39 10.138 13.453 -7.959 1.00 48.21 C ATOM 252 CE2 PHE A 39 12.020 12.281 -8.842 1.00 47.89 C ATOM 253 CZ PHE A 39 10.876 12.293 -8.072 1.00 48.06 C ATOM 254 N ALA A 40 13.685 18.519 -10.587 1.00 48.14 N ATOM 255 CA ALA A 40 14.129 19.667 -11.370 1.00 48.37 C ATOM 256 C ALA A 40 15.626 19.587 -11.598 1.00 48.61 C ATOM 257 O ALA A 40 16.078 19.588 -12.735 1.00 48.93 O ATOM 258 CB ALA A 40 13.785 20.964 -10.670 1.00 48.31 C ATOM 259 N GLN A 41 16.384 19.497 -10.510 1.00 48.97 N ATOM 260 CA GLN A 41 17.850 19.418 -10.570 1.00 49.20 C ATOM 261 C GLN A 41 18.312 18.412 -11.620 1.00 49.25 C ATOM 262 O GLN A 41 19.165 18.722 -12.455 1.00 49.23 O ATOM 263 CB GLN A 41 18.435 19.006 -9.211 1.00 49.64 C ATOM 264 CG GLN A 41 18.079 19.903 -8.004 1.00 50.68 C ATOM 265 CD GLN A 41 18.650 21.303 -8.113 1.00 51.85 C ATOM 266 OE1 GLN A 41 19.667 21.621 -7.486 1.00 52.26 O ATOM 267 NE2 GLN A 41 18.004 22.149 -8.918 1.00 52.30 N ATOM 268 N LEU A 42 17.746 17.206 -11.562 1.00 49.25 N ATOM 269 CA LEU A 42 17.994 16.177 -12.574 1.00 49.19 C ATOM 270 C LEU A 42 17.354 16.577 -13.896 1.00 49.16 C ATOM 271 O LEU A 42 16.169 16.907 -13.937 1.00 49.33 O ATOM 272 CB LEU A 42 17.375 14.841 -12.151 1.00 49.25 C ATOM 273 CG LEU A 42 17.779 14.174 -10.838 1.00 49.26 C ATOM 274 CD1 LEU A 42 17.011 12.853 -10.694 1.00 48.83 C ATOM 275 CD2 LEU A 42 19.284 13.951 -10.770 1.00 49.28 C ATOM 276 N ASN A 43 18.110 16.543 -14.983 1.00 48.95 N ATOM 277 CA ASN A 43 17.487 16.703 -16.284 1.00 48.83 C ATOM 278 C ASN A 43 16.662 15.468 -16.576 1.00 48.67 C ATOM 279 O ASN A 43 15.435 15.523 -16.571 1.00 48.69 O ATOM 280 CB ASN A 43 18.526 16.963 -17.364 1.00 48.88 C ATOM 281 CG ASN A 43 19.049 18.377 -17.313 1.00 49.39 C ATOM 282 OD1 ASN A 43 18.638 19.165 -16.452 1.00 49.80 O ATOM 283 ND2 ASN A 43 19.953 18.717 -18.233 1.00 49.62 N ATOM 284 N GLY A 44 17.331 14.348 -16.789 1.00 48.50 N ATOM 285 CA GLY A 44 16.640 13.075 -16.914 1.00 48.47 C ATOM 286 C GLY A 44 17.608 11.948 -16.674 1.00 48.45 C ATOM 287 O GLY A 44 17.638 10.972 -17.424 1.00 48.69 O ATOM 288 N GLN A 45 18.402 12.084 -15.618 1.00 48.29 N ATOM 289 CA GLN A 45 19.474 11.138 -15.345 1.00 48.18 C ATOM 290 C GLN A 45 18.844 10.080 -14.471 1.00 48.28 C ATOM 291 O GLN A 45 18.518 10.348 -13.322 1.00 48.26 O ATOM 292 CB GLN A 45 20.658 11.808 -14.634 1.00 48.17 C ATOM 293 CG GLN A 45 20.729 13.331 -14.781 1.00 47.53 C ATOM 294 CD GLN A 45 21.986 13.919 -14.192 1.00 47.16 C ATOM 295 OE1 GLN A 45 21.966 15.031 -13.682 1.00 46.01 O ATOM 296 NE2 GLN A 45 23.086 13.176 -14.248 1.00 45.20 N ATOM 297 N ASP A 46 18.641 8.887 -15.017 1.00 48.51 N ATOM 298 CA ASP A 46 17.800 7.897 -14.340 1.00 48.67 C ATOM 299 C ASP A 46 18.100 7.822 -12.837 1.00 48.81 C ATOM 300 O ASP A 46 19.259 7.847 -12.414 1.00 48.89 O ATOM 301 CB ASP A 46 17.869 6.504 -15.011 1.00 48.68 C ATOM 302 CG ASP A 46 19.292 6.007 -15.230 1.00 48.34 C ATOM 303 OD1 ASP A 46 19.991 6.580 -16.092 1.00 47.86 O ATOM 304 OD2 ASP A 46 19.695 5.028 -14.562 1.00 47.51 O ATOM 305 N VAL A 47 17.035 7.781 -12.041 1.00 48.95 N ATOM 306 CA VAL A 47 17.147 7.680 -10.593 1.00 49.10 C ATOM 307 C VAL A 47 17.288 6.203 -10.234 1.00 49.35 C ATOM 308 O VAL A 47 16.919 5.327 -11.018 1.00 49.37 O ATOM 309 CB VAL A 47 15.932 8.316 -9.899 1.00 49.03 C ATOM 310 CG1 VAL A 47 16.067 8.240 -8.384 1.00 48.98 C ATOM 311 CG2 VAL A 47 15.771 9.767 -10.354 1.00 48.75 C ATOM 312 N ASN A 48 17.831 5.928 -9.053 1.00 49.70 N ATOM 313 CA ASN A 48 18.345 4.600 -8.758 1.00 49.92 C ATOM 314 C ASN A 48 17.680 3.933 -7.565 1.00 50.01 C ATOM 315 O ASN A 48 16.830 3.059 -7.741 1.00 50.19 O ATOM 316 CB ASN A 48 19.856 4.702 -8.577 1.00 50.17 C ATOM 317 CG ASN A 48 20.545 5.219 -9.830 1.00 50.96 C ATOM 318 OD1 ASN A 48 20.141 4.896 -10.955 1.00 51.29 O ATOM 319 ND2 ASN A 48 21.580 6.038 -9.645 1.00 51.99 N ATOM 320 N ASP A 49 18.062 4.329 -6.359 1.00 49.92 N ATOM 321 CA ASP A 49 17.432 3.794 -5.164 1.00 50.01 C ATOM 322 C ASP A 49 16.870 4.951 -4.389 1.00 49.80 C ATOM 323 O ASP A 49 17.448 5.394 -3.401 1.00 49.70 O ATOM 324 CB ASP A 49 18.425 2.999 -4.329 1.00 50.22 C ATOM 325 CG ASP A 49 18.843 1.717 -5.007 1.00 50.73 C ATOM 326 OD1 ASP A 49 19.686 1.788 -5.930 1.00 50.89 O ATOM 327 OD2 ASP A 49 18.320 0.645 -4.619 1.00 51.61 O ATOM 328 N LEU A 50 15.738 5.445 -4.870 1.00 49.63 N ATOM 329 CA LEU A 50 15.131 6.629 -4.310 1.00 49.66 C ATOM 330 C LEU A 50 14.528 6.310 -2.970 1.00 49.88 C ATOM 331 O LEU A 50 14.448 7.187 -2.105 1.00 50.21 O ATOM 332 CB LEU A 50 14.048 7.178 -5.229 1.00 49.57 C ATOM 333 CG LEU A 50 13.769 8.655 -4.987 1.00 49.45 C ATOM 334 CD1 LEU A 50 14.969 9.449 -5.429 1.00 49.58 C ATOM 335 CD2 LEU A 50 12.531 9.108 -5.726 1.00 49.61 C ATOM 336 N TYR A 51 14.097 5.061 -2.795 1.00 49.91 N ATOM 337 CA TYR A 51 13.514 4.646 -1.531 1.00 49.85 C ATOM 338 C TYR A 51 14.599 4.620 -0.463 1.00 49.89 C ATOM 339 O TYR A 51 14.570 5.399 0.487 1.00 49.84 O ATOM 340 CB TYR A 51 12.849 3.285 -1.657 1.00 49.94 C ATOM 341 CG TYR A 51 11.991 2.966 -0.468 1.00 50.05 C ATOM 342 CD1 TYR A 51 10.645 3.309 -0.452 1.00 50.28 C ATOM 343 CD2 TYR A 51 12.526 2.343 0.656 1.00 50.33 C ATOM 344 CE1 TYR A 51 9.845 3.028 0.644 1.00 50.25 C ATOM 345 CE2 TYR A 51 11.737 2.059 1.761 1.00 50.37 C ATOM 346 CZ TYR A 51 10.394 2.405 1.748 1.00 50.47 C ATOM 347 OH TYR A 51 9.599 2.127 2.834 1.00 50.41 O ATOM 348 N GLU A 52 15.585 3.755 -0.661 1.00 50.12 N ATOM 349 CA GLU A 52 16.719 3.629 0.249 1.00 49.86 C ATOM 350 C GLU A 52 17.411 4.981 0.507 1.00 49.64 C ATOM 351 O GLU A 52 18.177 5.117 1.463 1.00 49.77 O ATOM 352 CB GLU A 52 17.699 2.591 -0.330 1.00 50.25 C ATOM 353 CG GLU A 52 18.977 2.325 0.461 1.00 51.04 C ATOM 354 CD GLU A 52 18.723 1.982 1.916 1.00 53.62 C ATOM 355 OE1 GLU A 52 17.597 1.528 2.248 1.00 54.58 O ATOM 356 OE2 GLU A 52 19.661 2.172 2.727 1.00 55.28 O ATOM 357 N LEU A 53 17.132 5.970 -0.345 1.00 49.23 N ATOM 358 CA LEU A 53 17.636 7.334 -0.171 1.00 48.98 C ATOM 359 C LEU A 53 16.767 8.079 0.812 1.00 48.63 C ATOM 360 O LEU A 53 17.249 8.565 1.834 1.00 48.70 O ATOM 361 CB LEU A 53 17.645 8.085 -1.510 1.00 49.03 C ATOM 362 CG LEU A 53 18.179 9.522 -1.546 1.00 49.02 C ATOM 363 CD1 LEU A 53 19.680 9.561 -1.848 1.00 48.47 C ATOM 364 CD2 LEU A 53 17.410 10.326 -2.584 1.00 49.00 C ATOM 365 N VAL A 54 15.482 8.173 0.494 1.00 48.22 N ATOM 366 CA VAL A 54 14.542 8.884 1.350 1.00 48.03 C ATOM 367 C VAL A 54 14.508 8.275 2.749 1.00 47.83 C ATOM 368 O VAL A 54 14.466 9.003 3.732 1.00 47.92 O ATOM 369 CB VAL A 54 13.131 8.907 0.751 1.00 47.85 C ATOM 370 CG1 VAL A 54 12.121 9.332 1.789 1.00 47.64 C ATOM 371 CG2 VAL A 54 13.091 9.836 -0.440 1.00 47.59 C ATOM 372 N LEU A 55 14.552 6.949 2.833 1.00 47.70 N ATOM 373 CA LEU A 55 14.609 6.258 4.123 1.00 47.69 C ATOM 374 C LEU A 55 15.773 6.788 4.951 1.00 47.72 C ATOM 375 O LEU A 55 15.577 7.282 6.061 1.00 47.79 O ATOM 376 CB LEU A 55 14.764 4.745 3.934 1.00 47.62 C ATOM 377 CG LEU A 55 13.855 3.884 4.805 1.00 47.52 C ATOM 378 CD1 LEU A 55 12.415 4.049 4.350 1.00 47.82 C ATOM 379 CD2 LEU A 55 14.265 2.423 4.743 1.00 47.56 C ATOM 380 N ALA A 56 16.979 6.704 4.396 1.00 47.75 N ATOM 381 CA ALA A 56 18.177 7.195 5.073 1.00 47.85 C ATOM 382 C ALA A 56 17.988 8.638 5.536 1.00 47.93 C ATOM 383 O ALA A 56 18.491 9.043 6.578 1.00 47.94 O ATOM 384 CB ALA A 56 19.389 7.085 4.153 1.00 47.80 C ATOM 385 N GLU A 57 17.242 9.406 4.759 1.00 48.10 N ATOM 386 CA GLU A 57 17.032 10.807 5.062 1.00 48.27 C ATOM 387 C GLU A 57 16.001 11.024 6.164 1.00 48.14 C ATOM 388 O GLU A 57 15.984 12.080 6.785 1.00 48.18 O ATOM 389 CB GLU A 57 16.597 11.552 3.797 1.00 48.54 C ATOM 390 CG GLU A 57 16.977 13.030 3.795 1.00 49.53 C ATOM 391 CD GLU A 57 18.446 13.276 3.458 1.00 50.77 C ATOM 392 OE1 GLU A 57 19.238 12.296 3.396 1.00 50.53 O ATOM 393 OE2 GLU A 57 18.800 14.467 3.260 1.00 51.61 O ATOM 394 N VAL A 58 15.131 10.043 6.389 1.00 48.10 N ATOM 395 CA VAL A 58 14.080 10.155 7.410 1.00 48.06 C ATOM 396 C VAL A 58 14.452 9.391 8.678 1.00 47.97 C ATOM 397 O VAL A 58 14.327 9.926 9.781 1.00 47.77 O ATOM 398 CB VAL A 58 12.712 9.648 6.889 1.00 48.01 C ATOM 399 CG1 VAL A 58 11.700 9.568 8.028 1.00 47.99 C ATOM 400 CG2 VAL A 58 12.197 10.554 5.791 1.00 47.50 C ATOM 401 N GLU A 59 14.909 8.151 8.511 1.00 47.91 N ATOM 402 CA GLU A 59 15.320 7.318 9.640 1.00 48.02 C ATOM 403 C GLU A 59 16.318 8.017 10.565 1.00 48.05 C ATOM 404 O GLU A 59 16.171 7.961 11.779 1.00 48.16 O ATOM 405 CB GLU A 59 15.899 5.978 9.162 1.00 47.94 C ATOM 406 CG GLU A 59 14.841 4.896 8.890 1.00 47.98 C ATOM 407 CD GLU A 59 15.446 3.540 8.491 1.00 48.03 C ATOM 408 OE1 GLU A 59 16.687 3.444 8.371 1.00 47.76 O ATOM 409 OE2 GLU A 59 14.683 2.565 8.299 1.00 47.44 O ATOM 410 N GLN A 60 17.315 8.692 10.004 1.00 48.15 N ATOM 411 CA GLN A 60 18.373 9.290 10.829 1.00 48.33 C ATOM 412 C GLN A 60 17.881 10.372 11.823 1.00 48.50 C ATOM 413 O GLN A 60 18.162 10.271 13.022 1.00 48.79 O ATOM 414 CB GLN A 60 19.547 9.769 9.959 1.00 48.35 C ATOM 415 CG GLN A 60 20.422 8.609 9.468 1.00 48.37 C ATOM 416 CD GLN A 60 21.494 9.036 8.481 1.00 48.39 C ATOM 417 OE1 GLN A 60 21.189 9.475 7.377 1.00 49.07 O ATOM 418 NE2 GLN A 60 22.757 8.885 8.866 1.00 48.25 N ATOM 419 N PRO A 61 17.157 11.401 11.341 1.00 48.50 N ATOM 420 CA PRO A 61 16.459 12.347 12.225 1.00 48.40 C ATOM 421 C PRO A 61 15.595 11.687 13.290 1.00 48.19 C ATOM 422 O PRO A 61 15.578 12.132 14.427 1.00 48.01 O ATOM 423 CB PRO A 61 15.539 13.113 11.271 1.00 48.53 C ATOM 424 CG PRO A 61 16.145 13.004 9.970 1.00 48.77 C ATOM 425 CD PRO A 61 17.001 11.772 9.928 1.00 48.69 C ATOM 426 N LEU A 62 14.870 10.647 12.895 1.00 48.05 N ATOM 427 CA LEU A 62 13.964 9.934 13.782 1.00 48.08 C ATOM 428 C LEU A 62 14.742 9.225 14.883 1.00 48.20 C ATOM 429 O LEU A 62 14.426 9.356 16.068 1.00 48.29 O ATOM 430 CB LEU A 62 13.153 8.918 12.976 1.00 47.86 C ATOM 431 CG LEU A 62 12.100 8.095 13.703 1.00 47.84 C ATOM 432 CD1 LEU A 62 11.073 8.998 14.338 1.00 48.26 C ATOM 433 CD2 LEU A 62 11.439 7.137 12.738 1.00 47.74 C ATOM 434 N LEU A 63 15.761 8.473 14.487 1.00 48.29 N ATOM 435 CA LEU A 63 16.571 7.747 15.447 1.00 48.40 C ATOM 436 C LEU A 63 17.216 8.739 16.382 1.00 48.58 C ATOM 437 O LEU A 63 17.179 8.565 17.593 1.00 48.75 O ATOM 438 CB LEU A 63 17.641 6.908 14.747 1.00 48.39 C ATOM 439 CG LEU A 63 17.124 5.715 13.936 1.00 48.18 C ATOM 440 CD1 LEU A 63 18.283 4.975 13.292 1.00 48.14 C ATOM 441 CD2 LEU A 63 16.298 4.777 14.804 1.00 47.75 C ATOM 442 N ASP A 64 17.787 9.796 15.823 1.00 48.89 N ATOM 443 CA ASP A 64 18.371 10.840 16.645 1.00 48.94 C ATOM 444 C ASP A 64 17.398 11.274 17.745 1.00 48.92 C ATOM 445 O ASP A 64 17.726 11.216 18.923 1.00 48.91 O ATOM 446 CB ASP A 64 18.769 12.044 15.790 1.00 49.17 C ATOM 447 CG ASP A 64 19.610 13.041 16.558 1.00 49.68 C ATOM 448 OD1 ASP A 64 19.037 13.926 17.240 1.00 51.02 O ATOM 449 OD2 ASP A 64 20.854 12.930 16.485 1.00 51.68 O ATOM 450 N MET A 65 16.192 11.665 17.349 1.00 48.89 N ATOM 451 CA MET A 65 15.241 12.297 18.261 1.00 48.94 C ATOM 452 C MET A 65 14.741 11.391 19.372 1.00 48.86 C ATOM 453 O MET A 65 14.655 11.822 20.513 1.00 48.91 O ATOM 454 CB MET A 65 14.037 12.840 17.493 1.00 49.06 C ATOM 455 CG MET A 65 14.351 13.974 16.532 1.00 49.69 C ATOM 456 SD MET A 65 14.742 15.530 17.342 1.00 51.20 S ATOM 457 CE MET A 65 16.520 15.392 17.568 1.00 51.00 C ATOM 458 N VAL A 66 14.400 10.149 19.057 1.00 48.85 N ATOM 459 CA VAL A 66 13.892 9.245 20.095 1.00 48.94 C ATOM 460 C VAL A 66 15.029 8.755 21.005 1.00 49.06 C ATOM 461 O VAL A 66 14.815 8.512 22.194 1.00 49.25 O ATOM 462 CB VAL A 66 13.114 8.046 19.519 1.00 48.85 C ATOM 463 CG1 VAL A 66 12.169 8.500 18.410 1.00 48.60 C ATOM 464 CG2 VAL A 66 14.069 6.982 19.020 1.00 49.01 C ATOM 465 N MET A 67 16.238 8.635 20.455 1.00 49.11 N ATOM 466 CA MET A 67 17.424 8.359 21.268 1.00 49.13 C ATOM 467 C MET A 67 17.888 9.617 22.001 1.00 49.22 C ATOM 468 O MET A 67 18.942 9.630 22.642 1.00 49.37 O ATOM 469 CB MET A 67 18.555 7.803 20.404 1.00 49.13 C ATOM 470 CG MET A 67 18.244 6.443 19.816 1.00 49.34 C ATOM 471 SD MET A 67 17.958 5.184 21.073 1.00 49.80 S ATOM 472 CE MET A 67 19.610 4.997 21.756 1.00 49.52 C ATOM 473 N GLN A 68 17.096 10.676 21.887 1.00 49.21 N ATOM 474 CA GLN A 68 17.297 11.901 22.635 1.00 49.16 C ATOM 475 C GLN A 68 16.159 12.010 23.639 1.00 49.03 C ATOM 476 O GLN A 68 16.391 12.216 24.829 1.00 49.19 O ATOM 477 CB GLN A 68 17.290 13.083 21.669 1.00 49.26 C ATOM 478 CG GLN A 68 17.991 14.329 22.154 1.00 49.43 C ATOM 479 CD GLN A 68 18.414 15.213 20.996 1.00 49.64 C ATOM 480 OE1 GLN A 68 19.242 14.817 20.165 1.00 50.49 O ATOM 481 NE2 GLN A 68 17.840 16.410 20.925 1.00 50.07 N ATOM 482 N TYR A 69 14.931 11.852 23.153 1.00 48.77 N ATOM 483 CA TYR A 69 13.748 11.866 24.002 1.00 48.63 C ATOM 484 C TYR A 69 13.780 10.769 25.060 1.00 48.47 C ATOM 485 O TYR A 69 13.333 10.994 26.180 1.00 48.63 O ATOM 486 CB TYR A 69 12.480 11.728 23.161 1.00 48.66 C ATOM 487 CG TYR A 69 11.211 11.780 23.974 1.00 48.61 C ATOM 488 CD1 TYR A 69 10.653 12.996 24.348 1.00 48.41 C ATOM 489 CD2 TYR A 69 10.575 10.612 24.380 1.00 48.63 C ATOM 490 CE1 TYR A 69 9.491 13.054 25.099 1.00 48.49 C ATOM 491 CE2 TYR A 69 9.411 10.657 25.135 1.00 48.89 C ATOM 492 CZ TYR A 69 8.874 11.883 25.490 1.00 48.78 C ATOM 493 OH TYR A 69 7.722 11.939 26.238 1.00 49.00 O ATOM 494 N THR A 70 14.296 9.589 24.717 1.00 48.26 N ATOM 495 CA THR A 70 14.465 8.528 25.711 1.00 48.22 C ATOM 496 C THR A 70 15.877 8.535 26.306 1.00 48.23 C ATOM 497 O THR A 70 16.298 7.549 26.907 1.00 48.21 O ATOM 498 CB THR A 70 14.170 7.126 25.136 1.00 48.10 C ATOM 499 OG1 THR A 70 15.301 6.659 24.397 1.00 48.00 O ATOM 500 CG2 THR A 70 12.936 7.137 24.242 1.00 48.04 C ATOM 501 N ARG A 71 16.597 9.645 26.136 1.00 48.32 N ATOM 502 CA ARG A 71 17.957 9.818 26.650 1.00 48.26 C ATOM 503 C ARG A 71 18.786 8.532 26.581 1.00 48.00 C ATOM 504 O ARG A 71 19.299 8.055 27.586 1.00 47.97 O ATOM 505 CB ARG A 71 17.898 10.365 28.077 1.00 48.22 C ATOM 506 CG ARG A 71 19.245 10.814 28.657 1.00 48.78 C ATOM 507 CD ARG A 71 19.109 11.414 30.069 1.00 49.50 C ATOM 508 NE ARG A 71 18.563 12.776 30.030 1.00 50.79 N ATOM 509 CZ ARG A 71 17.268 13.100 30.089 1.00 51.09 C ATOM 510 NH1 ARG A 71 16.321 12.166 30.208 1.00 51.28 N ATOM 511 NH2 ARG A 71 16.913 14.382 30.031 1.00 50.98 N ATOM 512 N GLY A 72 18.891 7.968 25.382 1.00 47.84 N ATOM 513 CA GLY A 72 19.714 6.784 25.141 1.00 47.70 C ATOM 514 C GLY A 72 19.056 5.445 25.416 1.00 47.47 C ATOM 515 O GLY A 72 19.641 4.403 25.128 1.00 47.39 O ATOM 516 N ASN A 73 17.845 5.456 25.964 1.00 47.39 N ATOM 517 CA ASN A 73 17.180 4.218 26.355 1.00 47.51 C ATOM 518 C ASN A 73 16.621 3.496 25.138 1.00 47.55 C ATOM 519 O ASN A 73 15.531 3.818 24.663 1.00 47.56 O ATOM 520 CB ASN A 73 16.065 4.496 27.372 1.00 47.48 C ATOM 521 CG ASN A 73 15.592 3.239 28.090 1.00 47.36 C ATOM 522 OD1 ASN A 73 15.808 2.119 27.628 1.00 47.16 O ATOM 523 ND2 ASN A 73 14.946 3.426 29.230 1.00 47.38 N ATOM 524 N GLN A 74 17.376 2.520 24.642 1.00 47.63 N ATOM 525 CA GLN A 74 16.970 1.746 23.470 1.00 47.69 C ATOM 526 C GLN A 74 15.721 0.921 23.740 1.00 47.80 C ATOM 527 O GLN A 74 14.844 0.831 22.881 1.00 47.96 O ATOM 528 CB GLN A 74 18.094 0.822 23.008 1.00 47.59 C ATOM 529 CG GLN A 74 19.275 1.549 22.414 1.00 47.56 C ATOM 530 CD GLN A 74 20.482 0.656 22.252 1.00 47.79 C ATOM 531 OE1 GLN A 74 21.607 1.074 22.513 1.00 48.36 O ATOM 532 NE2 GLN A 74 20.257 -0.584 21.829 1.00 48.00 N ATOM 533 N THR A 75 15.643 0.319 24.925 1.00 47.90 N ATOM 534 CA THR A 75 14.483 -0.492 25.298 1.00 48.00 C ATOM 535 C THR A 75 13.186 0.326 25.225 1.00 48.14 C ATOM 536 O THR A 75 12.168 -0.168 24.736 1.00 48.16 O ATOM 537 CB THR A 75 14.647 -1.120 26.707 1.00 47.97 C ATOM 538 OG1 THR A 75 15.824 -1.940 26.737 1.00 47.99 O ATOM 539 CG2 THR A 75 13.437 -1.978 27.065 1.00 47.89 C ATOM 540 N ARG A 76 13.232 1.574 25.693 1.00 48.28 N ATOM 541 CA ARG A 76 12.073 2.469 25.613 1.00 48.36 C ATOM 542 C ARG A 76 11.889 3.018 24.200 1.00 48.33 C ATOM 543 O ARG A 76 10.759 3.171 23.738 1.00 48.48 O ATOM 544 CB ARG A 76 12.179 3.635 26.612 1.00 48.44 C ATOM 545 CG ARG A 76 11.723 3.311 28.053 1.00 48.76 C ATOM 546 CD ARG A 76 10.862 4.434 28.664 1.00 49.05 C ATOM 547 NE ARG A 76 11.372 5.777 28.354 1.00 49.87 N ATOM 548 CZ ARG A 76 10.643 6.899 28.341 1.00 50.08 C ATOM 549 NH1 ARG A 76 9.342 6.879 28.627 1.00 50.35 N ATOM 550 NH2 ARG A 76 11.219 8.062 28.039 1.00 49.88 N ATOM 551 N ALA A 77 12.993 3.324 23.523 1.00 48.24 N ATOM 552 CA ALA A 77 12.936 3.839 22.152 1.00 48.08 C ATOM 553 C ALA A 77 12.184 2.875 21.240 1.00 47.93 C ATOM 554 O ALA A 77 11.223 3.264 20.583 1.00 47.82 O ATOM 555 CB ALA A 77 14.335 4.082 21.617 1.00 48.10 C ATOM 556 N ALA A 78 12.620 1.617 21.220 1.00 47.80 N ATOM 557 CA ALA A 78 11.973 0.579 20.414 1.00 47.78 C ATOM 558 C ALA A 78 10.466 0.560 20.657 1.00 47.74 C ATOM 559 O ALA A 78 9.684 0.778 19.733 1.00 47.79 O ATOM 560 CB ALA A 78 12.580 -0.785 20.717 1.00 47.68 C ATOM 561 N LEU A 79 10.078 0.312 21.908 1.00 47.78 N ATOM 562 CA LEU A 79 8.672 0.353 22.355 1.00 47.70 C ATOM 563 C LEU A 79 7.896 1.504 21.736 1.00 47.63 C ATOM 564 O LEU A 79 6.788 1.325 21.232 1.00 47.44 O ATOM 565 CB LEU A 79 8.605 0.504 23.889 1.00 47.64 C ATOM 566 CG LEU A 79 8.491 -0.736 24.784 1.00 47.16 C ATOM 567 CD1 LEU A 79 7.043 -1.204 24.852 1.00 46.57 C ATOM 568 CD2 LEU A 79 9.422 -1.863 24.329 1.00 46.75 C ATOM 569 N MET A 80 8.506 2.684 21.797 1.00 47.78 N ATOM 570 CA MET A 80 7.873 3.942 21.406 1.00 47.92 C ATOM 571 C MET A 80 7.629 4.042 19.898 1.00 47.84 C ATOM 572 O MET A 80 6.712 4.733 19.455 1.00 47.86 O ATOM 573 CB MET A 80 8.755 5.107 21.872 1.00 47.94 C ATOM 574 CG MET A 80 8.077 6.462 21.872 1.00 48.09 C ATOM 575 SD MET A 80 9.152 7.753 22.548 1.00 48.70 S ATOM 576 CE MET A 80 8.144 9.220 22.287 1.00 48.04 C ATOM 577 N MET A 81 8.453 3.348 19.119 1.00 47.78 N ATOM 578 CA MET A 81 8.337 3.338 17.665 1.00 47.62 C ATOM 579 C MET A 81 7.517 2.146 17.158 1.00 47.60 C ATOM 580 O MET A 81 6.908 2.220 16.088 1.00 47.72 O ATOM 581 CB MET A 81 9.731 3.308 17.047 1.00 47.64 C ATOM 582 CG MET A 81 10.629 4.448 17.498 1.00 47.57 C ATOM 583 SD MET A 81 12.310 4.283 16.879 1.00 47.32 S ATOM 584 CE MET A 81 12.124 4.986 15.252 1.00 47.69 C ATOM 585 N GLY A 82 7.506 1.057 17.924 1.00 47.43 N ATOM 586 CA GLY A 82 6.742 -0.137 17.574 1.00 47.38 C ATOM 587 C GLY A 82 7.568 -1.218 16.901 1.00 47.34 C ATOM 588 O GLY A 82 7.012 -2.180 16.359 1.00 47.31 O ATOM 589 N ILE A 83 8.892 -1.075 16.940 1.00 47.21 N ATOM 590 CA ILE A 83 9.776 -2.046 16.307 1.00 47.22 C ATOM 591 C ILE A 83 10.605 -2.793 17.357 1.00 47.16 C ATOM 592 O ILE A 83 11.060 -2.202 18.338 1.00 47.19 O ATOM 593 CB ILE A 83 10.658 -1.386 15.187 1.00 47.32 C ATOM 594 CG1 ILE A 83 11.968 -0.783 15.716 1.00 47.35 C ATOM 595 CG2 ILE A 83 9.858 -0.313 14.449 1.00 47.36 C ATOM 596 CD1 ILE A 83 11.783 0.475 16.506 1.00 47.60 C ATOM 597 N ASN A 84 10.764 -4.099 17.148 1.00 47.01 N ATOM 598 CA ASN A 84 11.581 -4.961 18.010 1.00 47.05 C ATOM 599 C ASN A 84 12.958 -4.342 18.263 1.00 46.98 C ATOM 600 O ASN A 84 13.601 -3.860 17.337 1.00 46.80 O ATOM 601 CB ASN A 84 11.669 -6.375 17.385 1.00 47.01 C ATOM 602 CG ASN A 84 12.914 -7.159 17.797 1.00 46.80 C ATOM 603 OD1 ASN A 84 14.029 -6.841 17.385 1.00 46.54 O ATOM 604 ND2 ASN A 84 12.713 -8.226 18.559 1.00 45.68 N ATOM 605 N ARG A 85 13.395 -4.347 19.522 1.00 47.10 N ATOM 606 CA ARG A 85 14.657 -3.710 19.904 1.00 47.18 C ATOM 607 C ARG A 85 15.768 -4.056 18.909 1.00 47.27 C ATOM 608 O ARG A 85 16.400 -3.163 18.347 1.00 47.28 O ATOM 609 CB ARG A 85 15.068 -4.105 21.333 1.00 47.18 C ATOM 610 CG ARG A 85 16.138 -3.188 21.940 1.00 47.22 C ATOM 611 CD ARG A 85 16.450 -3.498 23.418 1.00 47.06 C ATOM 612 NE ARG A 85 17.129 -4.783 23.594 1.00 46.67 N ATOM 613 CZ ARG A 85 16.528 -5.940 23.878 1.00 46.67 C ATOM 614 NH1 ARG A 85 15.208 -6.008 24.039 1.00 46.49 N ATOM 615 NH2 ARG A 85 17.256 -7.045 24.007 1.00 46.62 N ATOM 616 N GLY A 86 15.971 -5.353 18.679 1.00 47.34 N ATOM 617 CA GLY A 86 16.980 -5.855 17.736 1.00 47.33 C ATOM 618 C GLY A 86 16.984 -5.170 16.381 1.00 47.30 C ATOM 619 O GLY A 86 18.044 -4.887 15.828 1.00 47.29 O ATOM 620 N THR A 87 15.797 -4.913 15.842 1.00 47.33 N ATOM 621 CA THR A 87 15.668 -4.126 14.621 1.00 47.44 C ATOM 622 C THR A 87 16.288 -2.741 14.817 1.00 47.46 C ATOM 623 O THR A 87 17.166 -2.339 14.060 1.00 47.45 O ATOM 624 CB THR A 87 14.190 -3.971 14.202 1.00 47.49 C ATOM 625 OG1 THR A 87 13.704 -5.216 13.682 1.00 47.54 O ATOM 626 CG2 THR A 87 14.036 -2.884 13.150 1.00 47.38 C ATOM 627 N LEU A 88 15.831 -2.033 15.848 1.00 47.57 N ATOM 628 CA LEU A 88 16.364 -0.708 16.211 1.00 47.64 C ATOM 629 C LEU A 88 17.890 -0.685 16.341 1.00 47.67 C ATOM 630 O LEU A 88 18.532 0.320 16.045 1.00 47.58 O ATOM 631 CB LEU A 88 15.708 -0.213 17.513 1.00 47.58 C ATOM 632 CG LEU A 88 16.413 0.836 18.381 1.00 47.50 C ATOM 633 CD1 LEU A 88 16.676 2.116 17.618 1.00 47.43 C ATOM 634 CD2 LEU A 88 15.574 1.125 19.613 1.00 47.60 C ATOM 635 N ARG A 89 18.465 -1.796 16.779 1.00 47.78 N ATOM 636 CA ARG A 89 19.912 -1.903 16.902 1.00 48.00 C ATOM 637 C ARG A 89 20.504 -1.954 15.505 1.00 47.88 C ATOM 638 O ARG A 89 21.475 -1.261 15.206 1.00 47.91 O ATOM 639 CB ARG A 89 20.303 -3.154 17.699 1.00 48.11 C ATOM 640 CG ARG A 89 19.414 -3.403 18.917 1.00 48.65 C ATOM 641 CD ARG A 89 19.866 -4.560 19.784 1.00 48.95 C ATOM 642 NE ARG A 89 20.566 -4.082 20.973 1.00 49.82 N ATOM 643 CZ ARG A 89 21.888 -4.021 21.112 1.00 50.31 C ATOM 644 NH1 ARG A 89 22.705 -4.423 20.140 1.00 50.73 N ATOM 645 NH2 ARG A 89 22.402 -3.563 22.244 1.00 50.07 N ATOM 646 N LYS A 90 19.887 -2.772 14.653 1.00 47.88 N ATOM 647 CA LYS A 90 20.298 -2.928 13.256 1.00 47.81 C ATOM 648 C LYS A 90 20.374 -1.567 12.563 1.00 47.65 C ATOM 649 O LYS A 90 21.337 -1.282 11.858 1.00 47.49 O ATOM 650 CB LYS A 90 19.321 -3.860 12.513 1.00 47.86 C ATOM 651 CG LYS A 90 19.967 -4.838 11.518 1.00 48.17 C ATOM 652 CD LYS A 90 20.012 -4.299 10.085 1.00 48.41 C ATOM 653 CE LYS A 90 18.659 -4.410 9.375 1.00 48.46 C ATOM 654 NZ LYS A 90 18.287 -5.816 9.037 1.00 48.27 N ATOM 655 N LYS A 91 19.366 -0.729 12.795 1.00 47.61 N ATOM 656 CA LYS A 91 19.293 0.606 12.190 1.00 47.63 C ATOM 657 C LYS A 91 20.363 1.542 12.733 1.00 47.61 C ATOM 658 O LYS A 91 20.986 2.284 11.983 1.00 47.39 O ATOM 659 CB LYS A 91 17.915 1.231 12.419 1.00 47.47 C ATOM 660 CG LYS A 91 16.764 0.374 11.925 1.00 47.37 C ATOM 661 CD LYS A 91 15.607 1.214 11.396 1.00 47.52 C ATOM 662 CE LYS A 91 14.466 0.351 10.857 1.00 47.77 C ATOM 663 NZ LYS A 91 14.950 -0.799 10.027 1.00 48.33 N ATOM 664 N LEU A 92 20.566 1.508 14.043 1.00 47.84 N ATOM 665 CA LEU A 92 21.601 2.316 14.667 1.00 48.05 C ATOM 666 C LEU A 92 22.943 1.938 14.065 1.00 48.18 C ATOM 667 O LEU A 92 23.659 2.789 13.542 1.00 48.23 O ATOM 668 CB LEU A 92 21.610 2.108 16.183 1.00 48.09 C ATOM 669 CG LEU A 92 20.368 2.645 16.899 1.00 48.00 C ATOM 670 CD1 LEU A 92 20.189 1.972 18.252 1.00 47.93 C ATOM 671 CD2 LEU A 92 20.446 4.153 17.040 1.00 48.04 C ATOM 672 N LYS A 93 23.264 0.650 14.122 1.00 48.41 N ATOM 673 CA LYS A 93 24.459 0.128 13.476 1.00 48.52 C ATOM 674 C LYS A 93 24.555 0.649 12.041 1.00 48.64 C ATOM 675 O LYS A 93 25.623 1.088 11.609 1.00 48.55 O ATOM 676 CB LYS A 93 24.440 -1.410 13.495 1.00 48.65 C ATOM 677 CG LYS A 93 25.538 -2.120 12.668 1.00 48.90 C ATOM 678 CD LYS A 93 26.782 -2.487 13.488 1.00 49.80 C ATOM 679 CE LYS A 93 27.417 -1.279 14.177 1.00 50.43 C ATOM 680 NZ LYS A 93 27.554 -0.090 13.272 1.00 51.12 N ATOM 681 N LYS A 94 23.422 0.619 11.333 1.00 48.80 N ATOM 682 CA LYS A 94 23.330 0.977 9.905 1.00 48.80 C ATOM 683 C LYS A 94 23.762 2.416 9.602 1.00 48.84 C ATOM 684 O LYS A 94 24.236 2.703 8.504 1.00 48.85 O ATOM 685 CB LYS A 94 21.896 0.728 9.401 1.00 48.74 C ATOM 686 CG LYS A 94 21.722 0.655 7.891 1.00 48.80 C ATOM 687 CD LYS A 94 21.239 1.974 7.287 1.00 49.03 C ATOM 688 CE LYS A 94 20.561 1.769 5.929 1.00 48.98 C ATOM 689 NZ LYS A 94 19.139 1.323 6.052 1.00 48.66 N ATOM 690 N TYR A 95 23.596 3.312 10.570 1.00 48.95 N ATOM 691 CA TYR A 95 24.070 4.691 10.444 1.00 49.12 C ATOM 692 C TYR A 95 25.219 4.985 11.400 1.00 49.25 C ATOM 693 O TYR A 95 25.694 6.117 11.472 1.00 49.22 O ATOM 694 CB TYR A 95 22.922 5.662 10.703 1.00 49.05 C ATOM 695 CG TYR A 95 21.727 5.390 9.826 1.00 49.06 C ATOM 696 CD1 TYR A 95 21.781 5.623 8.455 1.00 49.04 C ATOM 697 CD2 TYR A 95 20.548 4.883 10.359 1.00 49.34 C ATOM 698 CE1 TYR A 95 20.690 5.368 7.639 1.00 48.97 C ATOM 699 CE2 TYR A 95 19.447 4.625 9.549 1.00 49.29 C ATOM 700 CZ TYR A 95 19.527 4.872 8.192 1.00 48.96 C ATOM 701 OH TYR A 95 18.448 4.615 7.391 1.00 48.71 O ATOM 702 N GLY A 96 25.670 3.964 12.122 1.00 49.53 N ATOM 703 CA GLY A 96 26.724 4.128 13.112 1.00 49.74 C ATOM 704 C GLY A 96 26.322 5.137 14.166 1.00 49.90 C ATOM 705 O GLY A 96 27.024 6.120 14.392 1.00 49.92 O ATOM 706 N MET A 97 25.172 4.901 14.789 1.00 50.13 N ATOM 707 CA MET A 97 24.688 5.754 15.868 1.00 50.38 C ATOM 708 C MET A 97 24.962 5.144 17.248 1.00 50.43 C ATOM 709 O MET A 97 24.762 5.802 18.270 1.00 50.47 O ATOM 710 CB MET A 97 23.196 6.049 15.680 1.00 50.36 C ATOM 711 CG MET A 97 22.921 6.981 14.510 1.00 50.48 C ATOM 712 SD MET A 97 21.223 7.587 14.439 1.00 51.06 S ATOM 713 CE MET A 97 21.421 9.032 13.382 1.00 50.56 C ATOM 714 N ASN A 98 25.430 3.897 17.270 1.00 50.54 N ATOM 715 CA ASN A 98 25.803 3.226 18.526 1.00 50.69 C ATOM 716 C ASN A 98 27.111 3.752 19.130 1.00 50.68 C ATOM 717 O ASN A 98 27.985 4.254 18.422 1.00 50.60 O ATOM 718 CB ASN A 98 25.890 1.701 18.335 1.00 50.79 C ATOM 719 CG ASN A 98 26.665 1.304 17.085 1.00 50.86 C ATOM 720 OD1 ASN A 98 26.278 1.655 15.969 1.00 51.03 O ATOM 721 ND2 ASN A 98 27.757 0.566 17.268 1.00 50.39 N TER 722 ASN A 98 ATOM 723 N MET B 1 36.649 20.888 -11.281 1.00 50.26 N ATOM 724 CA MET B 1 35.861 19.671 -10.926 1.00 50.27 C ATOM 725 C MET B 1 34.447 20.038 -10.472 1.00 50.05 C ATOM 726 O MET B 1 34.050 21.204 -10.507 1.00 50.07 O ATOM 727 CB MET B 1 36.589 18.865 -9.833 1.00 50.62 C ATOM 728 CG MET B 1 37.604 17.824 -10.353 1.00 51.55 C ATOM 729 SD MET B 1 36.908 16.447 -11.329 1.00 53.45 S ATOM 730 CE MET B 1 35.548 15.866 -10.308 1.00 51.74 C ATOM 731 N PHE B 2 33.690 19.026 -10.064 1.00 49.75 N ATOM 732 CA PHE B 2 32.351 19.221 -9.531 1.00 49.50 C ATOM 733 C PHE B 2 32.454 19.440 -8.037 1.00 49.15 C ATOM 734 O PHE B 2 33.169 18.715 -7.357 1.00 49.11 O ATOM 735 CB PHE B 2 31.495 17.982 -9.781 1.00 49.66 C ATOM 736 CG PHE B 2 31.560 17.472 -11.189 1.00 49.75 C ATOM 737 CD1 PHE B 2 32.453 16.466 -11.534 1.00 50.16 C ATOM 738 CD2 PHE B 2 30.730 17.994 -12.168 1.00 49.88 C ATOM 739 CE1 PHE B 2 32.522 15.990 -12.834 1.00 50.20 C ATOM 740 CE2 PHE B 2 30.789 17.525 -13.468 1.00 50.02 C ATOM 741 CZ PHE B 2 31.690 16.520 -13.804 1.00 50.19 C ATOM 742 N GLU B 3 31.728 20.421 -7.522 1.00 48.81 N ATOM 743 CA GLU B 3 31.703 20.664 -6.086 1.00 48.72 C ATOM 744 C GLU B 3 30.914 19.563 -5.394 1.00 48.65 C ATOM 745 O GLU B 3 29.998 18.996 -5.980 1.00 48.66 O ATOM 746 CB GLU B 3 31.088 22.024 -5.790 1.00 48.63 C ATOM 747 CG GLU B 3 31.861 23.170 -6.415 1.00 48.54 C ATOM 748 CD GLU B 3 31.254 24.518 -6.129 1.00 48.41 C ATOM 749 OE1 GLU B 3 30.433 24.614 -5.196 1.00 47.37 O ATOM 750 OE2 GLU B 3 31.609 25.482 -6.841 1.00 48.59 O ATOM 751 N GLN B 4 31.271 19.253 -4.152 1.00 48.67 N ATOM 752 CA GLN B 4 30.616 18.167 -3.423 1.00 48.66 C ATOM 753 C GLN B 4 29.202 18.562 -3.029 1.00 48.55 C ATOM 754 O GLN B 4 28.961 19.705 -2.645 1.00 48.44 O ATOM 755 CB GLN B 4 31.409 17.801 -2.167 1.00 48.73 C ATOM 756 CG GLN B 4 30.796 16.665 -1.340 1.00 48.77 C ATOM 757 CD GLN B 4 31.549 16.406 -0.047 1.00 48.90 C ATOM 758 OE1 GLN B 4 32.073 17.331 0.581 1.00 49.18 O ATOM 759 NE2 GLN B 4 31.602 15.142 0.361 1.00 49.32 N ATOM 760 N ARG B 5 28.276 17.613 -3.140 1.00 48.54 N ATOM 761 CA ARG B 5 26.913 17.784 -2.640 1.00 48.59 C ATOM 762 C ARG B 5 26.638 16.660 -1.656 1.00 48.49 C ATOM 763 O ARG B 5 26.417 15.514 -2.048 1.00 48.23 O ATOM 764 CB ARG B 5 25.893 17.777 -3.784 1.00 48.53 C ATOM 765 CG ARG B 5 24.428 17.753 -3.331 1.00 48.66 C ATOM 766 CD ARG B 5 23.492 18.361 -4.370 1.00 48.97 C ATOM 767 NE ARG B 5 23.213 19.779 -4.118 1.00 49.55 N ATOM 768 CZ ARG B 5 23.030 20.714 -5.060 1.00 50.44 C ATOM 769 NH1 ARG B 5 23.110 20.419 -6.356 1.00 50.80 N ATOM 770 NH2 ARG B 5 22.773 21.971 -4.705 1.00 50.28 N ATOM 771 N VAL B 6 26.668 17.000 -0.373 1.00 48.57 N ATOM 772 CA VAL B 6 26.549 16.010 0.676 1.00 48.69 C ATOM 773 C VAL B 6 25.120 15.519 0.669 1.00 48.81 C ATOM 774 O VAL B 6 24.214 16.280 0.343 1.00 48.89 O ATOM 775 CB VAL B 6 26.905 16.597 2.043 1.00 48.64 C ATOM 776 CG1 VAL B 6 26.839 15.522 3.121 1.00 49.01 C ATOM 777 CG2 VAL B 6 28.294 17.229 1.999 1.00 48.54 C ATOM 778 N ASN B 7 24.928 14.250 1.026 1.00 49.00 N ATOM 779 CA ASN B 7 23.615 13.583 0.946 1.00 49.14 C ATOM 780 C ASN B 7 22.499 14.392 1.614 1.00 49.15 C ATOM 781 O ASN B 7 21.337 14.325 1.220 1.00 49.07 O ATOM 782 CB ASN B 7 23.675 12.181 1.568 1.00 49.25 C ATOM 783 CG ASN B 7 24.929 11.403 1.168 1.00 49.87 C ATOM 784 OD1 ASN B 7 26.040 11.941 1.170 1.00 51.11 O ATOM 785 ND2 ASN B 7 24.757 10.127 0.843 1.00 50.43 N ATOM 786 N SER B 8 22.877 15.146 2.638 1.00 49.35 N ATOM 787 CA SER B 8 22.003 16.114 3.287 1.00 49.45 C ATOM 788 C SER B 8 21.367 17.089 2.293 1.00 49.50 C ATOM 789 O SER B 8 20.185 17.383 2.405 1.00 49.73 O ATOM 790 CB SER B 8 22.801 16.888 4.350 1.00 49.64 C ATOM 791 OG SER B 8 23.802 16.064 4.955 1.00 49.63 O ATOM 792 N ASP B 9 22.147 17.566 1.321 1.00 49.59 N ATOM 793 CA ASP B 9 21.688 18.564 0.332 1.00 49.56 C ATOM 794 C ASP B 9 21.019 17.995 -0.924 1.00 49.35 C ATOM 795 O ASP B 9 20.522 18.759 -1.746 1.00 49.53 O ATOM 796 CB ASP B 9 22.859 19.443 -0.124 1.00 49.90 C ATOM 797 CG ASP B 9 23.285 20.454 0.923 1.00 51.23 C ATOM 798 OD1 ASP B 9 24.213 21.243 0.616 1.00 52.04 O ATOM 799 OD2 ASP B 9 22.703 20.464 2.040 1.00 53.41 O ATOM 800 N VAL B 10 21.016 16.674 -1.083 1.00 48.96 N ATOM 801 CA VAL B 10 20.330 16.029 -2.208 1.00 48.73 C ATOM 802 C VAL B 10 18.795 16.168 -2.149 1.00 48.68 C ATOM 803 O VAL B 10 18.109 16.068 -3.166 1.00 48.57 O ATOM 804 CB VAL B 10 20.705 14.553 -2.270 1.00 48.46 C ATOM 805 CG1 VAL B 10 19.868 13.823 -3.296 1.00 48.09 C ATOM 806 CG2 VAL B 10 22.180 14.426 -2.578 1.00 48.51 C ATOM 807 N LEU B 11 18.269 16.404 -0.951 1.00 48.77 N ATOM 808 CA LEU B 11 16.831 16.570 -0.724 1.00 48.59 C ATOM 809 C LEU B 11 16.615 17.729 0.253 1.00 48.42 C ATOM 810 O LEU B 11 16.983 17.625 1.428 1.00 48.34 O ATOM 811 CB LEU B 11 16.249 15.269 -0.164 1.00 48.62 C ATOM 812 CG LEU B 11 15.881 14.225 -1.218 1.00 48.38 C ATOM 813 CD1 LEU B 11 16.067 12.801 -0.722 1.00 47.92 C ATOM 814 CD2 LEU B 11 14.454 14.465 -1.644 1.00 49.09 C ATOM 815 N THR B 12 16.036 18.829 -0.224 1.00 48.11 N ATOM 816 CA THR B 12 15.995 20.047 0.573 1.00 48.07 C ATOM 817 C THR B 12 14.748 20.912 0.386 1.00 48.00 C ATOM 818 O THR B 12 14.212 21.052 -0.716 1.00 47.94 O ATOM 819 CB THR B 12 17.207 20.931 0.276 1.00 48.07 C ATOM 820 OG1 THR B 12 16.993 21.634 -0.952 1.00 48.56 O ATOM 821 CG2 THR B 12 18.480 20.102 0.176 1.00 47.99 C ATOM 822 N VAL B 13 14.329 21.509 1.499 1.00 47.98 N ATOM 823 CA VAL B 13 13.206 22.425 1.558 1.00 47.81 C ATOM 824 C VAL B 13 13.749 23.825 1.777 1.00 47.74 C ATOM 825 O VAL B 13 14.762 24.000 2.446 1.00 47.89 O ATOM 826 CB VAL B 13 12.293 22.066 2.725 1.00 47.73 C ATOM 827 CG1 VAL B 13 11.148 23.063 2.836 1.00 47.93 C ATOM 828 CG2 VAL B 13 11.769 20.650 2.552 1.00 47.66 C ATOM 829 N SER B 14 13.073 24.818 1.216 1.00 47.62 N ATOM 830 CA SER B 14 13.531 26.193 1.289 1.00 47.63 C ATOM 831 C SER B 14 12.959 26.863 2.526 1.00 47.60 C ATOM 832 O SER B 14 11.822 26.608 2.912 1.00 47.52 O ATOM 833 CB SER B 14 13.132 26.966 0.029 1.00 47.62 C ATOM 834 OG SER B 14 11.946 26.450 -0.539 1.00 47.56 O ATOM 835 N THR B 15 13.761 27.726 3.137 1.00 47.74 N ATOM 836 CA THR B 15 13.390 28.395 4.377 1.00 47.85 C ATOM 837 C THR B 15 13.868 29.846 4.380 1.00 47.91 C ATOM 838 O THR B 15 14.928 30.159 3.846 1.00 47.90 O ATOM 839 CB THR B 15 14.013 27.684 5.602 1.00 47.87 C ATOM 840 OG1 THR B 15 15.415 27.975 5.674 1.00 48.24 O ATOM 841 CG2 THR B 15 13.812 26.183 5.519 1.00 47.49 C ATOM 842 N VAL B 16 13.074 30.719 4.991 1.00 48.03 N ATOM 843 CA VAL B 16 13.466 32.100 5.242 1.00 48.07 C ATOM 844 C VAL B 16 14.343 32.125 6.482 1.00 48.18 C ATOM 845 O VAL B 16 13.999 31.502 7.487 1.00 48.21 O ATOM 846 CB VAL B 16 12.235 32.981 5.497 1.00 48.03 C ATOM 847 CG1 VAL B 16 12.647 34.332 6.083 1.00 48.24 C ATOM 848 CG2 VAL B 16 11.438 33.148 4.213 1.00 47.86 C ATOM 849 N ASN B 17 15.467 32.838 6.416 1.00 48.28 N ATOM 850 CA ASN B 17 16.392 32.909 7.547 1.00 48.36 C ATOM 851 C ASN B 17 16.262 34.219 8.327 1.00 48.50 C ATOM 852 O ASN B 17 15.437 35.082 7.988 1.00 48.42 O ATOM 853 CB ASN B 17 17.839 32.653 7.091 1.00 48.26 C ATOM 854 CG ASN B 17 18.536 33.896 6.562 1.00 48.23 C ATOM 855 OD1 ASN B 17 17.917 34.941 6.352 1.00 48.47 O ATOM 856 ND2 ASN B 17 19.843 33.784 6.348 1.00 48.01 N ATOM 857 N SER B 18 17.083 34.346 9.371 1.00 48.66 N ATOM 858 CA SER B 18 17.090 35.516 10.255 1.00 48.75 C ATOM 859 C SER B 18 17.048 36.858 9.505 1.00 48.95 C ATOM 860 O SER B 18 16.388 37.799 9.959 1.00 48.99 O ATOM 861 CB SER B 18 18.308 35.460 11.195 1.00 48.76 C ATOM 862 OG SER B 18 19.445 34.895 10.553 1.00 48.51 O ATOM 863 N GLN B 19 17.740 36.935 8.364 1.00 49.04 N ATOM 864 CA GLN B 19 17.799 38.160 7.558 1.00 49.01 C ATOM 865 C GLN B 19 16.842 38.125 6.366 1.00 49.02 C ATOM 866 O GLN B 19 17.130 38.725 5.329 1.00 49.10 O ATOM 867 CB GLN B 19 19.225 38.407 7.040 1.00 49.07 C ATOM 868 CG GLN B 19 20.304 38.508 8.111 1.00 49.30 C ATOM 869 CD GLN B 19 20.851 37.159 8.555 1.00 49.81 C ATOM 870 OE1 GLN B 19 20.488 36.112 8.014 1.00 49.99 O ATOM 871 NE2 GLN B 19 21.730 37.183 9.553 1.00 50.26 N ATOM 872 N ASP B 20 15.711 37.434 6.502 1.00 49.02 N ATOM 873 CA ASP B 20 14.713 37.377 5.428 1.00 49.00 C ATOM 874 C ASP B 20 15.394 37.027 4.100 1.00 48.75 C ATOM 875 O ASP B 20 15.225 37.723 3.097 1.00 48.76 O ATOM 876 CB ASP B 20 13.966 38.722 5.302 1.00 49.33 C ATOM 877 CG ASP B 20 13.452 39.255 6.652 1.00 50.29 C ATOM 878 OD1 ASP B 20 12.642 38.554 7.306 1.00 51.64 O ATOM 879 OD2 ASP B 20 13.847 40.382 7.050 1.00 50.69 O ATOM 880 N GLN B 21 16.181 35.953 4.119 1.00 48.40 N ATOM 881 CA GLN B 21 16.941 35.496 2.957 1.00 48.15 C ATOM 882 C GLN B 21 16.629 34.013 2.722 1.00 47.90 C ATOM 883 O GLN B 21 16.896 33.180 3.586 1.00 47.79 O ATOM 884 CB GLN B 21 18.437 35.689 3.215 1.00 48.06 C ATOM 885 CG GLN B 21 19.254 36.044 1.984 1.00 48.03 C ATOM 886 CD GLN B 21 19.159 37.511 1.613 1.00 48.17 C ATOM 887 OE1 GLN B 21 18.343 38.256 2.159 1.00 48.43 O ATOM 888 NE2 GLN B 21 20.000 37.935 0.676 1.00 48.02 N ATOM 889 N VAL B 22 16.067 33.686 1.559 1.00 47.70 N ATOM 890 CA VAL B 22 15.583 32.328 1.299 1.00 47.62 C ATOM 891 C VAL B 22 16.734 31.375 1.010 1.00 47.54 C ATOM 892 O VAL B 22 17.669 31.725 0.302 1.00 47.52 O ATOM 893 CB VAL B 22 14.584 32.284 0.137 1.00 47.55 C ATOM 894 CG1 VAL B 22 14.062 30.870 -0.056 1.00 47.36 C ATOM 895 CG2 VAL B 22 13.425 33.244 0.396 1.00 47.79 C ATOM 896 N THR B 23 16.646 30.165 1.558 1.00 47.60 N ATOM 897 CA THR B 23 17.755 29.206 1.543 1.00 47.55 C ATOM 898 C THR B 23 17.271 27.760 1.721 1.00 47.66 C ATOM 899 O THR B 23 16.257 27.515 2.373 1.00 47.72 O ATOM 900 CB THR B 23 18.778 29.533 2.653 1.00 47.39 C ATOM 901 OG1 THR B 23 19.189 28.324 3.298 1.00 47.38 O ATOM 902 CG2 THR B 23 18.175 30.443 3.702 1.00 47.19 C ATOM 903 N GLN B 24 18.010 26.812 1.146 1.00 47.72 N ATOM 904 CA GLN B 24 17.670 25.393 1.248 1.00 47.76 C ATOM 905 C GLN B 24 18.243 24.805 2.521 1.00 47.89 C ATOM 906 O GLN B 24 19.407 25.035 2.830 1.00 48.03 O ATOM 907 CB GLN B 24 18.246 24.605 0.069 1.00 47.70 C ATOM 908 CG GLN B 24 17.803 25.071 -1.307 1.00 47.57 C ATOM 909 CD GLN B 24 16.293 25.068 -1.494 1.00 47.45 C ATOM 910 OE1 GLN B 24 15.682 26.131 -1.567 1.00 47.47 O ATOM 911 NE2 GLN B 24 15.687 23.877 -1.576 1.00 46.50 N ATOM 912 N LYS B 25 17.434 24.036 3.245 1.00 47.98 N ATOM 913 CA LYS B 25 17.923 23.246 4.373 1.00 48.14 C ATOM 914 C LYS B 25 17.545 21.782 4.135 1.00 47.74 C ATOM 915 O LYS B 25 16.529 21.519 3.502 1.00 47.48 O ATOM 916 CB LYS B 25 17.343 23.766 5.698 1.00 48.45 C ATOM 917 CG LYS B 25 15.852 23.436 5.933 1.00 49.33 C ATOM 918 CD LYS B 25 15.359 23.822 7.348 1.00 49.24 C ATOM 919 CE LYS B 25 13.914 23.325 7.588 1.00 49.96 C ATOM 920 NZ LYS B 25 13.358 23.637 8.950 1.00 50.10 N ATOM 921 N PRO B 26 18.359 20.829 4.633 1.00 47.61 N ATOM 922 CA PRO B 26 18.080 19.411 4.417 1.00 47.74 C ATOM 923 C PRO B 26 16.694 19.007 4.861 1.00 47.79 C ATOM 924 O PRO B 26 16.113 19.650 5.735 1.00 48.01 O ATOM 925 CB PRO B 26 19.119 18.708 5.290 1.00 47.56 C ATOM 926 CG PRO B 26 20.231 19.652 5.365 1.00 47.69 C ATOM 927 CD PRO B 26 19.596 21.012 5.409 1.00 47.69 C ATOM 928 N LEU B 27 16.170 17.947 4.260 1.00 47.91 N ATOM 929 CA LEU B 27 14.857 17.437 4.638 1.00 48.06 C ATOM 930 C LEU B 27 14.917 16.915 6.068 1.00 48.30 C ATOM 931 O LEU B 27 13.985 17.118 6.845 1.00 48.27 O ATOM 932 CB LEU B 27 14.411 16.327 3.690 1.00 48.01 C ATOM 933 CG LEU B 27 12.962 15.869 3.796 1.00 47.65 C ATOM 934 CD1 LEU B 27 12.012 16.958 3.359 1.00 47.73 C ATOM 935 CD2 LEU B 27 12.782 14.648 2.938 1.00 47.80 C ATOM 936 N ARG B 28 16.026 16.252 6.404 1.00 48.46 N ATOM 937 CA ARG B 28 16.291 15.813 7.767 1.00 48.68 C ATOM 938 C ARG B 28 15.722 16.811 8.767 1.00 48.73 C ATOM 939 O ARG B 28 14.978 16.444 9.681 1.00 48.79 O ATOM 940 CB ARG B 28 17.794 15.736 8.023 1.00 48.74 C ATOM 941 CG ARG B 28 18.583 14.727 7.213 1.00 49.09 C ATOM 942 CD ARG B 28 20.068 15.029 7.390 1.00 49.52 C ATOM 943 NE ARG B 28 20.908 13.834 7.384 1.00 50.40 N ATOM 944 CZ ARG B 28 21.298 13.175 6.293 1.00 51.04 C ATOM 945 NH1 ARG B 28 20.917 13.573 5.087 1.00 50.93 N ATOM 946 NH2 ARG B 28 22.077 12.103 6.412 1.00 51.30 N ATOM 947 N ASP B 29 16.088 18.077 8.577 1.00 48.76 N ATOM 948 CA ASP B 29 15.768 19.135 9.524 1.00 48.85 C ATOM 949 C ASP B 29 14.270 19.378 9.652 1.00 48.93 C ATOM 950 O ASP B 29 13.787 19.632 10.756 1.00 49.10 O ATOM 951 CB ASP B 29 16.506 20.421 9.150 1.00 48.90 C ATOM 952 CG ASP B 29 18.024 20.285 9.296 1.00 49.66 C ATOM 953 OD1 ASP B 29 18.498 19.194 9.701 1.00 49.82 O ATOM 954 OD2 ASP B 29 18.747 21.269 9.004 1.00 50.42 O ATOM 955 N SER B 30 13.533 19.283 8.545 1.00 48.90 N ATOM 956 CA SER B 30 12.066 19.342 8.603 1.00 48.79 C ATOM 957 C SER B 30 11.537 18.195 9.459 1.00 48.67 C ATOM 958 O SER B 30 10.650 18.384 10.284 1.00 48.59 O ATOM 959 CB SER B 30 11.448 19.265 7.203 1.00 48.75 C ATOM 960 OG SER B 30 11.895 20.328 6.387 1.00 48.81 O ATOM 961 N VAL B 31 12.096 17.007 9.256 1.00 48.69 N ATOM 962 CA VAL B 31 11.706 15.833 10.022 1.00 48.76 C ATOM 963 C VAL B 31 12.012 16.033 11.508 1.00 48.78 C ATOM 964 O VAL B 31 11.182 15.698 12.349 1.00 48.73 O ATOM 965 CB VAL B 31 12.382 14.541 9.479 1.00 48.78 C ATOM 966 CG1 VAL B 31 12.122 13.361 10.393 1.00 48.58 C ATOM 967 CG2 VAL B 31 11.882 14.233 8.070 1.00 48.71 C ATOM 968 N LYS B 32 13.177 16.593 11.834 1.00 48.82 N ATOM 969 CA LYS B 32 13.506 16.883 13.236 1.00 49.00 C ATOM 970 C LYS B 32 12.432 17.766 13.860 1.00 48.98 C ATOM 971 O LYS B 32 11.719 17.349 14.771 1.00 48.98 O ATOM 972 CB LYS B 32 14.868 17.571 13.368 1.00 49.01 C ATOM 973 CG LYS B 32 16.058 16.633 13.279 1.00 49.42 C ATOM 974 CD LYS B 32 17.285 17.217 13.990 1.00 49.64 C ATOM 975 CE LYS B 32 18.477 16.249 13.979 1.00 49.91 C ATOM 976 NZ LYS B 32 19.442 16.536 15.083 1.00 49.78 N ATOM 977 N GLN B 33 12.326 18.985 13.340 1.00 49.05 N ATOM 978 CA GLN B 33 11.317 19.965 13.746 1.00 48.99 C ATOM 979 C GLN B 33 9.922 19.355 13.945 1.00 48.62 C ATOM 980 O GLN B 33 9.227 19.696 14.898 1.00 48.58 O ATOM 981 CB GLN B 33 11.271 21.063 12.680 1.00 49.06 C ATOM 982 CG GLN B 33 10.339 22.244 12.919 1.00 49.48 C ATOM 983 CD GLN B 33 10.257 23.166 11.686 1.00 50.42 C ATOM 984 OE1 GLN B 33 10.745 22.828 10.591 1.00 52.49 O ATOM 985 NE2 GLN B 33 9.638 24.333 11.862 1.00 52.54 N ATOM 986 N ALA B 34 9.519 18.455 13.052 1.00 48.36 N ATOM 987 CA ALA B 34 8.187 17.847 13.124 1.00 48.22 C ATOM 988 C ALA B 34 8.002 16.982 14.375 1.00 48.06 C ATOM 989 O ALA B 34 6.899 16.911 14.927 1.00 48.07 O ATOM 990 CB ALA B 34 7.898 17.036 11.864 1.00 48.00 C ATOM 991 N LEU B 35 9.084 16.337 14.812 1.00 47.88 N ATOM 992 CA LEU B 35 9.080 15.491 16.010 1.00 47.73 C ATOM 993 C LEU B 35 9.265 16.339 17.271 1.00 47.62 C ATOM 994 O LEU B 35 8.498 16.229 18.227 1.00 47.45 O ATOM 995 CB LEU B 35 10.186 14.432 15.922 1.00 47.59 C ATOM 996 CG LEU B 35 10.089 13.449 14.750 1.00 47.20 C ATOM 997 CD1 LEU B 35 11.382 12.661 14.561 1.00 46.63 C ATOM 998 CD2 LEU B 35 8.917 12.513 14.948 1.00 46.79 C ATOM 999 N LYS B 36 10.290 17.185 17.262 1.00 47.62 N ATOM 1000 CA LYS B 36 10.511 18.161 18.326 1.00 47.71 C ATOM 1001 C LYS B 36 9.195 18.837 18.706 1.00 47.74 C ATOM 1002 O LYS B 36 8.899 19.027 19.887 1.00 47.84 O ATOM 1003 CB LYS B 36 11.543 19.195 17.862 1.00 47.70 C ATOM 1004 CG LYS B 36 11.681 20.442 18.727 1.00 47.74 C ATOM 1005 CD LYS B 36 12.876 21.284 18.271 1.00 47.90 C ATOM 1006 CE LYS B 36 12.819 22.719 18.803 1.00 48.15 C ATOM 1007 NZ LYS B 36 13.257 22.835 20.226 1.00 47.88 N ATOM 1008 N ASN B 37 8.416 19.185 17.686 1.00 47.83 N ATOM 1009 CA ASN B 37 7.084 19.763 17.853 1.00 47.76 C ATOM 1010 C ASN B 37 6.050 18.724 18.307 1.00 47.58 C ATOM 1011 O ASN B 37 5.175 19.014 19.118 1.00 47.39 O ATOM 1012 CB ASN B 37 6.652 20.415 16.529 1.00 47.93 C ATOM 1013 CG ASN B 37 5.220 20.927 16.554 1.00 48.23 C ATOM 1014 OD1 ASN B 37 4.742 21.453 17.561 1.00 48.81 O ATOM 1015 ND2 ASN B 37 4.532 20.787 15.427 1.00 49.52 N ATOM 1016 N TYR B 38 6.153 17.519 17.766 1.00 47.48 N ATOM 1017 CA TYR B 38 5.232 16.439 18.096 1.00 47.53 C ATOM 1018 C TYR B 38 5.361 15.986 19.539 1.00 47.53 C ATOM 1019 O TYR B 38 4.356 15.690 20.184 1.00 47.68 O ATOM 1020 CB TYR B 38 5.469 15.259 17.161 1.00 47.50 C ATOM 1021 CG TYR B 38 4.806 13.969 17.571 1.00 47.40 C ATOM 1022 CD1 TYR B 38 5.556 12.907 18.055 1.00 47.07 C ATOM 1023 CD2 TYR B 38 3.431 13.802 17.454 1.00 47.65 C ATOM 1024 CE1 TYR B 38 4.959 11.712 18.415 1.00 47.29 C ATOM 1025 CE2 TYR B 38 2.820 12.610 17.818 1.00 47.56 C ATOM 1026 CZ TYR B 38 3.591 11.568 18.298 1.00 47.40 C ATOM 1027 OH TYR B 38 2.997 10.382 18.659 1.00 47.32 O ATOM 1028 N PHE B 39 6.591 15.924 20.040 1.00 47.63 N ATOM 1029 CA PHE B 39 6.827 15.606 21.450 1.00 47.67 C ATOM 1030 C PHE B 39 6.237 16.700 22.328 1.00 47.74 C ATOM 1031 O PHE B 39 5.438 16.420 23.214 1.00 47.71 O ATOM 1032 CB PHE B 39 8.322 15.468 21.762 1.00 47.47 C ATOM 1033 CG PHE B 39 9.017 14.352 21.020 1.00 47.42 C ATOM 1034 CD1 PHE B 39 8.415 13.112 20.844 1.00 47.35 C ATOM 1035 CD2 PHE B 39 10.300 14.535 20.528 1.00 47.31 C ATOM 1036 CE1 PHE B 39 9.075 12.089 20.165 1.00 47.19 C ATOM 1037 CE2 PHE B 39 10.960 13.513 19.855 1.00 47.17 C ATOM 1038 CZ PHE B 39 10.347 12.293 19.674 1.00 46.94 C ATOM 1039 N ALA B 40 6.623 17.946 22.063 1.00 47.96 N ATOM 1040 CA ALA B 40 6.129 19.105 22.812 1.00 48.21 C ATOM 1041 C ALA B 40 4.616 19.072 23.061 1.00 48.41 C ATOM 1042 O ALA B 40 4.157 19.470 24.130 1.00 48.39 O ATOM 1043 CB ALA B 40 6.511 20.386 22.095 1.00 48.15 C ATOM 1044 N GLN B 41 3.856 18.600 22.073 1.00 48.81 N ATOM 1045 CA GLN B 41 2.394 18.455 22.196 1.00 49.13 C ATOM 1046 C GLN B 41 1.981 17.205 22.962 1.00 49.27 C ATOM 1047 O GLN B 41 0.851 17.112 23.427 1.00 49.26 O ATOM 1048 CB GLN B 41 1.722 18.432 20.809 1.00 49.26 C ATOM 1049 CG GLN B 41 1.024 19.736 20.420 1.00 49.74 C ATOM 1050 CD GLN B 41 1.951 20.944 20.461 1.00 50.48 C ATOM 1051 OE1 GLN B 41 3.104 20.871 20.031 1.00 50.96 O ATOM 1052 NE2 GLN B 41 1.448 22.064 20.980 1.00 50.79 N ATOM 1053 N LEU B 42 2.900 16.258 23.096 1.00 49.62 N ATOM 1054 CA LEU B 42 2.591 14.932 23.624 1.00 49.87 C ATOM 1055 C LEU B 42 2.301 14.927 25.133 1.00 50.07 C ATOM 1056 O LEU B 42 1.356 14.274 25.578 1.00 50.08 O ATOM 1057 CB LEU B 42 3.744 13.980 23.293 1.00 49.93 C ATOM 1058 CG LEU B 42 3.485 12.480 23.339 1.00 49.90 C ATOM 1059 CD1 LEU B 42 2.260 12.094 22.521 1.00 50.26 C ATOM 1060 CD2 LEU B 42 4.727 11.753 22.842 1.00 49.92 C ATOM 1061 N ASN B 43 3.118 15.645 25.905 1.00 50.32 N ATOM 1062 CA ASN B 43 2.883 15.871 27.345 1.00 50.60 C ATOM 1063 C ASN B 43 2.574 14.632 28.191 1.00 50.84 C ATOM 1064 O ASN B 43 1.587 14.607 28.931 1.00 50.82 O ATOM 1065 CB ASN B 43 1.774 16.920 27.547 1.00 50.60 C ATOM 1066 CG ASN B 43 2.306 18.335 27.555 1.00 50.61 C ATOM 1067 OD1 ASN B 43 2.075 19.089 28.499 1.00 50.43 O ATOM 1068 ND2 ASN B 43 3.036 18.700 26.507 1.00 50.68 N ATOM 1069 N GLY B 44 3.420 13.608 28.085 1.00 51.15 N ATOM 1070 CA GLY B 44 3.278 12.400 28.908 1.00 51.36 C ATOM 1071 C GLY B 44 2.371 11.317 28.337 1.00 51.60 C ATOM 1072 O GLY B 44 2.369 10.183 28.832 1.00 51.64 O ATOM 1073 N GLN B 45 1.583 11.669 27.318 1.00 51.85 N ATOM 1074 CA GLN B 45 0.797 10.694 26.560 1.00 51.84 C ATOM 1075 C GLN B 45 1.756 9.689 25.933 1.00 51.88 C ATOM 1076 O GLN B 45 2.812 10.078 25.429 1.00 51.87 O ATOM 1077 CB GLN B 45 -0.012 11.404 25.464 1.00 52.01 C ATOM 1078 CG GLN B 45 -0.990 10.518 24.693 1.00 52.24 C ATOM 1079 CD GLN B 45 -2.121 10.002 25.569 1.00 53.20 C ATOM 1080 OE1 GLN B 45 -1.976 8.991 26.259 1.00 53.95 O ATOM 1081 NE2 GLN B 45 -3.255 10.697 25.545 1.00 53.53 N ATOM 1082 N ASP B 46 1.403 8.403 25.971 1.00 51.83 N ATOM 1083 CA ASP B 46 2.317 7.361 25.491 1.00 51.79 C ATOM 1084 C ASP B 46 2.114 7.055 23.998 1.00 51.80 C ATOM 1085 O ASP B 46 1.013 7.198 23.456 1.00 51.85 O ATOM 1086 CB ASP B 46 2.253 6.097 26.377 1.00 51.74 C ATOM 1087 CG ASP B 46 1.282 5.046 25.864 1.00 51.65 C ATOM 1088 OD1 ASP B 46 0.281 4.789 26.560 1.00 51.56 O ATOM 1089 OD2 ASP B 46 1.527 4.458 24.785 1.00 51.43 O ATOM 1090 N VAL B 47 3.206 6.635 23.362 1.00 51.73 N ATOM 1091 CA VAL B 47 3.265 6.378 21.930 1.00 51.62 C ATOM 1092 C VAL B 47 3.674 4.931 21.682 1.00 51.59 C ATOM 1093 O VAL B 47 4.393 4.333 22.478 1.00 51.68 O ATOM 1094 CB VAL B 47 4.303 7.292 21.269 1.00 51.54 C ATOM 1095 CG1 VAL B 47 4.198 7.216 19.750 1.00 51.78 C ATOM 1096 CG2 VAL B 47 4.120 8.718 21.751 1.00 51.36 C ATOM 1097 N ASN B 48 3.222 4.376 20.567 1.00 51.58 N ATOM 1098 CA ASN B 48 3.545 2.990 20.218 1.00 51.57 C ATOM 1099 C ASN B 48 3.918 2.764 18.750 1.00 51.58 C ATOM 1100 O ASN B 48 4.719 1.881 18.449 1.00 51.68 O ATOM 1101 CB ASN B 48 2.415 2.028 20.643 1.00 51.57 C ATOM 1102 CG ASN B 48 1.015 2.475 20.184 1.00 51.66 C ATOM 1103 OD1 ASN B 48 0.029 1.815 20.502 1.00 51.69 O ATOM 1104 ND2 ASN B 48 0.925 3.579 19.447 1.00 51.71 N ATOM 1105 N ASP B 49 3.363 3.576 17.852 1.00 51.51 N ATOM 1106 CA ASP B 49 3.454 3.340 16.411 1.00 51.43 C ATOM 1107 C ASP B 49 4.414 4.293 15.695 1.00 51.13 C ATOM 1108 O ASP B 49 4.546 4.222 14.476 1.00 51.18 O ATOM 1109 CB ASP B 49 2.058 3.478 15.784 1.00 51.79 C ATOM 1110 CG ASP B 49 1.443 4.872 16.000 1.00 52.99 C ATOM 1111 OD1 ASP B 49 1.766 5.532 17.021 1.00 54.51 O ATOM 1112 OD2 ASP B 49 0.628 5.302 15.149 1.00 54.34 O ATOM 1113 N LEU B 50 5.098 5.155 16.446 1.00 50.72 N ATOM 1114 CA LEU B 50 5.823 6.300 15.871 1.00 50.48 C ATOM 1115 C LEU B 50 6.569 6.031 14.555 1.00 50.13 C ATOM 1116 O LEU B 50 6.668 6.926 13.715 1.00 50.08 O ATOM 1117 CB LEU B 50 6.784 6.915 16.903 1.00 50.50 C ATOM 1118 CG LEU B 50 7.596 8.148 16.460 1.00 50.68 C ATOM 1119 CD1 LEU B 50 6.721 9.208 15.800 1.00 50.87 C ATOM 1120 CD2 LEU B 50 8.349 8.754 17.636 1.00 50.62 C ATOM 1121 N TYR B 51 7.095 4.824 14.364 1.00 49.76 N ATOM 1122 CA TYR B 51 7.760 4.510 13.100 1.00 49.58 C ATOM 1123 C TYR B 51 6.750 4.519 11.955 1.00 49.31 C ATOM 1124 O TYR B 51 6.869 5.310 11.019 1.00 49.13 O ATOM 1125 CB TYR B 51 8.487 3.166 13.156 1.00 49.58 C ATOM 1126 CG TYR B 51 9.445 2.976 12.002 1.00 49.64 C ATOM 1127 CD1 TYR B 51 10.791 3.291 12.137 1.00 49.75 C ATOM 1128 CD2 TYR B 51 9.004 2.500 10.765 1.00 49.58 C ATOM 1129 CE1 TYR B 51 11.684 3.123 11.074 1.00 49.90 C ATOM 1130 CE2 TYR B 51 9.886 2.332 9.697 1.00 49.47 C ATOM 1131 CZ TYR B 51 11.224 2.644 9.862 1.00 49.62 C ATOM 1132 OH TYR B 51 12.107 2.489 8.822 1.00 49.62 O ATOM 1133 N GLU B 52 5.754 3.641 12.046 1.00 49.18 N ATOM 1134 CA GLU B 52 4.687 3.567 11.052 1.00 48.92 C ATOM 1135 C GLU B 52 4.082 4.946 10.796 1.00 48.65 C ATOM 1136 O GLU B 52 3.876 5.339 9.651 1.00 48.78 O ATOM 1137 CB GLU B 52 3.601 2.594 11.515 1.00 49.05 C ATOM 1138 CG GLU B 52 2.354 2.551 10.627 1.00 49.62 C ATOM 1139 CD GLU B 52 2.666 2.247 9.164 1.00 50.64 C ATOM 1140 OE1 GLU B 52 1.949 2.781 8.282 1.00 51.22 O ATOM 1141 OE2 GLU B 52 3.623 1.479 8.900 1.00 50.75 O ATOM 1142 N LEU B 53 3.802 5.671 11.872 1.00 48.20 N ATOM 1143 CA LEU B 53 3.324 7.045 11.782 1.00 47.96 C ATOM 1144 C LEU B 53 4.201 7.881 10.855 1.00 47.74 C ATOM 1145 O LEU B 53 3.697 8.489 9.917 1.00 47.89 O ATOM 1146 CB LEU B 53 3.301 7.687 13.168 1.00 47.88 C ATOM 1147 CG LEU B 53 2.590 9.034 13.246 1.00 47.74 C ATOM 1148 CD1 LEU B 53 1.160 8.829 13.691 1.00 47.50 C ATOM 1149 CD2 LEU B 53 3.317 9.964 14.192 1.00 47.69 C ATOM 1150 N VAL B 54 5.505 7.912 11.124 1.00 47.48 N ATOM 1151 CA VAL B 54 6.448 8.684 10.310 1.00 47.43 C ATOM 1152 C VAL B 54 6.480 8.174 8.879 1.00 47.44 C ATOM 1153 O VAL B 54 6.314 8.945 7.930 1.00 47.53 O ATOM 1154 CB VAL B 54 7.881 8.595 10.864 1.00 47.40 C ATOM 1155 CG1 VAL B 54 8.901 9.060 9.822 1.00 46.95 C ATOM 1156 CG2 VAL B 54 8.001 9.398 12.140 1.00 47.54 C ATOM 1157 N LEU B 55 6.702 6.869 8.745 1.00 47.33 N ATOM 1158 CA LEU B 55 6.757 6.194 7.447 1.00 47.24 C ATOM 1159 C LEU B 55 5.561 6.553 6.564 1.00 47.11 C ATOM 1160 O LEU B 55 5.728 6.950 5.416 1.00 46.90 O ATOM 1161 CB LEU B 55 6.809 4.675 7.653 1.00 47.23 C ATOM 1162 CG LEU B 55 7.294 3.825 6.479 1.00 47.17 C ATOM 1163 CD1 LEU B 55 8.811 3.942 6.331 1.00 46.73 C ATOM 1164 CD2 LEU B 55 6.869 2.370 6.656 1.00 46.91 C ATOM 1165 N ALA B 56 4.362 6.422 7.116 1.00 47.14 N ATOM 1166 CA ALA B 56 3.140 6.740 6.386 1.00 47.40 C ATOM 1167 C ALA B 56 3.106 8.188 5.913 1.00 47.54 C ATOM 1168 O ALA B 56 2.602 8.476 4.825 1.00 47.60 O ATOM 1169 CB ALA B 56 1.919 6.446 7.240 1.00 47.46 C ATOM 1170 N GLU B 57 3.632 9.101 6.723 1.00 47.65 N ATOM 1171 CA GLU B 57 3.660 10.508 6.335 1.00 47.83 C ATOM 1172 C GLU B 57 4.617 10.709 5.179 1.00 48.07 C ATOM 1173 O GLU B 57 4.357 11.521 4.301 1.00 48.37 O ATOM 1174 CB GLU B 57 4.064 11.416 7.503 1.00 47.64 C ATOM 1175 CG GLU B 57 3.820 12.908 7.258 1.00 47.25 C ATOM 1176 CD GLU B 57 2.342 13.284 7.252 1.00 47.15 C ATOM 1177 OE1 GLU B 57 1.485 12.385 7.121 1.00 46.42 O ATOM 1178 OE2 GLU B 57 2.030 14.488 7.388 1.00 47.49 O ATOM 1179 N VAL B 58 5.716 9.964 5.177 1.00 48.27 N ATOM 1180 CA VAL B 58 6.758 10.155 4.178 1.00 48.42 C ATOM 1181 C VAL B 58 6.463 9.381 2.888 1.00 48.58 C ATOM 1182 O VAL B 58 6.598 9.930 1.794 1.00 48.71 O ATOM 1183 CB VAL B 58 8.150 9.766 4.737 1.00 48.54 C ATOM 1184 CG1 VAL B 58 8.553 8.356 4.304 1.00 48.19 C ATOM 1185 CG2 VAL B 58 9.185 10.774 4.290 1.00 48.93 C ATOM 1186 N GLU B 59 6.049 8.121 3.017 1.00 48.60 N ATOM 1187 CA GLU B 59 5.805 7.268 1.851 1.00 48.58 C ATOM 1188 C GLU B 59 4.763 7.850 0.895 1.00 48.59 C ATOM 1189 O GLU B 59 5.001 7.876 -0.309 1.00 48.58 O ATOM 1190 CB GLU B 59 5.393 5.849 2.270 1.00 48.60 C ATOM 1191 CG GLU B 59 6.555 4.977 2.721 1.00 48.52 C ATOM 1192 CD GLU B 59 6.202 3.492 2.845 1.00 48.57 C ATOM 1193 OE1 GLU B 59 7.140 2.673 2.908 1.00 48.54 O ATOM 1194 OE2 GLU B 59 5.005 3.133 2.891 1.00 48.11 O ATOM 1195 N GLN B 60 3.623 8.306 1.422 1.00 48.57 N ATOM 1196 CA GLN B 60 2.573 8.897 0.586 1.00 48.76 C ATOM 1197 C GLN B 60 3.172 9.839 -0.482 1.00 48.70 C ATOM 1198 O GLN B 60 3.094 9.526 -1.667 1.00 48.97 O ATOM 1199 CB GLN B 60 1.492 9.595 1.430 1.00 48.70 C ATOM 1200 CG GLN B 60 0.429 8.668 1.997 1.00 49.59 C ATOM 1201 CD GLN B 60 -0.692 9.411 2.755 1.00 50.03 C ATOM 1202 OE1 GLN B 60 -1.860 9.407 2.338 1.00 51.46 O ATOM 1203 NE2 GLN B 60 -0.336 10.041 3.877 1.00 51.58 N ATOM 1204 N PRO B 61 3.790 10.973 -0.074 1.00 48.54 N ATOM 1205 CA PRO B 61 4.495 11.911 -0.958 1.00 48.26 C ATOM 1206 C PRO B 61 5.436 11.296 -1.976 1.00 47.93 C ATOM 1207 O PRO B 61 5.393 11.665 -3.146 1.00 47.74 O ATOM 1208 CB PRO B 61 5.340 12.726 0.018 1.00 48.39 C ATOM 1209 CG PRO B 61 4.583 12.748 1.225 1.00 48.63 C ATOM 1210 CD PRO B 61 3.811 11.466 1.311 1.00 48.71 C ATOM 1211 N LEU B 62 6.307 10.402 -1.519 1.00 47.70 N ATOM 1212 CA LEU B 62 7.255 9.745 -2.403 1.00 47.63 C ATOM 1213 C LEU B 62 6.462 9.041 -3.498 1.00 47.66 C ATOM 1214 O LEU B 62 6.519 9.441 -4.656 1.00 47.74 O ATOM 1215 CB LEU B 62 8.149 8.768 -1.631 1.00 47.36 C ATOM 1216 CG LEU B 62 9.115 7.916 -2.457 1.00 47.43 C ATOM 1217 CD1 LEU B 62 9.749 8.733 -3.557 1.00 47.45 C ATOM 1218 CD2 LEU B 62 10.192 7.287 -1.589 1.00 47.33 C ATOM 1219 N LEU B 63 5.682 8.031 -3.129 1.00 47.69 N ATOM 1220 CA LEU B 63 4.849 7.336 -4.102 1.00 47.74 C ATOM 1221 C LEU B 63 4.143 8.357 -4.993 1.00 47.88 C ATOM 1222 O LEU B 63 4.274 8.324 -6.214 1.00 47.99 O ATOM 1223 CB LEU B 63 3.826 6.430 -3.404 1.00 47.68 C ATOM 1224 CG LEU B 63 4.363 5.272 -2.551 1.00 47.24 C ATOM 1225 CD1 LEU B 63 3.232 4.352 -2.108 1.00 46.58 C ATOM 1226 CD2 LEU B 63 5.412 4.486 -3.305 1.00 46.72 C ATOM 1227 N ASP B 64 3.432 9.286 -4.363 1.00 48.11 N ATOM 1228 CA ASP B 64 2.701 10.344 -5.067 1.00 48.21 C ATOM 1229 C ASP B 64 3.558 11.015 -6.136 1.00 48.21 C ATOM 1230 O ASP B 64 3.211 11.020 -7.315 1.00 48.10 O ATOM 1231 CB ASP B 64 2.231 11.406 -4.057 1.00 48.30 C ATOM 1232 CG ASP B 64 1.147 12.310 -4.600 1.00 48.35 C ATOM 1233 OD1 ASP B 64 0.908 12.340 -5.828 1.00 48.87 O ATOM 1234 OD2 ASP B 64 0.536 13.007 -3.768 1.00 48.74 O ATOM 1235 N MET B 65 4.685 11.567 -5.713 1.00 48.30 N ATOM 1236 CA MET B 65 5.482 12.401 -6.589 1.00 48.54 C ATOM 1237 C MET B 65 6.165 11.574 -7.673 1.00 48.66 C ATOM 1238 O MET B 65 6.303 12.035 -8.800 1.00 48.87 O ATOM 1239 CB MET B 65 6.509 13.208 -5.787 1.00 48.62 C ATOM 1240 CG MET B 65 6.792 14.574 -6.383 1.00 48.98 C ATOM 1241 SD MET B 65 5.364 15.672 -6.246 1.00 50.08 S ATOM 1242 CE MET B 65 5.186 16.264 -7.941 1.00 49.47 C ATOM 1243 N VAL B 66 6.577 10.355 -7.337 1.00 48.82 N ATOM 1244 CA VAL B 66 7.195 9.447 -8.312 1.00 48.90 C ATOM 1245 C VAL B 66 6.188 9.020 -9.374 1.00 49.04 C ATOM 1246 O VAL B 66 6.508 8.974 -10.562 1.00 49.13 O ATOM 1247 CB VAL B 66 7.792 8.184 -7.638 1.00 48.82 C ATOM 1248 CG1 VAL B 66 7.764 7.005 -8.580 1.00 48.64 C ATOM 1249 CG2 VAL B 66 9.209 8.449 -7.167 1.00 48.53 C ATOM 1250 N MET B 67 4.971 8.713 -8.950 1.00 49.23 N ATOM 1251 CA MET B 67 3.941 8.302 -9.896 1.00 49.57 C ATOM 1252 C MET B 67 3.539 9.421 -10.850 1.00 49.84 C ATOM 1253 O MET B 67 3.189 9.151 -11.995 1.00 50.04 O ATOM 1254 CB MET B 67 2.713 7.762 -9.165 1.00 49.53 C ATOM 1255 CG MET B 67 2.971 6.432 -8.494 1.00 49.31 C ATOM 1256 SD MET B 67 3.217 5.111 -9.684 1.00 48.07 S ATOM 1257 CE MET B 67 1.512 4.791 -10.124 1.00 48.06 C ATOM 1258 N GLN B 68 3.581 10.669 -10.389 1.00 50.14 N ATOM 1259 CA GLN B 68 3.351 11.809 -11.282 1.00 50.43 C ATOM 1260 C GLN B 68 4.469 11.896 -12.311 1.00 50.30 C ATOM 1261 O GLN B 68 4.219 12.148 -13.486 1.00 50.33 O ATOM 1262 CB GLN B 68 3.260 13.128 -10.504 1.00 50.64 C ATOM 1263 CG GLN B 68 1.914 13.359 -9.810 1.00 51.35 C ATOM 1264 CD GLN B 68 1.907 14.604 -8.931 1.00 51.44 C ATOM 1265 OE1 GLN B 68 1.428 14.575 -7.788 1.00 52.30 O ATOM 1266 NE2 GLN B 68 2.450 15.703 -9.459 1.00 52.64 N ATOM 1267 N TYR B 69 5.697 11.670 -11.854 1.00 50.28 N ATOM 1268 CA TYR B 69 6.886 11.698 -12.705 1.00 50.31 C ATOM 1269 C TYR B 69 6.816 10.636 -13.797 1.00 50.31 C ATOM 1270 O TYR B 69 7.024 10.927 -14.980 1.00 50.53 O ATOM 1271 CB TYR B 69 8.122 11.453 -11.845 1.00 50.50 C ATOM 1272 CG TYR B 69 9.454 11.767 -12.488 1.00 50.49 C ATOM 1273 CD1 TYR B 69 9.874 13.084 -12.641 1.00 50.86 C ATOM 1274 CD2 TYR B 69 10.317 10.747 -12.895 1.00 50.54 C ATOM 1275 CE1 TYR B 69 11.111 13.388 -13.206 1.00 50.84 C ATOM 1276 CE2 TYR B 69 11.560 11.037 -13.458 1.00 50.61 C ATOM 1277 CZ TYR B 69 11.952 12.364 -13.610 1.00 50.75 C ATOM 1278 OH TYR B 69 13.180 12.677 -14.161 1.00 50.59 O ATOM 1279 N THR B 70 6.508 9.407 -13.398 1.00 50.03 N ATOM 1280 CA THR B 70 6.402 8.316 -14.352 1.00 49.98 C ATOM 1281 C THR B 70 5.013 8.281 -15.004 1.00 50.04 C ATOM 1282 O THR B 70 4.703 7.372 -15.779 1.00 49.98 O ATOM 1283 CB THR B 70 6.680 6.970 -13.692 1.00 49.80 C ATOM 1284 OG1 THR B 70 5.505 6.527 -13.007 1.00 49.76 O ATOM 1285 CG2 THR B 70 7.839 7.078 -12.715 1.00 49.73 C ATOM 1286 N ARG B 71 4.176 9.263 -14.673 1.00 50.09 N ATOM 1287 CA ARG B 71 2.861 9.414 -15.282 1.00 50.17 C ATOM 1288 C ARG B 71 2.031 8.135 -15.183 1.00 49.76 C ATOM 1289 O ARG B 71 1.389 7.720 -16.144 1.00 49.78 O ATOM 1290 CB ARG B 71 3.023 9.886 -16.729 1.00 50.30 C ATOM 1291 CG ARG B 71 2.618 11.355 -16.969 1.00 51.44 C ATOM 1292 CD ARG B 71 3.586 12.124 -17.876 1.00 51.74 C ATOM 1293 NE ARG B 71 4.591 11.268 -18.517 1.00 53.48 N ATOM 1294 CZ ARG B 71 5.640 11.721 -19.203 1.00 53.91 C ATOM 1295 NH1 ARG B 71 5.820 13.031 -19.397 1.00 54.50 N ATOM 1296 NH2 ARG B 71 6.504 10.848 -19.729 1.00 54.37 N ATOM 1297 N GLY B 72 2.054 7.527 -14.000 1.00 49.45 N ATOM 1298 CA GLY B 72 1.270 6.332 -13.711 1.00 49.28 C ATOM 1299 C GLY B 72 1.983 5.018 -13.969 1.00 49.01 C ATOM 1300 O GLY B 72 1.431 3.954 -13.689 1.00 48.92 O ATOM 1301 N ASN B 73 3.205 5.072 -14.491 1.00 48.81 N ATOM 1302 CA ASN B 73 3.903 3.856 -14.885 1.00 48.88 C ATOM 1303 C ASN B 73 4.550 3.174 -13.689 1.00 48.86 C ATOM 1304 O ASN B 73 5.552 3.657 -13.160 1.00 49.04 O ATOM 1305 CB ASN B 73 4.956 4.159 -15.955 1.00 48.88 C ATOM 1306 CG ASN B 73 5.511 2.899 -16.616 1.00 48.84 C ATOM 1307 OD1 ASN B 73 5.092 1.777 -16.318 1.00 48.92 O ATOM 1308 ND2 ASN B 73 6.455 3.086 -17.525 1.00 48.60 N ATOM 1309 N GLN B 74 3.983 2.044 -13.277 1.00 48.84 N ATOM 1310 CA GLN B 74 4.466 1.325 -12.097 1.00 48.85 C ATOM 1311 C GLN B 74 5.840 0.698 -12.332 1.00 48.93 C ATOM 1312 O GLN B 74 6.734 0.821 -11.492 1.00 48.89 O ATOM 1313 CB GLN B 74 3.471 0.244 -11.680 1.00 48.74 C ATOM 1314 CG GLN B 74 2.107 0.773 -11.293 1.00 48.66 C ATOM 1315 CD GLN B 74 1.141 -0.326 -10.906 1.00 48.90 C ATOM 1316 OE1 GLN B 74 1.530 -1.478 -10.699 1.00 49.08 O ATOM 1317 NE2 GLN B 74 -0.133 0.026 -10.801 1.00 49.27 N ATOM 1318 N THR B 75 6.002 0.025 -13.472 1.00 49.03 N ATOM 1319 CA THR B 75 7.272 -0.620 -13.817 1.00 49.08 C ATOM 1320 C THR B 75 8.425 0.376 -13.691 1.00 49.19 C ATOM 1321 O THR B 75 9.459 0.055 -13.109 1.00 49.14 O ATOM 1322 CB THR B 75 7.239 -1.219 -15.244 1.00 49.01 C ATOM 1323 OG1 THR B 75 6.196 -2.197 -15.330 1.00 48.81 O ATOM 1324 CG2 THR B 75 8.568 -1.875 -15.593 1.00 48.93 C ATOM 1325 N ARG B 76 8.227 1.585 -14.216 1.00 49.34 N ATOM 1326 CA ARG B 76 9.226 2.653 -14.118 1.00 49.52 C ATOM 1327 C ARG B 76 9.443 3.106 -12.673 1.00 49.38 C ATOM 1328 O ARG B 76 10.573 3.114 -12.180 1.00 49.34 O ATOM 1329 CB ARG B 76 8.837 3.862 -14.987 1.00 49.58 C ATOM 1330 CG ARG B 76 9.421 3.849 -16.412 1.00 50.18 C ATOM 1331 CD ARG B 76 9.837 5.257 -16.880 1.00 50.65 C ATOM 1332 NE ARG B 76 8.709 6.084 -17.331 1.00 51.71 N ATOM 1333 CZ ARG B 76 8.629 7.417 -17.218 1.00 52.32 C ATOM 1334 NH1 ARG B 76 9.600 8.130 -16.639 1.00 52.39 N ATOM 1335 NH2 ARG B 76 7.551 8.052 -17.677 1.00 52.60 N ATOM 1336 N ALA B 77 8.357 3.485 -12.005 1.00 49.25 N ATOM 1337 CA ALA B 77 8.417 3.927 -10.614 1.00 49.18 C ATOM 1338 C ALA B 77 9.242 2.966 -9.753 1.00 49.10 C ATOM 1339 O ALA B 77 10.258 3.353 -9.179 1.00 49.01 O ATOM 1340 CB ALA B 77 7.010 4.068 -10.049 1.00 49.06 C ATOM 1341 N ALA B 78 8.813 1.708 -9.697 1.00 49.15 N ATOM 1342 CA ALA B 78 9.470 0.690 -8.872 1.00 49.17 C ATOM 1343 C ALA B 78 10.940 0.526 -9.228 1.00 49.18 C ATOM 1344 O ALA B 78 11.752 0.169 -8.383 1.00 49.16 O ATOM 1345 CB ALA B 78 8.752 -0.645 -9.005 1.00 49.09 C ATOM 1346 N LEU B 79 11.280 0.787 -10.483 1.00 49.39 N ATOM 1347 CA LEU B 79 12.658 0.662 -10.930 1.00 49.48 C ATOM 1348 C LEU B 79 13.487 1.808 -10.377 1.00 49.51 C ATOM 1349 O LEU B 79 14.557 1.581 -9.819 1.00 49.47 O ATOM 1350 CB LEU B 79 12.729 0.626 -12.462 1.00 49.58 C ATOM 1351 CG LEU B 79 13.941 -0.094 -13.066 1.00 49.53 C ATOM 1352 CD1 LEU B 79 13.530 -0.872 -14.318 1.00 49.29 C ATOM 1353 CD2 LEU B 79 15.092 0.886 -13.355 1.00 49.48 C ATOM 1354 N MET B 80 12.982 3.031 -10.514 1.00 49.64 N ATOM 1355 CA MET B 80 13.701 4.208 -10.023 1.00 49.81 C ATOM 1356 C MET B 80 13.637 4.360 -8.501 1.00 49.68 C ATOM 1357 O MET B 80 14.487 5.023 -7.919 1.00 49.83 O ATOM 1358 CB MET B 80 13.231 5.491 -10.720 1.00 49.87 C ATOM 1359 CG MET B 80 11.812 5.956 -10.410 1.00 50.34 C ATOM 1360 SD MET B 80 11.422 7.549 -11.200 1.00 50.78 S ATOM 1361 CE MET B 80 12.398 8.685 -10.203 1.00 50.38 C ATOM 1362 N MET B 81 12.644 3.750 -7.860 1.00 49.56 N ATOM 1363 CA MET B 81 12.624 3.666 -6.398 1.00 49.51 C ATOM 1364 C MET B 81 13.539 2.562 -5.868 1.00 49.52 C ATOM 1365 O MET B 81 13.940 2.589 -4.699 1.00 49.99 O ATOM 1366 CB MET B 81 11.213 3.428 -5.896 1.00 49.34 C ATOM 1367 CG MET B 81 10.340 4.630 -6.049 1.00 49.56 C ATOM 1368 SD MET B 81 8.718 4.341 -5.357 1.00 50.01 S ATOM 1369 CE MET B 81 9.146 4.075 -3.639 1.00 50.16 C ATOM 1370 N GLY B 82 13.860 1.591 -6.718 1.00 49.18 N ATOM 1371 CA GLY B 82 14.766 0.517 -6.346 1.00 48.94 C ATOM 1372 C GLY B 82 14.097 -0.574 -5.534 1.00 48.73 C ATOM 1373 O GLY B 82 14.766 -1.292 -4.793 1.00 48.98 O ATOM 1374 N ILE B 83 12.784 -0.716 -5.687 1.00 48.41 N ATOM 1375 CA ILE B 83 12.027 -1.760 -4.995 1.00 48.23 C ATOM 1376 C ILE B 83 11.306 -2.679 -5.986 1.00 48.07 C ATOM 1377 O ILE B 83 11.145 -2.340 -7.155 1.00 48.15 O ATOM 1378 CB ILE B 83 11.010 -1.147 -3.994 1.00 48.27 C ATOM 1379 CG1 ILE B 83 9.801 -0.534 -4.714 1.00 47.96 C ATOM 1380 CG2 ILE B 83 11.699 -0.105 -3.118 1.00 48.44 C ATOM 1381 CD1 ILE B 83 8.996 0.398 -3.849 1.00 47.85 C ATOM 1382 N ASN B 84 10.879 -3.843 -5.503 1.00 47.87 N ATOM 1383 CA ASN B 84 10.093 -4.787 -6.300 1.00 47.78 C ATOM 1384 C ASN B 84 8.832 -4.125 -6.845 1.00 47.63 C ATOM 1385 O ASN B 84 8.245 -3.251 -6.210 1.00 47.58 O ATOM 1386 CB ASN B 84 9.700 -6.010 -5.453 1.00 47.83 C ATOM 1387 CG ASN B 84 9.388 -7.245 -6.291 1.00 47.80 C ATOM 1388 OD1 ASN B 84 8.220 -7.841 -6.063 1.00 47.26 O ATOM 1389 ND2 ASN B 84 10.201 -7.673 -7.108 1.00 47.73 N ATOM 1390 N ARG B 85 8.425 -4.546 -8.033 1.00 47.51 N ATOM 1391 CA ARG B 85 7.208 -4.045 -8.655 1.00 47.43 C ATOM 1392 C ARG B 85 6.003 -4.446 -7.810 1.00 47.28 C ATOM 1393 O ARG B 85 5.016 -3.718 -7.727 1.00 47.15 O ATOM 1394 CB ARG B 85 7.082 -4.632 -10.060 1.00 47.44 C ATOM 1395 CG ARG B 85 6.377 -3.747 -11.062 1.00 47.57 C ATOM 1396 CD ARG B 85 6.646 -4.237 -12.477 1.00 47.60 C ATOM 1397 NE ARG B 85 6.241 -5.630 -12.645 1.00 47.66 N ATOM 1398 CZ ARG B 85 4.991 -6.042 -12.853 1.00 47.91 C ATOM 1399 NH1 ARG B 85 3.984 -5.172 -12.929 1.00 48.10 N ATOM 1400 NH2 ARG B 85 4.745 -7.341 -12.986 1.00 47.84 N ATOM 1401 N GLY B 86 6.109 -5.615 -7.182 1.00 47.23 N ATOM 1402 CA GLY B 86 5.042 -6.180 -6.371 1.00 47.15 C ATOM 1403 C GLY B 86 4.799 -5.453 -5.068 1.00 46.99 C ATOM 1404 O GLY B 86 3.659 -5.362 -4.619 1.00 46.84 O ATOM 1405 N THR B 87 5.858 -4.943 -4.449 1.00 46.96 N ATOM 1406 CA THR B 87 5.692 -4.193 -3.207 1.00 47.07 C ATOM 1407 C THR B 87 5.178 -2.787 -3.513 1.00 47.09 C ATOM 1408 O THR B 87 4.256 -2.311 -2.856 1.00 47.10 O ATOM 1409 CB THR B 87 6.980 -4.141 -2.353 1.00 46.94 C ATOM 1410 OG1 THR B 87 7.958 -3.314 -2.988 1.00 46.88 O ATOM 1411 CG2 THR B 87 7.540 -5.539 -2.139 1.00 46.71 C ATOM 1412 N LEU B 88 5.749 -2.136 -4.522 1.00 47.22 N ATOM 1413 CA LEU B 88 5.244 -0.838 -4.973 1.00 47.42 C ATOM 1414 C LEU B 88 3.737 -0.888 -5.142 1.00 47.64 C ATOM 1415 O LEU B 88 3.028 0.054 -4.797 1.00 47.68 O ATOM 1416 CB LEU B 88 5.868 -0.448 -6.306 1.00 47.36 C ATOM 1417 CG LEU B 88 5.364 0.871 -6.903 1.00 47.19 C ATOM 1418 CD1 LEU B 88 6.005 2.051 -6.201 1.00 46.96 C ATOM 1419 CD2 LEU B 88 5.645 0.917 -8.390 1.00 47.46 C ATOM 1420 N ARG B 89 3.261 -1.992 -5.703 1.00 48.05 N ATOM 1421 CA ARG B 89 1.836 -2.228 -5.869 1.00 48.13 C ATOM 1422 C ARG B 89 1.167 -2.296 -4.499 1.00 48.06 C ATOM 1423 O ARG B 89 0.156 -1.632 -4.269 1.00 47.95 O ATOM 1424 CB ARG B 89 1.626 -3.520 -6.671 1.00 48.32 C ATOM 1425 CG ARG B 89 0.184 -4.028 -6.781 1.00 48.64 C ATOM 1426 CD ARG B 89 0.092 -5.276 -7.696 1.00 48.89 C ATOM 1427 NE ARG B 89 0.444 -4.953 -9.079 1.00 49.45 N ATOM 1428 CZ ARG B 89 -0.346 -4.303 -9.935 1.00 49.56 C ATOM 1429 NH1 ARG B 89 -1.562 -3.900 -9.576 1.00 49.59 N ATOM 1430 NH2 ARG B 89 0.082 -4.053 -11.166 1.00 49.59 N ATOM 1431 N LYS B 90 1.752 -3.082 -3.594 1.00 48.10 N ATOM 1432 CA LYS B 90 1.239 -3.230 -2.222 1.00 48.10 C ATOM 1433 C LYS B 90 1.108 -1.876 -1.521 1.00 47.93 C ATOM 1434 O LYS B 90 0.040 -1.528 -1.012 1.00 47.82 O ATOM 1435 CB LYS B 90 2.150 -4.157 -1.404 1.00 48.04 C ATOM 1436 CG LYS B 90 1.743 -4.318 0.059 1.00 48.29 C ATOM 1437 CD LYS B 90 2.926 -4.702 0.963 1.00 48.50 C ATOM 1438 CE LYS B 90 2.995 -6.207 1.216 1.00 49.07 C ATOM 1439 NZ LYS B 90 3.912 -6.549 2.342 1.00 49.04 N ATOM 1440 N LYS B 91 2.204 -1.129 -1.499 1.00 47.79 N ATOM 1441 CA LYS B 91 2.228 0.191 -0.881 1.00 47.87 C ATOM 1442 C LYS B 91 1.180 1.109 -1.497 1.00 48.01 C ATOM 1443 O LYS B 91 0.459 1.800 -0.780 1.00 47.98 O ATOM 1444 CB LYS B 91 3.612 0.824 -1.032 1.00 47.76 C ATOM 1445 CG LYS B 91 4.697 0.143 -0.213 1.00 47.73 C ATOM 1446 CD LYS B 91 6.086 0.657 -0.567 1.00 47.45 C ATOM 1447 CE LYS B 91 7.047 0.538 0.618 1.00 47.20 C ATOM 1448 NZ LYS B 91 7.162 -0.830 1.195 1.00 46.40 N ATOM 1449 N LEU B 92 1.104 1.110 -2.826 1.00 48.27 N ATOM 1450 CA LEU B 92 0.161 1.964 -3.554 1.00 48.45 C ATOM 1451 C LEU B 92 -1.279 1.663 -3.173 1.00 48.65 C ATOM 1452 O LEU B 92 -2.102 2.575 -3.078 1.00 48.68 O ATOM 1453 CB LEU B 92 0.325 1.794 -5.067 1.00 48.45 C ATOM 1454 CG LEU B 92 1.407 2.638 -5.731 1.00 48.49 C ATOM 1455 CD1 LEU B 92 1.608 2.207 -7.171 1.00 48.33 C ATOM 1456 CD2 LEU B 92 1.027 4.099 -5.659 1.00 48.84 C ATOM 1457 N LYS B 93 -1.576 0.381 -2.975 1.00 48.92 N ATOM 1458 CA LYS B 93 -2.904 -0.048 -2.555 1.00 49.03 C ATOM 1459 C LYS B 93 -3.177 0.455 -1.144 1.00 49.09 C ATOM 1460 O LYS B 93 -4.244 1.002 -0.869 1.00 48.86 O ATOM 1461 CB LYS B 93 -3.016 -1.576 -2.599 1.00 49.14 C ATOM 1462 CG LYS B 93 -4.446 -2.101 -2.444 1.00 49.22 C ATOM 1463 CD LYS B 93 -4.483 -3.600 -2.165 1.00 49.16 C ATOM 1464 CE LYS B 93 -5.899 -4.072 -1.862 1.00 49.23 C ATOM 1465 NZ LYS B 93 -5.907 -5.324 -1.056 1.00 49.40 N ATOM 1466 N LYS B 94 -2.196 0.263 -0.264 1.00 49.36 N ATOM 1467 CA LYS B 94 -2.261 0.734 1.122 1.00 49.51 C ATOM 1468 C LYS B 94 -2.667 2.201 1.231 1.00 49.71 C ATOM 1469 O LYS B 94 -3.559 2.542 2.009 1.00 49.91 O ATOM 1470 CB LYS B 94 -0.915 0.513 1.819 1.00 49.45 C ATOM 1471 CG LYS B 94 -0.708 1.311 3.090 1.00 49.37 C ATOM 1472 CD LYS B 94 0.559 0.865 3.794 1.00 49.52 C ATOM 1473 CE LYS B 94 0.786 1.635 5.079 1.00 49.46 C ATOM 1474 NZ LYS B 94 2.122 1.334 5.646 1.00 49.38 N ATOM 1475 N TYR B 95 -2.026 3.063 0.450 1.00 49.87 N ATOM 1476 CA TYR B 95 -2.301 4.498 0.522 1.00 50.01 C ATOM 1477 C TYR B 95 -3.384 4.959 -0.445 1.00 50.07 C ATOM 1478 O TYR B 95 -3.435 6.135 -0.793 1.00 50.07 O ATOM 1479 CB TYR B 95 -1.021 5.289 0.278 1.00 50.14 C ATOM 1480 CG TYR B 95 0.057 5.004 1.294 1.00 50.21 C ATOM 1481 CD1 TYR B 95 -0.084 5.413 2.615 1.00 50.04 C ATOM 1482 CD2 TYR B 95 1.218 4.332 0.935 1.00 50.40 C ATOM 1483 CE1 TYR B 95 0.905 5.159 3.551 1.00 50.26 C ATOM 1484 CE2 TYR B 95 2.211 4.074 1.861 1.00 50.40 C ATOM 1485 CZ TYR B 95 2.052 4.489 3.169 1.00 50.25 C ATOM 1486 OH TYR B 95 3.034 4.232 4.096 1.00 50.14 O ATOM 1487 N GLY B 96 -4.244 4.036 -0.871 1.00 50.26 N ATOM 1488 CA GLY B 96 -5.374 4.354 -1.747 1.00 50.47 C ATOM 1489 C GLY B 96 -5.001 5.046 -3.044 1.00 50.61 C ATOM 1490 O GLY B 96 -5.778 5.849 -3.566 1.00 50.57 O ATOM 1491 N MET B 97 -3.812 4.737 -3.561 1.00 50.88 N ATOM 1492 CA MET B 97 -3.311 5.346 -4.792 1.00 51.11 C ATOM 1493 C MET B 97 -3.599 4.428 -5.973 1.00 51.28 C ATOM 1494 O MET B 97 -2.736 3.666 -6.413 1.00 51.24 O ATOM 1495 CB MET B 97 -1.814 5.647 -4.684 1.00 51.09 C ATOM 1496 CG MET B 97 -1.512 6.887 -3.871 1.00 51.08 C ATOM 1497 SD MET B 97 0.227 7.022 -3.409 1.00 51.30 S ATOM 1498 CE MET B 97 0.360 8.796 -3.235 1.00 51.44 C ATOM 1499 N ASN B 98 -4.834 4.514 -6.463 1.00 51.52 N ATOM 1500 CA ASN B 98 -5.309 3.706 -7.583 1.00 51.65 C ATOM 1501 C ASN B 98 -6.338 4.486 -8.414 1.00 51.77 C ATOM 1502 O ASN B 98 -7.542 4.215 -8.368 1.00 51.83 O ATOM 1503 CB ASN B 98 -5.915 2.381 -7.077 1.00 51.78 C ATOM 1504 CG ASN B 98 -4.870 1.433 -6.476 1.00 51.90 C ATOM 1505 OD1 ASN B 98 -5.104 0.807 -5.440 1.00 52.02 O ATOM 1506 ND2 ASN B 98 -3.718 1.323 -7.131 1.00 51.75 N TER 1507 ASN B 98 ATOM 1508 O5' DA C 1 0.850 -6.022 -38.555 1.00 47.46 O ATOM 1509 C5' DA C 1 1.385 -7.298 -38.218 1.00 48.02 C ATOM 1510 C4' DA C 1 2.141 -7.274 -36.901 1.00 48.28 C ATOM 1511 O4' DA C 1 1.790 -6.072 -36.164 1.00 48.53 O ATOM 1512 C3' DA C 1 1.821 -8.453 -35.972 1.00 48.50 C ATOM 1513 O3' DA C 1 2.921 -8.889 -35.131 1.00 48.46 O ATOM 1514 C2' DA C 1 0.706 -7.832 -35.133 1.00 48.59 C ATOM 1515 C1' DA C 1 1.350 -6.469 -34.879 1.00 48.59 C ATOM 1516 N9 DA C 1 0.527 -5.422 -34.276 1.00 48.34 N ATOM 1517 C8 DA C 1 -0.829 -5.386 -34.108 1.00 48.30 C ATOM 1518 N7 DA C 1 -1.257 -4.296 -33.516 1.00 48.10 N ATOM 1519 C5 DA C 1 -0.102 -3.576 -33.279 1.00 48.02 C ATOM 1520 C6 DA C 1 0.129 -2.327 -32.677 1.00 48.22 C ATOM 1521 N6 DA C 1 -0.854 -1.570 -32.191 1.00 48.20 N ATOM 1522 N1 DA C 1 1.407 -1.888 -32.594 1.00 48.55 N ATOM 1523 C2 DA C 1 2.390 -2.661 -33.085 1.00 48.53 C ATOM 1524 N3 DA C 1 2.290 -3.857 -33.670 1.00 48.25 N ATOM 1525 C4 DA C 1 1.007 -4.255 -33.738 1.00 48.09 C ATOM 1526 P DA C 2 4.434 -9.154 -35.614 1.00 48.29 P ATOM 1527 OP1 DA C 2 4.461 -9.345 -37.083 1.00 48.46 O ATOM 1528 OP2 DA C 2 4.999 -10.198 -34.732 1.00 48.36 O ATOM 1529 O5' DA C 2 5.169 -7.789 -35.238 1.00 47.30 O ATOM 1530 C5' DA C 2 4.935 -7.254 -33.960 1.00 46.61 C ATOM 1531 C4' DA C 2 6.081 -6.382 -33.499 1.00 46.42 C ATOM 1532 O4' DA C 2 5.531 -5.240 -32.809 1.00 46.32 O ATOM 1533 C3' DA C 2 6.997 -6.995 -32.455 1.00 46.21 C ATOM 1534 O3' DA C 2 8.202 -6.234 -32.370 1.00 46.03 O ATOM 1535 C2' DA C 2 6.112 -6.905 -31.214 1.00 46.10 C ATOM 1536 C1' DA C 2 5.353 -5.597 -31.450 1.00 45.77 C ATOM 1537 N9 DA C 2 3.915 -5.640 -31.175 1.00 45.56 N ATOM 1538 C8 DA C 2 3.015 -6.642 -31.433 1.00 45.14 C ATOM 1539 N7 DA C 2 1.792 -6.355 -31.056 1.00 45.09 N ATOM 1540 C5 DA C 2 1.898 -5.085 -30.517 1.00 45.25 C ATOM 1541 C6 DA C 2 0.958 -4.211 -29.942 1.00 45.19 C ATOM 1542 N6 DA C 2 -0.332 -4.513 -29.811 1.00 45.21 N ATOM 1543 N1 DA C 2 1.397 -3.011 -29.508 1.00 45.18 N ATOM 1544 C2 DA C 2 2.694 -2.704 -29.629 1.00 45.09 C ATOM 1545 N3 DA C 2 3.670 -3.441 -30.156 1.00 44.95 N ATOM 1546 C4 DA C 2 3.201 -4.629 -30.581 1.00 45.38 C ATOM 1547 P DA C 3 9.276 -6.485 -31.210 1.00 45.98 P ATOM 1548 OP1 DA C 3 10.580 -5.937 -31.645 1.00 45.50 O ATOM 1549 OP2 DA C 3 9.160 -7.885 -30.743 1.00 45.90 O ATOM 1550 O5' DA C 3 8.698 -5.554 -30.057 1.00 45.67 O ATOM 1551 C5' DA C 3 8.515 -4.178 -30.317 1.00 45.07 C ATOM 1552 C4' DA C 3 8.137 -3.474 -29.033 1.00 44.67 C ATOM 1553 O4' DA C 3 6.718 -3.629 -28.789 1.00 43.63 O ATOM 1554 C3' DA C 3 8.848 -3.999 -27.790 1.00 44.64 C ATOM 1555 O3' DA C 3 9.226 -2.872 -27.016 1.00 46.11 O ATOM 1556 C2' DA C 3 7.794 -4.889 -27.142 1.00 43.82 C ATOM 1557 C1' DA C 3 6.527 -4.122 -27.487 1.00 42.82 C ATOM 1558 N9 DA C 3 5.298 -4.901 -27.502 1.00 42.27 N ATOM 1559 C8 DA C 3 5.098 -6.171 -27.961 1.00 42.19 C ATOM 1560 N7 DA C 3 3.862 -6.588 -27.834 1.00 41.97 N ATOM 1561 C5 DA C 3 3.217 -5.517 -27.257 1.00 41.83 C ATOM 1562 C6 DA C 3 1.889 -5.309 -26.859 1.00 42.25 C ATOM 1563 N6 DA C 3 0.933 -6.228 -26.996 1.00 42.22 N ATOM 1564 N1 DA C 3 1.581 -4.113 -26.313 1.00 42.30 N ATOM 1565 C2 DA C 3 2.530 -3.185 -26.168 1.00 42.18 C ATOM 1566 N3 DA C 3 3.810 -3.274 -26.510 1.00 42.16 N ATOM 1567 C4 DA C 3 4.086 -4.471 -27.048 1.00 41.89 C ATOM 1568 P DT C 4 10.058 -2.970 -25.650 1.00 46.88 P ATOM 1569 OP1 DT C 4 11.039 -1.857 -25.665 1.00 46.04 O ATOM 1570 OP2 DT C 4 10.503 -4.370 -25.420 1.00 46.19 O ATOM 1571 O5' DT C 4 8.896 -2.626 -24.602 1.00 46.34 O ATOM 1572 C5' DT C 4 8.203 -1.387 -24.724 1.00 45.80 C ATOM 1573 C4' DT C 4 7.002 -1.375 -23.807 1.00 45.36 C ATOM 1574 O4' DT C 4 6.069 -2.394 -24.233 1.00 44.91 O ATOM 1575 C3' DT C 4 7.326 -1.675 -22.347 1.00 45.14 C ATOM 1576 O3' DT C 4 7.025 -0.521 -21.567 1.00 45.28 O ATOM 1577 C2' DT C 4 6.470 -2.897 -22.005 1.00 44.69 C ATOM 1578 C1' DT C 4 5.409 -2.901 -23.094 1.00 44.01 C ATOM 1579 N1 DT C 4 4.858 -4.240 -23.453 1.00 43.48 N ATOM 1580 C2 DT C 4 3.511 -4.519 -23.299 1.00 42.89 C ATOM 1581 O2 DT C 4 2.686 -3.740 -22.870 1.00 42.60 O ATOM 1582 N3 DT C 4 3.133 -5.775 -23.690 1.00 43.00 N ATOM 1583 C4 DT C 4 3.957 -6.764 -24.188 1.00 43.16 C ATOM 1584 O4 DT C 4 3.516 -7.860 -24.500 1.00 43.31 O ATOM 1585 C5 DT C 4 5.348 -6.420 -24.336 1.00 43.07 C ATOM 1586 C7 DT C 4 6.308 -7.393 -24.956 1.00 42.85 C ATOM 1587 C6 DT C 4 5.728 -5.189 -23.965 1.00 43.46 C ATOM 1588 P DT C 5 7.341 -0.432 -20.001 1.00 45.23 P ATOM 1589 OP1 DT C 5 7.577 0.998 -19.704 1.00 44.89 O ATOM 1590 OP2 DT C 5 8.313 -1.474 -19.588 1.00 45.22 O ATOM 1591 O5' DT C 5 5.936 -0.854 -19.404 1.00 44.99 O ATOM 1592 C5' DT C 5 4.811 -0.141 -19.860 1.00 45.40 C ATOM 1593 C4' DT C 5 3.564 -0.782 -19.306 1.00 45.39 C ATOM 1594 O4' DT C 5 3.393 -2.082 -19.917 1.00 45.39 O ATOM 1595 C3' DT C 5 3.617 -1.019 -17.802 1.00 45.21 C ATOM 1596 O3' DT C 5 2.394 -0.620 -17.237 1.00 44.73 O ATOM 1597 C2' DT C 5 3.845 -2.521 -17.685 1.00 45.18 C ATOM 1598 C1' DT C 5 3.064 -3.004 -18.902 1.00 44.81 C ATOM 1599 N1 DT C 5 3.382 -4.376 -19.400 1.00 44.19 N ATOM 1600 C2 DT C 5 2.355 -5.284 -19.585 1.00 43.76 C ATOM 1601 O2 DT C 5 1.177 -5.052 -19.354 1.00 43.60 O ATOM 1602 N3 DT C 5 2.761 -6.512 -20.037 1.00 43.82 N ATOM 1603 C4 DT C 5 4.055 -6.891 -20.351 1.00 44.09 C ATOM 1604 O4 DT C 5 4.304 -8.022 -20.762 1.00 44.20 O ATOM 1605 C5 DT C 5 5.080 -5.893 -20.145 1.00 43.70 C ATOM 1606 C7 DT C 5 6.476 -6.117 -20.648 1.00 43.05 C ATOM 1607 C6 DT C 5 4.697 -4.698 -19.683 1.00 43.80 C ATOM 1608 P DT C 6 2.291 -0.304 -15.687 1.00 44.65 P ATOM 1609 OP1 DT C 6 1.815 1.093 -15.560 1.00 44.29 O ATOM 1610 OP2 DT C 6 3.528 -0.777 -15.018 1.00 44.70 O ATOM 1611 O5' DT C 6 1.121 -1.289 -15.252 1.00 44.45 O ATOM 1612 C5' DT C 6 -0.143 -1.156 -15.864 1.00 44.46 C ATOM 1613 C4' DT C 6 -0.844 -2.495 -15.860 1.00 44.40 C ATOM 1614 O4' DT C 6 0.002 -3.520 -16.432 1.00 43.81 O ATOM 1615 C3' DT C 6 -1.182 -2.976 -14.459 1.00 44.59 C ATOM 1616 O3' DT C 6 -2.589 -3.105 -14.353 1.00 45.54 O ATOM 1617 C2' DT C 6 -0.433 -4.301 -14.320 1.00 44.27 C ATOM 1618 C1' DT C 6 -0.270 -4.728 -15.761 1.00 43.38 C ATOM 1619 N1 DT C 6 0.841 -5.676 -16.052 1.00 42.90 N ATOM 1620 C2 DT C 6 0.545 -6.983 -16.366 1.00 43.07 C ATOM 1621 O2 DT C 6 -0.589 -7.425 -16.391 1.00 43.38 O ATOM 1622 N3 DT C 6 1.627 -7.780 -16.638 1.00 42.99 N ATOM 1623 C4 DT C 6 2.952 -7.397 -16.650 1.00 43.13 C ATOM 1624 O4 DT C 6 3.852 -8.195 -16.913 1.00 42.95 O ATOM 1625 C5 DT C 6 3.195 -6.011 -16.320 1.00 43.15 C ATOM 1626 C7 DT C 6 4.588 -5.454 -16.403 1.00 43.32 C ATOM 1627 C6 DT C 6 2.145 -5.224 -16.037 1.00 42.82 C ATOM 1628 P DG C 7 -3.323 -2.897 -12.950 1.00 46.72 P ATOM 1629 OP1 DG C 7 -4.713 -2.456 -13.208 1.00 47.10 O ATOM 1630 OP2 DG C 7 -2.440 -2.092 -12.077 1.00 46.45 O ATOM 1631 O5' DG C 7 -3.385 -4.393 -12.398 1.00 47.69 O ATOM 1632 C5' DG C 7 -4.219 -5.340 -13.051 1.00 48.60 C ATOM 1633 C4' DG C 7 -3.690 -6.746 -12.852 1.00 49.48 C ATOM 1634 O4' DG C 7 -2.356 -6.890 -13.407 1.00 49.86 O ATOM 1635 C3' DG C 7 -3.544 -7.170 -11.394 1.00 50.13 C ATOM 1636 O3' DG C 7 -4.359 -8.293 -11.114 1.00 50.81 O ATOM 1637 C2' DG C 7 -2.069 -7.528 -11.250 1.00 50.11 C ATOM 1638 C1' DG C 7 -1.782 -7.946 -12.674 1.00 50.29 C ATOM 1639 N9 DG C 7 -0.373 -8.134 -12.979 1.00 50.39 N ATOM 1640 C8 DG C 7 0.664 -7.265 -12.770 1.00 50.51 C ATOM 1641 N7 DG C 7 1.813 -7.747 -13.150 1.00 50.49 N ATOM 1642 C5 DG C 7 1.522 -9.012 -13.638 1.00 50.48 C ATOM 1643 C6 DG C 7 2.361 -10.013 -14.194 1.00 50.54 C ATOM 1644 O6 DG C 7 3.587 -9.990 -14.365 1.00 50.65 O ATOM 1645 N1 DG C 7 1.658 -11.159 -14.554 1.00 50.52 N ATOM 1646 C2 DG C 7 0.296 -11.293 -14.416 1.00 50.57 C ATOM 1647 N2 DG C 7 -0.227 -12.460 -14.819 1.00 50.69 N ATOM 1648 N3 DG C 7 -0.502 -10.370 -13.900 1.00 50.46 N ATOM 1649 C4 DG C 7 0.177 -9.260 -13.536 1.00 50.35 C ATOM 1650 P DG C 8 -4.865 -8.483 -9.612 1.00 51.69 P ATOM 1651 OP1 DG C 8 -6.166 -7.776 -9.525 1.00 51.41 O ATOM 1652 OP2 DG C 8 -3.749 -8.093 -8.713 1.00 51.59 O ATOM 1653 O5' DG C 8 -5.080 -10.063 -9.416 1.00 51.55 O ATOM 1654 C5' DG C 8 -4.908 -11.030 -10.454 1.00 51.23 C ATOM 1655 C4' DG C 8 -3.616 -11.827 -10.319 1.00 50.97 C ATOM 1656 O4' DG C 8 -2.507 -11.157 -10.973 1.00 50.89 O ATOM 1657 C3' DG C 8 -2.998 -12.041 -8.941 1.00 50.73 C ATOM 1658 O3' DG C 8 -3.800 -12.865 -8.080 1.00 50.96 O ATOM 1659 C2' DG C 8 -1.673 -12.668 -9.380 1.00 50.48 C ATOM 1660 C1' DG C 8 -1.405 -12.013 -10.731 1.00 50.12 C ATOM 1661 N9 DG C 8 -0.118 -11.327 -10.729 1.00 49.83 N ATOM 1662 C8 DG C 8 0.195 -10.061 -10.295 1.00 49.67 C ATOM 1663 N7 DG C 8 1.464 -9.782 -10.429 1.00 49.59 N ATOM 1664 C5 DG C 8 2.018 -10.937 -10.963 1.00 49.60 C ATOM 1665 C6 DG C 8 3.351 -11.243 -11.327 1.00 49.82 C ATOM 1666 O6 DG C 8 4.345 -10.515 -11.233 1.00 49.91 O ATOM 1667 N1 DG C 8 3.495 -12.539 -11.828 1.00 49.72 N ATOM 1668 C2 DG C 8 2.447 -13.418 -11.981 1.00 49.61 C ATOM 1669 N2 DG C 8 2.747 -14.619 -12.482 1.00 49.68 N ATOM 1670 N3 DG C 8 1.193 -13.153 -11.645 1.00 49.52 N ATOM 1671 C4 DG C 8 1.055 -11.897 -11.148 1.00 49.64 C ATOM 1672 P DT C 9 -3.190 -13.956 -7.066 1.00 51.34 P ATOM 1673 OP1 DT C 9 -4.262 -14.407 -6.150 1.00 51.41 O ATOM 1674 OP2 DT C 9 -1.914 -13.467 -6.489 1.00 51.13 O ATOM 1675 O5' DT C 9 -2.902 -15.124 -8.117 1.00 51.36 O ATOM 1676 C5' DT C 9 -2.820 -16.477 -7.747 1.00 51.32 C ATOM 1677 C4' DT C 9 -1.559 -17.080 -8.338 1.00 51.41 C ATOM 1678 O4' DT C 9 -0.672 -16.043 -8.837 1.00 51.33 O ATOM 1679 C3' DT C 9 -0.740 -17.882 -7.337 1.00 51.69 C ATOM 1680 O3' DT C 9 -0.669 -19.229 -7.749 1.00 52.20 O ATOM 1681 C2' DT C 9 0.628 -17.212 -7.319 1.00 51.56 C ATOM 1682 C1' DT C 9 0.652 -16.486 -8.646 1.00 51.57 C ATOM 1683 N1 DT C 9 1.633 -15.371 -8.587 1.00 51.70 N ATOM 1684 C2 DT C 9 2.933 -15.620 -8.981 1.00 51.73 C ATOM 1685 O2 DT C 9 3.322 -16.698 -9.395 1.00 51.91 O ATOM 1686 N3 DT C 9 3.781 -14.549 -8.876 1.00 51.68 N ATOM 1687 C4 DT C 9 3.459 -13.280 -8.424 1.00 51.79 C ATOM 1688 O4 DT C 9 4.296 -12.383 -8.374 1.00 51.99 O ATOM 1689 C5 DT C 9 2.086 -13.087 -8.012 1.00 51.73 C ATOM 1690 C7 DT C 9 1.634 -11.774 -7.440 1.00 51.20 C ATOM 1691 C6 DT C 9 1.249 -14.132 -8.105 1.00 51.72 C ATOM 1692 P DC C 10 -0.088 -20.304 -6.726 1.00 52.52 P ATOM 1693 OP1 DC C 10 -0.499 -21.641 -7.208 1.00 52.39 O ATOM 1694 OP2 DC C 10 -0.413 -19.860 -5.348 1.00 52.34 O ATOM 1695 O5' DC C 10 1.491 -20.130 -6.911 1.00 52.77 O ATOM 1696 C5' DC C 10 2.151 -20.481 -8.129 1.00 52.70 C ATOM 1697 C4' DC C 10 3.651 -20.534 -7.902 1.00 52.50 C ATOM 1698 O4' DC C 10 4.186 -19.184 -7.930 1.00 52.42 O ATOM 1699 C3' DC C 10 4.061 -21.125 -6.554 1.00 52.25 C ATOM 1700 O3' DC C 10 5.181 -21.974 -6.697 1.00 52.06 O ATOM 1701 C2' DC C 10 4.388 -19.899 -5.713 1.00 52.17 C ATOM 1702 C1' DC C 10 4.970 -18.973 -6.774 1.00 52.27 C ATOM 1703 N1 DC C 10 4.970 -17.508 -6.437 1.00 52.32 N ATOM 1704 C2 DC C 10 5.983 -16.687 -6.959 1.00 52.23 C ATOM 1705 O2 DC C 10 6.858 -17.170 -7.685 1.00 52.29 O ATOM 1706 N3 DC C 10 5.986 -15.366 -6.656 1.00 52.21 N ATOM 1707 C4 DC C 10 5.037 -14.860 -5.872 1.00 52.26 C ATOM 1708 N4 DC C 10 5.094 -13.555 -5.608 1.00 52.36 N ATOM 1709 C5 DC C 10 3.995 -15.668 -5.328 1.00 52.28 C ATOM 1710 C6 DC C 10 3.991 -16.973 -5.636 1.00 52.38 C ATOM 1711 P DA C 11 5.566 -23.020 -5.546 1.00 51.93 P ATOM 1712 OP1 DA C 11 5.452 -24.378 -6.128 1.00 51.52 O ATOM 1713 OP2 DA C 11 4.847 -22.664 -4.299 1.00 51.83 O ATOM 1714 O5' DA C 11 7.109 -22.696 -5.299 1.00 51.18 O ATOM 1715 C5' DA C 11 8.030 -22.736 -6.382 1.00 50.25 C ATOM 1716 C4' DA C 11 9.325 -22.063 -5.981 1.00 49.45 C ATOM 1717 O4' DA C 11 9.097 -20.640 -5.820 1.00 49.02 O ATOM 1718 C3' DA C 11 9.896 -22.563 -4.661 1.00 48.97 C ATOM 1719 O3' DA C 11 11.283 -22.775 -4.831 1.00 48.81 O ATOM 1720 C2' DA C 11 9.539 -21.466 -3.660 1.00 48.77 C ATOM 1721 C1' DA C 11 9.485 -20.217 -4.530 1.00 48.53 C ATOM 1722 N9 DA C 11 8.538 -19.202 -4.074 1.00 48.32 N ATOM 1723 C8 DA C 11 7.272 -19.388 -3.589 1.00 48.22 C ATOM 1724 N7 DA C 11 6.660 -18.278 -3.259 1.00 48.04 N ATOM 1725 C5 DA C 11 7.587 -17.297 -3.549 1.00 48.00 C ATOM 1726 C6 DA C 11 7.558 -15.896 -3.426 1.00 48.22 C ATOM 1727 N6 DA C 11 6.504 -15.225 -2.956 1.00 48.25 N ATOM 1728 N1 DA C 11 8.661 -15.214 -3.804 1.00 48.30 N ATOM 1729 C2 DA C 11 9.720 -15.882 -4.280 1.00 48.20 C ATOM 1730 N3 DA C 11 9.859 -17.197 -4.440 1.00 48.15 N ATOM 1731 C4 DA C 11 8.749 -17.849 -4.054 1.00 48.07 C ATOM 1732 P DT C 12 12.192 -23.334 -3.643 1.00 48.79 P ATOM 1733 OP1 DT C 12 13.101 -24.364 -4.196 1.00 48.62 O ATOM 1734 OP2 DT C 12 11.335 -23.650 -2.475 1.00 48.67 O ATOM 1735 O5' DT C 12 13.032 -22.022 -3.296 1.00 48.77 O ATOM 1736 C5' DT C 12 13.637 -21.266 -4.341 1.00 48.37 C ATOM 1737 C4' DT C 12 14.247 -20.005 -3.774 1.00 48.12 C ATOM 1738 O4' DT C 12 13.196 -19.045 -3.505 1.00 47.85 O ATOM 1739 C3' DT C 12 14.993 -20.207 -2.461 1.00 47.90 C ATOM 1740 O3' DT C 12 16.281 -19.648 -2.596 1.00 47.98 O ATOM 1741 C2' DT C 12 14.125 -19.496 -1.424 1.00 47.89 C ATOM 1742 C1' DT C 12 13.461 -18.418 -2.272 1.00 47.91 C ATOM 1743 N1 DT C 12 12.163 -17.866 -1.765 1.00 47.89 N ATOM 1744 C2 DT C 12 11.978 -16.491 -1.678 1.00 48.00 C ATOM 1745 O2 DT C 12 12.817 -15.648 -1.961 1.00 47.94 O ATOM 1746 N3 DT C 12 10.757 -16.095 -1.198 1.00 47.93 N ATOM 1747 C4 DT C 12 9.706 -16.925 -0.848 1.00 48.10 C ATOM 1748 O4 DT C 12 8.644 -16.458 -0.441 1.00 48.09 O ATOM 1749 C5 DT C 12 9.952 -18.346 -0.965 1.00 47.91 C ATOM 1750 C7 DT C 12 8.917 -19.333 -0.508 1.00 47.73 C ATOM 1751 C6 DT C 12 11.150 -18.745 -1.420 1.00 47.78 C ATOM 1752 P DT C 13 17.435 -19.961 -1.540 1.00 48.38 P ATOM 1753 OP1 DT C 13 18.681 -20.223 -2.292 1.00 48.52 O ATOM 1754 OP2 DT C 13 16.944 -20.961 -0.565 1.00 48.28 O ATOM 1755 O5' DT C 13 17.567 -18.546 -0.804 1.00 48.41 O ATOM 1756 C5' DT C 13 17.887 -17.382 -1.563 1.00 48.15 C ATOM 1757 C4' DT C 13 17.171 -16.150 -1.040 1.00 47.96 C ATOM 1758 O4' DT C 13 15.797 -16.439 -0.669 1.00 47.53 O ATOM 1759 C3' DT C 13 17.797 -15.534 0.211 1.00 47.82 C ATOM 1760 O3' DT C 13 18.444 -14.309 -0.118 1.00 48.35 O ATOM 1761 C2' DT C 13 16.619 -15.297 1.150 1.00 47.33 C ATOM 1762 C1' DT C 13 15.429 -15.400 0.215 1.00 46.62 C ATOM 1763 N1 DT C 13 14.144 -15.675 0.929 1.00 45.96 N ATOM 1764 C2 DT C 13 13.354 -14.603 1.303 1.00 45.26 C ATOM 1765 O2 DT C 13 13.641 -13.439 1.089 1.00 44.80 O ATOM 1766 N3 DT C 13 12.202 -14.940 1.965 1.00 45.10 N ATOM 1767 C4 DT C 13 11.764 -16.221 2.256 1.00 45.51 C ATOM 1768 O4 DT C 13 10.708 -16.418 2.849 1.00 45.42 O ATOM 1769 C5 DT C 13 12.632 -17.301 1.838 1.00 45.35 C ATOM 1770 C7 DT C 13 12.145 -18.719 1.883 1.00 45.07 C ATOM 1771 C6 DT C 13 13.774 -16.983 1.207 1.00 45.65 C ATOM 1772 P DT C 14 19.500 -13.649 0.887 1.00 48.94 P ATOM 1773 OP1 DT C 14 20.840 -13.892 0.306 1.00 48.89 O ATOM 1774 OP2 DT C 14 19.191 -14.093 2.268 1.00 49.24 O ATOM 1775 O5' DT C 14 19.201 -12.079 0.813 1.00 48.48 O ATOM 1776 C5' DT C 14 17.930 -11.548 0.463 1.00 47.70 C ATOM 1777 C4' DT C 14 17.208 -10.957 1.660 1.00 47.07 C ATOM 1778 O4' DT C 14 16.255 -11.929 2.138 1.00 46.32 O ATOM 1779 C3' DT C 14 18.033 -10.550 2.888 1.00 47.01 C ATOM 1780 O3' DT C 14 17.766 -9.143 3.108 1.00 48.39 O ATOM 1781 C2' DT C 14 17.535 -11.517 3.968 1.00 46.47 C ATOM 1782 C1' DT C 14 16.095 -11.701 3.514 1.00 45.87 C ATOM 1783 N1 DT C 14 15.283 -12.848 4.020 1.00 45.42 N ATOM 1784 C2 DT C 14 13.976 -12.628 4.431 1.00 45.03 C ATOM 1785 O2 DT C 14 13.421 -11.544 4.438 1.00 44.84 O ATOM 1786 N3 DT C 14 13.304 -13.744 4.847 1.00 44.97 N ATOM 1787 C4 DT C 14 13.806 -15.031 4.899 1.00 45.34 C ATOM 1788 O4 DT C 14 13.123 -15.968 5.295 1.00 45.53 O ATOM 1789 C5 DT C 14 15.168 -15.203 4.452 1.00 45.17 C ATOM 1790 C7 DT C 14 15.829 -16.548 4.545 1.00 45.15 C ATOM 1791 C6 DT C 14 15.833 -14.117 4.036 1.00 45.18 C ATOM 1792 P DC C 15 17.942 -8.313 4.477 1.00 49.01 P ATOM 1793 OP1 DC C 15 18.065 -6.876 4.128 1.00 48.50 O ATOM 1794 OP2 DC C 15 18.989 -8.973 5.297 1.00 49.05 O ATOM 1795 O5' DC C 15 16.527 -8.531 5.187 1.00 48.05 O ATOM 1796 C5' DC C 15 15.370 -7.883 4.689 1.00 47.52 C ATOM 1797 C4' DC C 15 14.470 -7.482 5.840 1.00 47.40 C ATOM 1798 O4' DC C 15 13.768 -8.655 6.328 1.00 47.13 O ATOM 1799 C3' DC C 15 15.166 -6.870 7.055 1.00 46.98 C ATOM 1800 O3' DC C 15 14.350 -5.765 7.471 1.00 46.82 O ATOM 1801 C2' DC C 15 15.291 -8.059 8.020 1.00 46.56 C ATOM 1802 C1' DC C 15 14.076 -8.923 7.681 1.00 45.99 C ATOM 1803 N1 DC C 15 14.203 -10.428 7.796 1.00 45.53 N ATOM 1804 C2 DC C 15 13.051 -11.188 8.084 1.00 45.50 C ATOM 1805 O2 DC C 15 11.967 -10.622 8.256 1.00 45.74 O ATOM 1806 N3 DC C 15 13.134 -12.536 8.179 1.00 45.26 N ATOM 1807 C4 DC C 15 14.305 -13.137 7.996 1.00 45.40 C ATOM 1808 N4 DC C 15 14.337 -14.468 8.103 1.00 45.39 N ATOM 1809 C5 DC C 15 15.490 -12.395 7.697 1.00 45.44 C ATOM 1810 C6 DC C 15 15.400 -11.059 7.595 1.00 45.20 C ATOM 1811 P DT C 16 14.313 -5.164 8.948 1.00 46.52 P ATOM 1812 OP1 DT C 16 13.673 -3.828 8.890 1.00 46.73 O ATOM 1813 OP2 DT C 16 15.673 -5.320 9.515 1.00 46.57 O ATOM 1814 O5' DT C 16 13.283 -6.141 9.680 1.00 44.75 O ATOM 1815 C5' DT C 16 11.949 -6.206 9.194 1.00 43.28 C ATOM 1816 C4' DT C 16 11.014 -6.796 10.230 1.00 42.52 C ATOM 1817 O4' DT C 16 11.217 -8.231 10.286 1.00 41.82 O ATOM 1818 C3' DT C 16 11.196 -6.275 11.656 1.00 42.02 C ATOM 1819 O3' DT C 16 9.915 -5.978 12.212 1.00 42.02 O ATOM 1820 C2' DT C 16 11.912 -7.411 12.378 1.00 41.37 C ATOM 1821 C1' DT C 16 11.427 -8.645 11.621 1.00 40.76 C ATOM 1822 N1 DT C 16 12.388 -9.799 11.605 1.00 39.95 N ATOM 1823 C2 DT C 16 11.931 -11.090 11.796 1.00 39.28 C ATOM 1824 O2 DT C 16 10.766 -11.391 11.976 1.00 39.16 O ATOM 1825 N3 DT C 16 12.896 -12.057 11.738 1.00 39.23 N ATOM 1826 C4 DT C 16 14.251 -11.849 11.554 1.00 39.75 C ATOM 1827 O4 DT C 16 15.042 -12.785 11.531 1.00 39.77 O ATOM 1828 C5 DT C 16 14.670 -10.481 11.364 1.00 39.50 C ATOM 1829 C7 DT C 16 16.127 -10.126 11.274 1.00 39.03 C ATOM 1830 C6 DT C 16 13.729 -9.533 11.389 1.00 39.68 C ATOM 1831 P DT C 17 9.740 -5.333 13.660 1.00 41.31 P ATOM 1832 OP1 DT C 17 8.506 -4.522 13.644 1.00 41.28 O ATOM 1833 OP2 DT C 17 11.035 -4.744 14.081 1.00 40.56 O ATOM 1834 O5' DT C 17 9.456 -6.639 14.534 1.00 42.04 O ATOM 1835 C5' DT C 17 8.321 -7.464 14.283 1.00 42.39 C ATOM 1836 C4' DT C 17 8.475 -8.811 14.968 1.00 42.87 C ATOM 1837 O4' DT C 17 9.612 -9.528 14.439 1.00 42.72 O ATOM 1838 C3' DT C 17 8.788 -8.751 16.453 1.00 43.37 C ATOM 1839 O3' DT C 17 7.595 -8.655 17.198 1.00 45.19 O ATOM 1840 C2' DT C 17 9.535 -10.050 16.738 1.00 42.69 C ATOM 1841 C1' DT C 17 9.931 -10.555 15.358 1.00 41.83 C ATOM 1842 N1 DT C 17 11.381 -10.887 15.240 1.00 41.02 N ATOM 1843 C2 DT C 17 11.773 -12.207 15.299 1.00 40.67 C ATOM 1844 O2 DT C 17 10.997 -13.134 15.434 1.00 40.50 O ATOM 1845 N3 DT C 17 13.119 -12.420 15.161 1.00 40.48 N ATOM 1846 C4 DT C 17 14.085 -11.445 15.021 1.00 40.67 C ATOM 1847 O4 DT C 17 15.270 -11.721 14.919 1.00 40.70 O ATOM 1848 C5 DT C 17 13.619 -10.087 14.963 1.00 40.67 C ATOM 1849 C7 DT C 17 14.581 -8.995 14.596 1.00 40.87 C ATOM 1850 C6 DT C 17 12.302 -9.869 15.085 1.00 40.71 C ATOM 1851 P DA C 18 7.664 -8.249 18.741 1.00 47.07 P ATOM 1852 OP1 DA C 18 6.348 -7.682 19.118 1.00 47.19 O ATOM 1853 OP2 DA C 18 8.913 -7.481 18.970 1.00 46.59 O ATOM 1854 O5' DA C 18 7.785 -9.673 19.446 1.00 47.19 O ATOM 1855 C5' DA C 18 6.683 -10.557 19.350 1.00 47.64 C ATOM 1856 C4' DA C 18 7.035 -11.900 19.947 1.00 47.93 C ATOM 1857 O4' DA C 18 8.289 -12.360 19.382 1.00 47.70 O ATOM 1858 C3' DA C 18 7.244 -11.892 21.454 1.00 48.18 C ATOM 1859 O3' DA C 18 6.856 -13.159 21.958 1.00 49.33 O ATOM 1860 C2' DA C 18 8.740 -11.626 21.559 1.00 47.73 C ATOM 1861 C1' DA C 18 9.245 -12.487 20.410 1.00 47.11 C ATOM 1862 N9 DA C 18 10.552 -12.107 19.891 1.00 46.77 N ATOM 1863 C8 DA C 18 11.052 -10.849 19.712 1.00 46.61 C ATOM 1864 N7 DA C 18 12.270 -10.836 19.227 1.00 46.57 N ATOM 1865 C5 DA C 18 12.587 -12.174 19.080 1.00 46.51 C ATOM 1866 C6 DA C 18 13.738 -12.836 18.611 1.00 46.70 C ATOM 1867 N6 DA C 18 14.828 -12.190 18.188 1.00 46.70 N ATOM 1868 N1 DA C 18 13.727 -14.188 18.601 1.00 46.76 N ATOM 1869 C2 DA C 18 12.633 -14.832 19.030 1.00 46.66 C ATOM 1870 N3 DA C 18 11.491 -14.316 19.486 1.00 46.58 N ATOM 1871 C4 DA C 18 11.536 -12.972 19.486 1.00 46.57 C ATOM 1872 P DA C 19 6.786 -13.495 23.526 1.00 50.36 P ATOM 1873 OP1 DA C 19 5.377 -13.308 23.932 1.00 50.34 O ATOM 1874 OP2 DA C 19 7.853 -12.760 24.249 1.00 49.97 O ATOM 1875 O5' DA C 19 7.109 -15.070 23.561 1.00 50.61 O ATOM 1876 C5' DA C 19 7.910 -15.738 22.564 1.00 50.93 C ATOM 1877 C4' DA C 19 9.187 -16.325 23.150 1.00 51.01 C ATOM 1878 O4' DA C 19 10.352 -15.697 22.542 1.00 51.20 O ATOM 1879 C3' DA C 19 9.371 -16.143 24.655 1.00 51.20 C ATOM 1880 O3' DA C 19 9.835 -17.357 25.208 1.00 51.54 O ATOM 1881 C2' DA C 19 10.385 -15.003 24.750 1.00 51.23 C ATOM 1882 C1' DA C 19 11.270 -15.314 23.552 1.00 50.99 C ATOM 1883 N9 DA C 19 12.108 -14.211 23.078 1.00 50.86 N ATOM 1884 C8 DA C 19 11.801 -12.878 23.032 1.00 50.83 C ATOM 1885 N7 DA C 19 12.769 -12.136 22.544 1.00 51.04 N ATOM 1886 C5 DA C 19 13.778 -13.038 22.252 1.00 50.86 C ATOM 1887 C6 DA C 19 15.074 -12.889 21.709 1.00 50.74 C ATOM 1888 N6 DA C 19 15.594 -11.716 21.347 1.00 50.75 N ATOM 1889 N1 DA C 19 15.823 -13.998 21.553 1.00 50.78 N ATOM 1890 C2 DA C 19 15.310 -15.181 21.912 1.00 50.91 C ATOM 1891 N3 DA C 19 14.111 -15.446 22.432 1.00 50.87 N ATOM 1892 C4 DA C 19 13.385 -14.323 22.578 1.00 50.85 C ATOM 1893 P DC C 20 9.880 -17.570 26.789 1.00 51.78 P ATOM 1894 OP1 DC C 20 9.023 -18.734 27.110 1.00 51.55 O ATOM 1895 OP2 DC C 20 9.642 -16.259 27.438 1.00 51.77 O ATOM 1896 O5' DC C 20 11.415 -17.956 27.021 1.00 51.67 O ATOM 1897 C5' DC C 20 12.399 -17.072 26.518 1.00 51.59 C ATOM 1898 C4' DC C 20 13.789 -17.651 26.590 1.00 51.55 C ATOM 1899 O4' DC C 20 14.609 -16.896 25.660 1.00 51.57 O ATOM 1900 C3' DC C 20 14.420 -17.516 27.967 1.00 51.53 C ATOM 1901 O3' DC C 20 15.323 -18.576 28.253 1.00 51.73 O ATOM 1902 C2' DC C 20 15.118 -16.169 27.857 1.00 51.49 C ATOM 1903 C1' DC C 20 15.536 -16.114 26.386 1.00 51.38 C ATOM 1904 N1 DC C 20 15.622 -14.706 25.849 1.00 51.26 N ATOM 1905 C2 DC C 20 16.656 -14.364 24.958 1.00 51.18 C ATOM 1906 O2 DC C 20 17.479 -15.218 24.595 1.00 50.97 O ATOM 1907 N3 DC C 20 16.726 -13.088 24.507 1.00 51.00 N ATOM 1908 C4 DC C 20 15.839 -12.176 24.898 1.00 50.95 C ATOM 1909 N4 DC C 20 15.968 -10.941 24.412 1.00 51.08 N ATOM 1910 C5 DC C 20 14.786 -12.496 25.803 1.00 50.94 C ATOM 1911 C6 DC C 20 14.709 -13.758 26.245 1.00 51.08 C ATOM 1912 P DT C 21 15.952 -18.726 29.721 1.00 52.08 P ATOM 1913 OP1 DT C 21 16.458 -20.113 29.837 1.00 51.92 O ATOM 1914 OP2 DT C 21 14.969 -18.231 30.713 1.00 51.98 O ATOM 1915 O5' DT C 21 17.168 -17.679 29.688 1.00 51.84 O ATOM 1916 C5' DT C 21 18.481 -18.000 30.143 1.00 51.96 C ATOM 1917 C4' DT C 21 19.537 -17.414 29.221 1.00 51.99 C ATOM 1918 O4' DT C 21 18.902 -16.514 28.283 1.00 52.29 O ATOM 1919 C3' DT C 21 20.609 -16.581 29.909 1.00 52.09 C ATOM 1920 O3' DT C 21 21.726 -17.392 30.272 1.00 51.88 O ATOM 1921 C2' DT C 21 20.998 -15.553 28.855 1.00 52.34 C ATOM 1922 C1' DT C 21 19.786 -15.467 27.932 1.00 52.56 C ATOM 1923 N1 DT C 21 19.071 -14.141 27.979 1.00 52.60 N ATOM 1924 C2 DT C 21 19.749 -13.034 27.517 1.00 52.77 C ATOM 1925 O2 DT C 21 20.890 -13.092 27.095 1.00 52.72 O ATOM 1926 N3 DT C 21 19.051 -11.849 27.577 1.00 52.98 N ATOM 1927 C4 DT C 21 17.754 -11.678 28.032 1.00 52.91 C ATOM 1928 O4 DT C 21 17.212 -10.575 28.045 1.00 52.65 O ATOM 1929 C5 DT C 21 17.097 -12.877 28.504 1.00 52.88 C ATOM 1930 C7 DT C 21 15.769 -12.780 29.200 1.00 52.84 C ATOM 1931 C6 DT C 21 17.774 -14.039 28.459 1.00 52.78 C ATOM 1932 P DA C 22 22.132 -17.665 31.802 1.00 51.84 P ATOM 1933 OP1 DA C 22 21.797 -19.077 32.098 1.00 51.34 O ATOM 1934 OP2 DA C 22 21.565 -16.577 32.633 1.00 51.62 O ATOM 1935 O5' DA C 22 23.731 -17.533 31.832 1.00 51.53 O ATOM 1936 C5' DA C 22 24.532 -17.261 30.672 1.00 51.12 C ATOM 1937 C4' DA C 22 24.872 -15.783 30.543 1.00 50.70 C ATOM 1938 O4' DA C 22 23.669 -15.007 30.300 1.00 50.63 O ATOM 1939 C3' DA C 22 25.528 -15.136 31.768 1.00 50.31 C ATOM 1940 O3' DA C 22 26.775 -14.539 31.406 1.00 49.72 O ATOM 1941 C2' DA C 22 24.517 -14.081 32.210 1.00 50.19 C ATOM 1942 C1' DA C 22 23.893 -13.737 30.869 1.00 50.35 C ATOM 1943 N9 DA C 22 22.650 -12.970 30.918 1.00 50.28 N ATOM 1944 C8 DA C 22 21.516 -13.237 31.632 1.00 50.24 C ATOM 1945 N7 DA C 22 20.563 -12.351 31.463 1.00 50.06 N ATOM 1946 C5 DA C 22 21.111 -11.438 30.582 1.00 50.15 C ATOM 1947 C6 DA C 22 20.613 -10.250 30.001 1.00 50.43 C ATOM 1948 N6 DA C 22 19.389 -9.759 30.234 1.00 50.16 N ATOM 1949 N1 DA C 22 21.435 -9.580 29.158 1.00 50.46 N ATOM 1950 C2 DA C 22 22.664 -10.064 28.914 1.00 50.29 C ATOM 1951 N3 DA C 22 23.237 -11.165 29.400 1.00 49.99 N ATOM 1952 C4 DA C 22 22.399 -11.808 30.234 1.00 50.12 C ATOM 1953 P DA C 23 28.031 -14.492 32.403 1.00 49.37 P ATOM 1954 OP1 DA C 23 29.121 -15.278 31.785 1.00 49.31 O ATOM 1955 OP2 DA C 23 27.581 -14.797 33.781 1.00 49.13 O ATOM 1956 O5' DA C 23 28.438 -12.947 32.359 1.00 48.92 O ATOM 1957 C5' DA C 23 28.826 -12.338 31.133 1.00 48.24 C ATOM 1958 C4' DA C 23 28.190 -10.970 30.996 1.00 47.75 C ATOM 1959 O4' DA C 23 26.768 -11.064 31.221 1.00 47.17 O ATOM 1960 C3' DA C 23 28.663 -9.940 32.014 1.00 47.64 C ATOM 1961 O3' DA C 23 29.683 -9.120 31.459 1.00 48.14 O ATOM 1962 C2' DA C 23 27.407 -9.141 32.359 1.00 47.39 C ATOM 1963 C1' DA C 23 26.340 -9.747 31.465 1.00 47.10 C ATOM 1964 N9 DA C 23 25.012 -9.775 32.059 1.00 46.97 N ATOM 1965 C8 DA C 23 24.518 -10.682 32.951 1.00 46.95 C ATOM 1966 N7 DA C 23 23.275 -10.444 33.295 1.00 46.90 N ATOM 1967 C5 DA C 23 22.941 -9.306 32.588 1.00 46.76 C ATOM 1968 C6 DA C 23 21.762 -8.539 32.511 1.00 46.96 C ATOM 1969 N6 DA C 23 20.652 -8.819 33.193 1.00 47.09 N ATOM 1970 N1 DA C 23 21.765 -7.458 31.703 1.00 47.03 N ATOM 1971 C2 DA C 23 22.872 -7.166 31.011 1.00 47.08 C ATOM 1972 N3 DA C 23 24.038 -7.813 31.003 1.00 47.14 N ATOM 1973 C4 DA C 23 24.003 -8.880 31.820 1.00 46.88 C ATOM 1974 P DA C 24 30.491 -8.086 32.382 1.00 48.78 P ATOM 1975 OP1 DA C 24 31.788 -7.803 31.731 1.00 49.26 O ATOM 1976 OP2 DA C 24 30.445 -8.541 33.790 1.00 48.74 O ATOM 1977 O5' DA C 24 29.623 -6.763 32.242 1.00 48.39 O ATOM 1978 C5' DA C 24 29.386 -6.239 30.954 1.00 47.87 C ATOM 1979 C4' DA C 24 28.415 -5.090 31.077 1.00 47.59 C ATOM 1980 O4' DA C 24 27.122 -5.594 31.495 1.00 47.18 O ATOM 1981 C3' DA C 24 28.837 -4.051 32.109 1.00 47.42 C ATOM 1982 O3' DA C 24 28.775 -2.783 31.472 1.00 47.57 O ATOM 1983 C2' DA C 24 27.850 -4.265 33.260 1.00 47.10 C ATOM 1984 C1' DA C 24 26.618 -4.769 32.522 1.00 46.78 C ATOM 1985 N9 DA C 24 25.676 -5.561 33.308 1.00 46.53 N ATOM 1986 C8 DA C 24 25.933 -6.698 34.019 1.00 46.47 C ATOM 1987 N7 DA C 24 24.876 -7.194 34.617 1.00 46.50 N ATOM 1988 C5 DA C 24 23.857 -6.326 34.275 1.00 46.34 C ATOM 1989 C6 DA C 24 22.485 -6.289 34.592 1.00 46.33 C ATOM 1990 N6 DA C 24 21.887 -7.199 35.359 1.00 46.37 N ATOM 1991 N1 DA C 24 21.743 -5.285 34.080 1.00 46.47 N ATOM 1992 C2 DA C 24 22.337 -4.369 33.304 1.00 46.61 C ATOM 1993 N3 DA C 24 23.618 -4.295 32.941 1.00 46.64 N ATOM 1994 C4 DA C 24 24.332 -5.312 33.464 1.00 46.56 C ATOM 1995 P DT C 25 29.112 -1.428 32.239 1.00 47.45 P ATOM 1996 OP1 DT C 25 29.553 -0.431 31.237 1.00 47.72 O ATOM 1997 OP2 DT C 25 29.958 -1.733 33.416 1.00 47.26 O ATOM 1998 O5' DT C 25 27.648 -1.022 32.709 1.00 46.70 O ATOM 1999 C5' DT C 25 26.651 -0.902 31.720 1.00 46.41 C ATOM 2000 C4' DT C 25 25.386 -0.400 32.359 1.00 46.28 C ATOM 2001 O4' DT C 25 24.793 -1.494 33.095 1.00 46.26 O ATOM 2002 C3' DT C 25 25.609 0.739 33.345 1.00 46.21 C ATOM 2003 O3' DT C 25 24.852 1.854 32.916 1.00 45.92 O ATOM 2004 C2' DT C 25 25.175 0.147 34.687 1.00 46.55 C ATOM 2005 C1' DT C 25 24.221 -0.964 34.268 1.00 46.62 C ATOM 2006 N1 DT C 25 24.041 -2.073 35.264 1.00 46.80 N ATOM 2007 C2 DT C 25 22.780 -2.365 35.768 1.00 46.75 C ATOM 2008 O2 DT C 25 21.757 -1.777 35.454 1.00 46.44 O ATOM 2009 N3 DT C 25 22.745 -3.416 36.651 1.00 46.68 N ATOM 2010 C4 DT C 25 23.831 -4.155 37.091 1.00 46.51 C ATOM 2011 O4 DT C 25 23.696 -5.068 37.892 1.00 46.54 O ATOM 2012 C5 DT C 25 25.115 -3.805 36.536 1.00 46.49 C ATOM 2013 C7 DT C 25 26.343 -4.589 36.897 1.00 46.31 C ATOM 2014 C6 DT C 25 25.159 -2.792 35.661 1.00 46.74 C ATOM 2015 P DT C 26 24.774 3.193 33.781 1.00 46.05 P ATOM 2016 OP1 DT C 26 24.615 4.318 32.835 1.00 45.96 O ATOM 2017 OP2 DT C 26 25.888 3.194 34.755 1.00 45.68 O ATOM 2018 O5' DT C 26 23.395 3.020 34.578 1.00 45.84 O ATOM 2019 C5' DT C 26 22.378 2.123 34.131 1.00 45.53 C ATOM 2020 C4' DT C 26 20.982 2.569 34.519 1.00 45.46 C ATOM 2021 O4' DT C 26 20.448 1.606 35.455 1.00 45.61 O ATOM 2022 C3' DT C 26 20.831 3.884 35.270 1.00 45.51 C ATOM 2023 O3' DT C 26 19.471 4.308 35.169 1.00 45.72 O ATOM 2024 C2' DT C 26 21.253 3.472 36.680 1.00 45.14 C ATOM 2025 C1' DT C 26 20.605 2.091 36.786 1.00 44.79 C ATOM 2026 N1 DT C 26 21.362 1.041 37.565 1.00 44.39 N ATOM 2027 C2 DT C 26 20.652 0.099 38.291 1.00 43.79 C ATOM 2028 O2 DT C 26 19.434 0.063 38.363 1.00 43.40 O ATOM 2029 N3 DT C 26 21.435 -0.820 38.943 1.00 43.65 N ATOM 2030 C4 DT C 26 22.817 -0.882 38.944 1.00 43.91 C ATOM 2031 O4 DT C 26 23.432 -1.740 39.562 1.00 44.18 O ATOM 2032 C5 DT C 26 23.498 0.122 38.176 1.00 43.89 C ATOM 2033 C7 DT C 26 24.956 0.369 38.424 1.00 43.37 C ATOM 2034 C6 DT C 26 22.748 1.015 37.519 1.00 44.14 C ATOM 2035 P DT C 27 18.892 5.469 36.102 1.00 45.93 P ATOM 2036 OP1 DT C 27 17.706 6.053 35.436 1.00 45.89 O ATOM 2037 OP2 DT C 27 20.029 6.338 36.478 1.00 45.49 O ATOM 2038 O5' DT C 27 18.413 4.654 37.393 1.00 46.06 O ATOM 2039 C5' DT C 27 17.084 4.128 37.478 1.00 45.87 C ATOM 2040 C4' DT C 27 16.825 3.498 38.835 1.00 45.62 C ATOM 2041 O4' DT C 27 17.839 2.501 39.112 1.00 45.35 O ATOM 2042 C3' DT C 27 16.894 4.471 40.007 1.00 45.54 C ATOM 2043 O3' DT C 27 15.605 4.943 40.358 1.00 45.56 O ATOM 2044 C2' DT C 27 17.507 3.669 41.148 1.00 45.48 C ATOM 2045 C1' DT C 27 17.942 2.355 40.512 1.00 45.26 C ATOM 2046 N1 DT C 27 19.339 1.977 40.855 1.00 45.10 N ATOM 2047 C2 DT C 27 19.565 0.838 41.599 1.00 45.25 C ATOM 2048 O2 DT C 27 18.676 0.104 42.000 1.00 45.05 O ATOM 2049 N3 DT C 27 20.887 0.564 41.846 1.00 45.27 N ATOM 2050 C4 DT C 27 21.974 1.330 41.461 1.00 45.23 C ATOM 2051 O4 DT C 27 23.124 1.008 41.738 1.00 44.99 O ATOM 2052 C5 DT C 27 21.675 2.507 40.685 1.00 45.37 C ATOM 2053 C7 DT C 27 22.795 3.237 39.999 1.00 45.61 C ATOM 2054 C6 DT C 27 20.385 2.775 40.427 1.00 45.27 C TER 2055 DT C 27 ATOM 2056 O5' DA D 1 21.370 -6.226 49.884 1.00 44.48 O ATOM 2057 C5' DA D 1 20.304 -7.140 49.643 1.00 44.79 C ATOM 2058 C4' DA D 1 19.692 -6.963 48.262 1.00 44.86 C ATOM 2059 O4' DA D 1 20.205 -5.755 47.630 1.00 45.07 O ATOM 2060 C3' DA D 1 19.978 -8.115 47.284 1.00 44.65 C ATOM 2061 O3' DA D 1 18.870 -8.472 46.439 1.00 43.41 O ATOM 2062 C2' DA D 1 21.081 -7.499 46.435 1.00 45.02 C ATOM 2063 C1' DA D 1 20.467 -6.111 46.292 1.00 45.50 C ATOM 2064 N9 DA D 1 21.266 -5.106 45.606 1.00 45.69 N ATOM 2065 C8 DA D 1 22.606 -5.125 45.332 1.00 45.76 C ATOM 2066 N7 DA D 1 23.017 -4.066 44.675 1.00 45.74 N ATOM 2067 C5 DA D 1 21.867 -3.316 44.504 1.00 45.68 C ATOM 2068 C6 DA D 1 21.631 -2.076 43.887 1.00 45.69 C ATOM 2069 N6 DA D 1 22.611 -1.377 43.310 1.00 45.69 N ATOM 2070 N1 DA D 1 20.363 -1.595 43.889 1.00 45.75 N ATOM 2071 C2 DA D 1 19.396 -2.319 44.475 1.00 45.75 C ATOM 2072 N3 DA D 1 19.501 -3.499 45.090 1.00 45.71 N ATOM 2073 C4 DA D 1 20.773 -3.943 45.068 1.00 45.74 C ATOM 2074 P DA D 2 17.434 -8.994 46.926 1.00 42.48 P ATOM 2075 OP1 DA D 2 17.147 -8.595 48.321 1.00 42.43 O ATOM 2076 OP2 DA D 2 17.321 -10.417 46.545 1.00 42.58 O ATOM 2077 O5' DA D 2 16.493 -8.126 45.983 1.00 41.16 O ATOM 2078 C5' DA D 2 16.600 -6.717 46.032 1.00 40.25 C ATOM 2079 C4' DA D 2 15.713 -6.051 45.001 1.00 39.64 C ATOM 2080 O4' DA D 2 16.508 -5.188 44.150 1.00 38.98 O ATOM 2081 C3' DA D 2 15.011 -6.963 44.011 1.00 39.30 C ATOM 2082 O3' DA D 2 13.900 -6.238 43.537 1.00 39.63 O ATOM 2083 C2' DA D 2 16.118 -7.200 42.989 1.00 38.68 C ATOM 2084 C1' DA D 2 16.674 -5.789 42.876 1.00 38.14 C ATOM 2085 N9 DA D 2 18.087 -5.669 42.539 1.00 37.73 N ATOM 2086 C8 DA D 2 19.103 -6.558 42.757 1.00 37.44 C ATOM 2087 N7 DA D 2 20.269 -6.131 42.341 1.00 37.14 N ATOM 2088 C5 DA D 2 19.996 -4.881 41.826 1.00 37.26 C ATOM 2089 C6 DA D 2 20.806 -3.903 41.229 1.00 37.52 C ATOM 2090 N6 DA D 2 22.120 -4.059 41.052 1.00 37.47 N ATOM 2091 N1 DA D 2 20.209 -2.760 40.826 1.00 37.58 N ATOM 2092 C2 DA D 2 18.890 -2.599 40.996 1.00 37.35 C ATOM 2093 N3 DA D 2 18.031 -3.450 41.548 1.00 37.21 N ATOM 2094 C4 DA D 2 18.655 -4.576 41.941 1.00 37.44 C ATOM 2095 P DA D 3 12.923 -6.784 42.405 1.00 39.91 P ATOM 2096 OP1 DA D 3 11.538 -6.628 42.898 1.00 39.64 O ATOM 2097 OP2 DA D 3 13.411 -8.083 41.889 1.00 39.81 O ATOM 2098 O5' DA D 3 13.168 -5.699 41.274 1.00 40.42 O ATOM 2099 C5' DA D 3 13.210 -4.328 41.618 1.00 40.65 C ATOM 2100 C4' DA D 3 13.513 -3.553 40.365 1.00 40.69 C ATOM 2101 O4' DA D 3 14.928 -3.654 40.083 1.00 40.29 O ATOM 2102 C3' DA D 3 12.808 -4.093 39.131 1.00 41.06 C ATOM 2103 O3' DA D 3 12.428 -2.976 38.350 1.00 42.03 O ATOM 2104 C2' DA D 3 13.873 -4.995 38.502 1.00 40.68 C ATOM 2105 C1' DA D 3 15.105 -4.156 38.775 1.00 40.13 C ATOM 2106 N9 DA D 3 16.385 -4.847 38.752 1.00 40.00 N ATOM 2107 C8 DA D 3 16.684 -6.123 39.143 1.00 40.06 C ATOM 2108 N7 DA D 3 17.956 -6.428 39.005 1.00 39.94 N ATOM 2109 C5 DA D 3 18.517 -5.271 38.497 1.00 39.57 C ATOM 2110 C6 DA D 3 19.826 -4.925 38.125 1.00 39.57 C ATOM 2111 N6 DA D 3 20.855 -5.761 38.219 1.00 39.95 N ATOM 2112 N1 DA D 3 20.047 -3.682 37.654 1.00 39.79 N ATOM 2113 C2 DA D 3 19.022 -2.829 37.552 1.00 40.02 C ATOM 2114 N3 DA D 3 17.746 -3.040 37.872 1.00 40.00 N ATOM 2115 C4 DA D 3 17.564 -4.289 38.338 1.00 39.85 C ATOM 2116 P DT D 4 11.744 -3.115 36.914 1.00 42.58 P ATOM 2117 OP1 DT D 4 10.679 -2.090 36.847 1.00 42.56 O ATOM 2118 OP2 DT D 4 11.449 -4.533 36.609 1.00 42.16 O ATOM 2119 O5' DT D 4 12.949 -2.670 35.983 1.00 42.95 O ATOM 2120 C5' DT D 4 13.465 -1.363 36.136 1.00 43.69 C ATOM 2121 C4' DT D 4 14.579 -1.192 35.138 1.00 44.14 C ATOM 2122 O4' DT D 4 15.668 -2.086 35.494 1.00 44.09 O ATOM 2123 C3' DT D 4 14.158 -1.558 33.714 1.00 44.45 C ATOM 2124 O3' DT D 4 14.463 -0.475 32.861 1.00 44.93 O ATOM 2125 C2' DT D 4 14.949 -2.833 33.415 1.00 44.06 C ATOM 2126 C1' DT D 4 16.176 -2.632 34.295 1.00 43.37 C ATOM 2127 N1 DT D 4 16.947 -3.873 34.604 1.00 42.67 N ATOM 2128 C2 DT D 4 18.323 -3.882 34.438 1.00 42.24 C ATOM 2129 O2 DT D 4 18.977 -2.927 34.055 1.00 41.90 O ATOM 2130 N3 DT D 4 18.933 -5.063 34.767 1.00 42.23 N ATOM 2131 C4 DT D 4 18.298 -6.212 35.205 1.00 42.28 C ATOM 2132 O4 DT D 4 18.930 -7.225 35.462 1.00 42.38 O ATOM 2133 C5 DT D 4 16.866 -6.139 35.356 1.00 41.89 C ATOM 2134 C7 DT D 4 16.087 -7.339 35.793 1.00 41.35 C ATOM 2135 C6 DT D 4 16.260 -4.986 35.056 1.00 42.20 C ATOM 2136 P DT D 5 14.202 -0.547 31.291 1.00 45.06 P ATOM 2137 OP1 DT D 5 13.782 0.821 30.892 1.00 44.61 O ATOM 2138 OP2 DT D 5 13.376 -1.740 30.969 1.00 44.08 O ATOM 2139 O5' DT D 5 15.691 -0.791 30.764 1.00 44.98 O ATOM 2140 C5' DT D 5 16.704 0.150 31.108 1.00 45.04 C ATOM 2141 C4' DT D 5 18.058 -0.313 30.610 1.00 45.08 C ATOM 2142 O4' DT D 5 18.414 -1.567 31.255 1.00 44.60 O ATOM 2143 C3' DT D 5 18.104 -0.574 29.107 1.00 45.29 C ATOM 2144 O3' DT D 5 19.299 -0.063 28.510 1.00 46.25 O ATOM 2145 C2' DT D 5 18.059 -2.090 29.032 1.00 44.76 C ATOM 2146 C1' DT D 5 18.882 -2.450 30.261 1.00 43.79 C ATOM 2147 N1 DT D 5 18.721 -3.868 30.698 1.00 43.02 N ATOM 2148 C2 DT D 5 19.819 -4.709 30.731 1.00 42.70 C ATOM 2149 O2 DT D 5 20.954 -4.376 30.423 1.00 42.37 O ATOM 2150 N3 DT D 5 19.539 -5.993 31.125 1.00 42.59 N ATOM 2151 C4 DT D 5 18.305 -6.487 31.512 1.00 42.61 C ATOM 2152 O4 DT D 5 18.166 -7.655 31.859 1.00 42.78 O ATOM 2153 C5 DT D 5 17.204 -5.560 31.450 1.00 42.16 C ATOM 2154 C7 DT D 5 15.806 -6.011 31.743 1.00 41.88 C ATOM 2155 C6 DT D 5 17.462 -4.311 31.054 1.00 42.40 C ATOM 2156 P DT D 6 19.367 0.207 26.934 1.00 46.72 P ATOM 2157 OP1 DT D 6 19.696 1.644 26.744 1.00 46.15 O ATOM 2158 OP2 DT D 6 18.153 -0.385 26.321 1.00 46.53 O ATOM 2159 O5' DT D 6 20.592 -0.699 26.448 1.00 46.62 O ATOM 2160 C5' DT D 6 21.887 -0.614 27.026 1.00 46.63 C ATOM 2161 C4' DT D 6 22.482 -2.007 27.075 1.00 46.83 C ATOM 2162 O4' DT D 6 21.493 -2.936 27.570 1.00 46.81 O ATOM 2163 C3' DT D 6 22.873 -2.591 25.726 1.00 47.21 C ATOM 2164 O3' DT D 6 24.272 -2.411 25.520 1.00 48.32 O ATOM 2165 C2' DT D 6 22.464 -4.067 25.795 1.00 46.78 C ATOM 2166 C1' DT D 6 21.930 -4.230 27.211 1.00 46.39 C ATOM 2167 N1 DT D 6 20.804 -5.217 27.416 1.00 45.93 N ATOM 2168 C2 DT D 6 21.109 -6.537 27.666 1.00 45.83 C ATOM 2169 O2 DT D 6 22.247 -6.963 27.713 1.00 45.90 O ATOM 2170 N3 DT D 6 20.025 -7.359 27.854 1.00 45.93 N ATOM 2171 C4 DT D 6 18.691 -6.998 27.827 1.00 46.07 C ATOM 2172 O4 DT D 6 17.791 -7.815 28.013 1.00 45.93 O ATOM 2173 C5 DT D 6 18.436 -5.600 27.573 1.00 46.03 C ATOM 2174 C7 DT D 6 17.054 -5.044 27.783 1.00 46.09 C ATOM 2175 C6 DT D 6 19.489 -4.790 27.371 1.00 45.92 C ATOM 2176 P DA D 7 24.879 -2.127 24.059 1.00 49.47 P ATOM 2177 OP1 DA D 7 26.167 -1.419 24.245 1.00 49.13 O ATOM 2178 OP2 DA D 7 23.831 -1.537 23.190 1.00 48.91 O ATOM 2179 O5' DA D 7 25.181 -3.608 23.534 1.00 49.58 O ATOM 2180 C5' DA D 7 26.168 -4.402 24.186 1.00 49.54 C ATOM 2181 C4' DA D 7 25.901 -5.878 23.970 1.00 49.45 C ATOM 2182 O4' DA D 7 24.643 -6.262 24.593 1.00 49.14 O ATOM 2183 C3' DA D 7 25.785 -6.306 22.506 1.00 49.52 C ATOM 2184 O3' DA D 7 26.638 -7.422 22.270 1.00 50.40 O ATOM 2185 C2' DA D 7 24.309 -6.666 22.376 1.00 49.03 C ATOM 2186 C1' DA D 7 24.078 -7.246 23.759 1.00 48.38 C ATOM 2187 N9 DA D 7 22.687 -7.506 24.099 1.00 48.00 N ATOM 2188 C8 DA D 7 21.595 -6.713 23.890 1.00 47.85 C ATOM 2189 N7 DA D 7 20.470 -7.243 24.308 1.00 47.77 N ATOM 2190 C5 DA D 7 20.851 -8.470 24.823 1.00 47.99 C ATOM 2191 C6 DA D 7 20.136 -9.532 25.421 1.00 47.99 C ATOM 2192 N6 DA D 7 18.813 -9.529 25.617 1.00 47.94 N ATOM 2193 N1 DA D 7 20.844 -10.611 25.817 1.00 47.82 N ATOM 2194 C2 DA D 7 22.170 -10.636 25.632 1.00 47.80 C ATOM 2195 N3 DA D 7 22.947 -9.706 25.084 1.00 47.69 N ATOM 2196 C4 DA D 7 22.219 -8.644 24.700 1.00 47.90 C ATOM 2197 P DG D 8 27.187 -7.767 20.809 1.00 51.23 P ATOM 2198 OP1 DG D 8 28.023 -8.988 20.928 1.00 50.85 O ATOM 2199 OP2 DG D 8 27.786 -6.536 20.246 1.00 51.26 O ATOM 2200 O5' DG D 8 25.840 -8.077 19.991 1.00 51.58 O ATOM 2201 C5' DG D 8 25.528 -9.390 19.515 1.00 52.05 C ATOM 2202 C4' DG D 8 25.332 -10.392 20.645 1.00 52.14 C ATOM 2203 O4' DG D 8 24.397 -9.858 21.613 1.00 52.32 O ATOM 2204 C3' DG D 8 24.767 -11.734 20.207 1.00 52.01 C ATOM 2205 O3' DG D 8 25.832 -12.652 19.966 1.00 51.44 O ATOM 2206 C2' DG D 8 23.908 -12.181 21.383 1.00 52.23 C ATOM 2207 C1' DG D 8 23.589 -10.893 22.142 1.00 52.37 C ATOM 2208 N9 DG D 8 22.184 -10.484 22.067 1.00 52.37 N ATOM 2209 C8 DG D 8 21.678 -9.287 21.609 1.00 52.32 C ATOM 2210 N7 DG D 8 20.378 -9.211 21.674 1.00 52.29 N ATOM 2211 C5 DG D 8 20.000 -10.435 22.204 1.00 52.28 C ATOM 2212 C6 DG D 8 18.713 -10.927 22.508 1.00 52.36 C ATOM 2213 O6 DG D 8 17.635 -10.347 22.341 1.00 52.42 O ATOM 2214 N1 DG D 8 18.740 -12.225 23.025 1.00 52.30 N ATOM 2215 C2 DG D 8 19.899 -12.935 23.252 1.00 52.16 C ATOM 2216 N2 DG D 8 19.746 -14.162 23.764 1.00 52.17 N ATOM 2217 N3 DG D 8 21.119 -12.488 22.976 1.00 52.13 N ATOM 2218 C4 DG D 8 21.094 -11.231 22.457 1.00 52.33 C ATOM 2219 P DT D 9 25.964 -13.452 18.586 1.00 51.23 P ATOM 2220 OP1 DT D 9 27.401 -13.623 18.282 1.00 51.29 O ATOM 2221 OP2 DT D 9 25.062 -12.808 17.600 1.00 50.95 O ATOM 2222 O5' DT D 9 25.362 -14.885 18.949 1.00 50.56 O ATOM 2223 C5' DT D 9 23.969 -14.946 18.970 1.00 50.30 C ATOM 2224 C4' DT D 9 23.427 -16.135 19.725 1.00 50.08 C ATOM 2225 O4' DT D 9 22.572 -15.627 20.778 1.00 49.97 O ATOM 2226 C3' DT D 9 22.581 -17.054 18.862 1.00 50.27 C ATOM 2227 O3' DT D 9 23.194 -18.330 18.752 1.00 51.16 O ATOM 2228 C2' DT D 9 21.228 -17.130 19.560 1.00 50.05 C ATOM 2229 C1' DT D 9 21.222 -16.005 20.581 1.00 49.70 C ATOM 2230 N1 DT D 9 20.351 -14.818 20.197 1.00 49.51 N ATOM 2231 C2 DT D 9 18.985 -14.900 20.404 1.00 49.38 C ATOM 2232 O2 DT D 9 18.428 -15.874 20.874 1.00 49.51 O ATOM 2233 N3 DT D 9 18.268 -13.790 20.035 1.00 49.23 N ATOM 2234 C4 DT D 9 18.775 -12.625 19.498 1.00 49.31 C ATOM 2235 O4 DT D 9 18.040 -11.690 19.209 1.00 49.53 O ATOM 2236 C5 DT D 9 20.205 -12.592 19.309 1.00 49.30 C ATOM 2237 C7 DT D 9 20.903 -11.299 19.004 1.00 48.82 C ATOM 2238 C6 DT D 9 20.914 -13.677 19.647 1.00 49.37 C ATOM 2239 P DT D 10 22.583 -19.418 17.746 1.00 52.24 P ATOM 2240 OP1 DT D 10 23.642 -20.406 17.430 1.00 52.05 O ATOM 2241 OP2 DT D 10 21.884 -18.700 16.649 1.00 52.24 O ATOM 2242 O5' DT D 10 21.468 -20.136 18.642 1.00 52.24 O ATOM 2243 C5' DT D 10 20.474 -20.946 18.026 1.00 52.29 C ATOM 2244 C4' DT D 10 19.062 -20.555 18.439 1.00 52.31 C ATOM 2245 O4' DT D 10 18.944 -19.174 18.865 1.00 52.21 O ATOM 2246 C3' DT D 10 18.048 -20.691 17.317 1.00 52.37 C ATOM 2247 O3' DT D 10 17.778 -22.097 17.189 1.00 52.63 O ATOM 2248 C2' DT D 10 16.911 -19.790 17.809 1.00 52.22 C ATOM 2249 C1' DT D 10 17.603 -18.744 18.681 1.00 52.00 C ATOM 2250 N1 DT D 10 17.610 -17.344 18.121 1.00 51.91 N ATOM 2251 C2 DT D 10 16.528 -16.497 18.326 1.00 51.74 C ATOM 2252 O2 DT D 10 15.516 -16.796 18.938 1.00 51.57 O ATOM 2253 N3 DT D 10 16.674 -15.250 17.772 1.00 51.58 N ATOM 2254 C4 DT D 10 17.758 -14.777 17.058 1.00 51.65 C ATOM 2255 O4 DT D 10 17.779 -13.641 16.608 1.00 51.59 O ATOM 2256 C5 DT D 10 18.855 -15.698 16.886 1.00 51.82 C ATOM 2257 C7 DT D 10 20.221 -15.174 16.546 1.00 51.79 C ATOM 2258 C6 DT D 10 18.720 -16.927 17.402 1.00 51.85 C ATOM 2259 P DA D 11 16.454 -22.724 16.544 1.00 52.92 P ATOM 2260 OP1 DA D 11 16.522 -24.191 16.753 1.00 52.55 O ATOM 2261 OP2 DA D 11 16.301 -22.169 15.180 1.00 52.72 O ATOM 2262 O5' DA D 11 15.302 -22.113 17.475 1.00 52.82 O ATOM 2263 C5' DA D 11 14.037 -22.734 17.658 1.00 52.62 C ATOM 2264 C4' DA D 11 13.007 -22.039 16.794 1.00 52.37 C ATOM 2265 O4' DA D 11 13.287 -20.616 16.788 1.00 52.06 O ATOM 2266 C3' DA D 11 13.023 -22.500 15.335 1.00 52.31 C ATOM 2267 O3' DA D 11 11.918 -23.364 15.013 1.00 52.62 O ATOM 2268 C2' DA D 11 13.051 -21.217 14.500 1.00 52.23 C ATOM 2269 C1' DA D 11 12.981 -20.076 15.518 1.00 51.69 C ATOM 2270 N9 DA D 11 13.891 -18.960 15.264 1.00 51.36 N ATOM 2271 C8 DA D 11 15.185 -18.979 14.812 1.00 51.19 C ATOM 2272 N7 DA D 11 15.728 -17.791 14.698 1.00 50.95 N ATOM 2273 C5 DA D 11 14.718 -16.937 15.102 1.00 51.07 C ATOM 2274 C6 DA D 11 14.638 -15.536 15.214 1.00 51.20 C ATOM 2275 N6 DA D 11 15.641 -14.710 14.911 1.00 51.23 N ATOM 2276 N1 DA D 11 13.474 -15.010 15.654 1.00 51.24 N ATOM 2277 C2 DA D 11 12.457 -15.827 15.956 1.00 51.31 C ATOM 2278 N3 DA D 11 12.413 -17.156 15.893 1.00 51.25 N ATOM 2279 C4 DA D 11 13.584 -17.644 15.455 1.00 51.17 C ATOM 2280 P DA D 12 10.362 -23.065 15.275 1.00 53.10 P ATOM 2281 OP1 DA D 12 9.980 -23.748 16.532 1.00 53.13 O ATOM 2282 OP2 DA D 12 9.672 -23.406 14.013 1.00 53.32 O ATOM 2283 O5' DA D 12 10.228 -21.483 15.499 1.00 53.44 O ATOM 2284 C5' DA D 12 8.994 -20.888 15.912 1.00 53.50 C ATOM 2285 C4' DA D 12 8.422 -19.990 14.827 1.00 53.47 C ATOM 2286 O4' DA D 12 9.394 -18.963 14.504 1.00 53.40 O ATOM 2287 C3' DA D 12 8.103 -20.694 13.503 1.00 53.50 C ATOM 2288 O3' DA D 12 7.009 -20.114 12.779 1.00 53.87 O ATOM 2289 C2' DA D 12 9.387 -20.441 12.720 1.00 53.44 C ATOM 2290 C1' DA D 12 9.558 -18.974 13.099 1.00 53.33 C ATOM 2291 N9 DA D 12 10.814 -18.317 12.766 1.00 53.11 N ATOM 2292 C8 DA D 12 12.018 -18.847 12.392 1.00 52.96 C ATOM 2293 N7 DA D 12 12.932 -17.933 12.169 1.00 52.79 N ATOM 2294 C5 DA D 12 12.274 -16.736 12.408 1.00 52.94 C ATOM 2295 C6 DA D 12 12.670 -15.384 12.355 1.00 53.13 C ATOM 2296 N6 DA D 12 13.901 -14.995 12.018 1.00 53.00 N ATOM 2297 N1 DA D 12 11.749 -14.440 12.665 1.00 53.25 N ATOM 2298 C2 DA D 12 10.509 -14.819 13.002 1.00 53.14 C ATOM 2299 N3 DA D 12 10.022 -16.054 13.090 1.00 52.95 N ATOM 2300 C4 DA D 12 10.966 -16.962 12.778 1.00 52.91 C ATOM 2301 P DG D 13 5.471 -20.091 13.231 1.00 54.03 P ATOM 2302 OP1 DG D 13 5.369 -20.315 14.690 1.00 54.06 O ATOM 2303 OP2 DG D 13 4.728 -20.982 12.310 1.00 53.82 O ATOM 2304 O5' DG D 13 5.066 -18.575 12.894 1.00 53.66 O ATOM 2305 C5' DG D 13 5.762 -17.470 13.485 1.00 53.42 C ATOM 2306 C4' DG D 13 5.349 -16.127 12.891 1.00 53.45 C ATOM 2307 O4' DG D 13 6.508 -15.494 12.282 1.00 53.57 O ATOM 2308 C3' DG D 13 4.302 -16.141 11.773 1.00 53.42 C ATOM 2309 O3' DG D 13 3.607 -14.875 11.744 1.00 53.09 O ATOM 2310 C2' DG D 13 5.180 -16.430 10.555 1.00 53.41 C ATOM 2311 C1' DG D 13 6.434 -15.612 10.866 1.00 53.26 C ATOM 2312 N9 DG D 13 7.685 -16.192 10.374 1.00 53.13 N ATOM 2313 C8 DG D 13 7.984 -17.524 10.168 1.00 52.99 C ATOM 2314 N7 DG D 13 9.195 -17.718 9.727 1.00 52.96 N ATOM 2315 C5 DG D 13 9.730 -16.439 9.637 1.00 53.00 C ATOM 2316 C6 DG D 13 11.014 -16.019 9.216 1.00 53.02 C ATOM 2317 O6 DG D 13 11.956 -16.725 8.834 1.00 53.03 O ATOM 2318 N1 DG D 13 11.165 -14.634 9.279 1.00 52.90 N ATOM 2319 C2 DG D 13 10.172 -13.773 9.689 1.00 52.84 C ATOM 2320 N2 DG D 13 10.486 -12.476 9.677 1.00 52.98 N ATOM 2321 N3 DG D 13 8.962 -14.145 10.089 1.00 52.53 N ATOM 2322 C4 DG D 13 8.814 -15.490 10.033 1.00 52.82 C ATOM 2323 P DA D 14 2.727 -14.343 10.506 1.00 52.39 P ATOM 2324 OP1 DA D 14 1.665 -13.459 11.042 1.00 52.38 O ATOM 2325 OP2 DA D 14 2.376 -15.481 9.624 1.00 51.98 O ATOM 2326 O5' DA D 14 3.783 -13.409 9.766 1.00 51.06 O ATOM 2327 C5' DA D 14 4.420 -12.406 10.533 1.00 49.85 C ATOM 2328 C4' DA D 14 5.060 -11.380 9.632 1.00 49.14 C ATOM 2329 O4' DA D 14 6.314 -11.905 9.133 1.00 48.66 O ATOM 2330 C3' DA D 14 4.245 -10.986 8.408 1.00 48.67 C ATOM 2331 O3' DA D 14 4.483 -9.599 8.184 1.00 48.66 O ATOM 2332 C2' DA D 14 4.805 -11.915 7.335 1.00 48.62 C ATOM 2333 C1' DA D 14 6.278 -11.949 7.723 1.00 48.49 C ATOM 2334 N9 DA D 14 7.027 -13.136 7.323 1.00 48.49 N ATOM 2335 C8 DA D 14 6.633 -14.451 7.339 1.00 48.31 C ATOM 2336 N7 DA D 14 7.556 -15.288 6.925 1.00 47.97 N ATOM 2337 C5 DA D 14 8.627 -14.462 6.625 1.00 48.35 C ATOM 2338 C6 DA D 14 9.923 -14.720 6.137 1.00 48.46 C ATOM 2339 N6 DA D 14 10.357 -15.951 5.856 1.00 48.31 N ATOM 2340 N1 DA D 14 10.749 -13.659 5.951 1.00 48.50 N ATOM 2341 C2 DA D 14 10.311 -12.421 6.227 1.00 48.25 C ATOM 2342 N3 DA D 14 9.115 -12.056 6.691 1.00 48.07 N ATOM 2343 C4 DA D 14 8.320 -13.131 6.867 1.00 48.41 C ATOM 2344 P DA D 15 3.892 -8.757 6.957 1.00 48.31 P ATOM 2345 OP1 DA D 15 3.491 -7.433 7.483 1.00 48.14 O ATOM 2346 OP2 DA D 15 2.932 -9.589 6.197 1.00 48.05 O ATOM 2347 O5' DA D 15 5.208 -8.529 6.094 1.00 47.23 O ATOM 2348 C5' DA D 15 6.307 -7.886 6.712 1.00 46.64 C ATOM 2349 C4' DA D 15 7.346 -7.585 5.663 1.00 46.38 C ATOM 2350 O4' DA D 15 8.006 -8.823 5.308 1.00 46.11 O ATOM 2351 C3' DA D 15 6.776 -6.998 4.372 1.00 46.32 C ATOM 2352 O3' DA D 15 7.630 -5.940 3.942 1.00 45.69 O ATOM 2353 C2' DA D 15 6.703 -8.206 3.435 1.00 46.14 C ATOM 2354 C1' DA D 15 7.853 -9.071 3.927 1.00 45.85 C ATOM 2355 N9 DA D 15 7.629 -10.495 3.756 1.00 45.66 N ATOM 2356 C8 DA D 15 6.483 -11.205 3.986 1.00 45.54 C ATOM 2357 N7 DA D 15 6.602 -12.486 3.734 1.00 45.48 N ATOM 2358 C5 DA D 15 7.915 -12.619 3.317 1.00 45.57 C ATOM 2359 C6 DA D 15 8.680 -13.728 2.901 1.00 45.72 C ATOM 2360 N6 DA D 15 8.203 -14.974 2.837 1.00 45.50 N ATOM 2361 N1 DA D 15 9.964 -13.500 2.548 1.00 45.78 N ATOM 2362 C2 DA D 15 10.455 -12.250 2.612 1.00 45.66 C ATOM 2363 N3 DA D 15 9.833 -11.136 2.989 1.00 45.30 N ATOM 2364 C4 DA D 15 8.561 -11.396 3.327 1.00 45.45 C ATOM 2365 P DA D 16 7.605 -5.349 2.463 1.00 44.39 P ATOM 2366 OP1 DA D 16 8.184 -3.989 2.584 1.00 44.02 O ATOM 2367 OP2 DA D 16 6.280 -5.564 1.824 1.00 43.55 O ATOM 2368 O5' DA D 16 8.660 -6.317 1.759 1.00 43.55 O ATOM 2369 C5' DA D 16 9.992 -6.357 2.257 1.00 42.82 C ATOM 2370 C4' DA D 16 10.940 -6.824 1.177 1.00 42.39 C ATOM 2371 O4' DA D 16 10.804 -8.259 1.048 1.00 42.47 O ATOM 2372 C3' DA D 16 10.678 -6.237 -0.210 1.00 42.20 C ATOM 2373 O3' DA D 16 11.931 -5.902 -0.819 1.00 41.48 O ATOM 2374 C2' DA D 16 9.881 -7.335 -0.921 1.00 41.91 C ATOM 2375 C1' DA D 16 10.417 -8.603 -0.268 1.00 41.75 C ATOM 2376 N9 DA D 16 9.465 -9.715 -0.203 1.00 41.35 N ATOM 2377 C8 DA D 16 8.128 -9.704 0.092 1.00 41.16 C ATOM 2378 N7 DA D 16 7.566 -10.890 0.057 1.00 40.57 N ATOM 2379 C5 DA D 16 8.606 -11.729 -0.277 1.00 40.53 C ATOM 2380 C6 DA D 16 8.687 -13.118 -0.476 1.00 41.18 C ATOM 2381 N6 DA D 16 7.654 -13.955 -0.358 1.00 41.13 N ATOM 2382 N1 DA D 16 9.892 -13.624 -0.803 1.00 41.51 N ATOM 2383 C2 DA D 16 10.946 -12.802 -0.920 1.00 41.45 C ATOM 2384 N3 DA D 16 10.991 -11.485 -0.758 1.00 40.88 N ATOM 2385 C4 DA D 16 9.778 -11.019 -0.438 1.00 40.65 C ATOM 2386 P DT D 17 12.025 -5.304 -2.294 1.00 39.97 P ATOM 2387 OP1 DT D 17 13.229 -4.447 -2.404 1.00 39.56 O ATOM 2388 OP2 DT D 17 10.686 -4.787 -2.659 1.00 38.89 O ATOM 2389 O5' DT D 17 12.317 -6.653 -3.093 1.00 40.19 O ATOM 2390 C5' DT D 17 13.562 -7.317 -2.921 1.00 40.26 C ATOM 2391 C4' DT D 17 13.522 -8.669 -3.599 1.00 40.56 C ATOM 2392 O4' DT D 17 12.429 -9.450 -3.081 1.00 40.12 O ATOM 2393 C3' DT D 17 13.219 -8.605 -5.082 1.00 41.31 C ATOM 2394 O3' DT D 17 14.412 -8.521 -5.829 1.00 43.39 O ATOM 2395 C2' DT D 17 12.465 -9.892 -5.392 1.00 40.51 C ATOM 2396 C1' DT D 17 12.147 -10.461 -4.024 1.00 39.35 C ATOM 2397 N1 DT D 17 10.730 -10.852 -3.899 1.00 38.53 N ATOM 2398 C2 DT D 17 10.389 -12.177 -4.033 1.00 38.26 C ATOM 2399 O2 DT D 17 11.197 -13.059 -4.252 1.00 38.42 O ATOM 2400 N3 DT D 17 9.053 -12.444 -3.909 1.00 38.07 N ATOM 2401 C4 DT D 17 8.061 -11.524 -3.650 1.00 38.32 C ATOM 2402 O4 DT D 17 6.892 -11.863 -3.551 1.00 38.30 O ATOM 2403 C5 DT D 17 8.484 -10.153 -3.524 1.00 38.44 C ATOM 2404 C7 DT D 17 7.481 -9.078 -3.224 1.00 38.56 C ATOM 2405 C6 DT D 17 9.786 -9.877 -3.657 1.00 38.38 C ATOM 2406 P DG D 18 14.332 -7.918 -7.308 1.00 45.20 P ATOM 2407 OP1 DG D 18 15.407 -6.905 -7.412 1.00 45.20 O ATOM 2408 OP2 DG D 18 12.921 -7.558 -7.583 1.00 45.11 O ATOM 2409 O5' DG D 18 14.681 -9.137 -8.273 1.00 45.32 O ATOM 2410 C5' DG D 18 15.586 -10.146 -7.880 1.00 46.27 C ATOM 2411 C4' DG D 18 15.162 -11.423 -8.564 1.00 46.85 C ATOM 2412 O4' DG D 18 13.894 -11.863 -8.016 1.00 46.72 O ATOM 2413 C3' DG D 18 14.968 -11.287 -10.073 1.00 47.18 C ATOM 2414 O3' DG D 18 15.675 -12.377 -10.667 1.00 48.02 O ATOM 2415 C2' DG D 18 13.444 -11.252 -10.219 1.00 46.91 C ATOM 2416 C1' DG D 18 13.003 -12.137 -9.068 1.00 46.70 C ATOM 2417 N9 DG D 18 11.666 -11.891 -8.555 1.00 46.62 N ATOM 2418 C8 DG D 18 11.013 -10.694 -8.400 1.00 46.76 C ATOM 2419 N7 DG D 18 9.814 -10.822 -7.898 1.00 46.74 N ATOM 2420 C5 DG D 18 9.672 -12.189 -7.706 1.00 46.65 C ATOM 2421 C6 DG D 18 8.589 -12.946 -7.193 1.00 46.70 C ATOM 2422 O6 DG D 18 7.494 -12.545 -6.781 1.00 46.77 O ATOM 2423 N1 DG D 18 8.863 -14.311 -7.168 1.00 46.73 N ATOM 2424 C2 DG D 18 10.044 -14.868 -7.601 1.00 46.80 C ATOM 2425 N2 DG D 18 10.143 -16.199 -7.507 1.00 46.88 N ATOM 2426 N3 DG D 18 11.065 -14.177 -8.083 1.00 46.76 N ATOM 2427 C4 DG D 18 10.807 -12.851 -8.105 1.00 46.54 C ATOM 2428 P DA D 19 15.292 -13.132 -12.021 1.00 48.71 P ATOM 2429 OP1 DA D 19 16.553 -13.733 -12.508 1.00 48.50 O ATOM 2430 OP2 DA D 19 14.499 -12.243 -12.912 1.00 47.94 O ATOM 2431 O5' DA D 19 14.343 -14.291 -11.445 1.00 49.38 O ATOM 2432 C5' DA D 19 14.410 -15.645 -11.898 1.00 49.68 C ATOM 2433 C4' DA D 19 13.096 -16.023 -12.549 1.00 49.84 C ATOM 2434 O4' DA D 19 12.032 -15.588 -11.671 1.00 49.78 O ATOM 2435 C3' DA D 19 12.843 -15.324 -13.887 1.00 50.03 C ATOM 2436 O3' DA D 19 13.217 -16.093 -15.070 1.00 50.35 O ATOM 2437 C2' DA D 19 11.363 -14.955 -13.852 1.00 49.92 C ATOM 2438 C1' DA D 19 10.888 -15.333 -12.450 1.00 49.98 C ATOM 2439 N9 DA D 19 10.088 -14.272 -11.844 1.00 50.14 N ATOM 2440 C8 DA D 19 10.410 -12.946 -11.728 1.00 50.19 C ATOM 2441 N7 DA D 19 9.479 -12.222 -11.153 1.00 50.20 N ATOM 2442 C5 DA D 19 8.477 -13.139 -10.876 1.00 50.11 C ATOM 2443 C6 DA D 19 7.209 -13.016 -10.269 1.00 50.00 C ATOM 2444 N6 DA D 19 6.716 -11.868 -9.807 1.00 50.12 N ATOM 2445 N1 DA D 19 6.458 -14.128 -10.147 1.00 50.11 N ATOM 2446 C2 DA D 19 6.938 -15.293 -10.602 1.00 50.18 C ATOM 2447 N3 DA D 19 8.109 -15.535 -11.193 1.00 50.14 N ATOM 2448 C4 DA D 19 8.836 -14.407 -11.297 1.00 50.15 C ATOM 2449 P DC D 20 12.819 -17.606 -15.442 1.00 50.44 P ATOM 2450 OP1 DC D 20 13.570 -18.519 -14.549 1.00 50.25 O ATOM 2451 OP2 DC D 20 12.971 -17.727 -16.909 1.00 50.41 O ATOM 2452 O5' DC D 20 11.260 -17.731 -15.118 1.00 50.16 O ATOM 2453 C5' DC D 20 10.281 -17.555 -16.134 1.00 49.80 C ATOM 2454 C4' DC D 20 8.904 -17.654 -15.514 1.00 49.66 C ATOM 2455 O4' DC D 20 8.756 -16.606 -14.536 1.00 49.59 O ATOM 2456 C3' DC D 20 7.733 -17.449 -16.456 1.00 49.78 C ATOM 2457 O3' DC D 20 7.415 -18.690 -17.092 1.00 50.27 O ATOM 2458 C2' DC D 20 6.636 -16.972 -15.506 1.00 49.59 C ATOM 2459 C1' DC D 20 7.382 -16.374 -14.316 1.00 49.36 C ATOM 2460 N1 DC D 20 7.148 -14.897 -14.095 1.00 49.17 N ATOM 2461 C2 DC D 20 5.922 -14.477 -13.549 1.00 49.11 C ATOM 2462 O2 DC D 20 5.058 -15.320 -13.266 1.00 48.85 O ATOM 2463 N3 DC D 20 5.711 -13.152 -13.342 1.00 48.87 N ATOM 2464 C4 DC D 20 6.656 -12.266 -13.646 1.00 48.86 C ATOM 2465 N4 DC D 20 6.388 -10.979 -13.419 1.00 48.85 N ATOM 2466 C5 DC D 20 7.910 -12.666 -14.200 1.00 48.79 C ATOM 2467 C6 DC D 20 8.115 -13.974 -14.411 1.00 48.85 C ATOM 2468 P DC D 21 7.095 -18.829 -18.660 1.00 50.46 P ATOM 2469 OP1 DC D 21 7.185 -20.265 -19.004 1.00 50.41 O ATOM 2470 OP2 DC D 21 7.904 -17.838 -19.406 1.00 50.51 O ATOM 2471 O5' DC D 21 5.563 -18.389 -18.759 1.00 50.60 O ATOM 2472 C5' DC D 21 4.583 -19.008 -17.935 1.00 50.89 C ATOM 2473 C4' DC D 21 3.426 -18.059 -17.705 1.00 51.07 C ATOM 2474 O4' DC D 21 3.868 -16.895 -16.965 1.00 51.19 O ATOM 2475 C3' DC D 21 2.806 -17.525 -18.992 1.00 51.24 C ATOM 2476 O3' DC D 21 1.499 -18.033 -19.124 1.00 51.72 O ATOM 2477 C2' DC D 21 2.792 -16.010 -18.832 1.00 51.20 C ATOM 2478 C1' DC D 21 3.054 -15.808 -17.349 1.00 51.17 C ATOM 2479 N1 DC D 21 3.716 -14.493 -17.068 1.00 51.20 N ATOM 2480 C2 DC D 21 2.929 -13.398 -16.681 1.00 51.19 C ATOM 2481 O2 DC D 21 1.704 -13.538 -16.566 1.00 51.02 O ATOM 2482 N3 DC D 21 3.538 -12.208 -16.435 1.00 51.14 N ATOM 2483 C4 DC D 21 4.860 -12.089 -16.569 1.00 50.95 C ATOM 2484 N4 DC D 21 5.402 -10.898 -16.320 1.00 51.05 N ATOM 2485 C5 DC D 21 5.680 -13.185 -16.967 1.00 50.95 C ATOM 2486 C6 DC D 21 5.073 -14.355 -17.214 1.00 51.12 C ATOM 2487 P DA D 22 0.838 -18.197 -20.569 1.00 52.20 P ATOM 2488 OP1 DA D 22 1.397 -19.444 -21.140 1.00 52.18 O ATOM 2489 OP2 DA D 22 0.974 -16.915 -21.306 1.00 51.73 O ATOM 2490 O5' DA D 22 -0.715 -18.442 -20.236 1.00 51.94 O ATOM 2491 C5' DA D 22 -1.357 -17.949 -19.050 1.00 51.60 C ATOM 2492 C4' DA D 22 -1.969 -16.564 -19.232 1.00 51.39 C ATOM 2493 O4' DA D 22 -0.982 -15.541 -18.966 1.00 51.32 O ATOM 2494 C3' DA D 22 -2.526 -16.237 -20.619 1.00 51.29 C ATOM 2495 O3' DA D 22 -3.961 -16.382 -20.516 1.00 51.24 O ATOM 2496 C2' DA D 22 -1.946 -14.848 -20.952 1.00 51.09 C ATOM 2497 C1' DA D 22 -1.396 -14.366 -19.619 1.00 51.13 C ATOM 2498 N9 DA D 22 -0.237 -13.477 -19.657 1.00 51.16 N ATOM 2499 C8 DA D 22 0.927 -13.632 -20.359 1.00 51.23 C ATOM 2500 N7 DA D 22 1.798 -12.668 -20.174 1.00 51.05 N ATOM 2501 C5 DA D 22 1.164 -11.820 -19.286 1.00 51.06 C ATOM 2502 C6 DA D 22 1.548 -10.603 -18.684 1.00 51.23 C ATOM 2503 N6 DA D 22 2.722 -10.003 -18.904 1.00 51.26 N ATOM 2504 N1 DA D 22 0.668 -10.018 -17.843 1.00 51.18 N ATOM 2505 C2 DA D 22 -0.512 -10.605 -17.616 1.00 51.11 C ATOM 2506 N3 DA D 22 -0.980 -11.745 -18.122 1.00 51.14 N ATOM 2507 C4 DA D 22 -0.088 -12.307 -18.955 1.00 51.06 C ATOM 2508 P DA D 23 -5.064 -15.451 -21.209 1.00 51.04 P ATOM 2509 OP1 DA D 23 -6.377 -16.132 -21.099 1.00 50.67 O ATOM 2510 OP2 DA D 23 -4.565 -15.011 -22.536 1.00 50.85 O ATOM 2511 O5' DA D 23 -5.054 -14.209 -20.206 1.00 50.32 O ATOM 2512 C5' DA D 23 -6.184 -13.376 -20.057 1.00 49.59 C ATOM 2513 C4' DA D 23 -5.698 -11.954 -19.893 1.00 49.10 C ATOM 2514 O4' DA D 23 -4.275 -11.930 -20.129 1.00 48.58 O ATOM 2515 C3' DA D 23 -6.274 -10.940 -20.870 1.00 48.98 C ATOM 2516 O3' DA D 23 -7.259 -10.162 -20.208 1.00 49.40 O ATOM 2517 C2' DA D 23 -5.079 -10.100 -21.313 1.00 48.75 C ATOM 2518 C1' DA D 23 -3.948 -10.598 -20.427 1.00 48.62 C ATOM 2519 N9 DA D 23 -2.614 -10.557 -21.023 1.00 48.65 N ATOM 2520 C8 DA D 23 -2.054 -11.424 -21.923 1.00 48.54 C ATOM 2521 N7 DA D 23 -0.822 -11.114 -22.257 1.00 48.39 N ATOM 2522 C5 DA D 23 -0.559 -9.968 -21.525 1.00 48.37 C ATOM 2523 C6 DA D 23 0.571 -9.132 -21.420 1.00 48.41 C ATOM 2524 N6 DA D 23 1.711 -9.318 -22.086 1.00 48.46 N ATOM 2525 N1 DA D 23 0.485 -8.070 -20.592 1.00 48.70 N ATOM 2526 C2 DA D 23 -0.644 -7.852 -19.906 1.00 48.61 C ATOM 2527 N3 DA D 23 -1.766 -8.566 -19.921 1.00 48.58 N ATOM 2528 C4 DA D 23 -1.653 -9.616 -20.757 1.00 48.54 C ATOM 2529 P DA D 24 -8.241 -9.218 -21.046 1.00 49.88 P ATOM 2530 OP1 DA D 24 -9.535 -9.164 -20.326 1.00 50.04 O ATOM 2531 OP2 DA D 24 -8.191 -9.608 -22.473 1.00 49.39 O ATOM 2532 O5' DA D 24 -7.523 -7.801 -20.929 1.00 49.55 O ATOM 2533 C5' DA D 24 -7.305 -7.222 -19.655 1.00 49.22 C ATOM 2534 C4' DA D 24 -6.356 -6.051 -19.796 1.00 48.97 C ATOM 2535 O4' DA D 24 -5.044 -6.516 -20.215 1.00 48.89 O ATOM 2536 C3' DA D 24 -6.794 -5.021 -20.835 1.00 48.63 C ATOM 2537 O3' DA D 24 -6.714 -3.737 -20.243 1.00 48.12 O ATOM 2538 C2' DA D 24 -5.812 -5.244 -21.985 1.00 48.65 C ATOM 2539 C1' DA D 24 -4.561 -5.658 -21.227 1.00 48.55 C ATOM 2540 N9 DA D 24 -3.559 -6.359 -22.028 1.00 48.44 N ATOM 2541 C8 DA D 24 -3.710 -7.526 -22.730 1.00 48.48 C ATOM 2542 N7 DA D 24 -2.621 -7.913 -23.354 1.00 48.27 N ATOM 2543 C5 DA D 24 -1.700 -6.929 -23.047 1.00 48.20 C ATOM 2544 C6 DA D 24 -0.349 -6.739 -23.405 1.00 48.26 C ATOM 2545 N6 DA D 24 0.333 -7.582 -24.182 1.00 48.21 N ATOM 2546 N1 DA D 24 0.280 -5.642 -22.923 1.00 48.60 N ATOM 2547 C2 DA D 24 -0.396 -4.791 -22.138 1.00 48.66 C ATOM 2548 N3 DA D 24 -1.668 -4.863 -21.738 1.00 48.58 N ATOM 2549 C4 DA D 24 -2.264 -5.963 -22.231 1.00 48.29 C ATOM 2550 P DT D 25 -7.323 -2.444 -20.953 1.00 47.36 P ATOM 2551 OP1 DT D 25 -8.449 -1.951 -20.128 1.00 47.52 O ATOM 2552 OP2 DT D 25 -7.547 -2.747 -22.386 1.00 47.34 O ATOM 2553 O5' DT D 25 -6.092 -1.430 -20.819 1.00 46.21 O ATOM 2554 C5' DT D 25 -4.758 -1.916 -20.886 1.00 45.16 C ATOM 2555 C4' DT D 25 -3.815 -0.878 -21.447 1.00 44.89 C ATOM 2556 O4' DT D 25 -2.672 -1.623 -21.914 1.00 44.68 O ATOM 2557 C3' DT D 25 -4.374 -0.065 -22.623 1.00 45.20 C ATOM 2558 O3' DT D 25 -4.426 1.361 -22.435 1.00 45.18 O ATOM 2559 C2' DT D 25 -3.498 -0.435 -23.807 1.00 45.38 C ATOM 2560 C1' DT D 25 -2.363 -1.288 -23.247 1.00 45.13 C ATOM 2561 N1 DT D 25 -2.190 -2.514 -24.090 1.00 45.26 N ATOM 2562 C2 DT D 25 -0.960 -2.801 -24.654 1.00 44.98 C ATOM 2563 O2 DT D 25 0.032 -2.121 -24.488 1.00 44.79 O ATOM 2564 N3 DT D 25 -0.930 -3.925 -25.443 1.00 44.97 N ATOM 2565 C4 DT D 25 -1.987 -4.780 -25.688 1.00 45.06 C ATOM 2566 O4 DT D 25 -1.851 -5.768 -26.396 1.00 44.91 O ATOM 2567 C5 DT D 25 -3.250 -4.423 -25.087 1.00 45.27 C ATOM 2568 C7 DT D 25 -4.490 -5.214 -25.384 1.00 45.30 C ATOM 2569 C6 DT D 25 -3.292 -3.323 -24.323 1.00 45.48 C ATOM 2570 P DT D 26 -3.195 2.341 -22.130 1.00 45.32 P ATOM 2571 OP1 DT D 26 -2.885 2.163 -20.697 1.00 45.83 O ATOM 2572 OP2 DT D 26 -3.606 3.679 -22.603 1.00 45.74 O ATOM 2573 O5' DT D 26 -1.939 1.894 -23.027 1.00 44.36 O ATOM 2574 C5' DT D 26 -0.670 1.738 -22.394 1.00 43.77 C ATOM 2575 C4' DT D 26 0.520 1.985 -23.302 1.00 43.18 C ATOM 2576 O4' DT D 26 0.601 0.962 -24.318 1.00 42.37 O ATOM 2577 C3' DT D 26 0.534 3.312 -24.050 1.00 42.84 C ATOM 2578 O3' DT D 26 1.887 3.753 -24.107 1.00 43.38 O ATOM 2579 C2' DT D 26 -0.047 2.943 -25.405 1.00 42.37 C ATOM 2580 C1' DT D 26 0.531 1.541 -25.605 1.00 42.04 C ATOM 2581 N1 DT D 26 -0.249 0.533 -26.405 1.00 41.73 N ATOM 2582 C2 DT D 26 0.433 -0.469 -27.073 1.00 41.51 C ATOM 2583 O2 DT D 26 1.649 -0.576 -27.083 1.00 41.37 O ATOM 2584 N3 DT D 26 -0.370 -1.361 -27.743 1.00 41.37 N ATOM 2585 C4 DT D 26 -1.753 -1.340 -27.814 1.00 41.39 C ATOM 2586 O4 DT D 26 -2.386 -2.179 -28.443 1.00 41.52 O ATOM 2587 C5 DT D 26 -2.402 -0.280 -27.091 1.00 41.24 C ATOM 2588 C7 DT D 26 -3.897 -0.193 -27.025 1.00 40.88 C ATOM 2589 C6 DT D 26 -1.631 0.588 -26.432 1.00 41.57 C ATOM 2590 P DT D 27 2.324 5.151 -24.742 1.00 44.01 P ATOM 2591 OP1 DT D 27 3.375 5.774 -23.906 1.00 43.60 O ATOM 2592 OP2 DT D 27 1.105 5.911 -25.096 1.00 43.76 O ATOM 2593 O5' DT D 27 3.046 4.619 -26.057 1.00 44.92 O ATOM 2594 C5' DT D 27 4.294 3.941 -25.910 1.00 45.32 C ATOM 2595 C4' DT D 27 4.727 3.301 -27.215 1.00 45.34 C ATOM 2596 O4' DT D 27 3.786 2.260 -27.581 1.00 45.39 O ATOM 2597 C3' DT D 27 4.780 4.274 -28.384 1.00 45.19 C ATOM 2598 O3' DT D 27 6.122 4.693 -28.600 1.00 44.50 O ATOM 2599 C2' DT D 27 4.198 3.492 -29.562 1.00 45.64 C ATOM 2600 C1' DT D 27 3.743 2.151 -28.985 1.00 45.55 C ATOM 2601 N1 DT D 27 2.354 1.756 -29.376 1.00 45.53 N ATOM 2602 C2 DT D 27 2.162 0.685 -30.225 1.00 45.66 C ATOM 2603 O2 DT D 27 3.070 0.023 -30.697 1.00 45.73 O ATOM 2604 N3 DT D 27 0.849 0.397 -30.508 1.00 45.69 N ATOM 2605 C4 DT D 27 -0.264 1.084 -30.052 1.00 45.65 C ATOM 2606 O4 DT D 27 -1.408 0.761 -30.362 1.00 45.54 O ATOM 2607 C5 DT D 27 0.003 2.194 -29.174 1.00 45.71 C ATOM 2608 C7 DT D 27 -1.125 3.096 -28.768 1.00 45.96 C ATOM 2609 C6 DT D 27 1.281 2.475 -28.879 1.00 45.62 C TER 2610 DT D 27 HETATM 2611 O HOH A 99 15.769 18.256 -3.299 1.00 21.42 O HETATM 2612 O HOH A 100 3.527 34.258 1.952 1.00 18.27 O HETATM 2613 O HOH A 101 23.406 -2.354 10.355 1.00 21.29 O HETATM 2614 O HOH A 102 3.650 30.852 6.909 1.00 56.28 O HETATM 2615 O HOH A 103 15.753 4.044 -13.642 1.00 18.44 O HETATM 2616 O HOH A 104 -9.936 15.864 12.272 1.00 41.98 O HETATM 2617 O HOH B 99 0.527 12.122 -0.370 1.00 27.97 O HETATM 2618 O HOH B 100 28.165 12.977 1.942 1.00 15.81 O MASTER 399 0 0 9 4 0 0 6 2614 4 0 22 END
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Related entries of code: 3jra
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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Complexes with the same small molecule ligand
PDB Code
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Ligand Name
3jr9
RCSB PDB
PDBbind
27 -mer
3jrb
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PDBbind
27 -mer
3jrd
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PDBbind
27 -mer
3jre
RCSB PDB
PDBbind
27 -mer
3jrf
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
3jra
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
DNA-binding protein fis
Ligand Name
27 -mer
EC.Number
E.C.-.-.-.-
Resolution
3.11(Å)
Affinity (Kd/Ki/IC50)
Kd=8nM
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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