Browse entries in the PDBbind-CN Database
HEADER DNA BINDING PROTEIN/DNA 31-AUG-09 3IV5 TITLE CRYSTAL STRUCTURE OF FIS BOUND TO 27 BP OPTIMAL BINDING SEQUENCE F1 COMPND MOL_ID: 1; COMPND 2 MOLECULE: DNA-BINDING PROTEIN FIS; COMPND 3 CHAIN: A, B; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: DNA (27-MER); COMPND 7 CHAIN: C; COMPND 8 ENGINEERED: YES; COMPND 9 MOL_ID: 3; COMPND 10 MOLECULE: DNA (27-MER); COMPND 11 CHAIN: D; COMPND 12 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; SOURCE 3 ORGANISM_TAXID: 83333; SOURCE 4 STRAIN: K-12; SOURCE 5 GENE: FIS, B3261, JW3229; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PET11A; SOURCE 11 MOL_ID: 2; SOURCE 12 SYNTHETIC: YES; SOURCE 13 MOL_ID: 3; SOURCE 14 SYNTHETIC: YES KEYWDS HTH DOMAIN, PROTEIN-DNA COMPLEX, MINOR GROOVE COMPRESSION, DNA KEYWDS 2 BENDING, INDIRECT RECOGNITION, ACTIVATOR, DNA-BINDING, KEYWDS 3 TRANSCRIPTION, TRANSCRIPTION REGULATION, DNA BINDING PROTEIN-DNA KEYWDS 4 COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR S.STELLA,D.CASCIO,R.C.JOHNSON REVDAT 3 01-NOV-17 3IV5 1 REMARK REVDAT 2 13-JUL-11 3IV5 1 VERSN REVDAT 1 28-APR-10 3IV5 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. 2.90 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.2.0019 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.90 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 77.15 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 91.2 REMARK 3 NUMBER OF REFLECTIONS : 13160 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) : 0.203 REMARK 3 R VALUE (WORKING SET) : 0.201 REMARK 3 FREE R VALUE : 0.240 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 656 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.90 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.98 REMARK 3 REFLECTION IN BIN (WORKING SET) : 178 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 18.63 REMARK 3 BIN R VALUE (WORKING SET) : 0.3040 REMARK 3 BIN FREE R VALUE SET COUNT : 12 REMARK 3 BIN FREE R VALUE : 0.2920 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 : 12 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) : 41.73 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): 0.695 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.334 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.222 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 : 0.942 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.921 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2752 ; 0.014 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): 1523 ; 0.005 ; 0.020 REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 3942 ; 1.804 ; 2.470 REMARK 3 BOND ANGLES OTHERS (DEGREES): 3785 ; 1.137 ; 3.000 REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 187 ; 4.538 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 75 ;38.558 ;25.600 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 303 ;17.687 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 11 ;13.252 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): NULL ; NULL ; NULL REMARK 3 GENERAL PLANES REFINED ATOMS (A): 2210 ; 0.005 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): 274 ; 0.001 ; 0.020 REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 577 ; 0.221 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): 1725 ; 0.225 ; 0.200 REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): 1273 ; 0.214 ; 0.200 REMARK 3 NON-BONDED TORSION OTHERS (A): 1149 ; 0.095 ; 0.200 REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 51 ; 0.129 ; 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): 21 ; 0.203 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): 48 ; 0.257 ; 0.200 REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 9 ; 0.174 ; 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): 12.6907 10.7137 8.9165 REMARK 3 T TENSOR REMARK 3 T11: 0.0051 T22: 0.0890 REMARK 3 T33: -0.0810 T12: 0.0382 REMARK 3 T13: 0.0134 T23: -0.0083 REMARK 3 L TENSOR REMARK 3 L11: 0.2369 L22: 1.2196 REMARK 3 L33: 0.9316 L12: -0.1291 REMARK 3 L13: 0.3498 L23: 0.5001 REMARK 3 S TENSOR REMARK 3 S11: -0.0003 S12: -0.0233 S13: 0.0538 REMARK 3 S21: 0.1500 S22: 0.0993 S23: 0.0670 REMARK 3 S31: 0.2171 S32: 0.1489 S33: -0.0990 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): 9.6665 11.0171 2.1336 REMARK 3 T TENSOR REMARK 3 T11: -0.0244 T22: 0.0162 REMARK 3 T33: -0.0098 T12: 0.0110 REMARK 3 T13: -0.0066 T23: -0.0083 REMARK 3 L TENSOR REMARK 3 L11: 0.6854 L22: 0.5893 REMARK 3 L33: 0.8330 L12: 0.4134 REMARK 3 L13: -0.2620 L23: -0.2116 REMARK 3 S TENSOR REMARK 3 S11: -0.0273 S12: -0.0634 S13: 0.0565 REMARK 3 S21: 0.0057 S22: 0.0710 S23: 0.0363 REMARK 3 S31: 0.1404 S32: -0.0093 S33: -0.0437 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): 11.6482 -10.0389 5.3804 REMARK 3 T TENSOR REMARK 3 T11: 0.2276 T22: -0.1432 REMARK 3 T33: -0.0855 T12: 0.0124 REMARK 3 T13: -0.0958 T23: -0.0224 REMARK 3 L TENSOR REMARK 3 L11: 0.3249 L22: 0.0906 REMARK 3 L33: 0.2322 L12: -0.1480 REMARK 3 L13: 0.0028 L23: -0.0747 REMARK 3 S TENSOR REMARK 3 S11: 0.1102 S12: 0.0378 S13: -0.3161 REMARK 3 S21: 0.0237 S22: 0.2390 S23: 0.1225 REMARK 3 S31: 0.3536 S32: 0.0278 S33: -0.3491 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): 10.7345 -10.0423 6.0586 REMARK 3 T TENSOR REMARK 3 T11: 0.2234 T22: -0.2129 REMARK 3 T33: -0.1055 T12: 0.0156 REMARK 3 T13: -0.1055 T23: -0.0220 REMARK 3 L TENSOR REMARK 3 L11: 0.3771 L22: 0.0622 REMARK 3 L33: 1.0237 L12: 0.0756 REMARK 3 L13: -0.0811 L23: 0.2013 REMARK 3 S TENSOR REMARK 3 S11: 0.0840 S12: 0.0352 S13: -0.2882 REMARK 3 S21: 0.0859 S22: 0.1984 S23: 0.1438 REMARK 3 S31: 0.3953 S32: 0.0000 S33: -0.2824 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 3IV5 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 01-SEP-09. REMARK 100 THE DEPOSITION ID IS D_1000054903. 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 : 14386 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.900 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 (%) : 98.7 REMARK 200 DATA REDUNDANCY : 7.000 REMARK 200 R MERGE (I) : 0.09200 REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 10.1000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.90 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 3.00 REMARK 200 COMPLETENESS FOR SHELL (%) : 90.7 REMARK 200 DATA REDUNDANCY IN SHELL : 5.30 REMARK 200 R MERGE FOR SHELL (I) : 0.65700 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER REMARK 200 STARTING MODEL: 1ETO REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 68.92 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.96 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 21.54000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 77.25500 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 46.49000 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 77.25500 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 21.54000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 46.49000 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: 8790 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 18890 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -64.0 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. = 3.1 DEGREES REMARK 500 DA C 1 C3' - O3' - P ANGL. DEV. = 10.0 DEGREES REMARK 500 DT C 6 OP1 - P - OP2 ANGL. DEV. = 9.4 DEGREES REMARK 500 DT C 8 O4' - C4' - C3' ANGL. DEV. = -4.9 DEGREES REMARK 500 DT C 8 C1' - O4' - C4' ANGL. DEV. = -6.7 DEGREES REMARK 500 DT C 8 O4' - C1' - N1 ANGL. DEV. = 2.5 DEGREES REMARK 500 DT C 9 C5 - C4 - O4 ANGL. DEV. = -4.8 DEGREES REMARK 500 DT C 10 O4' - C1' - N1 ANGL. DEV. = 2.4 DEGREES REMARK 500 DT C 14 N3 - C2 - O2 ANGL. DEV. = -5.2 DEGREES REMARK 500 DT C 15 C4 - C5 - C7 ANGL. DEV. = 3.7 DEGREES REMARK 500 DT C 15 C6 - C5 - C7 ANGL. DEV. = -4.6 DEGREES REMARK 500 DT C 16 C5 - C4 - O4 ANGL. DEV. = -5.7 DEGREES REMARK 500 DT C 17 N3 - C4 - O4 ANGL. DEV. = 5.0 DEGREES REMARK 500 DT C 17 C5 - C4 - O4 ANGL. DEV. = -7.2 DEGREES REMARK 500 DG C 18 O4' - C1' - N9 ANGL. DEV. = 2.1 DEGREES REMARK 500 DA C 19 O4' - C1' - N9 ANGL. DEV. = 4.5 DEGREES REMARK 500 DA C 19 C3' - O3' - P ANGL. DEV. = 7.7 DEGREES REMARK 500 DG C 20 O4' - C1' - N9 ANGL. DEV. = 3.5 DEGREES REMARK 500 DC C 21 O4' - C1' - N1 ANGL. DEV. = 2.8 DEGREES REMARK 500 DA C 24 O4' - C1' - N9 ANGL. DEV. = -4.5 DEGREES REMARK 500 DA D 1 C3' - C2' - C1' ANGL. DEV. = -6.8 DEGREES REMARK 500 DA D 1 O4' - C1' - N9 ANGL. DEV. = 5.7 DEGREES REMARK 500 DA D 1 C3' - O3' - P ANGL. DEV. = 7.4 DEGREES REMARK 500 DA D 2 O4' - C1' - N9 ANGL. DEV. = 2.5 DEGREES REMARK 500 DC D 8 O4' - C4' - C3' ANGL. DEV. = -4.2 DEGREES REMARK 500 DC D 8 C1' - O4' - C4' ANGL. DEV. = -7.1 DEGREES REMARK 500 DT D 9 O5' - C5' - C4' ANGL. DEV. = -4.9 DEGREES REMARK 500 DT D 9 O4' - C1' - N1 ANGL. DEV. = 2.3 DEGREES REMARK 500 DT D 9 N3 - C2 - O2 ANGL. DEV. = -4.1 DEGREES REMARK 500 DC D 10 O4' - C1' - N1 ANGL. DEV. = 2.5 DEGREES REMARK 500 DA D 11 O4' - C1' - N9 ANGL. DEV. = 3.6 DEGREES REMARK 500 DA D 12 O4' - C1' - N9 ANGL. DEV. = 3.1 DEGREES REMARK 500 DA D 18 O5' - C5' - C4' ANGL. DEV. = -6.8 DEGREES REMARK 500 DA D 19 O4' - C1' - N9 ANGL. DEV. = 3.2 DEGREES REMARK 500 DC D 21 O4' - C1' - N1 ANGL. DEV. = 2.5 DEGREES REMARK 500 DC D 21 C3' - O3' - P ANGL. DEV. = 7.6 DEGREES REMARK 500 DT D 25 O4' - C1' - N1 ANGL. DEV. = 5.1 DEGREES REMARK 500 DT D 26 O4' - C1' - N1 ANGL. DEV. = -6.2 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 -68.46 -120.36 REMARK 500 ASP A 49 60.22 -111.45 REMARK 500 MET A 97 77.82 -106.70 REMARK 500 ASN B 43 72.90 -118.37 REMARK 500 ASP B 49 36.80 -144.55 REMARK 500 MET B 97 71.49 -107.58 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 3JR9 RELATED DB: PDB REMARK 900 RELATED ID: 3JRA RELATED DB: PDB REMARK 900 RELATED ID: 3JRB RELATED DB: PDB REMARK 900 RELATED ID: 3JRC RELATED DB: PDB REMARK 900 RELATED ID: 3JRD RELATED DB: PDB REMARK 900 RELATED ID: 3JRE RELATED DB: PDB REMARK 900 RELATED ID: 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 3IV5 A 1 98 UNP P0A6R3 FIS_ECOLI 1 98 DBREF 3IV5 B 1 98 UNP P0A6R3 FIS_ECOLI 1 98 DBREF 3IV5 C 1 27 PDB 3IV5 3IV5 1 27 DBREF 3IV5 D 1 27 PDB 3IV5 3IV5 1 27 SEQRES 1 A 98 MET PHE GLU GLN ARG VAL ASN SER ASP VAL LEU THR VAL SEQRES 2 A 98 SER THR VAL ASN SER GLN ASP GLN VAL THR GLN LYS PRO SEQRES 3 A 98 LEU ARG ASP SER VAL LYS GLN ALA LEU LYS ASN TYR PHE SEQRES 4 A 98 ALA GLN LEU ASN GLY GLN ASP VAL ASN ASP LEU TYR GLU SEQRES 5 A 98 LEU VAL LEU ALA GLU VAL GLU GLN PRO LEU LEU ASP MET SEQRES 6 A 98 VAL MET GLN TYR THR ARG GLY ASN GLN THR ARG ALA ALA SEQRES 7 A 98 LEU MET MET GLY ILE ASN ARG GLY THR LEU ARG LYS LYS SEQRES 8 A 98 LEU LYS LYS TYR GLY MET ASN SEQRES 1 B 98 MET PHE GLU GLN ARG VAL ASN SER ASP VAL LEU THR VAL SEQRES 2 B 98 SER THR VAL ASN SER GLN ASP GLN VAL THR GLN LYS PRO SEQRES 3 B 98 LEU ARG ASP SER VAL LYS GLN ALA LEU LYS ASN TYR PHE SEQRES 4 B 98 ALA GLN LEU ASN GLY GLN ASP VAL ASN ASP LEU TYR GLU SEQRES 5 B 98 LEU VAL LEU ALA GLU VAL GLU GLN PRO LEU LEU ASP MET SEQRES 6 B 98 VAL MET GLN TYR THR ARG GLY ASN GLN THR ARG ALA ALA SEQRES 7 B 98 LEU MET MET GLY ILE ASN ARG GLY THR LEU ARG LYS LYS SEQRES 8 B 98 LEU LYS LYS TYR GLY MET ASN SEQRES 1 C 27 DA DA DA DT DT DT DG DT DT DT DG DA DA SEQRES 2 C 27 DT DT DT DT DG DA DG DC DA DA DA DT DT SEQRES 3 C 27 DT SEQRES 1 D 27 DA DA DA DT DT DT DG DC DT DC DA DA DA SEQRES 2 D 27 DA DT DT DC DA DA DA DC DA DA DA DT DT SEQRES 3 D 27 DT FORMUL 5 HOH *12(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 GLN B 41 1 15 HELIX 7 7 ASP B 49 THR B 70 1 22 HELIX 8 8 ASN B 73 GLY B 82 1 10 HELIX 9 9 ASN B 84 TYR B 95 1 12 SHEET 1 A 2 THR A 12 VAL A 16 0 SHEET 2 A 2 VAL A 22 PRO A 26 -1 O LYS A 25 N VAL A 13 SHEET 1 B 2 THR B 12 VAL B 16 0 SHEET 2 B 2 VAL B 22 PRO B 26 -1 O THR B 23 N THR B 15 CISPEP 1 ASN B 43 GLY B 44 0 -4.02 CRYST1 43.080 92.980 154.510 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 0.023213 0.000000 0.000000 0.00000 SCALE2 0.000000 0.010755 0.000000 0.00000 SCALE3 0.000000 0.000000 0.006472 0.00000 ATOM 1 N SER A 8 -5.963 17.231 13.650 1.00 55.88 N ATOM 2 CA SER A 8 -6.070 15.974 12.830 1.00 58.67 C ATOM 3 C SER A 8 -4.708 15.237 12.537 1.00 59.29 C ATOM 4 O SER A 8 -4.616 14.002 12.702 1.00 60.08 O ATOM 5 CB SER A 8 -6.809 16.281 11.515 1.00 60.51 C ATOM 6 OG SER A 8 -6.895 15.118 10.700 1.00 61.44 O ATOM 7 N ASP A 9 -3.688 15.992 12.085 1.00 54.65 N ATOM 8 CA ASP A 9 -2.371 15.441 11.683 1.00 47.15 C ATOM 9 C ASP A 9 -1.428 15.594 12.837 1.00 38.79 C ATOM 10 O ASP A 9 -1.348 16.653 13.422 1.00 38.68 O ATOM 11 CB ASP A 9 -1.780 16.175 10.458 1.00 49.61 C ATOM 12 CG ASP A 9 -2.595 15.967 9.172 1.00 53.01 C ATOM 13 OD1 ASP A 9 -3.194 14.869 9.010 1.00 56.93 O ATOM 14 OD2 ASP A 9 -2.642 16.896 8.315 1.00 52.48 O ATOM 15 N VAL A 10 -0.700 14.540 13.158 1.00 34.18 N ATOM 16 CA VAL A 10 0.187 14.548 14.323 1.00 34.28 C ATOM 17 C VAL A 10 1.627 14.968 13.948 1.00 34.03 C ATOM 18 O VAL A 10 2.381 15.529 14.788 1.00 35.22 O ATOM 19 CB VAL A 10 0.170 13.157 15.043 1.00 34.00 C ATOM 20 CG1 VAL A 10 -1.287 12.664 15.301 1.00 30.24 C ATOM 21 CG2 VAL A 10 0.959 12.119 14.261 1.00 36.01 C ATOM 22 N LEU A 11 2.005 14.700 12.690 1.00 29.11 N ATOM 23 CA LEU A 11 3.343 15.047 12.190 1.00 23.35 C ATOM 24 C LEU A 11 3.308 16.264 11.263 1.00 21.29 C ATOM 25 O LEU A 11 2.926 16.175 10.077 1.00 17.55 O ATOM 26 CB LEU A 11 3.940 13.871 11.458 1.00 19.48 C ATOM 27 CG LEU A 11 4.245 12.612 12.268 1.00 17.08 C ATOM 28 CD1 LEU A 11 4.668 11.409 11.351 1.00 16.35 C ATOM 29 CD2 LEU A 11 5.318 12.945 13.245 1.00 18.12 C ATOM 30 N THR A 12 3.692 17.407 11.835 1.00 20.93 N ATOM 31 CA THR A 12 3.670 18.673 11.118 1.00 18.40 C ATOM 32 C THR A 12 4.859 19.566 11.432 1.00 18.56 C ATOM 33 O THR A 12 5.539 19.417 12.450 1.00 18.36 O ATOM 34 CB THR A 12 2.426 19.457 11.444 1.00 17.72 C ATOM 35 OG1 THR A 12 2.517 20.015 12.772 1.00 19.91 O ATOM 36 CG2 THR A 12 1.266 18.552 11.347 1.00 14.41 C ATOM 37 N VAL A 13 5.059 20.525 10.544 1.00 15.07 N ATOM 38 CA VAL A 13 6.224 21.374 10.591 1.00 14.34 C ATOM 39 C VAL A 13 5.803 22.837 10.477 1.00 15.87 C ATOM 40 O VAL A 13 4.725 23.138 10.003 1.00 24.41 O ATOM 41 CB VAL A 13 7.210 21.002 9.467 1.00 10.69 C ATOM 42 CG1 VAL A 13 7.372 19.502 9.414 1.00 8.92 C ATOM 43 CG2 VAL A 13 6.770 21.602 8.118 1.00 5.32 C ATOM 44 N SER A 14 6.667 23.736 10.914 1.00 10.93 N ATOM 45 CA SER A 14 6.320 25.129 10.977 1.00 12.49 C ATOM 46 C SER A 14 6.763 25.843 9.725 1.00 13.49 C ATOM 47 O SER A 14 7.914 25.756 9.328 1.00 22.00 O ATOM 48 CB SER A 14 6.970 25.767 12.189 1.00 15.26 C ATOM 49 OG SER A 14 6.835 24.903 13.287 1.00 20.50 O ATOM 50 N THR A 15 5.841 26.584 9.138 1.00 9.42 N ATOM 51 CA THR A 15 6.108 27.380 8.003 1.00 9.40 C ATOM 52 C THR A 15 5.895 28.817 8.437 1.00 11.51 C ATOM 53 O THR A 15 5.268 29.064 9.438 1.00 12.27 O ATOM 54 CB THR A 15 5.107 27.069 6.874 1.00 11.65 C ATOM 55 OG1 THR A 15 3.867 27.750 7.160 1.00 16.16 O ATOM 56 CG2 THR A 15 4.851 25.564 6.720 1.00 8.20 C ATOM 57 N VAL A 16 6.429 29.754 7.656 1.00 18.58 N ATOM 58 CA VAL A 16 6.100 31.175 7.775 1.00 21.06 C ATOM 59 C VAL A 16 5.810 31.763 6.429 1.00 22.43 C ATOM 60 O VAL A 16 6.588 31.539 5.500 1.00 20.16 O ATOM 61 CB VAL A 16 7.237 32.035 8.341 1.00 22.27 C ATOM 62 CG1 VAL A 16 7.341 31.794 9.788 1.00 27.92 C ATOM 63 CG2 VAL A 16 8.535 31.744 7.645 1.00 22.93 C ATOM 64 N ASN A 17 4.713 32.529 6.361 1.00 21.79 N ATOM 65 CA ASN A 17 4.381 33.314 5.171 1.00 24.19 C ATOM 66 C ASN A 17 4.940 34.715 5.216 1.00 24.30 C ATOM 67 O ASN A 17 5.599 35.097 6.175 1.00 26.13 O ATOM 68 CB ASN A 17 2.879 33.359 4.947 1.00 26.17 C ATOM 69 CG ASN A 17 2.128 33.952 6.108 1.00 27.77 C ATOM 70 OD1 ASN A 17 2.496 35.002 6.668 1.00 21.87 O ATOM 71 ND2 ASN A 17 1.035 33.277 6.468 1.00 30.53 N ATOM 72 N SER A 18 4.679 35.470 4.153 1.00 27.12 N ATOM 73 CA SER A 18 5.266 36.787 3.984 1.00 29.79 C ATOM 74 C SER A 18 4.711 37.769 4.988 1.00 32.00 C ATOM 75 O SER A 18 5.305 38.798 5.183 1.00 38.30 O ATOM 76 CB SER A 18 5.061 37.309 2.555 1.00 32.10 C ATOM 77 OG SER A 18 3.683 37.422 2.258 1.00 36.44 O ATOM 78 N GLN A 19 3.594 37.451 5.638 1.00 35.05 N ATOM 79 CA GLN A 19 3.047 38.289 6.704 1.00 35.53 C ATOM 80 C GLN A 19 3.616 37.837 8.069 1.00 33.13 C ATOM 81 O GLN A 19 3.060 38.136 9.114 1.00 32.99 O ATOM 82 CB GLN A 19 1.517 38.193 6.709 1.00 40.56 C ATOM 83 CG GLN A 19 0.745 39.231 5.879 1.00 46.21 C ATOM 84 CD GLN A 19 -0.810 39.116 6.100 1.00 51.08 C ATOM 85 OE1 GLN A 19 -1.442 38.122 5.697 1.00 54.48 O ATOM 86 NE2 GLN A 19 -1.411 40.138 6.752 1.00 57.58 N ATOM 87 N ASP A 20 4.724 37.106 8.060 1.00 31.50 N ATOM 88 CA ASP A 20 5.380 36.653 9.290 1.00 31.27 C ATOM 89 C ASP A 20 4.462 35.849 10.191 1.00 25.73 C ATOM 90 O ASP A 20 4.667 35.807 11.369 1.00 28.01 O ATOM 91 CB ASP A 20 6.018 37.831 10.055 1.00 40.03 C ATOM 92 CG ASP A 20 7.242 38.433 9.318 1.00 47.98 C ATOM 93 OD1 ASP A 20 8.101 37.673 8.831 1.00 53.61 O ATOM 94 OD2 ASP A 20 7.357 39.674 9.216 1.00 53.76 O ATOM 95 N GLN A 21 3.473 35.172 9.624 1.00 20.84 N ATOM 96 CA GLN A 21 2.618 34.281 10.384 1.00 18.43 C ATOM 97 C GLN A 21 3.121 32.846 10.329 1.00 16.35 C ATOM 98 O GLN A 21 3.338 32.292 9.255 1.00 16.05 O ATOM 99 CB GLN A 21 1.216 34.321 9.812 1.00 18.40 C ATOM 100 CG GLN A 21 0.526 35.673 9.886 1.00 22.13 C ATOM 101 CD GLN A 21 -0.737 35.744 9.068 1.00 22.21 C ATOM 102 OE1 GLN A 21 -1.605 36.583 9.304 1.00 27.04 O ATOM 103 NE2 GLN A 21 -0.834 34.886 8.081 1.00 22.44 N ATOM 104 N VAL A 22 3.296 32.229 11.488 1.00 17.70 N ATOM 105 CA VAL A 22 3.704 30.827 11.546 1.00 14.41 C ATOM 106 C VAL A 22 2.494 29.939 11.456 1.00 15.16 C ATOM 107 O VAL A 22 1.405 30.302 11.862 1.00 24.42 O ATOM 108 CB VAL A 22 4.484 30.489 12.821 1.00 11.38 C ATOM 109 CG1 VAL A 22 4.780 29.006 12.903 1.00 8.13 C ATOM 110 CG2 VAL A 22 5.780 31.276 12.858 1.00 8.21 C ATOM 111 N THR A 23 2.674 28.763 10.892 1.00 13.78 N ATOM 112 CA THR A 23 1.540 27.935 10.527 1.00 12.84 C ATOM 113 C THR A 23 2.034 26.521 10.234 1.00 15.41 C ATOM 114 O THR A 23 3.036 26.361 9.556 1.00 25.96 O ATOM 115 CB THR A 23 0.827 28.548 9.304 1.00 11.96 C ATOM 116 OG1 THR A 23 0.037 27.541 8.684 1.00 15.74 O ATOM 117 CG2 THR A 23 1.870 29.185 8.239 1.00 15.09 C ATOM 118 N GLN A 24 1.357 25.503 10.758 1.00 12.50 N ATOM 119 CA GLN A 24 1.784 24.122 10.533 1.00 13.91 C ATOM 120 C GLN A 24 1.435 23.618 9.156 1.00 16.60 C ATOM 121 O GLN A 24 0.530 24.129 8.508 1.00 25.78 O ATOM 122 CB GLN A 24 1.157 23.149 11.525 1.00 13.19 C ATOM 123 CG GLN A 24 1.481 23.419 12.990 1.00 12.06 C ATOM 124 CD GLN A 24 2.938 23.452 13.252 1.00 16.49 C ATOM 125 OE1 GLN A 24 3.485 24.535 13.475 1.00 18.79 O ATOM 126 NE2 GLN A 24 3.618 22.275 13.167 1.00 19.39 N ATOM 127 N LYS A 25 2.182 22.607 8.720 1.00 15.13 N ATOM 128 CA LYS A 25 1.828 21.826 7.552 1.00 16.82 C ATOM 129 C LYS A 25 2.336 20.429 7.723 1.00 16.75 C ATOM 130 O LYS A 25 3.369 20.225 8.355 1.00 17.89 O ATOM 131 CB LYS A 25 2.392 22.428 6.274 1.00 20.21 C ATOM 132 CG LYS A 25 3.697 21.871 5.795 1.00 17.84 C ATOM 133 CD LYS A 25 4.096 22.512 4.494 1.00 17.71 C ATOM 134 CE LYS A 25 5.637 22.622 4.319 1.00 19.06 C ATOM 135 NZ LYS A 25 5.848 23.927 3.559 1.00 19.52 N ATOM 136 N PRO A 26 1.635 19.458 7.129 1.00 16.70 N ATOM 137 CA PRO A 26 1.982 18.063 7.348 1.00 16.73 C ATOM 138 C PRO A 26 3.370 17.798 6.829 1.00 16.75 C ATOM 139 O PRO A 26 3.762 18.353 5.809 1.00 15.22 O ATOM 140 CB PRO A 26 0.997 17.305 6.462 1.00 16.17 C ATOM 141 CG PRO A 26 -0.090 18.278 6.160 1.00 14.96 C ATOM 142 CD PRO A 26 0.535 19.610 6.165 1.00 13.87 C ATOM 143 N LEU A 27 4.093 16.931 7.517 1.00 17.02 N ATOM 144 CA LEU A 27 5.421 16.542 7.088 1.00 16.39 C ATOM 145 C LEU A 27 5.405 16.088 5.650 1.00 20.93 C ATOM 146 O LEU A 27 6.308 16.404 4.890 1.00 27.78 O ATOM 147 CB LEU A 27 5.925 15.391 7.941 1.00 13.50 C ATOM 148 CG LEU A 27 7.311 14.845 7.583 1.00 10.72 C ATOM 149 CD1 LEU A 27 8.355 15.900 7.758 1.00 6.65 C ATOM 150 CD2 LEU A 27 7.601 13.702 8.494 1.00 10.38 C ATOM 151 N ARG A 28 4.375 15.344 5.284 1.00 18.74 N ATOM 152 CA ARG A 28 4.322 14.771 3.950 1.00 16.55 C ATOM 153 C ARG A 28 4.485 15.806 2.849 1.00 12.58 C ATOM 154 O ARG A 28 5.124 15.552 1.839 1.00 11.77 O ATOM 155 CB ARG A 28 3.022 14.004 3.791 1.00 16.47 C ATOM 156 CG ARG A 28 1.795 14.832 3.775 1.00 18.89 C ATOM 157 CD ARG A 28 0.593 13.891 3.799 1.00 25.71 C ATOM 158 NE ARG A 28 0.105 13.767 5.160 1.00 30.00 N ATOM 159 CZ ARG A 28 -0.909 14.466 5.665 1.00 31.56 C ATOM 160 NH1 ARG A 28 -1.622 15.325 4.941 1.00 29.60 N ATOM 161 NH2 ARG A 28 -1.226 14.294 6.923 1.00 36.47 N ATOM 162 N ASP A 29 3.924 16.985 3.077 1.00 12.60 N ATOM 163 CA ASP A 29 4.085 18.105 2.156 1.00 13.66 C ATOM 164 C ASP A 29 5.568 18.458 1.951 1.00 14.05 C ATOM 165 O ASP A 29 6.006 18.727 0.828 1.00 15.20 O ATOM 166 CB ASP A 29 3.342 19.350 2.679 1.00 19.83 C ATOM 167 CG ASP A 29 1.818 19.269 2.521 1.00 24.62 C ATOM 168 OD1 ASP A 29 1.188 20.355 2.613 1.00 29.58 O ATOM 169 OD2 ASP A 29 1.256 18.158 2.316 1.00 26.58 O ATOM 170 N SER A 30 6.340 18.482 3.036 1.00 14.06 N ATOM 171 CA SER A 30 7.798 18.697 2.920 1.00 13.09 C ATOM 172 C SER A 30 8.462 17.633 2.049 1.00 10.48 C ATOM 173 O SER A 30 9.249 17.932 1.164 1.00 7.98 O ATOM 174 CB SER A 30 8.451 18.767 4.305 1.00 13.96 C ATOM 175 OG SER A 30 8.118 20.011 4.912 1.00 21.62 O ATOM 176 N VAL A 31 8.083 16.390 2.295 1.00 10.95 N ATOM 177 CA VAL A 31 8.592 15.262 1.550 1.00 9.72 C ATOM 178 C VAL A 31 8.254 15.425 0.075 1.00 14.81 C ATOM 179 O VAL A 31 9.107 15.234 -0.787 1.00 20.93 O ATOM 180 CB VAL A 31 8.080 13.918 2.116 1.00 5.23 C ATOM 181 CG1 VAL A 31 8.520 12.797 1.263 1.00 4.01 C ATOM 182 CG2 VAL A 31 8.626 13.688 3.506 1.00 3.65 C ATOM 183 N LYS A 32 7.028 15.830 -0.223 1.00 18.30 N ATOM 184 CA LYS A 32 6.630 15.985 -1.622 1.00 20.60 C ATOM 185 C LYS A 32 7.522 17.047 -2.261 1.00 19.24 C ATOM 186 O LYS A 32 8.140 16.839 -3.309 1.00 14.97 O ATOM 187 CB LYS A 32 5.160 16.365 -1.715 1.00 26.76 C ATOM 188 CG LYS A 32 4.383 15.728 -2.860 1.00 30.99 C ATOM 189 CD LYS A 32 2.834 15.896 -2.639 1.00 36.19 C ATOM 190 CE LYS A 32 1.937 15.066 -3.625 1.00 39.52 C ATOM 191 NZ LYS A 32 1.575 15.693 -4.965 1.00 44.06 N ATOM 192 N GLN A 33 7.649 18.173 -1.578 1.00 20.65 N ATOM 193 CA GLN A 33 8.468 19.263 -2.093 1.00 19.52 C ATOM 194 C GLN A 33 9.879 18.799 -2.450 1.00 15.68 C ATOM 195 O GLN A 33 10.384 19.080 -3.526 1.00 13.51 O ATOM 196 CB GLN A 33 8.540 20.413 -1.083 1.00 19.10 C ATOM 197 CG GLN A 33 9.434 21.500 -1.609 1.00 22.53 C ATOM 198 CD GLN A 33 9.522 22.670 -0.709 1.00 27.39 C ATOM 199 OE1 GLN A 33 8.754 22.784 0.230 1.00 39.56 O ATOM 200 NE2 GLN A 33 10.480 23.566 -0.980 1.00 31.66 N ATOM 201 N ALA A 34 10.494 18.095 -1.504 1.00 13.85 N ATOM 202 CA ALA A 34 11.864 17.617 -1.631 1.00 12.06 C ATOM 203 C ALA A 34 12.011 16.831 -2.919 1.00 10.06 C ATOM 204 O ALA A 34 12.854 17.124 -3.744 1.00 15.66 O ATOM 205 CB ALA A 34 12.218 16.764 -0.426 1.00 10.28 C ATOM 206 N LEU A 35 11.142 15.853 -3.099 1.00 10.94 N ATOM 207 CA LEU A 35 11.138 15.031 -4.311 1.00 13.37 C ATOM 208 C LEU A 35 10.870 15.844 -5.587 1.00 13.19 C ATOM 209 O LEU A 35 11.552 15.669 -6.583 1.00 15.30 O ATOM 210 CB LEU A 35 10.095 13.922 -4.182 1.00 13.03 C ATOM 211 CG LEU A 35 10.388 12.945 -3.055 1.00 13.42 C ATOM 212 CD1 LEU A 35 9.208 12.045 -2.816 1.00 18.20 C ATOM 213 CD2 LEU A 35 11.617 12.125 -3.366 1.00 14.22 C ATOM 214 N LYS A 36 9.870 16.714 -5.567 1.00 10.25 N ATOM 215 CA LYS A 36 9.632 17.543 -6.724 1.00 16.29 C ATOM 216 C LYS A 36 10.953 18.191 -7.115 1.00 15.66 C ATOM 217 O LYS A 36 11.438 18.053 -8.229 1.00 21.40 O ATOM 218 CB LYS A 36 8.555 18.597 -6.438 1.00 19.60 C ATOM 219 CG LYS A 36 7.169 18.313 -7.062 1.00 30.42 C ATOM 220 CD LYS A 36 5.913 18.530 -6.101 1.00 35.47 C ATOM 221 CE LYS A 36 5.434 20.024 -5.926 1.00 41.34 C ATOM 222 NZ LYS A 36 4.443 20.239 -4.775 1.00 37.51 N ATOM 223 N ASN A 37 11.551 18.865 -6.166 1.00 19.34 N ATOM 224 CA ASN A 37 12.789 19.570 -6.414 1.00 20.93 C ATOM 225 C ASN A 37 13.850 18.635 -6.952 1.00 18.29 C ATOM 226 O ASN A 37 14.464 18.945 -7.939 1.00 20.86 O ATOM 227 CB ASN A 37 13.287 20.214 -5.117 1.00 27.87 C ATOM 228 CG ASN A 37 14.569 20.944 -5.303 1.00 28.73 C ATOM 229 OD1 ASN A 37 14.604 21.957 -5.985 1.00 34.56 O ATOM 230 ND2 ASN A 37 15.642 20.430 -4.710 1.00 31.84 N ATOM 231 N TYR A 38 14.053 17.505 -6.280 1.00 16.00 N ATOM 232 CA TYR A 38 14.978 16.463 -6.720 1.00 15.47 C ATOM 233 C TYR A 38 14.824 16.106 -8.195 1.00 17.38 C ATOM 234 O TYR A 38 15.785 16.168 -8.969 1.00 19.33 O ATOM 235 CB TYR A 38 14.778 15.193 -5.856 1.00 18.55 C ATOM 236 CG TYR A 38 15.758 14.040 -6.130 1.00 22.32 C ATOM 237 CD1 TYR A 38 17.148 14.246 -6.182 1.00 28.28 C ATOM 238 CD2 TYR A 38 15.308 12.755 -6.336 1.00 24.29 C ATOM 239 CE1 TYR A 38 18.040 13.188 -6.418 1.00 23.88 C ATOM 240 CE2 TYR A 38 16.199 11.695 -6.577 1.00 23.78 C ATOM 241 CZ TYR A 38 17.559 11.917 -6.605 1.00 23.25 C ATOM 242 OH TYR A 38 18.411 10.850 -6.856 1.00 23.21 O ATOM 243 N PHE A 39 13.613 15.719 -8.565 1.00 20.56 N ATOM 244 CA PHE A 39 13.335 15.292 -9.928 1.00 21.91 C ATOM 245 C PHE A 39 13.611 16.381 -10.946 1.00 21.59 C ATOM 246 O PHE A 39 14.057 16.081 -12.046 1.00 22.00 O ATOM 247 CB PHE A 39 11.880 14.851 -10.117 1.00 26.35 C ATOM 248 CG PHE A 39 11.498 13.592 -9.376 1.00 27.07 C ATOM 249 CD1 PHE A 39 10.245 13.471 -8.798 1.00 28.95 C ATOM 250 CD2 PHE A 39 12.367 12.546 -9.255 1.00 29.77 C ATOM 251 CE1 PHE A 39 9.871 12.336 -8.131 1.00 29.97 C ATOM 252 CE2 PHE A 39 11.996 11.398 -8.597 1.00 30.76 C ATOM 253 CZ PHE A 39 10.749 11.294 -8.030 1.00 30.88 C ATOM 254 N ALA A 40 13.304 17.629 -10.597 1.00 20.64 N ATOM 255 CA ALA A 40 13.568 18.756 -11.491 1.00 20.00 C ATOM 256 C ALA A 40 15.036 18.902 -11.715 1.00 21.90 C ATOM 257 O ALA A 40 15.456 19.045 -12.836 1.00 29.79 O ATOM 258 CB ALA A 40 13.024 20.043 -10.938 1.00 18.33 C ATOM 259 N GLN A 41 15.813 18.866 -10.638 1.00 29.66 N ATOM 260 CA GLN A 41 17.265 19.041 -10.714 1.00 32.75 C ATOM 261 C GLN A 41 17.876 18.041 -11.689 1.00 32.72 C ATOM 262 O GLN A 41 18.737 18.413 -12.457 1.00 36.62 O ATOM 263 CB GLN A 41 17.936 18.908 -9.344 1.00 36.19 C ATOM 264 CG GLN A 41 17.861 20.142 -8.456 1.00 38.64 C ATOM 265 CD GLN A 41 18.307 19.838 -6.984 1.00 44.40 C ATOM 266 OE1 GLN A 41 18.694 18.698 -6.621 1.00 51.49 O ATOM 267 NE2 GLN A 41 18.231 20.862 -6.138 1.00 47.32 N ATOM 268 N LEU A 42 17.441 16.786 -11.677 1.00 30.93 N ATOM 269 CA LEU A 42 18.078 15.794 -12.548 1.00 32.76 C ATOM 270 C LEU A 42 17.360 15.702 -13.863 1.00 35.71 C ATOM 271 O LEU A 42 16.227 15.241 -13.934 1.00 47.88 O ATOM 272 CB LEU A 42 18.166 14.419 -11.864 1.00 33.81 C ATOM 273 CG LEU A 42 17.012 13.708 -11.141 1.00 32.06 C ATOM 274 CD1 LEU A 42 15.904 13.152 -12.064 1.00 33.19 C ATOM 275 CD2 LEU A 42 17.643 12.572 -10.404 1.00 31.71 C ATOM 276 N ASN A 43 17.986 16.165 -14.917 1.00 34.47 N ATOM 277 CA ASN A 43 17.308 16.159 -16.195 1.00 34.53 C ATOM 278 C ASN A 43 17.449 14.814 -16.799 1.00 30.35 C ATOM 279 O ASN A 43 18.445 14.511 -17.434 1.00 36.24 O ATOM 280 CB ASN A 43 17.862 17.219 -17.123 1.00 39.80 C ATOM 281 CG ASN A 43 17.232 18.558 -16.866 1.00 45.75 C ATOM 282 OD1 ASN A 43 17.075 18.953 -15.706 1.00 47.66 O ATOM 283 ND2 ASN A 43 16.821 19.256 -17.939 1.00 47.96 N ATOM 284 N GLY A 44 16.453 13.986 -16.551 1.00 26.67 N ATOM 285 CA GLY A 44 16.402 12.652 -17.100 1.00 27.48 C ATOM 286 C GLY A 44 17.527 11.703 -16.742 1.00 28.83 C ATOM 287 O GLY A 44 17.617 10.632 -17.331 1.00 34.70 O ATOM 288 N GLN A 45 18.384 12.043 -15.783 1.00 28.13 N ATOM 289 CA GLN A 45 19.359 11.031 -15.304 1.00 25.91 C ATOM 290 C GLN A 45 18.533 9.976 -14.610 1.00 24.75 C ATOM 291 O GLN A 45 17.434 10.272 -14.155 1.00 30.46 O ATOM 292 CB GLN A 45 20.374 11.639 -14.354 1.00 23.01 C ATOM 293 CG GLN A 45 20.960 12.958 -14.855 1.00 20.85 C ATOM 294 CD GLN A 45 22.054 13.468 -13.974 1.00 19.83 C ATOM 295 OE1 GLN A 45 22.018 14.597 -13.561 1.00 15.22 O ATOM 296 NE2 GLN A 45 23.011 12.626 -13.648 1.00 23.37 N ATOM 297 N ASP A 46 18.982 8.744 -14.562 1.00 25.40 N ATOM 298 CA ASP A 46 18.090 7.732 -13.992 1.00 33.95 C ATOM 299 C ASP A 46 18.334 7.633 -12.517 1.00 33.13 C ATOM 300 O ASP A 46 19.454 7.864 -12.060 1.00 31.94 O ATOM 301 CB ASP A 46 18.144 6.338 -14.677 1.00 43.08 C ATOM 302 CG ASP A 46 19.459 6.065 -15.400 1.00 47.82 C ATOM 303 OD1 ASP A 46 19.661 6.690 -16.473 1.00 52.50 O ATOM 304 OD2 ASP A 46 20.257 5.217 -14.919 1.00 45.92 O ATOM 305 N VAL A 47 17.249 7.321 -11.803 1.00 32.40 N ATOM 306 CA VAL A 47 17.245 7.163 -10.364 1.00 33.46 C ATOM 307 C VAL A 47 17.368 5.699 -10.084 1.00 32.02 C ATOM 308 O VAL A 47 16.875 4.922 -10.869 1.00 29.67 O ATOM 309 CB VAL A 47 15.924 7.609 -9.750 1.00 33.02 C ATOM 310 CG1 VAL A 47 16.086 7.723 -8.224 1.00 37.13 C ATOM 311 CG2 VAL A 47 15.434 8.927 -10.368 1.00 31.35 C ATOM 312 N ASN A 48 17.983 5.319 -8.968 1.00 38.95 N ATOM 313 CA ASN A 48 18.103 3.898 -8.665 1.00 46.30 C ATOM 314 C ASN A 48 17.480 3.393 -7.373 1.00 48.26 C ATOM 315 O ASN A 48 16.521 2.604 -7.398 1.00 51.82 O ATOM 316 CB ASN A 48 19.552 3.461 -8.742 1.00 54.85 C ATOM 317 CG ASN A 48 19.861 2.802 -10.046 1.00 59.60 C ATOM 318 OD1 ASN A 48 20.433 1.718 -10.088 1.00 64.24 O ATOM 319 ND2 ASN A 48 19.450 3.440 -11.129 1.00 63.05 N ATOM 320 N ASP A 49 18.036 3.783 -6.243 1.00 42.71 N ATOM 321 CA ASP A 49 17.532 3.218 -5.026 1.00 42.80 C ATOM 322 C ASP A 49 16.836 4.299 -4.273 1.00 34.31 C ATOM 323 O ASP A 49 17.176 4.607 -3.148 1.00 34.20 O ATOM 324 CB ASP A 49 18.648 2.546 -4.232 1.00 49.30 C ATOM 325 CG ASP A 49 19.314 1.412 -5.015 1.00 53.93 C ATOM 326 OD1 ASP A 49 18.615 0.655 -5.734 1.00 54.58 O ATOM 327 OD2 ASP A 49 20.549 1.286 -4.921 1.00 58.21 O ATOM 328 N LEU A 50 15.813 4.855 -4.900 1.00 25.06 N ATOM 329 CA LEU A 50 15.143 6.014 -4.336 1.00 20.86 C ATOM 330 C LEU A 50 14.467 5.713 -3.013 1.00 23.47 C ATOM 331 O LEU A 50 14.374 6.585 -2.123 1.00 26.65 O ATOM 332 CB LEU A 50 14.126 6.589 -5.307 1.00 14.65 C ATOM 333 CG LEU A 50 13.496 7.907 -4.858 1.00 17.13 C ATOM 334 CD1 LEU A 50 14.573 8.956 -4.547 1.00 13.94 C ATOM 335 CD2 LEU A 50 12.538 8.427 -5.915 1.00 17.12 C ATOM 336 N TYR A 51 13.993 4.484 -2.863 1.00 25.92 N ATOM 337 CA TYR A 51 13.338 4.121 -1.604 1.00 25.00 C ATOM 338 C TYR A 51 14.358 4.127 -0.474 1.00 24.63 C ATOM 339 O TYR A 51 14.141 4.766 0.541 1.00 22.47 O ATOM 340 CB TYR A 51 12.622 2.776 -1.710 1.00 29.61 C ATOM 341 CG TYR A 51 11.822 2.436 -0.477 1.00 29.65 C ATOM 342 CD1 TYR A 51 10.499 2.810 -0.351 1.00 30.66 C ATOM 343 CD2 TYR A 51 12.403 1.756 0.572 1.00 33.66 C ATOM 344 CE1 TYR A 51 9.773 2.503 0.801 1.00 30.88 C ATOM 345 CE2 TYR A 51 11.697 1.456 1.720 1.00 33.32 C ATOM 346 CZ TYR A 51 10.383 1.824 1.825 1.00 32.29 C ATOM 347 OH TYR A 51 9.697 1.497 2.962 1.00 32.47 O ATOM 348 N GLU A 52 15.487 3.441 -0.665 1.00 29.12 N ATOM 349 CA GLU A 52 16.561 3.439 0.337 1.00 27.25 C ATOM 350 C GLU A 52 16.967 4.890 0.652 1.00 26.51 C ATOM 351 O GLU A 52 17.187 5.257 1.810 1.00 25.10 O ATOM 352 CB GLU A 52 17.761 2.624 -0.161 1.00 34.73 C ATOM 353 CG GLU A 52 18.560 1.925 0.915 1.00 42.47 C ATOM 354 CD GLU A 52 17.688 1.003 1.771 1.00 55.32 C ATOM 355 OE1 GLU A 52 16.804 0.310 1.190 1.00 61.37 O ATOM 356 OE2 GLU A 52 17.870 1.005 3.026 1.00 60.54 O ATOM 357 N LEU A 53 16.998 5.726 -0.385 1.00 24.75 N ATOM 358 CA LEU A 53 17.437 7.102 -0.233 1.00 22.07 C ATOM 359 C LEU A 53 16.578 7.848 0.751 1.00 20.40 C ATOM 360 O LEU A 53 17.086 8.473 1.689 1.00 23.00 O ATOM 361 CB LEU A 53 17.438 7.846 -1.558 1.00 21.16 C ATOM 362 CG LEU A 53 17.806 9.327 -1.405 1.00 23.68 C ATOM 363 CD1 LEU A 53 19.287 9.537 -0.940 1.00 26.90 C ATOM 364 CD2 LEU A 53 17.542 10.061 -2.675 1.00 23.70 C ATOM 365 N VAL A 54 15.279 7.797 0.523 1.00 19.08 N ATOM 366 CA VAL A 54 14.355 8.518 1.388 1.00 18.65 C ATOM 367 C VAL A 54 14.284 7.915 2.783 1.00 16.41 C ATOM 368 O VAL A 54 14.321 8.607 3.768 1.00 23.51 O ATOM 369 CB VAL A 54 12.954 8.517 0.819 1.00 14.51 C ATOM 370 CG1 VAL A 54 12.031 9.095 1.818 1.00 14.98 C ATOM 371 CG2 VAL A 54 12.908 9.309 -0.443 1.00 16.84 C ATOM 372 N LEU A 55 14.163 6.615 2.847 1.00 15.31 N ATOM 373 CA LEU A 55 14.194 5.906 4.105 1.00 18.12 C ATOM 374 C LEU A 55 15.363 6.339 4.988 1.00 18.73 C ATOM 375 O LEU A 55 15.159 6.721 6.128 1.00 24.50 O ATOM 376 CB LEU A 55 14.298 4.402 3.819 1.00 22.76 C ATOM 377 CG LEU A 55 13.985 3.415 4.947 1.00 23.48 C ATOM 378 CD1 LEU A 55 12.510 3.570 5.333 1.00 22.04 C ATOM 379 CD2 LEU A 55 14.318 1.961 4.505 1.00 25.30 C ATOM 380 N ALA A 56 16.586 6.281 4.461 1.00 16.80 N ATOM 381 CA ALA A 56 17.776 6.685 5.223 1.00 17.24 C ATOM 382 C ALA A 56 17.660 8.123 5.725 1.00 19.34 C ATOM 383 O ALA A 56 18.044 8.451 6.834 1.00 25.60 O ATOM 384 CB ALA A 56 19.023 6.535 4.380 1.00 11.91 C ATOM 385 N GLU A 57 17.113 8.981 4.889 1.00 22.67 N ATOM 386 CA GLU A 57 16.984 10.382 5.215 1.00 22.31 C ATOM 387 C GLU A 57 15.929 10.627 6.306 1.00 22.23 C ATOM 388 O GLU A 57 15.850 11.713 6.901 1.00 25.85 O ATOM 389 CB GLU A 57 16.615 11.137 3.946 1.00 26.99 C ATOM 390 CG GLU A 57 16.908 12.621 4.015 1.00 32.30 C ATOM 391 CD GLU A 57 18.409 13.001 3.906 1.00 37.35 C ATOM 392 OE1 GLU A 57 19.279 12.062 3.757 1.00 28.82 O ATOM 393 OE2 GLU A 57 18.650 14.267 3.963 1.00 39.53 O ATOM 394 N VAL A 58 15.128 9.609 6.584 1.00 19.88 N ATOM 395 CA VAL A 58 14.040 9.719 7.546 1.00 20.24 C ATOM 396 C VAL A 58 14.299 8.887 8.805 1.00 20.44 C ATOM 397 O VAL A 58 14.023 9.344 9.926 1.00 21.59 O ATOM 398 CB VAL A 58 12.728 9.288 6.888 1.00 21.85 C ATOM 399 CG1 VAL A 58 11.657 9.025 7.950 1.00 22.37 C ATOM 400 CG2 VAL A 58 12.292 10.353 5.892 1.00 21.61 C ATOM 401 N GLU A 59 14.824 7.674 8.621 1.00 18.59 N ATOM 402 CA GLU A 59 15.159 6.794 9.743 1.00 18.74 C ATOM 403 C GLU A 59 16.208 7.435 10.676 1.00 21.00 C ATOM 404 O GLU A 59 16.130 7.339 11.906 1.00 21.56 O ATOM 405 CB GLU A 59 15.672 5.446 9.223 1.00 17.96 C ATOM 406 CG GLU A 59 14.577 4.425 8.873 1.00 18.50 C ATOM 407 CD GLU A 59 15.128 2.982 8.674 1.00 22.32 C ATOM 408 OE1 GLU A 59 16.337 2.754 8.371 1.00 23.05 O ATOM 409 OE2 GLU A 59 14.325 2.045 8.835 1.00 26.77 O ATOM 410 N GLN A 60 17.199 8.095 10.093 1.00 20.40 N ATOM 411 CA GLN A 60 18.225 8.745 10.910 1.00 21.24 C ATOM 412 C GLN A 60 17.652 9.743 11.917 1.00 23.88 C ATOM 413 O GLN A 60 17.777 9.526 13.118 1.00 24.19 O ATOM 414 CB GLN A 60 19.315 9.368 10.035 1.00 19.26 C ATOM 415 CG GLN A 60 20.279 8.303 9.510 1.00 23.56 C ATOM 416 CD GLN A 60 21.277 8.830 8.512 1.00 26.78 C ATOM 417 OE1 GLN A 60 20.943 9.033 7.326 1.00 31.54 O ATOM 418 NE2 GLN A 60 22.525 9.034 8.972 1.00 25.33 N ATOM 419 N PRO A 61 16.993 10.814 11.434 1.00 25.44 N ATOM 420 CA PRO A 61 16.435 11.810 12.333 1.00 22.02 C ATOM 421 C PRO A 61 15.386 11.257 13.290 1.00 23.03 C ATOM 422 O PRO A 61 15.102 11.881 14.312 1.00 22.11 O ATOM 423 CB PRO A 61 15.777 12.801 11.378 1.00 23.67 C ATOM 424 CG PRO A 61 15.565 12.077 10.123 1.00 24.94 C ATOM 425 CD PRO A 61 16.734 11.166 10.028 1.00 26.17 C ATOM 426 N LEU A 62 14.802 10.110 12.952 1.00 21.13 N ATOM 427 CA LEU A 62 13.831 9.467 13.829 1.00 19.19 C ATOM 428 C LEU A 62 14.524 8.782 14.996 1.00 23.00 C ATOM 429 O LEU A 62 14.107 8.903 16.147 1.00 28.96 O ATOM 430 CB LEU A 62 13.020 8.440 13.041 1.00 18.21 C ATOM 431 CG LEU A 62 12.073 7.534 13.835 1.00 16.81 C ATOM 432 CD1 LEU A 62 11.158 8.368 14.698 1.00 18.33 C ATOM 433 CD2 LEU A 62 11.288 6.668 12.898 1.00 10.92 C ATOM 434 N LEU A 63 15.571 8.038 14.694 1.00 22.05 N ATOM 435 CA LEU A 63 16.327 7.353 15.725 1.00 22.91 C ATOM 436 C LEU A 63 17.006 8.410 16.576 1.00 25.74 C ATOM 437 O LEU A 63 16.980 8.369 17.796 1.00 31.77 O ATOM 438 CB LEU A 63 17.368 6.437 15.080 1.00 22.36 C ATOM 439 CG LEU A 63 16.782 5.347 14.162 1.00 19.66 C ATOM 440 CD1 LEU A 63 17.808 4.913 13.120 1.00 15.20 C ATOM 441 CD2 LEU A 63 16.220 4.162 14.998 1.00 15.90 C ATOM 442 N ASP A 64 17.585 9.393 15.919 1.00 28.92 N ATOM 443 CA ASP A 64 18.255 10.463 16.611 1.00 32.94 C ATOM 444 C ASP A 64 17.354 11.104 17.711 1.00 33.13 C ATOM 445 O ASP A 64 17.848 11.596 18.724 1.00 35.64 O ATOM 446 CB ASP A 64 18.689 11.477 15.555 1.00 41.74 C ATOM 447 CG ASP A 64 19.597 12.554 16.089 1.00 48.20 C ATOM 448 OD1 ASP A 64 19.536 13.688 15.534 1.00 51.46 O ATOM 449 OD2 ASP A 64 20.362 12.273 17.037 1.00 53.70 O ATOM 450 N MET A 65 16.043 11.058 17.529 1.00 29.55 N ATOM 451 CA MET A 65 15.127 11.761 18.413 1.00 30.01 C ATOM 452 C MET A 65 14.466 10.869 19.419 1.00 32.27 C ATOM 453 O MET A 65 14.183 11.325 20.518 1.00 37.07 O ATOM 454 CB MET A 65 14.021 12.434 17.618 1.00 31.45 C ATOM 455 CG MET A 65 14.488 13.581 16.753 1.00 31.82 C ATOM 456 SD MET A 65 14.574 15.124 17.671 1.00 36.93 S ATOM 457 CE MET A 65 15.957 15.933 16.847 1.00 39.33 C ATOM 458 N VAL A 66 14.160 9.622 19.061 1.00 32.17 N ATOM 459 CA VAL A 66 13.540 8.719 20.061 1.00 32.59 C ATOM 460 C VAL A 66 14.550 8.394 21.134 1.00 33.91 C ATOM 461 O VAL A 66 14.255 8.516 22.323 1.00 40.30 O ATOM 462 CB VAL A 66 12.995 7.420 19.497 1.00 29.39 C ATOM 463 CG1 VAL A 66 11.898 7.715 18.493 1.00 29.28 C ATOM 464 CG2 VAL A 66 14.079 6.658 18.864 1.00 32.00 C ATOM 465 N MET A 67 15.752 8.024 20.710 1.00 31.52 N ATOM 466 CA MET A 67 16.842 7.809 21.638 1.00 32.87 C ATOM 467 C MET A 67 16.978 9.004 22.551 1.00 35.88 C ATOM 468 O MET A 67 16.940 8.867 23.767 1.00 40.70 O ATOM 469 CB MET A 67 18.140 7.585 20.885 1.00 31.74 C ATOM 470 CG MET A 67 18.171 6.236 20.179 1.00 32.79 C ATOM 471 SD MET A 67 17.458 4.930 21.198 1.00 39.79 S ATOM 472 CE MET A 67 18.964 4.257 22.004 1.00 32.56 C ATOM 473 N GLN A 68 17.097 10.178 21.959 1.00 34.91 N ATOM 474 CA GLN A 68 17.113 11.390 22.741 1.00 35.31 C ATOM 475 C GLN A 68 15.940 11.459 23.753 1.00 33.95 C ATOM 476 O GLN A 68 16.138 11.752 24.944 1.00 36.44 O ATOM 477 CB GLN A 68 17.101 12.587 21.801 1.00 38.79 C ATOM 478 CG GLN A 68 17.261 13.937 22.461 1.00 40.65 C ATOM 479 CD GLN A 68 17.829 14.956 21.508 1.00 44.24 C ATOM 480 OE1 GLN A 68 18.804 14.694 20.782 1.00 48.38 O ATOM 481 NE2 GLN A 68 17.215 16.122 21.482 1.00 49.36 N ATOM 482 N TYR A 69 14.733 11.159 23.300 1.00 29.28 N ATOM 483 CA TYR A 69 13.564 11.227 24.184 1.00 28.83 C ATOM 484 C TYR A 69 13.550 10.134 25.246 1.00 28.74 C ATOM 485 O TYR A 69 13.116 10.368 26.337 1.00 33.64 O ATOM 486 CB TYR A 69 12.296 11.128 23.358 1.00 28.45 C ATOM 487 CG TYR A 69 11.004 11.210 24.124 1.00 27.14 C ATOM 488 CD1 TYR A 69 10.473 12.439 24.508 1.00 28.48 C ATOM 489 CD2 TYR A 69 10.291 10.076 24.418 1.00 27.75 C ATOM 490 CE1 TYR A 69 9.257 12.540 25.207 1.00 28.69 C ATOM 491 CE2 TYR A 69 9.074 10.161 25.093 1.00 32.37 C ATOM 492 CZ TYR A 69 8.559 11.400 25.499 1.00 31.91 C ATOM 493 OH TYR A 69 7.353 11.454 26.184 1.00 31.74 O ATOM 494 N THR A 70 14.015 8.940 24.927 1.00 25.83 N ATOM 495 CA THR A 70 14.093 7.884 25.916 1.00 26.29 C ATOM 496 C THR A 70 15.458 7.904 26.622 1.00 31.26 C ATOM 497 O THR A 70 15.893 6.898 27.198 1.00 31.54 O ATOM 498 CB THR A 70 13.891 6.524 25.257 1.00 20.91 C ATOM 499 OG1 THR A 70 15.036 6.213 24.457 1.00 20.00 O ATOM 500 CG2 THR A 70 12.640 6.522 24.376 1.00 16.86 C ATOM 501 N ARG A 71 16.148 9.040 26.539 1.00 36.62 N ATOM 502 CA ARG A 71 17.440 9.226 27.184 1.00 40.03 C ATOM 503 C ARG A 71 18.411 8.044 26.991 1.00 37.32 C ATOM 504 O ARG A 71 19.064 7.615 27.914 1.00 35.51 O ATOM 505 CB ARG A 71 17.212 9.516 28.663 1.00 53.92 C ATOM 506 CG ARG A 71 18.261 10.459 29.288 1.00 65.60 C ATOM 507 CD ARG A 71 17.921 11.934 29.063 1.00 74.33 C ATOM 508 NE ARG A 71 16.652 12.290 29.700 1.00 78.23 N ATOM 509 CZ ARG A 71 16.494 12.574 30.992 1.00 82.41 C ATOM 510 NH1 ARG A 71 17.529 12.560 31.830 1.00 84.90 N ATOM 511 NH2 ARG A 71 15.285 12.876 31.455 1.00 82.58 N ATOM 512 N GLY A 72 18.500 7.530 25.772 1.00 35.50 N ATOM 513 CA GLY A 72 19.448 6.478 25.434 1.00 34.25 C ATOM 514 C GLY A 72 18.899 5.077 25.591 1.00 32.61 C ATOM 515 O GLY A 72 19.538 4.129 25.180 1.00 32.49 O ATOM 516 N ASN A 73 17.719 4.934 26.188 1.00 33.00 N ATOM 517 CA ASN A 73 17.155 3.607 26.447 1.00 32.85 C ATOM 518 C ASN A 73 16.610 2.911 25.185 1.00 32.89 C ATOM 519 O ASN A 73 15.500 3.202 24.717 1.00 36.09 O ATOM 520 CB ASN A 73 16.059 3.690 27.518 1.00 32.96 C ATOM 521 CG ASN A 73 15.468 2.317 27.872 1.00 34.62 C ATOM 522 OD1 ASN A 73 15.792 1.302 27.255 1.00 37.36 O ATOM 523 ND2 ASN A 73 14.604 2.290 28.869 1.00 34.62 N ATOM 524 N GLN A 74 17.376 1.960 24.663 1.00 28.62 N ATOM 525 CA GLN A 74 16.939 1.196 23.497 1.00 29.31 C ATOM 526 C GLN A 74 15.609 0.510 23.713 1.00 28.88 C ATOM 527 O GLN A 74 14.746 0.527 22.843 1.00 33.40 O ATOM 528 CB GLN A 74 17.962 0.132 23.117 1.00 28.10 C ATOM 529 CG GLN A 74 19.254 0.676 22.534 1.00 31.84 C ATOM 530 CD GLN A 74 20.156 -0.441 22.064 1.00 36.26 C ATOM 531 OE1 GLN A 74 20.792 -0.342 21.018 1.00 38.26 O ATOM 532 NE2 GLN A 74 20.214 -1.528 22.846 1.00 44.71 N ATOM 533 N THR A 75 15.452 -0.114 24.868 1.00 28.82 N ATOM 534 CA THR A 75 14.253 -0.888 25.133 1.00 31.00 C ATOM 535 C THR A 75 12.994 -0.024 25.003 1.00 33.52 C ATOM 536 O THR A 75 12.068 -0.421 24.300 1.00 31.59 O ATOM 537 CB THR A 75 14.334 -1.577 26.500 1.00 29.18 C ATOM 538 OG1 THR A 75 15.553 -2.333 26.560 1.00 31.00 O ATOM 539 CG2 THR A 75 13.118 -2.509 26.742 1.00 26.04 C ATOM 540 N ARG A 76 12.966 1.150 25.639 1.00 37.11 N ATOM 541 CA ARG A 76 11.768 1.983 25.596 1.00 42.32 C ATOM 542 C ARG A 76 11.602 2.526 24.196 1.00 40.85 C ATOM 543 O ARG A 76 10.502 2.535 23.652 1.00 43.36 O ATOM 544 CB ARG A 76 11.787 3.117 26.634 1.00 49.72 C ATOM 545 CG ARG A 76 11.502 2.636 28.088 1.00 57.40 C ATOM 546 CD ARG A 76 10.612 3.578 28.942 1.00 60.45 C ATOM 547 NE ARG A 76 11.072 4.976 28.964 1.00 66.21 N ATOM 548 CZ ARG A 76 10.405 6.027 28.460 1.00 68.28 C ATOM 549 NH1 ARG A 76 9.218 5.867 27.881 1.00 69.31 N ATOM 550 NH2 ARG A 76 10.919 7.262 28.540 1.00 67.35 N ATOM 551 N ALA A 77 12.705 2.955 23.601 1.00 36.57 N ATOM 552 CA ALA A 77 12.700 3.360 22.203 1.00 31.95 C ATOM 553 C ALA A 77 11.972 2.325 21.332 1.00 27.72 C ATOM 554 O ALA A 77 10.956 2.625 20.732 1.00 30.92 O ATOM 555 CB ALA A 77 14.106 3.560 21.731 1.00 24.84 C ATOM 556 N ALA A 78 12.463 1.096 21.298 1.00 26.72 N ATOM 557 CA ALA A 78 11.874 0.064 20.423 1.00 29.99 C ATOM 558 C ALA A 78 10.375 -0.139 20.644 1.00 30.23 C ATOM 559 O ALA A 78 9.644 -0.501 19.706 1.00 33.76 O ATOM 560 CB ALA A 78 12.639 -1.292 20.530 1.00 27.16 C ATOM 561 N LEU A 79 9.916 0.110 21.863 1.00 30.02 N ATOM 562 CA LEU A 79 8.517 -0.162 22.212 1.00 33.43 C ATOM 563 C LEU A 79 7.653 0.967 21.718 1.00 33.97 C ATOM 564 O LEU A 79 6.517 0.744 21.299 1.00 37.06 O ATOM 565 CB LEU A 79 8.328 -0.315 23.730 1.00 34.99 C ATOM 566 CG LEU A 79 9.137 -1.415 24.428 1.00 35.18 C ATOM 567 CD1 LEU A 79 9.333 -1.046 25.872 1.00 35.44 C ATOM 568 CD2 LEU A 79 8.491 -2.777 24.300 1.00 34.12 C ATOM 569 N MET A 80 8.210 2.174 21.803 1.00 33.70 N ATOM 570 CA MET A 80 7.556 3.395 21.359 1.00 35.04 C ATOM 571 C MET A 80 7.356 3.366 19.846 1.00 33.21 C ATOM 572 O MET A 80 6.304 3.712 19.328 1.00 33.25 O ATOM 573 CB MET A 80 8.425 4.588 21.728 1.00 36.62 C ATOM 574 CG MET A 80 7.645 5.833 21.948 1.00 41.91 C ATOM 575 SD MET A 80 8.635 7.160 22.673 1.00 48.96 S ATOM 576 CE MET A 80 7.464 8.523 22.528 1.00 45.67 C ATOM 577 N MET A 81 8.390 2.927 19.149 1.00 32.31 N ATOM 578 CA MET A 81 8.371 2.840 17.707 1.00 31.85 C ATOM 579 C MET A 81 7.487 1.687 17.192 1.00 35.10 C ATOM 580 O MET A 81 6.919 1.768 16.095 1.00 41.86 O ATOM 581 CB MET A 81 9.811 2.695 17.200 1.00 27.31 C ATOM 582 CG MET A 81 10.656 3.952 17.341 1.00 23.54 C ATOM 583 SD MET A 81 12.357 3.736 16.758 1.00 33.18 S ATOM 584 CE MET A 81 12.221 4.086 15.009 1.00 36.09 C ATOM 585 N GLY A 82 7.383 0.615 17.961 1.00 31.29 N ATOM 586 CA GLY A 82 6.629 -0.531 17.505 1.00 31.67 C ATOM 587 C GLY A 82 7.471 -1.546 16.753 1.00 33.67 C ATOM 588 O GLY A 82 6.947 -2.349 15.948 1.00 34.35 O ATOM 589 N ILE A 83 8.771 -1.559 17.032 1.00 32.04 N ATOM 590 CA ILE A 83 9.642 -2.527 16.378 1.00 31.03 C ATOM 591 C ILE A 83 10.503 -3.286 17.385 1.00 31.20 C ATOM 592 O ILE A 83 10.756 -2.824 18.496 1.00 32.25 O ATOM 593 CB ILE A 83 10.530 -1.833 15.340 1.00 29.52 C ATOM 594 CG1 ILE A 83 11.580 -0.965 16.037 1.00 28.47 C ATOM 595 CG2 ILE A 83 9.688 -0.952 14.407 1.00 28.35 C ATOM 596 CD1 ILE A 83 12.563 -0.334 15.084 1.00 26.39 C ATOM 597 N ASN A 84 10.964 -4.448 16.961 1.00 29.58 N ATOM 598 CA ASN A 84 11.845 -5.278 17.760 1.00 32.83 C ATOM 599 C ASN A 84 13.112 -4.560 18.182 1.00 31.68 C ATOM 600 O ASN A 84 13.717 -3.836 17.385 1.00 27.04 O ATOM 601 CB ASN A 84 12.251 -6.515 16.956 1.00 36.31 C ATOM 602 CG ASN A 84 12.794 -7.613 17.821 1.00 37.51 C ATOM 603 OD1 ASN A 84 13.979 -7.947 17.753 1.00 38.16 O ATOM 604 ND2 ASN A 84 11.921 -8.187 18.652 1.00 36.64 N ATOM 605 N ARG A 85 13.524 -4.788 19.427 1.00 33.85 N ATOM 606 CA ARG A 85 14.759 -4.196 19.926 1.00 36.36 C ATOM 607 C ARG A 85 15.933 -4.642 19.049 1.00 37.41 C ATOM 608 O ARG A 85 16.888 -3.903 18.842 1.00 37.68 O ATOM 609 CB ARG A 85 15.006 -4.567 21.395 1.00 37.59 C ATOM 610 CG ARG A 85 16.232 -3.859 22.028 1.00 37.76 C ATOM 611 CD ARG A 85 16.428 -4.153 23.564 1.00 36.77 C ATOM 612 NE ARG A 85 17.291 -5.316 23.836 1.00 36.04 N ATOM 613 CZ ARG A 85 16.856 -6.521 24.214 1.00 32.57 C ATOM 614 NH1 ARG A 85 15.560 -6.738 24.396 1.00 31.02 N ATOM 615 NH2 ARG A 85 17.716 -7.519 24.424 1.00 29.49 N ATOM 616 N GLY A 86 15.848 -5.849 18.517 1.00 38.27 N ATOM 617 CA GLY A 86 16.904 -6.361 17.668 1.00 37.78 C ATOM 618 C GLY A 86 16.991 -5.509 16.438 1.00 38.40 C ATOM 619 O GLY A 86 18.064 -5.023 16.077 1.00 38.46 O ATOM 620 N THR A 87 15.837 -5.332 15.806 1.00 38.47 N ATOM 621 CA THR A 87 15.712 -4.489 14.633 1.00 36.22 C ATOM 622 C THR A 87 16.275 -3.098 14.907 1.00 34.68 C ATOM 623 O THR A 87 17.075 -2.578 14.129 1.00 36.80 O ATOM 624 CB THR A 87 14.248 -4.375 14.208 1.00 36.83 C ATOM 625 OG1 THR A 87 13.754 -5.677 13.882 1.00 37.58 O ATOM 626 CG2 THR A 87 14.110 -3.501 13.010 1.00 35.61 C ATOM 627 N LEU A 88 15.887 -2.506 16.030 1.00 30.40 N ATOM 628 CA LEU A 88 16.405 -1.180 16.399 1.00 30.38 C ATOM 629 C LEU A 88 17.924 -1.157 16.492 1.00 30.89 C ATOM 630 O LEU A 88 18.575 -0.223 16.043 1.00 30.16 O ATOM 631 CB LEU A 88 15.791 -0.713 17.714 1.00 27.48 C ATOM 632 CG LEU A 88 16.372 0.521 18.405 1.00 27.08 C ATOM 633 CD1 LEU A 88 16.542 1.720 17.461 1.00 25.37 C ATOM 634 CD2 LEU A 88 15.475 0.871 19.599 1.00 27.47 C ATOM 635 N ARG A 89 18.497 -2.204 17.058 1.00 34.75 N ATOM 636 CA ARG A 89 19.944 -2.246 17.197 1.00 37.97 C ATOM 637 C ARG A 89 20.595 -2.234 15.825 1.00 35.66 C ATOM 638 O ARG A 89 21.544 -1.483 15.571 1.00 31.94 O ATOM 639 CB ARG A 89 20.371 -3.483 17.958 1.00 43.30 C ATOM 640 CG ARG A 89 19.606 -3.715 19.269 1.00 49.21 C ATOM 641 CD ARG A 89 20.100 -4.956 20.044 1.00 51.45 C ATOM 642 NE ARG A 89 21.063 -4.570 21.071 1.00 54.64 N ATOM 643 CZ ARG A 89 22.370 -4.404 20.882 1.00 56.29 C ATOM 644 NH1 ARG A 89 22.931 -4.609 19.694 1.00 57.78 N ATOM 645 NH2 ARG A 89 23.127 -4.045 21.906 1.00 56.38 N ATOM 646 N LYS A 90 20.046 -3.064 14.945 1.00 34.16 N ATOM 647 CA LYS A 90 20.516 -3.176 13.578 1.00 33.21 C ATOM 648 C LYS A 90 20.564 -1.810 12.891 1.00 29.96 C ATOM 649 O LYS A 90 21.573 -1.469 12.268 1.00 27.71 O ATOM 650 CB LYS A 90 19.615 -4.136 12.791 1.00 36.33 C ATOM 651 CG LYS A 90 20.339 -4.874 11.682 1.00 41.50 C ATOM 652 CD LYS A 90 20.069 -4.315 10.270 1.00 45.75 C ATOM 653 CE LYS A 90 18.874 -5.031 9.563 1.00 47.09 C ATOM 654 NZ LYS A 90 19.065 -6.499 9.207 1.00 44.63 N ATOM 655 N LYS A 91 19.485 -1.034 13.045 1.00 26.12 N ATOM 656 CA LYS A 91 19.355 0.285 12.414 1.00 26.84 C ATOM 657 C LYS A 91 20.338 1.296 12.960 1.00 27.74 C ATOM 658 O LYS A 91 20.862 2.122 12.237 1.00 30.60 O ATOM 659 CB LYS A 91 17.937 0.823 12.564 1.00 22.98 C ATOM 660 CG LYS A 91 16.938 0.108 11.663 1.00 24.64 C ATOM 661 CD LYS A 91 15.605 0.848 11.541 1.00 25.83 C ATOM 662 CE LYS A 91 14.421 -0.037 11.050 1.00 25.47 C ATOM 663 NZ LYS A 91 14.703 -0.985 9.937 1.00 23.05 N ATOM 664 N LEU A 92 20.587 1.234 14.250 1.00 32.10 N ATOM 665 CA LEU A 92 21.533 2.147 14.862 1.00 34.39 C ATOM 666 C LEU A 92 22.948 1.862 14.361 1.00 37.29 C ATOM 667 O LEU A 92 23.754 2.784 14.169 1.00 36.06 O ATOM 668 CB LEU A 92 21.444 2.029 16.380 1.00 33.92 C ATOM 669 CG LEU A 92 20.091 2.480 16.950 1.00 32.64 C ATOM 670 CD1 LEU A 92 19.914 1.874 18.323 1.00 32.84 C ATOM 671 CD2 LEU A 92 19.941 4.013 16.981 1.00 28.30 C ATOM 672 N LYS A 93 23.243 0.583 14.144 1.00 41.71 N ATOM 673 CA LYS A 93 24.543 0.199 13.631 1.00 42.09 C ATOM 674 C LYS A 93 24.678 0.613 12.182 1.00 41.43 C ATOM 675 O LYS A 93 25.757 1.043 11.764 1.00 36.55 O ATOM 676 CB LYS A 93 24.768 -1.312 13.770 1.00 48.17 C ATOM 677 CG LYS A 93 26.127 -1.819 13.232 1.00 52.39 C ATOM 678 CD LYS A 93 27.287 -1.739 14.261 1.00 60.07 C ATOM 679 CE LYS A 93 27.649 -0.292 14.735 1.00 64.09 C ATOM 680 NZ LYS A 93 28.087 0.689 13.672 1.00 66.30 N ATOM 681 N LYS A 94 23.571 0.464 11.439 1.00 41.43 N ATOM 682 CA LYS A 94 23.477 0.816 9.991 1.00 38.96 C ATOM 683 C LYS A 94 23.823 2.257 9.742 1.00 36.45 C ATOM 684 O LYS A 94 24.359 2.578 8.688 1.00 40.50 O ATOM 685 CB LYS A 94 22.076 0.545 9.425 1.00 35.02 C ATOM 686 CG LYS A 94 21.885 0.866 7.964 1.00 36.10 C ATOM 687 CD LYS A 94 20.399 0.623 7.570 1.00 40.65 C ATOM 688 CE LYS A 94 20.002 1.099 6.150 1.00 40.41 C ATOM 689 NZ LYS A 94 20.047 0.004 5.125 1.00 41.22 N ATOM 690 N TYR A 95 23.523 3.115 10.713 1.00 33.37 N ATOM 691 CA TYR A 95 23.782 4.539 10.581 1.00 36.64 C ATOM 692 C TYR A 95 24.912 4.960 11.492 1.00 39.37 C ATOM 693 O TYR A 95 25.135 6.142 11.713 1.00 42.37 O ATOM 694 CB TYR A 95 22.494 5.339 10.854 1.00 31.68 C ATOM 695 CG TYR A 95 21.380 5.016 9.875 1.00 31.19 C ATOM 696 CD1 TYR A 95 21.515 5.295 8.517 1.00 28.87 C ATOM 697 CD2 TYR A 95 20.199 4.416 10.300 1.00 31.01 C ATOM 698 CE1 TYR A 95 20.506 4.986 7.614 1.00 28.22 C ATOM 699 CE2 TYR A 95 19.184 4.127 9.397 1.00 30.89 C ATOM 700 CZ TYR A 95 19.356 4.420 8.062 1.00 28.39 C ATOM 701 OH TYR A 95 18.375 4.113 7.188 1.00 30.73 O ATOM 702 N GLY A 96 25.623 3.979 12.026 1.00 44.08 N ATOM 703 CA GLY A 96 26.768 4.241 12.867 1.00 47.31 C ATOM 704 C GLY A 96 26.472 5.181 14.009 1.00 51.27 C ATOM 705 O GLY A 96 27.338 5.948 14.398 1.00 55.00 O ATOM 706 N MET A 97 25.254 5.144 14.544 1.00 55.12 N ATOM 707 CA MET A 97 24.948 5.936 15.740 1.00 59.24 C ATOM 708 C MET A 97 24.838 5.005 16.944 1.00 64.32 C ATOM 709 O MET A 97 23.757 4.652 17.384 1.00 66.73 O ATOM 710 CB MET A 97 23.709 6.852 15.567 1.00 58.77 C ATOM 711 CG MET A 97 22.485 6.247 14.857 1.00 57.03 C ATOM 712 SD MET A 97 21.189 7.447 14.431 1.00 54.03 S ATOM 713 CE MET A 97 22.021 8.542 13.241 1.00 48.90 C ATOM 714 N ASN A 98 25.993 4.594 17.446 1.00 68.88 N ATOM 715 CA ASN A 98 26.081 3.792 18.658 1.00 71.27 C ATOM 716 C ASN A 98 27.548 3.698 19.089 1.00 75.03 C ATOM 717 O ASN A 98 27.882 2.966 20.028 1.00 80.09 O ATOM 718 CB ASN A 98 25.444 2.393 18.471 1.00 73.02 C ATOM 719 CG ASN A 98 26.056 1.593 17.314 1.00 73.77 C ATOM 720 OD1 ASN A 98 25.427 0.660 16.826 1.00 74.39 O ATOM 721 ND2 ASN A 98 27.275 1.938 16.890 1.00 72.27 N TER 722 ASN A 98 ATOM 723 N MET B 1 36.247 19.840 -10.227 1.00 57.79 N ATOM 724 CA MET B 1 35.146 20.227 -11.174 1.00 58.87 C ATOM 725 C MET B 1 33.759 20.009 -10.550 1.00 54.07 C ATOM 726 O MET B 1 32.922 20.917 -10.521 1.00 55.97 O ATOM 727 CB MET B 1 35.259 19.429 -12.485 1.00 65.60 C ATOM 728 CG MET B 1 34.295 19.836 -13.639 1.00 67.64 C ATOM 729 SD MET B 1 34.229 18.534 -14.924 1.00 76.53 S ATOM 730 CE MET B 1 35.977 18.069 -15.187 1.00 72.74 C ATOM 731 N PHE B 2 33.488 18.806 -10.071 1.00 43.26 N ATOM 732 CA PHE B 2 32.209 18.575 -9.442 1.00 36.53 C ATOM 733 C PHE B 2 32.296 18.864 -7.967 1.00 27.61 C ATOM 734 O PHE B 2 33.155 18.350 -7.281 1.00 30.55 O ATOM 735 CB PHE B 2 31.761 17.150 -9.656 1.00 31.76 C ATOM 736 CG PHE B 2 31.460 16.819 -11.081 1.00 30.46 C ATOM 737 CD1 PHE B 2 31.839 15.583 -11.618 1.00 33.67 C ATOM 738 CD2 PHE B 2 30.792 17.716 -11.887 1.00 30.18 C ATOM 739 CE1 PHE B 2 31.558 15.264 -12.933 1.00 34.10 C ATOM 740 CE2 PHE B 2 30.519 17.410 -13.204 1.00 32.06 C ATOM 741 CZ PHE B 2 30.896 16.188 -13.731 1.00 33.12 C ATOM 742 N GLU B 3 31.401 19.688 -7.470 1.00 18.98 N ATOM 743 CA GLU B 3 31.417 19.989 -6.066 1.00 21.00 C ATOM 744 C GLU B 3 30.634 18.916 -5.310 1.00 22.74 C ATOM 745 O GLU B 3 29.598 18.442 -5.764 1.00 24.56 O ATOM 746 CB GLU B 3 30.870 21.396 -5.798 1.00 21.39 C ATOM 747 CG GLU B 3 31.466 22.474 -6.697 1.00 22.35 C ATOM 748 CD GLU B 3 31.206 23.911 -6.235 1.00 25.92 C ATOM 749 OE1 GLU B 3 30.749 24.125 -5.090 1.00 25.72 O ATOM 750 OE2 GLU B 3 31.482 24.831 -7.054 1.00 31.35 O ATOM 751 N GLN B 4 31.128 18.521 -4.146 1.00 23.94 N ATOM 752 CA GLN B 4 30.471 17.468 -3.373 1.00 21.38 C ATOM 753 C GLN B 4 29.085 17.903 -2.977 1.00 18.59 C ATOM 754 O GLN B 4 28.888 19.021 -2.562 1.00 15.87 O ATOM 755 CB GLN B 4 31.253 17.157 -2.109 1.00 22.21 C ATOM 756 CG GLN B 4 30.765 15.945 -1.331 1.00 21.20 C ATOM 757 CD GLN B 4 31.379 15.875 0.039 1.00 23.62 C ATOM 758 OE1 GLN B 4 31.640 16.911 0.691 1.00 26.26 O ATOM 759 NE2 GLN B 4 31.603 14.664 0.505 1.00 25.28 N ATOM 760 N ARG B 5 28.123 17.020 -3.165 1.00 18.11 N ATOM 761 CA ARG B 5 26.792 17.216 -2.665 1.00 16.37 C ATOM 762 C ARG B 5 26.519 16.077 -1.742 1.00 16.21 C ATOM 763 O ARG B 5 26.443 14.927 -2.174 1.00 15.95 O ATOM 764 CB ARG B 5 25.785 17.180 -3.791 1.00 15.20 C ATOM 765 CG ARG B 5 24.360 17.405 -3.301 1.00 13.16 C ATOM 766 CD ARG B 5 23.487 18.012 -4.361 1.00 14.37 C ATOM 767 NE ARG B 5 23.193 19.429 -4.174 1.00 13.17 N ATOM 768 CZ ARG B 5 22.865 20.270 -5.168 1.00 17.46 C ATOM 769 NH1 ARG B 5 22.808 19.876 -6.435 1.00 20.30 N ATOM 770 NH2 ARG B 5 22.563 21.535 -4.915 1.00 17.91 N ATOM 771 N VAL B 6 26.358 16.389 -0.469 1.00 14.06 N ATOM 772 CA VAL B 6 26.265 15.342 0.515 1.00 15.57 C ATOM 773 C VAL B 6 24.886 14.769 0.509 1.00 20.24 C ATOM 774 O VAL B 6 23.974 15.385 0.016 1.00 26.53 O ATOM 775 CB VAL B 6 26.691 15.803 1.914 1.00 12.07 C ATOM 776 CG1 VAL B 6 28.138 15.462 2.097 1.00 12.03 C ATOM 777 CG2 VAL B 6 26.525 17.234 2.096 1.00 5.64 C ATOM 778 N ASN B 7 24.743 13.564 1.028 1.00 24.31 N ATOM 779 CA ASN B 7 23.455 12.882 1.033 1.00 22.56 C ATOM 780 C ASN B 7 22.318 13.690 1.655 1.00 21.83 C ATOM 781 O ASN B 7 21.190 13.709 1.152 1.00 27.79 O ATOM 782 CB ASN B 7 23.620 11.584 1.791 1.00 26.45 C ATOM 783 CG ASN B 7 24.678 10.705 1.190 1.00 27.28 C ATOM 784 OD1 ASN B 7 25.476 10.125 1.906 1.00 34.69 O ATOM 785 ND2 ASN B 7 24.710 10.629 -0.133 1.00 25.30 N ATOM 786 N SER B 8 22.626 14.385 2.734 1.00 17.17 N ATOM 787 CA SER B 8 21.635 15.259 3.380 1.00 17.48 C ATOM 788 C SER B 8 21.154 16.422 2.529 1.00 16.63 C ATOM 789 O SER B 8 20.214 17.100 2.879 1.00 23.47 O ATOM 790 CB SER B 8 22.187 15.820 4.699 1.00 14.50 C ATOM 791 OG SER B 8 23.291 16.676 4.482 1.00 20.75 O ATOM 792 N ASP B 9 21.816 16.649 1.419 1.00 19.00 N ATOM 793 CA ASP B 9 21.573 17.805 0.599 1.00 20.32 C ATOM 794 C ASP B 9 20.968 17.407 -0.741 1.00 16.63 C ATOM 795 O ASP B 9 20.758 18.267 -1.595 1.00 21.49 O ATOM 796 CB ASP B 9 22.893 18.526 0.373 1.00 32.22 C ATOM 797 CG ASP B 9 22.823 19.938 0.773 1.00 43.22 C ATOM 798 OD1 ASP B 9 23.091 20.202 1.975 1.00 50.41 O ATOM 799 OD2 ASP B 9 22.437 20.761 -0.092 1.00 52.23 O ATOM 800 N VAL B 10 20.686 16.115 -0.922 1.00 7.98 N ATOM 801 CA VAL B 10 19.985 15.646 -2.104 1.00 9.81 C ATOM 802 C VAL B 10 18.476 15.933 -2.091 1.00 9.40 C ATOM 803 O VAL B 10 17.910 16.333 -3.104 1.00 10.48 O ATOM 804 CB VAL B 10 20.223 14.172 -2.330 1.00 7.95 C ATOM 805 CG1 VAL B 10 19.279 13.651 -3.439 1.00 6.11 C ATOM 806 CG2 VAL B 10 21.693 13.953 -2.683 1.00 8.96 C ATOM 807 N LEU B 11 17.836 15.711 -0.956 1.00 14.75 N ATOM 808 CA LEU B 11 16.428 16.048 -0.786 1.00 12.68 C ATOM 809 C LEU B 11 16.344 17.223 0.189 1.00 12.70 C ATOM 810 O LEU B 11 16.668 17.085 1.380 1.00 11.09 O ATOM 811 CB LEU B 11 15.679 14.835 -0.237 1.00 12.86 C ATOM 812 CG LEU B 11 15.820 13.559 -1.081 1.00 13.66 C ATOM 813 CD1 LEU B 11 15.117 12.329 -0.497 1.00 13.60 C ATOM 814 CD2 LEU B 11 15.296 13.853 -2.467 1.00 19.27 C ATOM 815 N THR B 12 15.959 18.390 -0.313 1.00 12.50 N ATOM 816 CA THR B 12 15.922 19.564 0.539 1.00 13.72 C ATOM 817 C THR B 12 14.624 20.356 0.394 1.00 14.73 C ATOM 818 O THR B 12 13.792 20.090 -0.446 1.00 9.71 O ATOM 819 CB THR B 12 17.104 20.495 0.257 1.00 14.22 C ATOM 820 OG1 THR B 12 16.992 20.980 -1.081 1.00 20.92 O ATOM 821 CG2 THR B 12 18.417 19.777 0.415 1.00 11.95 C ATOM 822 N VAL B 13 14.502 21.351 1.260 1.00 18.01 N ATOM 823 CA VAL B 13 13.277 22.071 1.488 1.00 14.70 C ATOM 824 C VAL B 13 13.554 23.556 1.763 1.00 15.41 C ATOM 825 O VAL B 13 14.303 23.899 2.651 1.00 18.04 O ATOM 826 CB VAL B 13 12.549 21.473 2.677 1.00 10.36 C ATOM 827 CG1 VAL B 13 11.507 22.425 3.169 1.00 17.14 C ATOM 828 CG2 VAL B 13 11.891 20.210 2.252 1.00 10.40 C ATOM 829 N SER B 14 12.912 24.422 0.997 1.00 8.78 N ATOM 830 CA SER B 14 13.059 25.841 1.178 1.00 11.24 C ATOM 831 C SER B 14 12.631 26.306 2.541 1.00 9.41 C ATOM 832 O SER B 14 11.527 26.030 2.968 1.00 16.80 O ATOM 833 CB SER B 14 12.241 26.546 0.136 1.00 16.49 C ATOM 834 OG SER B 14 12.556 25.963 -1.122 1.00 24.50 O ATOM 835 N THR B 15 13.529 27.007 3.208 1.00 12.43 N ATOM 836 CA THR B 15 13.300 27.575 4.526 1.00 18.24 C ATOM 837 C THR B 15 13.546 29.081 4.484 1.00 21.25 C ATOM 838 O THR B 15 13.962 29.623 3.466 1.00 22.98 O ATOM 839 CB THR B 15 14.269 26.975 5.576 1.00 16.98 C ATOM 840 OG1 THR B 15 15.601 27.402 5.276 1.00 21.82 O ATOM 841 CG2 THR B 15 14.231 25.462 5.560 1.00 11.88 C ATOM 842 N VAL B 16 13.305 29.751 5.601 1.00 25.48 N ATOM 843 CA VAL B 16 13.658 31.155 5.736 1.00 27.21 C ATOM 844 C VAL B 16 14.502 31.319 6.971 1.00 35.20 C ATOM 845 O VAL B 16 14.126 30.837 8.043 1.00 40.46 O ATOM 846 CB VAL B 16 12.450 32.007 5.916 1.00 21.43 C ATOM 847 CG1 VAL B 16 12.906 33.399 6.170 1.00 25.57 C ATOM 848 CG2 VAL B 16 11.587 31.930 4.690 1.00 12.96 C ATOM 849 N ASN B 17 15.635 32.003 6.831 1.00 40.45 N ATOM 850 CA ASN B 17 16.594 32.087 7.927 1.00 41.05 C ATOM 851 C ASN B 17 16.447 33.393 8.674 1.00 44.50 C ATOM 852 O ASN B 17 15.651 34.275 8.278 1.00 38.12 O ATOM 853 CB ASN B 17 18.028 31.902 7.425 1.00 39.92 C ATOM 854 CG ASN B 17 18.521 33.081 6.623 1.00 38.92 C ATOM 855 OD1 ASN B 17 17.809 34.084 6.445 1.00 35.51 O ATOM 856 ND2 ASN B 17 19.757 32.973 6.134 1.00 41.11 N ATOM 857 N SER B 18 17.245 33.496 9.743 1.00 50.51 N ATOM 858 CA SER B 18 17.280 34.661 10.639 1.00 51.72 C ATOM 859 C SER B 18 17.351 36.018 9.930 1.00 53.97 C ATOM 860 O SER B 18 16.951 37.003 10.527 1.00 53.27 O ATOM 861 CB SER B 18 18.436 34.522 11.651 1.00 52.08 C ATOM 862 OG SER B 18 19.549 33.800 11.117 1.00 50.81 O ATOM 863 N GLN B 19 17.842 36.066 8.681 1.00 56.89 N ATOM 864 CA GLN B 19 17.866 37.307 7.867 1.00 57.67 C ATOM 865 C GLN B 19 16.799 37.328 6.782 1.00 55.72 C ATOM 866 O GLN B 19 16.988 37.961 5.747 1.00 53.24 O ATOM 867 CB GLN B 19 19.244 37.517 7.204 1.00 63.06 C ATOM 868 CG GLN B 19 20.373 37.967 8.139 1.00 67.29 C ATOM 869 CD GLN B 19 20.880 36.834 9.040 1.00 72.41 C ATOM 870 OE1 GLN B 19 20.835 35.648 8.667 1.00 75.19 O ATOM 871 NE2 GLN B 19 21.359 37.196 10.240 1.00 75.30 N ATOM 872 N ASP B 20 15.686 36.638 7.009 1.00 57.17 N ATOM 873 CA ASP B 20 14.580 36.607 6.037 1.00 57.78 C ATOM 874 C ASP B 20 15.095 36.427 4.599 1.00 52.99 C ATOM 875 O ASP B 20 14.869 37.254 3.712 1.00 50.94 O ATOM 876 CB ASP B 20 13.702 37.867 6.163 1.00 66.92 C ATOM 877 CG ASP B 20 12.977 37.962 7.526 1.00 73.03 C ATOM 878 OD1 ASP B 20 12.620 36.900 8.089 1.00 76.53 O ATOM 879 OD2 ASP B 20 12.748 39.099 8.026 1.00 76.16 O ATOM 880 N GLN B 21 15.778 35.310 4.401 1.00 44.59 N ATOM 881 CA GLN B 21 16.488 35.021 3.176 1.00 39.46 C ATOM 882 C GLN B 21 16.244 33.537 2.802 1.00 34.85 C ATOM 883 O GLN B 21 16.392 32.633 3.638 1.00 31.55 O ATOM 884 CB GLN B 21 17.961 35.292 3.447 1.00 38.79 C ATOM 885 CG GLN B 21 18.846 35.348 2.236 1.00 41.24 C ATOM 886 CD GLN B 21 19.020 36.736 1.677 1.00 40.96 C ATOM 887 OE1 GLN B 21 18.504 37.733 2.225 1.00 37.16 O ATOM 888 NE2 GLN B 21 19.745 36.813 0.564 1.00 39.65 N ATOM 889 N VAL B 22 15.847 33.271 1.560 1.00 30.99 N ATOM 890 CA VAL B 22 15.368 31.920 1.246 1.00 28.42 C ATOM 891 C VAL B 22 16.496 30.965 1.003 1.00 25.62 C ATOM 892 O VAL B 22 17.372 31.242 0.226 1.00 26.36 O ATOM 893 CB VAL B 22 14.489 31.851 0.023 1.00 27.14 C ATOM 894 CG1 VAL B 22 13.960 30.403 -0.136 1.00 20.92 C ATOM 895 CG2 VAL B 22 13.367 32.871 0.134 1.00 30.01 C ATOM 896 N THR B 23 16.447 29.814 1.647 1.00 25.44 N ATOM 897 CA THR B 23 17.560 28.883 1.614 1.00 22.91 C ATOM 898 C THR B 23 17.068 27.443 1.760 1.00 22.55 C ATOM 899 O THR B 23 16.020 27.184 2.316 1.00 28.85 O ATOM 900 CB THR B 23 18.591 29.211 2.712 1.00 20.30 C ATOM 901 OG1 THR B 23 19.117 27.994 3.231 1.00 28.92 O ATOM 902 CG2 THR B 23 17.953 29.951 3.879 1.00 17.68 C ATOM 903 N GLN B 24 17.859 26.510 1.265 1.00 23.23 N ATOM 904 CA GLN B 24 17.520 25.102 1.312 1.00 22.64 C ATOM 905 C GLN B 24 18.021 24.438 2.571 1.00 21.08 C ATOM 906 O GLN B 24 19.103 24.716 3.002 1.00 29.06 O ATOM 907 CB GLN B 24 18.152 24.427 0.117 1.00 22.55 C ATOM 908 CG GLN B 24 17.634 24.978 -1.185 1.00 22.22 C ATOM 909 CD GLN B 24 16.185 24.571 -1.466 1.00 21.44 C ATOM 910 OE1 GLN B 24 15.348 25.440 -1.755 1.00 25.32 O ATOM 911 NE2 GLN B 24 15.881 23.264 -1.378 1.00 7.95 N ATOM 912 N LYS B 25 17.217 23.579 3.169 1.00 19.92 N ATOM 913 CA LYS B 25 17.643 22.818 4.329 1.00 24.20 C ATOM 914 C LYS B 25 17.236 21.385 4.124 1.00 14.50 C ATOM 915 O LYS B 25 16.263 21.114 3.454 1.00 15.46 O ATOM 916 CB LYS B 25 17.107 23.415 5.640 1.00 35.23 C ATOM 917 CG LYS B 25 18.041 24.600 6.156 1.00 43.57 C ATOM 918 CD LYS B 25 17.437 25.486 7.329 1.00 44.51 C ATOM 919 CE LYS B 25 18.093 26.928 7.426 1.00 45.13 C ATOM 920 NZ LYS B 25 17.229 27.991 8.073 1.00 44.01 N ATOM 921 N PRO B 26 18.043 20.445 4.615 1.00 15.04 N ATOM 922 CA PRO B 26 17.782 19.033 4.427 1.00 15.07 C ATOM 923 C PRO B 26 16.405 18.616 4.817 1.00 10.90 C ATOM 924 O PRO B 26 15.813 19.149 5.754 1.00 12.23 O ATOM 925 CB PRO B 26 18.776 18.370 5.395 1.00 14.24 C ATOM 926 CG PRO B 26 19.900 19.275 5.422 1.00 14.80 C ATOM 927 CD PRO B 26 19.313 20.649 5.337 1.00 16.78 C ATOM 928 N LEU B 27 15.920 17.604 4.138 1.00 13.15 N ATOM 929 CA LEU B 27 14.674 16.989 4.553 1.00 13.77 C ATOM 930 C LEU B 27 14.817 16.382 5.946 1.00 15.73 C ATOM 931 O LEU B 27 13.855 16.374 6.700 1.00 21.64 O ATOM 932 CB LEU B 27 14.254 15.901 3.555 1.00 12.88 C ATOM 933 CG LEU B 27 12.865 15.316 3.748 1.00 10.59 C ATOM 934 CD1 LEU B 27 11.825 16.466 3.704 1.00 8.78 C ATOM 935 CD2 LEU B 27 12.687 14.263 2.685 1.00 4.87 C ATOM 936 N ARG B 28 15.996 15.840 6.255 1.00 14.56 N ATOM 937 CA ARG B 28 16.288 15.366 7.609 1.00 18.79 C ATOM 938 C ARG B 28 15.675 16.310 8.653 1.00 18.88 C ATOM 939 O ARG B 28 15.018 15.855 9.612 1.00 17.15 O ATOM 940 CB ARG B 28 17.804 15.346 7.852 1.00 21.38 C ATOM 941 CG ARG B 28 18.558 14.127 7.349 1.00 22.58 C ATOM 942 CD ARG B 28 20.059 14.446 7.290 1.00 28.19 C ATOM 943 NE ARG B 28 20.950 13.302 7.521 1.00 30.46 N ATOM 944 CZ ARG B 28 21.483 12.525 6.576 1.00 38.87 C ATOM 945 NH1 ARG B 28 21.224 12.708 5.290 1.00 40.94 N ATOM 946 NH2 ARG B 28 22.289 11.537 6.922 1.00 42.05 N ATOM 947 N ASP B 29 15.895 17.619 8.453 1.00 16.73 N ATOM 948 CA ASP B 29 15.525 18.624 9.451 1.00 19.62 C ATOM 949 C ASP B 29 14.036 18.696 9.610 1.00 20.03 C ATOM 950 O ASP B 29 13.565 18.924 10.712 1.00 23.34 O ATOM 951 CB ASP B 29 16.031 20.012 9.092 1.00 27.10 C ATOM 952 CG ASP B 29 17.535 20.153 9.229 1.00 36.02 C ATOM 953 OD1 ASP B 29 18.259 19.188 9.612 1.00 38.27 O ATOM 954 OD2 ASP B 29 17.995 21.279 8.928 1.00 45.56 O ATOM 955 N SER B 30 13.300 18.536 8.511 1.00 16.12 N ATOM 956 CA SER B 30 11.845 18.587 8.559 1.00 13.10 C ATOM 957 C SER B 30 11.322 17.486 9.465 1.00 13.05 C ATOM 958 O SER B 30 10.409 17.671 10.275 1.00 15.63 O ATOM 959 CB SER B 30 11.270 18.395 7.155 1.00 14.73 C ATOM 960 OG SER B 30 11.478 19.532 6.305 1.00 13.39 O ATOM 961 N VAL B 31 11.912 16.313 9.306 1.00 14.80 N ATOM 962 CA VAL B 31 11.546 15.164 10.109 1.00 13.87 C ATOM 963 C VAL B 31 11.907 15.433 11.551 1.00 15.25 C ATOM 964 O VAL B 31 11.122 15.145 12.413 1.00 20.78 O ATOM 965 CB VAL B 31 12.195 13.881 9.581 1.00 9.43 C ATOM 966 CG1 VAL B 31 11.771 12.694 10.411 1.00 10.00 C ATOM 967 CG2 VAL B 31 11.803 13.666 8.090 1.00 6.34 C ATOM 968 N LYS B 32 13.061 16.027 11.807 1.00 20.30 N ATOM 969 CA LYS B 32 13.418 16.415 13.179 1.00 28.32 C ATOM 970 C LYS B 32 12.333 17.292 13.786 1.00 26.09 C ATOM 971 O LYS B 32 11.842 17.025 14.877 1.00 26.32 O ATOM 972 CB LYS B 32 14.740 17.174 13.245 1.00 37.06 C ATOM 973 CG LYS B 32 15.964 16.343 13.532 1.00 43.48 C ATOM 974 CD LYS B 32 17.171 17.274 13.811 1.00 47.58 C ATOM 975 CE LYS B 32 18.401 16.552 14.420 1.00 51.53 C ATOM 976 NZ LYS B 32 19.255 17.529 15.214 1.00 52.97 N ATOM 977 N GLN B 33 11.939 18.333 13.072 1.00 28.98 N ATOM 978 CA GLN B 33 11.008 19.309 13.626 1.00 29.16 C ATOM 979 C GLN B 33 9.660 18.660 13.863 1.00 23.51 C ATOM 980 O GLN B 33 9.075 18.843 14.920 1.00 24.82 O ATOM 981 CB GLN B 33 10.885 20.514 12.704 1.00 35.07 C ATOM 982 CG GLN B 33 10.306 21.756 13.355 1.00 41.98 C ATOM 983 CD GLN B 33 10.291 22.967 12.394 1.00 48.93 C ATOM 984 OE1 GLN B 33 10.108 22.828 11.153 1.00 54.00 O ATOM 985 NE2 GLN B 33 10.500 24.169 12.967 1.00 59.11 N ATOM 986 N ALA B 34 9.200 17.871 12.893 1.00 22.79 N ATOM 987 CA ALA B 34 7.909 17.177 12.971 1.00 22.32 C ATOM 988 C ALA B 34 7.744 16.349 14.260 1.00 24.31 C ATOM 989 O ALA B 34 6.636 16.331 14.889 1.00 28.44 O ATOM 990 CB ALA B 34 7.727 16.304 11.764 1.00 15.87 C ATOM 991 N LEU B 35 8.845 15.685 14.634 1.00 23.75 N ATOM 992 CA LEU B 35 8.934 14.836 15.830 1.00 21.07 C ATOM 993 C LEU B 35 9.156 15.662 17.083 1.00 22.64 C ATOM 994 O LEU B 35 8.576 15.385 18.119 1.00 26.84 O ATOM 995 CB LEU B 35 10.083 13.849 15.697 1.00 15.83 C ATOM 996 CG LEU B 35 9.952 12.739 14.648 1.00 16.45 C ATOM 997 CD1 LEU B 35 11.349 12.307 14.130 1.00 20.69 C ATOM 998 CD2 LEU B 35 9.203 11.540 15.192 1.00 12.40 C ATOM 999 N LYS B 36 10.019 16.661 17.002 1.00 25.95 N ATOM 1000 CA LYS B 36 10.225 17.537 18.137 1.00 30.67 C ATOM 1001 C LYS B 36 8.869 17.991 18.613 1.00 30.41 C ATOM 1002 O LYS B 36 8.552 17.922 19.796 1.00 29.96 O ATOM 1003 CB LYS B 36 11.108 18.732 17.757 1.00 36.43 C ATOM 1004 CG LYS B 36 11.112 19.844 18.796 1.00 41.24 C ATOM 1005 CD LYS B 36 12.319 20.797 18.672 1.00 44.62 C ATOM 1006 CE LYS B 36 12.203 21.954 19.694 1.00 46.78 C ATOM 1007 NZ LYS B 36 13.491 22.667 19.887 1.00 48.82 N ATOM 1008 N ASN B 37 8.072 18.426 17.650 1.00 32.73 N ATOM 1009 CA ASN B 37 6.750 18.970 17.898 1.00 33.49 C ATOM 1010 C ASN B 37 5.744 17.903 18.307 1.00 29.92 C ATOM 1011 O ASN B 37 4.868 18.136 19.119 1.00 30.13 O ATOM 1012 CB ASN B 37 6.266 19.704 16.648 1.00 38.93 C ATOM 1013 CG ASN B 37 4.793 19.628 16.489 1.00 43.61 C ATOM 1014 OD1 ASN B 37 4.064 20.437 17.065 1.00 42.75 O ATOM 1015 ND2 ASN B 37 4.324 18.619 15.718 1.00 49.81 N ATOM 1016 N TYR B 38 5.858 16.730 17.712 1.00 28.67 N ATOM 1017 CA TYR B 38 5.074 15.566 18.150 1.00 28.87 C ATOM 1018 C TYR B 38 5.251 15.276 19.624 1.00 28.37 C ATOM 1019 O TYR B 38 4.285 15.146 20.353 1.00 32.29 O ATOM 1020 CB TYR B 38 5.505 14.333 17.356 1.00 25.85 C ATOM 1021 CG TYR B 38 4.833 13.032 17.738 1.00 25.68 C ATOM 1022 CD1 TYR B 38 5.540 12.026 18.382 1.00 27.66 C ATOM 1023 CD2 TYR B 38 3.509 12.787 17.428 1.00 27.18 C ATOM 1024 CE1 TYR B 38 4.945 10.806 18.716 1.00 25.57 C ATOM 1025 CE2 TYR B 38 2.893 11.571 17.764 1.00 27.13 C ATOM 1026 CZ TYR B 38 3.622 10.586 18.408 1.00 26.49 C ATOM 1027 OH TYR B 38 3.033 9.379 18.745 1.00 26.40 O ATOM 1028 N PHE B 39 6.497 15.161 20.048 1.00 30.02 N ATOM 1029 CA PHE B 39 6.808 14.900 21.447 1.00 32.75 C ATOM 1030 C PHE B 39 6.247 15.956 22.403 1.00 35.80 C ATOM 1031 O PHE B 39 5.670 15.611 23.417 1.00 40.54 O ATOM 1032 CB PHE B 39 8.323 14.770 21.651 1.00 28.93 C ATOM 1033 CG PHE B 39 8.923 13.556 20.990 1.00 27.52 C ATOM 1034 CD1 PHE B 39 8.332 12.318 21.113 1.00 28.27 C ATOM 1035 CD2 PHE B 39 10.084 13.653 20.253 1.00 27.80 C ATOM 1036 CE1 PHE B 39 8.885 11.194 20.508 1.00 28.03 C ATOM 1037 CE2 PHE B 39 10.651 12.539 19.655 1.00 26.73 C ATOM 1038 CZ PHE B 39 10.046 11.311 19.782 1.00 27.64 C ATOM 1039 N ALA B 40 6.409 17.234 22.095 1.00 35.00 N ATOM 1040 CA ALA B 40 5.793 18.262 22.916 1.00 37.87 C ATOM 1041 C ALA B 40 4.304 17.985 23.161 1.00 40.44 C ATOM 1042 O ALA B 40 3.882 17.974 24.303 1.00 42.48 O ATOM 1043 CB ALA B 40 5.981 19.620 22.310 1.00 36.72 C ATOM 1044 N GLN B 41 3.535 17.737 22.100 1.00 45.42 N ATOM 1045 CA GLN B 41 2.106 17.370 22.202 1.00 53.07 C ATOM 1046 C GLN B 41 1.759 16.105 23.042 1.00 54.00 C ATOM 1047 O GLN B 41 0.599 15.860 23.319 1.00 52.57 O ATOM 1048 CB GLN B 41 1.532 17.116 20.811 1.00 58.25 C ATOM 1049 CG GLN B 41 1.271 18.311 19.909 1.00 61.96 C ATOM 1050 CD GLN B 41 0.513 17.856 18.607 1.00 65.43 C ATOM 1051 OE1 GLN B 41 0.757 16.764 18.044 1.00 68.74 O ATOM 1052 NE2 GLN B 41 -0.428 18.678 18.165 1.00 69.88 N ATOM 1053 N LEU B 42 2.731 15.275 23.393 1.00 59.13 N ATOM 1054 CA LEU B 42 2.474 14.101 24.246 1.00 64.13 C ATOM 1055 C LEU B 42 2.425 14.499 25.717 1.00 70.53 C ATOM 1056 O LEU B 42 3.432 14.484 26.434 1.00 71.63 O ATOM 1057 CB LEU B 42 3.577 13.057 24.076 1.00 63.52 C ATOM 1058 CG LEU B 42 3.351 11.948 23.085 1.00 62.26 C ATOM 1059 CD1 LEU B 42 2.897 12.540 21.768 1.00 64.48 C ATOM 1060 CD2 LEU B 42 4.663 11.192 22.975 1.00 61.39 C ATOM 1061 N ASN B 43 1.249 14.836 26.197 1.00 76.48 N ATOM 1062 CA ASN B 43 1.136 15.209 27.590 1.00 79.29 C ATOM 1063 C ASN B 43 0.203 14.225 28.282 1.00 84.72 C ATOM 1064 O ASN B 43 -0.937 14.565 28.585 1.00 88.19 O ATOM 1065 CB ASN B 43 0.624 16.657 27.712 1.00 80.80 C ATOM 1066 CG ASN B 43 1.613 17.686 27.173 1.00 79.40 C ATOM 1067 OD1 ASN B 43 2.821 17.473 27.182 1.00 78.17 O ATOM 1068 ND2 ASN B 43 1.092 18.820 26.721 1.00 77.75 N ATOM 1069 N GLY B 44 0.651 12.992 28.517 1.00 85.97 N ATOM 1070 CA GLY B 44 1.954 12.472 28.086 1.00 83.83 C ATOM 1071 C GLY B 44 1.880 10.962 27.973 1.00 83.95 C ATOM 1072 O GLY B 44 2.729 10.250 28.504 1.00 82.75 O ATOM 1073 N GLN B 45 0.852 10.491 27.263 1.00 82.78 N ATOM 1074 CA GLN B 45 0.498 9.068 27.187 1.00 79.82 C ATOM 1075 C GLN B 45 1.493 8.271 26.361 1.00 77.55 C ATOM 1076 O GLN B 45 2.452 8.826 25.838 1.00 77.35 O ATOM 1077 CB GLN B 45 -0.908 8.895 26.599 1.00 79.83 C ATOM 1078 CG GLN B 45 -0.995 9.096 25.093 1.00 79.62 C ATOM 1079 CD GLN B 45 -0.999 10.555 24.676 1.00 79.80 C ATOM 1080 OE1 GLN B 45 -0.458 11.428 25.366 1.00 79.05 O ATOM 1081 NE2 GLN B 45 -1.614 10.825 23.529 1.00 80.51 N ATOM 1082 N ASP B 46 1.244 6.971 26.229 1.00 74.69 N ATOM 1083 CA ASP B 46 2.176 6.079 25.539 1.00 72.22 C ATOM 1084 C ASP B 46 1.918 5.964 24.018 1.00 69.29 C ATOM 1085 O ASP B 46 0.780 6.086 23.539 1.00 67.32 O ATOM 1086 CB ASP B 46 2.202 4.677 26.191 1.00 73.36 C ATOM 1087 CG ASP B 46 0.957 3.854 25.884 1.00 73.18 C ATOM 1088 OD1 ASP B 46 -0.074 4.166 26.511 1.00 74.03 O ATOM 1089 OD2 ASP B 46 1.011 2.906 25.044 1.00 69.58 O ATOM 1090 N VAL B 47 3.008 5.712 23.292 1.00 63.25 N ATOM 1091 CA VAL B 47 3.001 5.481 21.866 1.00 59.09 C ATOM 1092 C VAL B 47 3.551 4.092 21.596 1.00 54.53 C ATOM 1093 O VAL B 47 4.495 3.674 22.247 1.00 54.82 O ATOM 1094 CB VAL B 47 3.936 6.474 21.183 1.00 59.05 C ATOM 1095 CG1 VAL B 47 3.618 6.554 19.683 1.00 61.64 C ATOM 1096 CG2 VAL B 47 3.855 7.841 21.868 1.00 56.10 C ATOM 1097 N ASN B 48 2.994 3.376 20.632 1.00 52.46 N ATOM 1098 CA ASN B 48 3.534 2.053 20.306 1.00 53.88 C ATOM 1099 C ASN B 48 3.696 1.800 18.818 1.00 54.48 C ATOM 1100 O ASN B 48 4.008 0.685 18.415 1.00 56.21 O ATOM 1101 CB ASN B 48 2.662 0.968 20.924 1.00 56.31 C ATOM 1102 CG ASN B 48 1.193 1.273 20.796 1.00 59.00 C ATOM 1103 OD1 ASN B 48 0.713 1.668 19.721 1.00 57.66 O ATOM 1104 ND2 ASN B 48 0.468 1.132 21.911 1.00 62.49 N ATOM 1105 N ASP B 49 3.508 2.836 18.003 1.00 53.49 N ATOM 1106 CA ASP B 49 3.488 2.673 16.547 1.00 49.50 C ATOM 1107 C ASP B 49 4.113 3.878 15.858 1.00 41.59 C ATOM 1108 O ASP B 49 3.683 4.283 14.786 1.00 44.97 O ATOM 1109 CB ASP B 49 2.045 2.470 16.074 1.00 58.00 C ATOM 1110 CG ASP B 49 1.110 3.574 16.573 1.00 66.47 C ATOM 1111 OD1 ASP B 49 1.581 4.514 17.284 1.00 70.42 O ATOM 1112 OD2 ASP B 49 -0.098 3.494 16.252 1.00 71.76 O ATOM 1113 N LEU B 50 5.151 4.428 16.462 1.00 29.73 N ATOM 1114 CA LEU B 50 5.767 5.645 15.951 1.00 26.95 C ATOM 1115 C LEU B 50 6.469 5.445 14.628 1.00 25.01 C ATOM 1116 O LEU B 50 6.495 6.356 13.810 1.00 26.71 O ATOM 1117 CB LEU B 50 6.751 6.233 16.964 1.00 23.57 C ATOM 1118 CG LEU B 50 7.424 7.544 16.569 1.00 20.81 C ATOM 1119 CD1 LEU B 50 6.398 8.580 16.226 1.00 19.23 C ATOM 1120 CD2 LEU B 50 8.350 8.048 17.676 1.00 17.59 C ATOM 1121 N TYR B 51 7.053 4.272 14.420 1.00 26.05 N ATOM 1122 CA TYR B 51 7.739 3.983 13.155 1.00 24.09 C ATOM 1123 C TYR B 51 6.716 3.920 12.022 1.00 26.02 C ATOM 1124 O TYR B 51 6.818 4.658 11.050 1.00 27.87 O ATOM 1125 CB TYR B 51 8.551 2.697 13.252 1.00 21.92 C ATOM 1126 CG TYR B 51 9.402 2.424 12.039 1.00 24.26 C ATOM 1127 CD1 TYR B 51 10.767 2.676 12.048 1.00 26.43 C ATOM 1128 CD2 TYR B 51 8.848 1.904 10.873 1.00 28.01 C ATOM 1129 CE1 TYR B 51 11.564 2.415 10.930 1.00 25.28 C ATOM 1130 CE2 TYR B 51 9.625 1.652 9.751 1.00 26.20 C ATOM 1131 CZ TYR B 51 10.978 1.910 9.790 1.00 25.48 C ATOM 1132 OH TYR B 51 11.735 1.643 8.681 1.00 24.69 O ATOM 1133 N GLU B 52 5.709 3.070 12.158 1.00 30.98 N ATOM 1134 CA GLU B 52 4.672 2.981 11.144 1.00 29.06 C ATOM 1135 C GLU B 52 4.047 4.348 10.909 1.00 28.73 C ATOM 1136 O GLU B 52 3.784 4.732 9.771 1.00 30.83 O ATOM 1137 CB GLU B 52 3.604 1.974 11.554 1.00 34.84 C ATOM 1138 CG GLU B 52 2.377 1.908 10.625 1.00 40.82 C ATOM 1139 CD GLU B 52 2.697 1.578 9.140 1.00 47.58 C ATOM 1140 OE1 GLU B 52 1.994 2.142 8.238 1.00 45.04 O ATOM 1141 OE2 GLU B 52 3.629 0.760 8.893 1.00 50.94 O ATOM 1142 N LEU B 53 3.829 5.091 11.985 1.00 27.26 N ATOM 1143 CA LEU B 53 3.180 6.397 11.883 1.00 25.64 C ATOM 1144 C LEU B 53 3.922 7.332 10.935 1.00 25.35 C ATOM 1145 O LEU B 53 3.314 7.986 10.070 1.00 27.66 O ATOM 1146 CB LEU B 53 3.075 7.033 13.253 1.00 25.27 C ATOM 1147 CG LEU B 53 2.471 8.440 13.288 1.00 27.36 C ATOM 1148 CD1 LEU B 53 0.932 8.379 13.257 1.00 28.07 C ATOM 1149 CD2 LEU B 53 2.985 9.260 14.498 1.00 25.40 C ATOM 1150 N VAL B 54 5.239 7.356 11.114 1.00 22.89 N ATOM 1151 CA VAL B 54 6.151 8.156 10.311 1.00 20.12 C ATOM 1152 C VAL B 54 6.276 7.613 8.915 1.00 19.80 C ATOM 1153 O VAL B 54 6.089 8.342 7.946 1.00 23.47 O ATOM 1154 CB VAL B 54 7.549 8.116 10.899 1.00 18.20 C ATOM 1155 CG1 VAL B 54 8.548 8.694 9.905 1.00 17.57 C ATOM 1156 CG2 VAL B 54 7.577 8.837 12.243 1.00 20.30 C ATOM 1157 N LEU B 55 6.617 6.334 8.826 1.00 19.93 N ATOM 1158 CA LEU B 55 6.772 5.641 7.546 1.00 21.23 C ATOM 1159 C LEU B 55 5.606 5.872 6.570 1.00 22.11 C ATOM 1160 O LEU B 55 5.798 5.978 5.360 1.00 21.93 O ATOM 1161 CB LEU B 55 6.933 4.129 7.796 1.00 24.85 C ATOM 1162 CG LEU B 55 7.250 3.202 6.594 1.00 25.55 C ATOM 1163 CD1 LEU B 55 8.722 3.363 6.154 1.00 22.55 C ATOM 1164 CD2 LEU B 55 6.929 1.728 6.912 1.00 23.13 C ATOM 1165 N ALA B 56 4.398 5.936 7.107 1.00 21.53 N ATOM 1166 CA ALA B 56 3.242 6.165 6.278 1.00 21.76 C ATOM 1167 C ALA B 56 3.241 7.601 5.816 1.00 23.76 C ATOM 1168 O ALA B 56 2.907 7.887 4.674 1.00 32.42 O ATOM 1169 CB ALA B 56 1.982 5.851 7.021 1.00 20.33 C ATOM 1170 N GLU B 57 3.629 8.513 6.695 1.00 19.19 N ATOM 1171 CA GLU B 57 3.641 9.933 6.320 1.00 19.31 C ATOM 1172 C GLU B 57 4.630 10.147 5.189 1.00 18.82 C ATOM 1173 O GLU B 57 4.569 11.117 4.453 1.00 22.64 O ATOM 1174 CB GLU B 57 4.019 10.797 7.523 1.00 20.84 C ATOM 1175 CG GLU B 57 3.875 12.300 7.348 1.00 22.49 C ATOM 1176 CD GLU B 57 2.450 12.795 7.371 1.00 27.24 C ATOM 1177 OE1 GLU B 57 1.549 11.965 7.644 1.00 28.15 O ATOM 1178 OE2 GLU B 57 2.244 14.014 7.120 1.00 31.35 O ATOM 1179 N VAL B 58 5.529 9.214 5.013 1.00 18.82 N ATOM 1180 CA VAL B 58 6.585 9.413 4.061 1.00 21.23 C ATOM 1181 C VAL B 58 6.438 8.541 2.796 1.00 23.87 C ATOM 1182 O VAL B 58 6.670 9.015 1.665 1.00 25.91 O ATOM 1183 CB VAL B 58 7.909 9.158 4.772 1.00 21.11 C ATOM 1184 CG1 VAL B 58 8.887 8.467 3.855 1.00 16.81 C ATOM 1185 CG2 VAL B 58 8.425 10.472 5.339 1.00 19.06 C ATOM 1186 N GLU B 59 6.055 7.279 2.969 1.00 21.79 N ATOM 1187 CA GLU B 59 5.774 6.423 1.820 1.00 20.28 C ATOM 1188 C GLU B 59 4.727 7.026 0.882 1.00 21.15 C ATOM 1189 O GLU B 59 4.881 6.977 -0.328 1.00 24.85 O ATOM 1190 CB GLU B 59 5.302 5.051 2.287 1.00 19.75 C ATOM 1191 CG GLU B 59 6.421 4.128 2.732 1.00 21.21 C ATOM 1192 CD GLU B 59 5.979 2.667 2.872 1.00 25.29 C ATOM 1193 OE1 GLU B 59 6.897 1.812 2.809 1.00 28.21 O ATOM 1194 OE2 GLU B 59 4.750 2.370 3.025 1.00 24.26 O ATOM 1195 N GLN B 60 3.669 7.603 1.442 1.00 21.95 N ATOM 1196 CA GLN B 60 2.582 8.177 0.640 1.00 26.08 C ATOM 1197 C GLN B 60 3.045 9.189 -0.430 1.00 23.43 C ATOM 1198 O GLN B 60 2.859 8.961 -1.639 1.00 21.89 O ATOM 1199 CB GLN B 60 1.541 8.810 1.556 1.00 31.86 C ATOM 1200 CG GLN B 60 0.140 8.490 1.175 1.00 43.37 C ATOM 1201 CD GLN B 60 -0.902 8.802 2.272 1.00 48.71 C ATOM 1202 OE1 GLN B 60 -0.643 9.562 3.221 1.00 59.69 O ATOM 1203 NE2 GLN B 60 -2.099 8.221 2.124 1.00 57.29 N ATOM 1204 N PRO B 61 3.690 10.287 0.001 1.00 21.36 N ATOM 1205 CA PRO B 61 4.152 11.292 -0.958 1.00 22.54 C ATOM 1206 C PRO B 61 5.156 10.738 -1.949 1.00 24.10 C ATOM 1207 O PRO B 61 5.173 11.170 -3.103 1.00 24.95 O ATOM 1208 CB PRO B 61 4.864 12.320 -0.086 1.00 21.47 C ATOM 1209 CG PRO B 61 4.493 12.016 1.303 1.00 19.09 C ATOM 1210 CD PRO B 61 4.077 10.629 1.378 1.00 20.00 C ATOM 1211 N LEU B 62 6.010 9.828 -1.472 1.00 21.88 N ATOM 1212 CA LEU B 62 7.050 9.226 -2.306 1.00 18.51 C ATOM 1213 C LEU B 62 6.462 8.426 -3.458 1.00 16.63 C ATOM 1214 O LEU B 62 6.898 8.560 -4.606 1.00 8.63 O ATOM 1215 CB LEU B 62 7.943 8.304 -1.480 1.00 17.79 C ATOM 1216 CG LEU B 62 8.943 7.404 -2.235 1.00 15.92 C ATOM 1217 CD1 LEU B 62 9.749 8.181 -3.240 1.00 13.58 C ATOM 1218 CD2 LEU B 62 9.873 6.764 -1.236 1.00 14.12 C ATOM 1219 N LEU B 63 5.488 7.583 -3.136 1.00 16.08 N ATOM 1220 CA LEU B 63 4.805 6.803 -4.148 1.00 17.13 C ATOM 1221 C LEU B 63 4.042 7.730 -5.064 1.00 16.43 C ATOM 1222 O LEU B 63 4.063 7.566 -6.276 1.00 17.80 O ATOM 1223 CB LEU B 63 3.820 5.828 -3.518 1.00 16.74 C ATOM 1224 CG LEU B 63 4.381 4.837 -2.512 1.00 14.94 C ATOM 1225 CD1 LEU B 63 3.218 4.316 -1.648 1.00 15.52 C ATOM 1226 CD2 LEU B 63 5.159 3.746 -3.221 1.00 7.24 C ATOM 1227 N ASP B 64 3.359 8.701 -4.471 1.00 17.67 N ATOM 1228 CA ASP B 64 2.578 9.647 -5.242 1.00 18.17 C ATOM 1229 C ASP B 64 3.485 10.267 -6.301 1.00 18.02 C ATOM 1230 O ASP B 64 3.245 10.171 -7.487 1.00 19.23 O ATOM 1231 CB ASP B 64 2.026 10.703 -4.291 1.00 26.71 C ATOM 1232 CG ASP B 64 1.073 11.694 -4.961 1.00 31.94 C ATOM 1233 OD1 ASP B 64 1.058 11.824 -6.214 1.00 37.36 O ATOM 1234 OD2 ASP B 64 0.357 12.379 -4.182 1.00 39.38 O ATOM 1235 N MET B 65 4.571 10.862 -5.862 1.00 18.50 N ATOM 1236 CA MET B 65 5.401 11.605 -6.755 1.00 15.86 C ATOM 1237 C MET B 65 6.002 10.674 -7.796 1.00 18.32 C ATOM 1238 O MET B 65 6.019 10.988 -8.966 1.00 25.99 O ATOM 1239 CB MET B 65 6.472 12.339 -5.965 1.00 20.14 C ATOM 1240 CG MET B 65 6.633 13.737 -6.437 1.00 26.74 C ATOM 1241 SD MET B 65 5.140 14.696 -6.100 1.00 37.59 S ATOM 1242 CE MET B 65 5.020 15.729 -7.623 1.00 32.30 C ATOM 1243 N VAL B 66 6.463 9.504 -7.394 1.00 17.00 N ATOM 1244 CA VAL B 66 7.127 8.632 -8.349 1.00 15.33 C ATOM 1245 C VAL B 66 6.167 8.153 -9.409 1.00 17.87 C ATOM 1246 O VAL B 66 6.544 8.031 -10.574 1.00 21.97 O ATOM 1247 CB VAL B 66 7.766 7.423 -7.697 1.00 11.85 C ATOM 1248 CG1 VAL B 66 8.057 6.376 -8.746 1.00 16.56 C ATOM 1249 CG2 VAL B 66 9.043 7.806 -6.997 1.00 8.37 C ATOM 1250 N MET B 67 4.930 7.877 -9.018 1.00 22.94 N ATOM 1251 CA MET B 67 3.889 7.485 -10.006 1.00 24.17 C ATOM 1252 C MET B 67 3.570 8.637 -10.968 1.00 23.80 C ATOM 1253 O MET B 67 3.412 8.426 -12.171 1.00 24.18 O ATOM 1254 CB MET B 67 2.599 6.990 -9.327 1.00 25.08 C ATOM 1255 CG MET B 67 2.741 5.690 -8.535 1.00 25.56 C ATOM 1256 SD MET B 67 3.544 4.375 -9.468 1.00 27.69 S ATOM 1257 CE MET B 67 2.250 3.973 -10.623 1.00 24.96 C ATOM 1258 N GLN B 68 3.492 9.850 -10.432 1.00 20.53 N ATOM 1259 CA GLN B 68 3.339 11.014 -11.281 1.00 22.58 C ATOM 1260 C GLN B 68 4.487 11.055 -12.268 1.00 19.25 C ATOM 1261 O GLN B 68 4.268 11.228 -13.460 1.00 19.32 O ATOM 1262 CB GLN B 68 3.256 12.327 -10.489 1.00 21.59 C ATOM 1263 CG GLN B 68 1.866 12.567 -9.853 1.00 30.51 C ATOM 1264 CD GLN B 68 1.756 13.916 -9.141 1.00 35.35 C ATOM 1265 OE1 GLN B 68 0.932 14.081 -8.204 1.00 40.99 O ATOM 1266 NE2 GLN B 68 2.603 14.893 -9.568 1.00 37.99 N ATOM 1267 N TYR B 69 5.698 10.857 -11.769 1.00 20.29 N ATOM 1268 CA TYR B 69 6.873 10.937 -12.608 1.00 21.14 C ATOM 1269 C TYR B 69 6.882 9.877 -13.701 1.00 22.17 C ATOM 1270 O TYR B 69 7.281 10.163 -14.817 1.00 24.93 O ATOM 1271 CB TYR B 69 8.101 10.771 -11.766 1.00 28.04 C ATOM 1272 CG TYR B 69 9.417 10.960 -12.484 1.00 30.75 C ATOM 1273 CD1 TYR B 69 9.895 12.242 -12.777 1.00 33.19 C ATOM 1274 CD2 TYR B 69 10.226 9.868 -12.810 1.00 35.17 C ATOM 1275 CE1 TYR B 69 11.134 12.438 -13.417 1.00 30.96 C ATOM 1276 CE2 TYR B 69 11.482 10.053 -13.439 1.00 33.75 C ATOM 1277 CZ TYR B 69 11.928 11.341 -13.737 1.00 32.33 C ATOM 1278 OH TYR B 69 13.174 11.534 -14.326 1.00 33.90 O ATOM 1279 N THR B 70 6.445 8.662 -13.385 1.00 19.51 N ATOM 1280 CA THR B 70 6.438 7.593 -14.372 1.00 20.15 C ATOM 1281 C THR B 70 5.086 7.512 -15.114 1.00 21.02 C ATOM 1282 O THR B 70 4.780 6.538 -15.774 1.00 15.94 O ATOM 1283 CB THR B 70 6.794 6.224 -13.697 1.00 17.01 C ATOM 1284 OG1 THR B 70 5.778 5.875 -12.759 1.00 14.45 O ATOM 1285 CG2 THR B 70 8.121 6.269 -12.981 1.00 11.08 C ATOM 1286 N ARG B 71 4.261 8.539 -14.969 1.00 30.26 N ATOM 1287 CA ARG B 71 2.906 8.559 -15.537 1.00 34.67 C ATOM 1288 C ARG B 71 2.174 7.247 -15.351 1.00 32.32 C ATOM 1289 O ARG B 71 1.669 6.678 -16.302 1.00 37.24 O ATOM 1290 CB ARG B 71 2.964 8.931 -17.017 1.00 40.63 C ATOM 1291 CG ARG B 71 3.128 10.448 -17.299 1.00 47.55 C ATOM 1292 CD ARG B 71 4.009 10.672 -18.528 1.00 54.89 C ATOM 1293 NE ARG B 71 5.336 10.065 -18.315 1.00 63.96 N ATOM 1294 CZ ARG B 71 6.307 9.963 -19.227 1.00 67.55 C ATOM 1295 NH1 ARG B 71 6.120 10.431 -20.456 1.00 70.23 N ATOM 1296 NH2 ARG B 71 7.477 9.401 -18.898 1.00 66.14 N ATOM 1297 N GLY B 72 2.137 6.766 -14.119 1.00 30.32 N ATOM 1298 CA GLY B 72 1.412 5.543 -13.773 1.00 28.46 C ATOM 1299 C GLY B 72 2.131 4.219 -14.019 1.00 26.52 C ATOM 1300 O GLY B 72 1.584 3.153 -13.696 1.00 29.18 O ATOM 1301 N ASN B 73 3.340 4.268 -14.584 1.00 22.97 N ATOM 1302 CA ASN B 73 4.035 3.045 -15.011 1.00 22.32 C ATOM 1303 C ASN B 73 4.687 2.365 -13.824 1.00 22.32 C ATOM 1304 O ASN B 73 5.796 2.712 -13.438 1.00 29.40 O ATOM 1305 CB ASN B 73 5.077 3.354 -16.097 1.00 19.65 C ATOM 1306 CG ASN B 73 5.793 2.097 -16.631 1.00 22.96 C ATOM 1307 OD1 ASN B 73 5.838 1.040 -15.988 1.00 25.04 O ATOM 1308 ND2 ASN B 73 6.376 2.230 -17.809 1.00 23.32 N ATOM 1309 N GLN B 74 4.008 1.373 -13.267 1.00 22.80 N ATOM 1310 CA GLN B 74 4.496 0.665 -12.066 1.00 24.62 C ATOM 1311 C GLN B 74 5.848 -0.007 -12.227 1.00 28.59 C ATOM 1312 O GLN B 74 6.614 -0.111 -11.258 1.00 33.51 O ATOM 1313 CB GLN B 74 3.507 -0.405 -11.630 1.00 20.88 C ATOM 1314 CG GLN B 74 2.157 0.170 -11.249 1.00 23.07 C ATOM 1315 CD GLN B 74 1.193 -0.873 -10.803 1.00 25.04 C ATOM 1316 OE1 GLN B 74 1.322 -2.055 -11.147 1.00 30.51 O ATOM 1317 NE2 GLN B 74 0.208 -0.450 -10.030 1.00 25.91 N ATOM 1318 N THR B 75 6.124 -0.493 -13.435 1.00 28.48 N ATOM 1319 CA THR B 75 7.340 -1.243 -13.677 1.00 28.42 C ATOM 1320 C THR B 75 8.511 -0.284 -13.493 1.00 28.79 C ATOM 1321 O THR B 75 9.445 -0.591 -12.745 1.00 30.44 O ATOM 1322 CB THR B 75 7.328 -1.917 -15.068 1.00 30.01 C ATOM 1323 OG1 THR B 75 6.249 -2.874 -15.145 1.00 33.32 O ATOM 1324 CG2 THR B 75 8.644 -2.638 -15.342 1.00 26.30 C ATOM 1325 N ARG B 76 8.438 0.888 -14.120 1.00 29.24 N ATOM 1326 CA ARG B 76 9.538 1.860 -14.021 1.00 34.54 C ATOM 1327 C ARG B 76 9.625 2.416 -12.600 1.00 28.77 C ATOM 1328 O ARG B 76 10.706 2.666 -12.074 1.00 27.34 O ATOM 1329 CB ARG B 76 9.416 2.994 -15.074 1.00 40.98 C ATOM 1330 CG ARG B 76 9.778 2.546 -16.537 1.00 49.88 C ATOM 1331 CD ARG B 76 10.355 3.663 -17.473 1.00 54.14 C ATOM 1332 NE ARG B 76 9.356 4.708 -17.753 1.00 60.95 N ATOM 1333 CZ ARG B 76 9.355 5.949 -17.238 1.00 63.28 C ATOM 1334 NH1 ARG B 76 10.331 6.363 -16.424 1.00 62.78 N ATOM 1335 NH2 ARG B 76 8.375 6.807 -17.552 1.00 62.68 N ATOM 1336 N ALA B 77 8.476 2.578 -11.972 1.00 23.12 N ATOM 1337 CA ALA B 77 8.431 3.130 -10.638 1.00 23.59 C ATOM 1338 C ALA B 77 9.210 2.224 -9.651 1.00 23.30 C ATOM 1339 O ALA B 77 10.129 2.660 -8.960 1.00 24.42 O ATOM 1340 CB ALA B 77 6.957 3.329 -10.211 1.00 18.67 C ATOM 1341 N ALA B 78 8.848 0.951 -9.630 1.00 23.13 N ATOM 1342 CA ALA B 78 9.520 -0.031 -8.807 1.00 22.18 C ATOM 1343 C ALA B 78 11.030 -0.046 -9.094 1.00 24.77 C ATOM 1344 O ALA B 78 11.881 -0.207 -8.198 1.00 27.66 O ATOM 1345 CB ALA B 78 8.909 -1.404 -9.076 1.00 16.52 C ATOM 1346 N LEU B 79 11.357 0.114 -10.363 1.00 25.80 N ATOM 1347 CA LEU B 79 12.739 0.077 -10.773 1.00 24.72 C ATOM 1348 C LEU B 79 13.475 1.249 -10.218 1.00 25.76 C ATOM 1349 O LEU B 79 14.510 1.084 -9.575 1.00 32.59 O ATOM 1350 CB LEU B 79 12.854 0.089 -12.276 1.00 25.89 C ATOM 1351 CG LEU B 79 12.974 -1.288 -12.886 1.00 26.42 C ATOM 1352 CD1 LEU B 79 12.875 -1.173 -14.420 1.00 28.27 C ATOM 1353 CD2 LEU B 79 14.301 -1.832 -12.447 1.00 25.02 C ATOM 1354 N MET B 80 12.921 2.435 -10.428 1.00 24.60 N ATOM 1355 CA MET B 80 13.574 3.638 -9.945 1.00 26.64 C ATOM 1356 C MET B 80 13.544 3.756 -8.424 1.00 21.60 C ATOM 1357 O MET B 80 14.340 4.485 -7.858 1.00 28.61 O ATOM 1358 CB MET B 80 13.032 4.900 -10.621 1.00 29.81 C ATOM 1359 CG MET B 80 11.735 5.467 -10.111 1.00 33.03 C ATOM 1360 SD MET B 80 11.302 6.937 -11.122 1.00 41.58 S ATOM 1361 CE MET B 80 12.199 8.229 -10.232 1.00 38.91 C ATOM 1362 N MET B 81 12.704 2.988 -7.750 1.00 18.48 N ATOM 1363 CA MET B 81 12.691 3.021 -6.286 1.00 21.39 C ATOM 1364 C MET B 81 13.611 2.000 -5.649 1.00 23.37 C ATOM 1365 O MET B 81 13.984 2.138 -4.472 1.00 27.96 O ATOM 1366 CB MET B 81 11.266 2.828 -5.768 1.00 19.35 C ATOM 1367 CG MET B 81 10.476 4.125 -5.759 1.00 22.46 C ATOM 1368 SD MET B 81 8.793 3.832 -5.310 1.00 33.64 S ATOM 1369 CE MET B 81 9.042 3.223 -3.648 1.00 31.86 C ATOM 1370 N GLY B 82 13.938 0.959 -6.410 1.00 18.45 N ATOM 1371 CA GLY B 82 14.759 -0.089 -5.887 1.00 18.81 C ATOM 1372 C GLY B 82 14.019 -1.132 -5.078 1.00 18.91 C ATOM 1373 O GLY B 82 14.635 -1.873 -4.291 1.00 25.75 O ATOM 1374 N ILE B 83 12.725 -1.250 -5.320 1.00 17.65 N ATOM 1375 CA ILE B 83 11.923 -2.317 -4.707 1.00 19.92 C ATOM 1376 C ILE B 83 11.232 -3.207 -5.764 1.00 22.74 C ATOM 1377 O ILE B 83 11.034 -2.808 -6.914 1.00 24.19 O ATOM 1378 CB ILE B 83 10.862 -1.712 -3.782 1.00 18.84 C ATOM 1379 CG1 ILE B 83 9.849 -0.879 -4.594 1.00 17.88 C ATOM 1380 CG2 ILE B 83 11.511 -0.833 -2.742 1.00 21.02 C ATOM 1381 CD1 ILE B 83 8.680 -0.279 -3.796 1.00 13.62 C ATOM 1382 N ASN B 84 10.868 -4.413 -5.357 1.00 24.40 N ATOM 1383 CA ASN B 84 10.097 -5.332 -6.198 1.00 25.06 C ATOM 1384 C ASN B 84 8.780 -4.711 -6.620 1.00 26.09 C ATOM 1385 O ASN B 84 8.135 -4.011 -5.843 1.00 27.15 O ATOM 1386 CB ASN B 84 9.780 -6.595 -5.401 1.00 29.41 C ATOM 1387 CG ASN B 84 9.379 -7.776 -6.266 1.00 30.06 C ATOM 1388 OD1 ASN B 84 8.107 -8.191 -6.157 1.00 29.30 O ATOM 1389 ND2 ASN B 84 10.222 -8.365 -6.957 1.00 33.97 N ATOM 1390 N ARG B 85 8.357 -4.998 -7.840 1.00 25.48 N ATOM 1391 CA ARG B 85 7.110 -4.451 -8.352 1.00 25.60 C ATOM 1392 C ARG B 85 5.937 -4.977 -7.551 1.00 28.64 C ATOM 1393 O ARG B 85 4.882 -4.369 -7.502 1.00 33.12 O ATOM 1394 CB ARG B 85 6.965 -4.840 -9.806 1.00 27.67 C ATOM 1395 CG ARG B 85 5.690 -4.409 -10.509 1.00 29.10 C ATOM 1396 CD ARG B 85 5.815 -4.686 -12.041 1.00 30.43 C ATOM 1397 NE ARG B 85 5.952 -6.114 -12.322 1.00 30.27 N ATOM 1398 CZ ARG B 85 4.940 -6.931 -12.611 1.00 32.12 C ATOM 1399 NH1 ARG B 85 3.697 -6.465 -12.706 1.00 35.12 N ATOM 1400 NH2 ARG B 85 5.174 -8.218 -12.837 1.00 31.00 N ATOM 1401 N GLY B 86 6.126 -6.118 -6.913 1.00 27.35 N ATOM 1402 CA GLY B 86 5.081 -6.685 -6.100 1.00 24.25 C ATOM 1403 C GLY B 86 4.906 -5.902 -4.835 1.00 19.24 C ATOM 1404 O GLY B 86 3.796 -5.604 -4.425 1.00 20.01 O ATOM 1405 N THR B 87 6.013 -5.571 -4.200 1.00 17.24 N ATOM 1406 CA THR B 87 5.901 -4.833 -2.952 1.00 25.08 C ATOM 1407 C THR B 87 5.338 -3.442 -3.234 1.00 23.69 C ATOM 1408 O THR B 87 4.517 -2.932 -2.464 1.00 22.34 O ATOM 1409 CB THR B 87 7.213 -4.836 -2.139 1.00 28.44 C ATOM 1410 OG1 THR B 87 8.294 -4.581 -3.009 1.00 32.26 O ATOM 1411 CG2 THR B 87 7.451 -6.235 -1.520 1.00 30.86 C ATOM 1412 N LEU B 88 5.709 -2.879 -4.383 1.00 20.94 N ATOM 1413 CA LEU B 88 5.193 -1.576 -4.770 1.00 20.30 C ATOM 1414 C LEU B 88 3.691 -1.646 -4.957 1.00 24.05 C ATOM 1415 O LEU B 88 2.947 -0.797 -4.460 1.00 27.72 O ATOM 1416 CB LEU B 88 5.841 -1.078 -6.038 1.00 17.47 C ATOM 1417 CG LEU B 88 5.164 0.068 -6.808 1.00 17.04 C ATOM 1418 CD1 LEU B 88 5.139 1.317 -5.994 1.00 14.99 C ATOM 1419 CD2 LEU B 88 5.947 0.333 -8.096 1.00 17.80 C ATOM 1420 N ARG B 89 3.223 -2.670 -5.651 1.00 25.82 N ATOM 1421 CA ARG B 89 1.786 -2.808 -5.809 1.00 28.01 C ATOM 1422 C ARG B 89 1.122 -2.850 -4.455 1.00 25.79 C ATOM 1423 O ARG B 89 0.127 -2.164 -4.232 1.00 27.53 O ATOM 1424 CB ARG B 89 1.438 -4.036 -6.617 1.00 32.13 C ATOM 1425 CG ARG B 89 1.888 -3.937 -8.077 1.00 39.11 C ATOM 1426 CD ARG B 89 1.592 -5.223 -8.836 1.00 42.56 C ATOM 1427 NE ARG B 89 0.161 -5.494 -8.826 1.00 45.41 N ATOM 1428 CZ ARG B 89 -0.688 -5.112 -9.772 1.00 47.65 C ATOM 1429 NH1 ARG B 89 -1.972 -5.410 -9.650 1.00 50.35 N ATOM 1430 NH2 ARG B 89 -0.271 -4.450 -10.840 1.00 47.17 N ATOM 1431 N LYS B 90 1.694 -3.613 -3.531 1.00 24.56 N ATOM 1432 CA LYS B 90 1.031 -3.779 -2.263 1.00 27.75 C ATOM 1433 C LYS B 90 1.066 -2.495 -1.445 1.00 24.01 C ATOM 1434 O LYS B 90 0.106 -2.162 -0.740 1.00 20.96 O ATOM 1435 CB LYS B 90 1.582 -4.953 -1.491 1.00 30.85 C ATOM 1436 CG LYS B 90 2.614 -4.610 -0.481 1.00 39.90 C ATOM 1437 CD LYS B 90 2.578 -5.610 0.686 1.00 43.80 C ATOM 1438 CE LYS B 90 4.008 -6.012 1.126 1.00 51.53 C ATOM 1439 NZ LYS B 90 4.083 -7.283 1.968 1.00 51.24 N ATOM 1440 N LYS B 91 2.162 -1.759 -1.559 1.00 22.76 N ATOM 1441 CA LYS B 91 2.251 -0.448 -0.918 1.00 21.07 C ATOM 1442 C LYS B 91 1.164 0.455 -1.416 1.00 21.12 C ATOM 1443 O LYS B 91 0.457 1.061 -0.634 1.00 26.34 O ATOM 1444 CB LYS B 91 3.621 0.203 -1.160 1.00 18.23 C ATOM 1445 CG LYS B 91 4.716 -0.443 -0.303 1.00 19.50 C ATOM 1446 CD LYS B 91 6.004 0.362 -0.207 1.00 17.92 C ATOM 1447 CE LYS B 91 7.175 -0.463 0.412 1.00 19.38 C ATOM 1448 NZ LYS B 91 7.010 -0.762 1.858 1.00 19.73 N ATOM 1449 N LEU B 92 1.040 0.530 -2.734 1.00 19.84 N ATOM 1450 CA LEU B 92 0.055 1.388 -3.365 1.00 21.60 C ATOM 1451 C LEU B 92 -1.336 1.016 -2.924 1.00 24.73 C ATOM 1452 O LEU B 92 -2.176 1.888 -2.704 1.00 24.71 O ATOM 1453 CB LEU B 92 0.137 1.265 -4.881 1.00 18.19 C ATOM 1454 CG LEU B 92 1.323 1.943 -5.561 1.00 16.79 C ATOM 1455 CD1 LEU B 92 1.354 1.622 -7.043 1.00 8.71 C ATOM 1456 CD2 LEU B 92 1.266 3.442 -5.327 1.00 16.39 C ATOM 1457 N LYS B 93 -1.576 -0.286 -2.813 1.00 32.68 N ATOM 1458 CA LYS B 93 -2.850 -0.776 -2.303 1.00 36.03 C ATOM 1459 C LYS B 93 -3.056 -0.231 -0.886 1.00 35.58 C ATOM 1460 O LYS B 93 -4.064 0.400 -0.590 1.00 34.59 O ATOM 1461 CB LYS B 93 -2.889 -2.314 -2.328 1.00 42.76 C ATOM 1462 CG LYS B 93 -4.284 -2.931 -2.123 1.00 44.14 C ATOM 1463 CD LYS B 93 -4.256 -4.466 -2.272 1.00 47.23 C ATOM 1464 CE LYS B 93 -5.651 -5.114 -2.094 1.00 48.60 C ATOM 1465 NZ LYS B 93 -6.080 -5.208 -0.676 1.00 49.76 N ATOM 1466 N LYS B 94 -2.063 -0.433 -0.031 1.00 34.58 N ATOM 1467 CA LYS B 94 -2.099 0.094 1.327 1.00 31.89 C ATOM 1468 C LYS B 94 -2.553 1.541 1.407 1.00 28.92 C ATOM 1469 O LYS B 94 -3.169 1.926 2.371 1.00 34.08 O ATOM 1470 CB LYS B 94 -0.721 -0.039 1.976 1.00 30.79 C ATOM 1471 CG LYS B 94 -0.596 0.637 3.312 1.00 31.58 C ATOM 1472 CD LYS B 94 0.682 0.218 4.018 1.00 33.20 C ATOM 1473 CE LYS B 94 0.793 0.880 5.376 1.00 33.40 C ATOM 1474 NZ LYS B 94 2.189 0.879 5.862 1.00 36.83 N ATOM 1475 N TYR B 95 -2.254 2.352 0.412 1.00 25.80 N ATOM 1476 CA TYR B 95 -2.540 3.764 0.522 1.00 28.97 C ATOM 1477 C TYR B 95 -3.606 4.159 -0.455 1.00 30.35 C ATOM 1478 O TYR B 95 -3.809 5.334 -0.720 1.00 33.84 O ATOM 1479 CB TYR B 95 -1.257 4.587 0.285 1.00 29.27 C ATOM 1480 CG TYR B 95 -0.158 4.305 1.300 1.00 28.67 C ATOM 1481 CD1 TYR B 95 -0.307 4.670 2.629 1.00 29.89 C ATOM 1482 CD2 TYR B 95 1.013 3.666 0.932 1.00 28.69 C ATOM 1483 CE1 TYR B 95 0.681 4.400 3.579 1.00 29.70 C ATOM 1484 CE2 TYR B 95 2.012 3.395 1.871 1.00 30.54 C ATOM 1485 CZ TYR B 95 1.838 3.764 3.201 1.00 29.56 C ATOM 1486 OH TYR B 95 2.823 3.500 4.133 1.00 28.67 O ATOM 1487 N GLY B 96 -4.287 3.174 -1.003 1.00 33.29 N ATOM 1488 CA GLY B 96 -5.347 3.432 -1.968 1.00 36.36 C ATOM 1489 C GLY B 96 -4.901 4.223 -3.179 1.00 37.42 C ATOM 1490 O GLY B 96 -5.597 5.144 -3.588 1.00 39.02 O ATOM 1491 N MET B 97 -3.757 3.864 -3.760 1.00 38.04 N ATOM 1492 CA MET B 97 -3.248 4.581 -4.924 1.00 43.17 C ATOM 1493 C MET B 97 -3.401 3.736 -6.182 1.00 48.65 C ATOM 1494 O MET B 97 -2.438 3.254 -6.745 1.00 49.04 O ATOM 1495 CB MET B 97 -1.792 5.030 -4.711 1.00 42.85 C ATOM 1496 CG MET B 97 -1.533 5.803 -3.376 1.00 42.28 C ATOM 1497 SD MET B 97 0.021 6.735 -3.316 1.00 33.31 S ATOM 1498 CE MET B 97 -0.001 7.190 -5.054 1.00 26.91 C ATOM 1499 N ASN B 98 -4.649 3.586 -6.625 1.00 60.50 N ATOM 1500 CA ASN B 98 -5.045 2.657 -7.730 1.00 63.69 C ATOM 1501 C ASN B 98 -6.586 2.453 -7.788 1.00 67.15 C ATOM 1502 O ASN B 98 -7.292 2.997 -8.649 1.00 69.79 O ATOM 1503 CB ASN B 98 -4.368 1.273 -7.560 1.00 66.62 C ATOM 1504 CG ASN B 98 -4.392 0.789 -6.111 1.00 67.20 C ATOM 1505 OD1 ASN B 98 -5.438 0.398 -5.578 1.00 66.24 O ATOM 1506 ND2 ASN B 98 -3.240 0.864 -5.454 1.00 68.07 N TER 1507 ASN B 98 ATOM 1508 O5' DA C 1 1.021 -6.292 -38.704 1.00 47.43 O ATOM 1509 C5' DA C 1 1.644 -7.520 -38.284 1.00 48.99 C ATOM 1510 C4' DA C 1 2.693 -7.382 -37.185 1.00 49.20 C ATOM 1511 O4' DA C 1 2.389 -6.155 -36.493 1.00 49.67 O ATOM 1512 C3' DA C 1 2.654 -8.519 -36.156 1.00 50.35 C ATOM 1513 O3' DA C 1 3.874 -9.331 -35.989 1.00 52.66 O ATOM 1514 C2' DA C 1 2.211 -7.859 -34.855 1.00 50.48 C ATOM 1515 C1' DA C 1 2.396 -6.357 -35.095 1.00 48.34 C ATOM 1516 N9 DA C 1 1.398 -5.513 -34.426 1.00 46.81 N ATOM 1517 C8 DA C 1 0.040 -5.713 -34.346 1.00 44.26 C ATOM 1518 N7 DA C 1 -0.603 -4.787 -33.671 1.00 40.94 N ATOM 1519 C5 DA C 1 0.413 -3.939 -33.286 1.00 43.12 C ATOM 1520 C6 DA C 1 0.395 -2.770 -32.545 1.00 43.40 C ATOM 1521 N6 DA C 1 -0.712 -2.275 -32.061 1.00 43.45 N ATOM 1522 N1 DA C 1 1.546 -2.137 -32.317 1.00 46.58 N ATOM 1523 C2 DA C 1 2.673 -2.665 -32.815 1.00 47.05 C ATOM 1524 N3 DA C 1 2.839 -3.779 -33.526 1.00 46.04 N ATOM 1525 C4 DA C 1 1.651 -4.364 -33.726 1.00 45.70 C ATOM 1526 P DA C 2 5.417 -8.871 -35.934 1.00 55.54 P ATOM 1527 OP1 DA C 2 5.923 -8.674 -37.298 1.00 59.69 O ATOM 1528 OP2 DA C 2 6.136 -9.779 -35.019 1.00 52.53 O ATOM 1529 O5' DA C 2 5.412 -7.389 -35.396 1.00 56.49 O ATOM 1530 C5' DA C 2 5.412 -7.190 -34.046 1.00 53.87 C ATOM 1531 C4' DA C 2 6.568 -6.349 -33.619 1.00 51.50 C ATOM 1532 O4' DA C 2 5.947 -5.317 -32.838 1.00 51.80 O ATOM 1533 C3' DA C 2 7.482 -7.073 -32.655 1.00 50.26 C ATOM 1534 O3' DA C 2 8.675 -6.318 -32.416 1.00 50.57 O ATOM 1535 C2' DA C 2 6.547 -7.180 -31.438 1.00 48.97 C ATOM 1536 C1' DA C 2 5.802 -5.835 -31.523 1.00 45.61 C ATOM 1537 N9 DA C 2 4.379 -5.893 -31.245 1.00 43.97 N ATOM 1538 C8 DA C 2 3.499 -6.868 -31.606 1.00 41.80 C ATOM 1539 N7 DA C 2 2.282 -6.624 -31.199 1.00 42.46 N ATOM 1540 C5 DA C 2 2.391 -5.437 -30.521 1.00 40.17 C ATOM 1541 C6 DA C 2 1.452 -4.685 -29.860 1.00 37.08 C ATOM 1542 N6 DA C 2 0.194 -5.014 -29.756 1.00 37.01 N ATOM 1543 N1 DA C 2 1.859 -3.557 -29.319 1.00 40.53 N ATOM 1544 C2 DA C 2 3.144 -3.203 -29.414 1.00 41.25 C ATOM 1545 N3 DA C 2 4.149 -3.833 -29.995 1.00 39.57 N ATOM 1546 C4 DA C 2 3.675 -4.960 -30.539 1.00 42.14 C ATOM 1547 P DA C 3 9.649 -6.799 -31.237 1.00 54.13 P ATOM 1548 OP1 DA C 3 11.021 -6.391 -31.639 1.00 52.94 O ATOM 1549 OP2 DA C 3 9.243 -8.181 -30.861 1.00 48.94 O ATOM 1550 O5' DA C 3 9.270 -5.880 -29.980 1.00 55.07 O ATOM 1551 C5' DA C 3 9.231 -4.470 -30.145 1.00 52.79 C ATOM 1552 C4' DA C 3 8.754 -3.829 -28.869 1.00 49.32 C ATOM 1553 O4' DA C 3 7.331 -4.038 -28.696 1.00 47.13 O ATOM 1554 C3' DA C 3 9.415 -4.413 -27.637 1.00 48.32 C ATOM 1555 O3' DA C 3 9.748 -3.324 -26.812 1.00 51.93 O ATOM 1556 C2' DA C 3 8.355 -5.333 -27.048 1.00 45.89 C ATOM 1557 C1' DA C 3 7.115 -4.539 -27.396 1.00 45.57 C ATOM 1558 N9 DA C 3 5.880 -5.306 -27.427 1.00 45.49 N ATOM 1559 C8 DA C 3 5.709 -6.563 -27.888 1.00 45.56 C ATOM 1560 N7 DA C 3 4.471 -6.976 -27.800 1.00 46.38 N ATOM 1561 C5 DA C 3 3.794 -5.927 -27.249 1.00 43.22 C ATOM 1562 C6 DA C 3 2.461 -5.744 -26.904 1.00 43.80 C ATOM 1563 N6 DA C 3 1.526 -6.648 -27.072 1.00 42.89 N ATOM 1564 N1 DA C 3 2.099 -4.570 -26.365 1.00 46.61 N ATOM 1565 C2 DA C 3 3.023 -3.624 -26.182 1.00 45.87 C ATOM 1566 N3 DA C 3 4.318 -3.687 -26.469 1.00 45.72 N ATOM 1567 C4 DA C 3 4.642 -4.883 -27.003 1.00 45.37 C ATOM 1568 P DT C 4 10.461 -3.483 -25.375 1.00 52.76 P ATOM 1569 OP1 DT C 4 11.431 -2.366 -25.245 1.00 46.54 O ATOM 1570 OP2 DT C 4 10.803 -4.913 -25.137 1.00 49.17 O ATOM 1571 O5' DT C 4 9.243 -3.126 -24.399 1.00 50.60 O ATOM 1572 C5' DT C 4 8.607 -1.862 -24.540 1.00 47.38 C ATOM 1573 C4' DT C 4 7.432 -1.841 -23.598 1.00 46.44 C ATOM 1574 O4' DT C 4 6.422 -2.790 -24.015 1.00 47.03 O ATOM 1575 C3' DT C 4 7.790 -2.235 -22.166 1.00 45.97 C ATOM 1576 O3' DT C 4 7.180 -1.319 -21.316 1.00 44.09 O ATOM 1577 C2' DT C 4 7.214 -3.633 -22.001 1.00 45.40 C ATOM 1578 C1' DT C 4 5.973 -3.451 -22.849 1.00 44.99 C ATOM 1579 N1 DT C 4 5.297 -4.690 -23.255 1.00 42.94 N ATOM 1580 C2 DT C 4 3.923 -4.730 -23.159 1.00 42.61 C ATOM 1581 O2 DT C 4 3.233 -3.802 -22.741 1.00 40.05 O ATOM 1582 N3 DT C 4 3.380 -5.914 -23.587 1.00 45.80 N ATOM 1583 C4 DT C 4 4.071 -7.024 -24.056 1.00 44.04 C ATOM 1584 O4 DT C 4 3.482 -8.036 -24.391 1.00 41.71 O ATOM 1585 C5 DT C 4 5.506 -6.905 -24.125 1.00 41.71 C ATOM 1586 C7 DT C 4 6.341 -8.021 -24.684 1.00 35.73 C ATOM 1587 C6 DT C 4 6.052 -5.748 -23.726 1.00 42.46 C ATOM 1588 P DT C 5 7.714 -1.119 -19.837 1.00 41.95 P ATOM 1589 OP1 DT C 5 8.113 0.307 -19.728 1.00 38.22 O ATOM 1590 OP2 DT C 5 8.547 -2.259 -19.354 1.00 41.58 O ATOM 1591 O5' DT C 5 6.340 -1.339 -19.071 1.00 36.07 O ATOM 1592 C5' DT C 5 5.187 -0.696 -19.602 1.00 32.34 C ATOM 1593 C4' DT C 5 3.953 -1.390 -19.091 1.00 32.37 C ATOM 1594 O4' DT C 5 3.846 -2.672 -19.761 1.00 32.25 O ATOM 1595 C3' DT C 5 3.955 -1.656 -17.577 1.00 33.67 C ATOM 1596 O3' DT C 5 2.795 -1.111 -17.019 1.00 32.02 O ATOM 1597 C2' DT C 5 4.002 -3.180 -17.510 1.00 33.91 C ATOM 1598 C1' DT C 5 3.276 -3.531 -18.811 1.00 32.15 C ATOM 1599 N1 DT C 5 3.452 -4.906 -19.306 1.00 29.83 N ATOM 1600 C2 DT C 5 2.344 -5.685 -19.545 1.00 33.31 C ATOM 1601 O2 DT C 5 1.182 -5.323 -19.364 1.00 34.37 O ATOM 1602 N3 DT C 5 2.633 -6.939 -20.018 1.00 35.91 N ATOM 1603 C4 DT C 5 3.890 -7.469 -20.273 1.00 32.79 C ATOM 1604 O4 DT C 5 4.027 -8.613 -20.701 1.00 32.26 O ATOM 1605 C5 DT C 5 4.997 -6.583 -19.997 1.00 28.75 C ATOM 1606 C7 DT C 5 6.416 -7.014 -20.192 1.00 21.51 C ATOM 1607 C6 DT C 5 4.726 -5.364 -19.531 1.00 28.29 C ATOM 1608 P DT C 6 2.545 -1.188 -15.467 1.00 32.71 P ATOM 1609 OP1 DT C 6 1.857 0.108 -15.105 1.00 23.33 O ATOM 1610 OP2 DT C 6 3.738 -1.820 -14.844 1.00 28.69 O ATOM 1611 O5' DT C 6 1.450 -2.354 -15.374 1.00 36.17 O ATOM 1612 C5' DT C 6 0.293 -2.219 -16.226 1.00 33.63 C ATOM 1613 C4' DT C 6 -0.660 -3.384 -16.093 1.00 29.71 C ATOM 1614 O4' DT C 6 -0.067 -4.567 -16.665 1.00 29.46 O ATOM 1615 C3' DT C 6 -1.004 -3.746 -14.669 1.00 34.53 C ATOM 1616 O3' DT C 6 -2.414 -3.995 -14.590 1.00 42.80 O ATOM 1617 C2' DT C 6 -0.158 -4.988 -14.393 1.00 35.37 C ATOM 1618 C1' DT C 6 -0.088 -5.652 -15.755 1.00 35.29 C ATOM 1619 N1 DT C 6 1.097 -6.505 -16.074 1.00 34.98 N ATOM 1620 C2 DT C 6 0.905 -7.758 -16.621 1.00 39.56 C ATOM 1621 O2 DT C 6 -0.190 -8.277 -16.833 1.00 41.69 O ATOM 1622 N3 DT C 6 2.065 -8.430 -16.916 1.00 42.02 N ATOM 1623 C4 DT C 6 3.366 -7.970 -16.749 1.00 43.04 C ATOM 1624 O4 DT C 6 4.342 -8.686 -17.062 1.00 42.14 O ATOM 1625 C5 DT C 6 3.480 -6.634 -16.176 1.00 41.27 C ATOM 1626 C7 DT C 6 4.827 -5.994 -15.933 1.00 43.27 C ATOM 1627 C6 DT C 6 2.350 -5.986 -15.886 1.00 36.40 C ATOM 1628 P DG C 7 -3.241 -3.814 -13.227 1.00 47.89 P ATOM 1629 OP1 DG C 7 -4.534 -3.187 -13.608 1.00 47.96 O ATOM 1630 OP2 DG C 7 -2.339 -3.216 -12.211 1.00 40.66 O ATOM 1631 O5' DG C 7 -3.541 -5.309 -12.773 1.00 47.88 O ATOM 1632 C5' DG C 7 -4.333 -6.154 -13.551 1.00 46.88 C ATOM 1633 C4' DG C 7 -3.931 -7.582 -13.248 1.00 48.29 C ATOM 1634 O4' DG C 7 -2.566 -7.843 -13.666 1.00 47.43 O ATOM 1635 C3' DG C 7 -3.963 -7.955 -11.771 1.00 49.24 C ATOM 1636 O3' DG C 7 -4.882 -9.001 -11.633 1.00 55.54 O ATOM 1637 C2' DG C 7 -2.535 -8.399 -11.447 1.00 47.54 C ATOM 1638 C1' DG C 7 -2.080 -8.855 -12.816 1.00 47.20 C ATOM 1639 N9 DG C 7 -0.646 -8.943 -13.027 1.00 48.34 N ATOM 1640 C8 DG C 7 0.335 -8.030 -12.726 1.00 48.97 C ATOM 1641 N7 DG C 7 1.539 -8.407 -13.071 1.00 48.46 N ATOM 1642 C5 DG C 7 1.344 -9.641 -13.636 1.00 48.24 C ATOM 1643 C6 DG C 7 2.272 -10.535 -14.196 1.00 47.16 C ATOM 1644 O6 DG C 7 3.486 -10.415 -14.286 1.00 47.48 O ATOM 1645 N1 DG C 7 1.669 -11.688 -14.677 1.00 47.48 N ATOM 1646 C2 DG C 7 0.313 -11.899 -14.611 1.00 48.01 C ATOM 1647 N2 DG C 7 -0.109 -13.037 -15.115 1.00 47.83 N ATOM 1648 N3 DG C 7 -0.588 -11.091 -14.089 1.00 49.26 N ATOM 1649 C4 DG C 7 0.007 -9.978 -13.622 1.00 49.54 C ATOM 1650 P DT C 8 -5.443 -9.430 -10.207 1.00 62.75 P ATOM 1651 OP1 DT C 8 -6.772 -9.985 -10.526 1.00 62.72 O ATOM 1652 OP2 DT C 8 -5.275 -8.293 -9.264 1.00 63.50 O ATOM 1653 O5' DT C 8 -4.504 -10.640 -9.739 1.00 52.85 O ATOM 1654 C5' DT C 8 -4.677 -11.771 -10.494 1.00 51.44 C ATOM 1655 C4' DT C 8 -3.437 -12.588 -10.390 1.00 53.50 C ATOM 1656 O4' DT C 8 -2.309 -11.881 -10.911 1.00 53.81 O ATOM 1657 C3' DT C 8 -2.928 -12.888 -9.011 1.00 55.88 C ATOM 1658 O3' DT C 8 -3.764 -13.879 -8.395 1.00 63.57 O ATOM 1659 C2' DT C 8 -1.532 -13.388 -9.379 1.00 54.03 C ATOM 1660 C1' DT C 8 -1.249 -12.780 -10.730 1.00 50.39 C ATOM 1661 N1 DT C 8 0.032 -12.083 -10.753 1.00 48.88 N ATOM 1662 C2 DT C 8 1.110 -12.742 -11.280 1.00 46.44 C ATOM 1663 O2 DT C 8 1.073 -13.864 -11.727 1.00 43.66 O ATOM 1664 N3 DT C 8 2.283 -12.038 -11.260 1.00 48.70 N ATOM 1665 C4 DT C 8 2.475 -10.766 -10.782 1.00 50.32 C ATOM 1666 O4 DT C 8 3.579 -10.227 -10.816 1.00 49.74 O ATOM 1667 C5 DT C 8 1.311 -10.119 -10.225 1.00 51.51 C ATOM 1668 C7 DT C 8 1.515 -8.762 -9.600 1.00 56.33 C ATOM 1669 C6 DT C 8 0.144 -10.800 -10.233 1.00 50.08 C ATOM 1670 P DT C 9 -3.218 -15.094 -7.482 1.00 67.92 P ATOM 1671 OP1 DT C 9 -4.408 -15.732 -6.897 1.00 68.69 O ATOM 1672 OP2 DT C 9 -2.084 -14.690 -6.610 1.00 66.35 O ATOM 1673 O5' DT C 9 -2.630 -16.083 -8.570 1.00 62.59 O ATOM 1674 C5' DT C 9 -2.603 -17.448 -8.330 1.00 61.18 C ATOM 1675 C4' DT C 9 -1.194 -17.935 -8.502 1.00 60.16 C ATOM 1676 O4' DT C 9 -0.396 -16.834 -8.935 1.00 57.08 O ATOM 1677 C3' DT C 9 -0.513 -18.364 -7.223 1.00 62.44 C ATOM 1678 O3' DT C 9 -0.802 -19.743 -6.985 1.00 66.65 O ATOM 1679 C2' DT C 9 0.957 -18.012 -7.497 1.00 60.30 C ATOM 1680 C1' DT C 9 0.943 -17.209 -8.781 1.00 55.32 C ATOM 1681 N1 DT C 9 1.803 -15.994 -8.680 1.00 53.10 N ATOM 1682 C2 DT C 9 3.126 -16.057 -9.086 1.00 50.65 C ATOM 1683 O2 DT C 9 3.649 -17.050 -9.530 1.00 50.24 O ATOM 1684 N3 DT C 9 3.844 -14.903 -8.930 1.00 49.52 N ATOM 1685 C4 DT C 9 3.348 -13.710 -8.421 1.00 49.60 C ATOM 1686 O4 DT C 9 4.030 -12.703 -8.322 1.00 51.52 O ATOM 1687 C5 DT C 9 1.970 -13.691 -8.010 1.00 48.44 C ATOM 1688 C7 DT C 9 1.401 -12.423 -7.429 1.00 43.32 C ATOM 1689 C6 DT C 9 1.262 -14.826 -8.148 1.00 50.69 C ATOM 1690 P DT C 10 0.329 -20.780 -6.569 1.00 70.66 P ATOM 1691 OP1 DT C 10 -0.341 -22.088 -6.480 1.00 73.46 O ATOM 1692 OP2 DT C 10 1.099 -20.204 -5.450 1.00 70.61 O ATOM 1693 O5' DT C 10 1.292 -20.845 -7.833 1.00 71.10 O ATOM 1694 C5' DT C 10 2.241 -21.868 -7.974 1.00 70.33 C ATOM 1695 C4' DT C 10 3.604 -21.451 -7.471 1.00 69.66 C ATOM 1696 O4' DT C 10 3.790 -20.021 -7.581 1.00 68.76 O ATOM 1697 C3' DT C 10 3.850 -21.789 -6.012 1.00 70.60 C ATOM 1698 O3' DT C 10 4.554 -23.011 -5.987 1.00 73.01 O ATOM 1699 C2' DT C 10 4.652 -20.590 -5.489 1.00 70.66 C ATOM 1700 C1' DT C 10 4.850 -19.704 -6.716 1.00 67.91 C ATOM 1701 N1 DT C 10 4.848 -18.242 -6.389 1.00 66.77 N ATOM 1702 C2 DT C 10 5.924 -17.489 -6.793 1.00 65.66 C ATOM 1703 O2 DT C 10 6.859 -17.955 -7.410 1.00 65.62 O ATOM 1704 N3 DT C 10 5.865 -16.173 -6.454 1.00 63.24 N ATOM 1705 C4 DT C 10 4.859 -15.557 -5.767 1.00 63.79 C ATOM 1706 O4 DT C 10 4.942 -14.370 -5.540 1.00 64.30 O ATOM 1707 C5 DT C 10 3.747 -16.390 -5.354 1.00 64.79 C ATOM 1708 C7 DT C 10 2.528 -15.825 -4.687 1.00 64.26 C ATOM 1709 C6 DT C 10 3.801 -17.683 -5.678 1.00 65.22 C ATOM 1710 P DG C 11 5.152 -23.616 -4.648 1.00 75.77 P ATOM 1711 OP1 DG C 11 4.605 -24.977 -4.630 1.00 78.07 O ATOM 1712 OP2 DG C 11 4.939 -22.723 -3.483 1.00 74.78 O ATOM 1713 O5' DG C 11 6.718 -23.700 -4.951 1.00 74.55 O ATOM 1714 C5' DG C 11 7.392 -22.859 -5.884 1.00 73.31 C ATOM 1715 C4' DG C 11 8.662 -22.236 -5.315 1.00 72.38 C ATOM 1716 O4' DG C 11 8.504 -20.796 -5.095 1.00 70.71 O ATOM 1717 C3' DG C 11 9.125 -22.757 -3.962 1.00 72.56 C ATOM 1718 O3' DG C 11 10.528 -22.653 -3.948 1.00 74.61 O ATOM 1719 C2' DG C 11 8.416 -21.802 -3.001 1.00 71.24 C ATOM 1720 C1' DG C 11 8.684 -20.487 -3.719 1.00 67.02 C ATOM 1721 N9 DG C 11 7.814 -19.378 -3.338 1.00 64.85 N ATOM 1722 C8 DG C 11 6.569 -19.411 -2.757 1.00 63.56 C ATOM 1723 N7 DG C 11 6.058 -18.230 -2.558 1.00 62.70 N ATOM 1724 C5 DG C 11 7.029 -17.373 -3.030 1.00 62.05 C ATOM 1725 C6 DG C 11 7.045 -15.974 -3.073 1.00 63.15 C ATOM 1726 O6 DG C 11 6.174 -15.198 -2.683 1.00 63.50 O ATOM 1727 N1 DG C 11 8.213 -15.479 -3.637 1.00 63.76 N ATOM 1728 C2 DG C 11 9.243 -16.265 -4.096 1.00 62.62 C ATOM 1729 N2 DG C 11 10.296 -15.614 -4.602 1.00 63.25 N ATOM 1730 N3 DG C 11 9.248 -17.586 -4.063 1.00 61.57 N ATOM 1731 C4 DG C 11 8.111 -18.059 -3.512 1.00 62.52 C ATOM 1732 P DA C 12 11.381 -23.322 -2.793 1.00 76.55 P ATOM 1733 OP1 DA C 12 11.564 -24.724 -3.169 1.00 78.94 O ATOM 1734 OP2 DA C 12 10.745 -22.993 -1.500 1.00 77.09 O ATOM 1735 O5' DA C 12 12.822 -22.644 -2.918 1.00 72.02 O ATOM 1736 C5' DA C 12 13.204 -21.907 -4.069 1.00 68.25 C ATOM 1737 C4' DA C 12 13.866 -20.578 -3.702 1.00 65.51 C ATOM 1738 O4' DA C 12 12.876 -19.547 -3.392 1.00 61.24 O ATOM 1739 C3' DA C 12 14.810 -20.625 -2.500 1.00 62.41 C ATOM 1740 O3' DA C 12 15.907 -19.789 -2.780 1.00 62.25 O ATOM 1741 C2' DA C 12 13.940 -20.110 -1.360 1.00 60.78 C ATOM 1742 C1' DA C 12 13.182 -19.020 -2.108 1.00 58.39 C ATOM 1743 N9 DA C 12 11.922 -18.580 -1.511 1.00 57.37 N ATOM 1744 C8 DA C 12 10.913 -19.347 -0.990 1.00 55.42 C ATOM 1745 N7 DA C 12 9.891 -18.646 -0.564 1.00 54.83 N ATOM 1746 C5 DA C 12 10.268 -17.334 -0.824 1.00 54.39 C ATOM 1747 C6 DA C 12 9.636 -16.102 -0.611 1.00 54.34 C ATOM 1748 N6 DA C 12 8.432 -15.975 -0.052 1.00 53.66 N ATOM 1749 N1 DA C 12 10.291 -14.991 -1.009 1.00 55.73 N ATOM 1750 C2 DA C 12 11.497 -15.084 -1.573 1.00 54.63 C ATOM 1751 N3 DA C 12 12.198 -16.177 -1.817 1.00 53.16 N ATOM 1752 C4 DA C 12 11.516 -17.270 -1.412 1.00 55.54 C ATOM 1753 P DA C 13 17.186 -19.780 -1.832 1.00 68.28 P ATOM 1754 OP1 DA C 13 18.384 -20.020 -2.660 1.00 70.19 O ATOM 1755 OP2 DA C 13 16.877 -20.632 -0.662 1.00 66.34 O ATOM 1756 O5' DA C 13 17.308 -18.253 -1.391 1.00 64.79 O ATOM 1757 C5' DA C 13 17.276 -17.241 -2.385 1.00 60.01 C ATOM 1758 C4' DA C 13 17.102 -15.880 -1.746 1.00 55.84 C ATOM 1759 O4' DA C 13 15.763 -15.724 -1.205 1.00 51.63 O ATOM 1760 C3' DA C 13 18.070 -15.661 -0.590 1.00 52.34 C ATOM 1761 O3' DA C 13 18.651 -14.360 -0.716 1.00 49.09 O ATOM 1762 C2' DA C 13 17.202 -15.890 0.653 1.00 50.68 C ATOM 1763 C1' DA C 13 15.883 -15.344 0.159 1.00 48.45 C ATOM 1764 N9 DA C 13 14.690 -15.857 0.803 1.00 47.42 N ATOM 1765 C8 DA C 13 14.358 -17.154 1.036 1.00 45.89 C ATOM 1766 N7 DA C 13 13.174 -17.286 1.593 1.00 47.14 N ATOM 1767 C5 DA C 13 12.696 -15.986 1.726 1.00 45.50 C ATOM 1768 C6 DA C 13 11.516 -15.421 2.238 1.00 42.56 C ATOM 1769 N6 DA C 13 10.504 -16.069 2.764 1.00 42.68 N ATOM 1770 N1 DA C 13 11.383 -14.101 2.209 1.00 45.45 N ATOM 1771 C2 DA C 13 12.361 -13.357 1.698 1.00 46.92 C ATOM 1772 N3 DA C 13 13.527 -13.746 1.194 1.00 46.50 N ATOM 1773 C4 DA C 13 13.630 -15.091 1.242 1.00 47.61 C ATOM 1774 P DT C 14 19.674 -13.911 0.416 1.00 53.24 P ATOM 1775 OP1 DT C 14 20.796 -13.092 -0.088 1.00 52.51 O ATOM 1776 OP2 DT C 14 19.925 -15.136 1.209 1.00 54.82 O ATOM 1777 O5' DT C 14 18.744 -12.960 1.296 1.00 49.70 O ATOM 1778 C5' DT C 14 18.044 -11.934 0.669 1.00 44.96 C ATOM 1779 C4' DT C 14 17.204 -11.217 1.671 1.00 42.79 C ATOM 1780 O4' DT C 14 16.161 -12.093 2.131 1.00 42.09 O ATOM 1781 C3' DT C 14 17.990 -10.809 2.888 1.00 43.92 C ATOM 1782 O3' DT C 14 17.768 -9.431 3.017 1.00 51.50 O ATOM 1783 C2' DT C 14 17.384 -11.647 4.012 1.00 44.01 C ATOM 1784 C1' DT C 14 15.972 -11.854 3.505 1.00 42.50 C ATOM 1785 N1 DT C 14 15.235 -13.014 4.029 1.00 40.41 N ATOM 1786 C2 DT C 14 13.941 -12.883 4.531 1.00 41.27 C ATOM 1787 O2 DT C 14 13.279 -11.863 4.633 1.00 42.17 O ATOM 1788 N3 DT C 14 13.361 -14.039 4.939 1.00 42.33 N ATOM 1789 C4 DT C 14 13.944 -15.292 4.919 1.00 44.16 C ATOM 1790 O4 DT C 14 13.308 -16.263 5.335 1.00 43.05 O ATOM 1791 C5 DT C 14 15.300 -15.375 4.382 1.00 44.02 C ATOM 1792 C7 DT C 14 16.044 -16.693 4.350 1.00 41.54 C ATOM 1793 C6 DT C 14 15.871 -14.230 3.958 1.00 41.67 C ATOM 1794 P DT C 15 18.368 -8.536 4.196 1.00 54.90 P ATOM 1795 OP1 DT C 15 18.646 -7.195 3.639 1.00 53.01 O ATOM 1796 OP2 DT C 15 19.406 -9.385 4.830 1.00 57.68 O ATOM 1797 O5' DT C 15 17.125 -8.425 5.193 1.00 47.76 O ATOM 1798 C5' DT C 15 15.876 -8.137 4.602 1.00 45.71 C ATOM 1799 C4' DT C 15 14.833 -7.912 5.666 1.00 45.87 C ATOM 1800 O4' DT C 15 14.252 -9.193 6.054 1.00 44.39 O ATOM 1801 C3' DT C 15 15.380 -7.246 6.934 1.00 45.62 C ATOM 1802 O3' DT C 15 14.511 -6.153 7.275 1.00 44.68 O ATOM 1803 C2' DT C 15 15.468 -8.424 7.924 1.00 44.95 C ATOM 1804 C1' DT C 15 14.312 -9.314 7.477 1.00 43.87 C ATOM 1805 N1 DT C 15 14.411 -10.777 7.710 1.00 43.26 N ATOM 1806 C2 DT C 15 13.272 -11.500 8.044 1.00 45.45 C ATOM 1807 O2 DT C 15 12.168 -11.008 8.211 1.00 45.97 O ATOM 1808 N3 DT C 15 13.446 -12.852 8.177 1.00 44.80 N ATOM 1809 C4 DT C 15 14.639 -13.533 8.008 1.00 44.14 C ATOM 1810 O4 DT C 15 14.663 -14.760 8.152 1.00 39.13 O ATOM 1811 C5 DT C 15 15.793 -12.704 7.650 1.00 45.22 C ATOM 1812 C7 DT C 15 17.163 -13.275 7.430 1.00 45.59 C ATOM 1813 C6 DT C 15 15.625 -11.387 7.508 1.00 44.08 C ATOM 1814 P DT C 16 14.593 -5.528 8.724 1.00 46.48 P ATOM 1815 OP1 DT C 16 14.102 -4.154 8.623 1.00 50.86 O ATOM 1816 OP2 DT C 16 15.916 -5.811 9.315 1.00 49.39 O ATOM 1817 O5' DT C 16 13.513 -6.386 9.515 1.00 40.95 O ATOM 1818 C5' DT C 16 12.179 -6.370 9.068 1.00 38.12 C ATOM 1819 C4' DT C 16 11.299 -7.048 10.102 1.00 39.54 C ATOM 1820 O4' DT C 16 11.601 -8.466 10.144 1.00 43.81 O ATOM 1821 C3' DT C 16 11.438 -6.549 11.544 1.00 40.17 C ATOM 1822 O3' DT C 16 10.132 -6.347 12.073 1.00 37.81 O ATOM 1823 C2' DT C 16 12.222 -7.646 12.265 1.00 41.30 C ATOM 1824 C1' DT C 16 11.782 -8.881 11.497 1.00 43.68 C ATOM 1825 N1 DT C 16 12.760 -10.004 11.497 1.00 44.39 N ATOM 1826 C2 DT C 16 12.329 -11.290 11.757 1.00 43.56 C ATOM 1827 O2 DT C 16 11.171 -11.582 12.015 1.00 43.45 O ATOM 1828 N3 DT C 16 13.315 -12.229 11.689 1.00 41.54 N ATOM 1829 C4 DT C 16 14.646 -11.987 11.403 1.00 42.24 C ATOM 1830 O4 DT C 16 15.487 -12.864 11.373 1.00 42.25 O ATOM 1831 C5 DT C 16 15.034 -10.641 11.124 1.00 44.40 C ATOM 1832 C7 DT C 16 16.465 -10.339 10.761 1.00 44.56 C ATOM 1833 C6 DT C 16 14.076 -9.709 11.184 1.00 45.08 C ATOM 1834 P DT C 17 9.916 -5.929 13.589 1.00 37.55 P ATOM 1835 OP1 DT C 17 8.608 -5.252 13.711 1.00 38.51 O ATOM 1836 OP2 DT C 17 11.189 -5.293 14.071 1.00 28.54 O ATOM 1837 O5' DT C 17 9.749 -7.349 14.275 1.00 46.42 O ATOM 1838 C5' DT C 17 8.766 -8.269 13.809 1.00 52.19 C ATOM 1839 C4' DT C 17 8.717 -9.517 14.690 1.00 54.98 C ATOM 1840 O4' DT C 17 9.793 -10.452 14.366 1.00 53.52 O ATOM 1841 C3' DT C 17 8.843 -9.195 16.180 1.00 56.94 C ATOM 1842 O3' DT C 17 7.802 -9.820 16.942 1.00 64.53 O ATOM 1843 C2' DT C 17 10.214 -9.721 16.547 1.00 53.17 C ATOM 1844 C1' DT C 17 10.374 -10.881 15.570 1.00 49.44 C ATOM 1845 N1 DT C 17 11.774 -11.167 15.322 1.00 47.22 N ATOM 1846 C2 DT C 17 12.232 -12.450 15.378 1.00 45.59 C ATOM 1847 O2 DT C 17 11.511 -13.405 15.610 1.00 46.30 O ATOM 1848 N3 DT C 17 13.573 -12.564 15.123 1.00 44.50 N ATOM 1849 C4 DT C 17 14.445 -11.522 14.881 1.00 45.27 C ATOM 1850 O4 DT C 17 15.631 -11.644 14.679 1.00 44.80 O ATOM 1851 C5 DT C 17 13.906 -10.216 14.854 1.00 48.27 C ATOM 1852 C7 DT C 17 14.842 -9.055 14.647 1.00 53.53 C ATOM 1853 C6 DT C 17 12.600 -10.093 15.067 1.00 48.55 C ATOM 1854 P DG C 18 7.476 -9.249 18.410 1.00 71.84 P ATOM 1855 OP1 DG C 18 6.025 -8.941 18.417 1.00 72.16 O ATOM 1856 OP2 DG C 18 8.547 -8.253 18.766 1.00 65.20 O ATOM 1857 O5' DG C 18 7.603 -10.568 19.317 1.00 74.63 O ATOM 1858 C5' DG C 18 6.923 -11.785 18.947 1.00 74.57 C ATOM 1859 C4' DG C 18 7.549 -12.955 19.674 1.00 72.57 C ATOM 1860 O4' DG C 18 8.893 -13.193 19.173 1.00 68.56 O ATOM 1861 C3' DG C 18 7.681 -12.684 21.168 1.00 73.04 C ATOM 1862 O3' DG C 18 7.492 -13.912 21.890 1.00 76.36 O ATOM 1863 C2' DG C 18 9.092 -12.112 21.241 1.00 70.24 C ATOM 1864 C1' DG C 18 9.790 -13.021 20.237 1.00 67.84 C ATOM 1865 N9 DG C 18 11.042 -12.504 19.757 1.00 65.50 N ATOM 1866 C8 DG C 18 11.389 -11.195 19.648 1.00 66.77 C ATOM 1867 N7 DG C 18 12.592 -11.009 19.207 1.00 66.81 N ATOM 1868 C5 DG C 18 13.068 -12.281 19.029 1.00 66.74 C ATOM 1869 C6 DG C 18 14.336 -12.682 18.564 1.00 68.39 C ATOM 1870 O6 DG C 18 15.275 -11.962 18.211 1.00 67.89 O ATOM 1871 N1 DG C 18 14.460 -14.061 18.535 1.00 67.41 N ATOM 1872 C2 DG C 18 13.449 -14.911 18.909 1.00 66.81 C ATOM 1873 N2 DG C 18 13.769 -16.193 18.792 1.00 67.39 N ATOM 1874 N3 DG C 18 12.242 -14.553 19.341 1.00 64.75 N ATOM 1875 C4 DG C 18 12.128 -13.216 19.371 1.00 64.69 C ATOM 1876 P DA C 19 7.313 -13.982 23.480 1.00 74.41 P ATOM 1877 OP1 DA C 19 5.898 -13.627 23.735 1.00 71.14 O ATOM 1878 OP2 DA C 19 8.428 -13.249 24.132 1.00 71.65 O ATOM 1879 O5' DA C 19 7.526 -15.541 23.786 1.00 74.90 O ATOM 1880 C5' DA C 19 8.415 -16.386 23.076 1.00 74.23 C ATOM 1881 C4' DA C 19 9.807 -16.414 23.681 1.00 74.50 C ATOM 1882 O4' DA C 19 10.663 -15.573 22.884 1.00 72.39 O ATOM 1883 C3' DA C 19 10.024 -15.885 25.106 1.00 76.65 C ATOM 1884 O3' DA C 19 9.854 -16.942 26.119 1.00 80.03 O ATOM 1885 C2' DA C 19 11.427 -15.252 25.036 1.00 75.20 C ATOM 1886 C1' DA C 19 11.873 -15.469 23.593 1.00 70.40 C ATOM 1887 N9 DA C 19 12.731 -14.394 23.095 1.00 68.63 N ATOM 1888 C8 DA C 19 12.470 -13.048 23.103 1.00 67.08 C ATOM 1889 N7 DA C 19 13.440 -12.322 22.600 1.00 66.42 N ATOM 1890 C5 DA C 19 14.401 -13.255 22.253 1.00 66.65 C ATOM 1891 C6 DA C 19 15.679 -13.139 21.674 1.00 67.00 C ATOM 1892 N6 DA C 19 16.215 -11.968 21.341 1.00 66.57 N ATOM 1893 N1 DA C 19 16.392 -14.272 21.458 1.00 66.66 N ATOM 1894 C2 DA C 19 15.858 -15.445 21.802 1.00 65.32 C ATOM 1895 N3 DA C 19 14.667 -15.682 22.352 1.00 63.98 N ATOM 1896 C4 DA C 19 13.985 -14.540 22.550 1.00 66.55 C ATOM 1897 P DG C 20 11.001 -17.610 27.041 1.00 80.24 P ATOM 1898 OP1 DG C 20 10.359 -18.778 27.667 1.00 78.87 O ATOM 1899 OP2 DG C 20 11.730 -16.568 27.815 1.00 77.85 O ATOM 1900 O5' DG C 20 12.015 -18.200 25.974 1.00 79.62 O ATOM 1901 C5' DG C 20 12.865 -19.249 26.289 1.00 78.04 C ATOM 1902 C4' DG C 20 14.264 -18.716 26.490 1.00 77.73 C ATOM 1903 O4' DG C 20 14.510 -17.467 25.789 1.00 74.88 O ATOM 1904 C3' DG C 20 14.593 -18.405 27.937 1.00 78.93 C ATOM 1905 O3' DG C 20 15.782 -19.095 28.202 1.00 85.03 O ATOM 1906 C2' DG C 20 14.829 -16.907 27.964 1.00 75.99 C ATOM 1907 C1' DG C 20 15.405 -16.720 26.574 1.00 71.20 C ATOM 1908 N9 DG C 20 15.471 -15.326 26.144 1.00 70.02 N ATOM 1909 C8 DG C 20 14.515 -14.346 26.328 1.00 68.49 C ATOM 1910 N7 DG C 20 14.861 -13.186 25.845 1.00 67.31 N ATOM 1911 C5 DG C 20 16.122 -13.415 25.318 1.00 67.46 C ATOM 1912 C6 DG C 20 16.999 -12.534 24.657 1.00 68.23 C ATOM 1913 O6 DG C 20 16.862 -11.343 24.385 1.00 68.37 O ATOM 1914 N1 DG C 20 18.168 -13.155 24.280 1.00 67.65 N ATOM 1915 C2 DG C 20 18.454 -14.458 24.514 1.00 66.16 C ATOM 1916 N2 DG C 20 19.639 -14.819 24.062 1.00 67.66 N ATOM 1917 N3 DG C 20 17.668 -15.319 25.126 1.00 64.18 N ATOM 1918 C4 DG C 20 16.518 -14.722 25.495 1.00 67.11 C ATOM 1919 P DC C 21 16.220 -19.540 29.659 1.00 86.95 P ATOM 1920 OP1 DC C 21 16.471 -20.995 29.514 1.00 86.89 O ATOM 1921 OP2 DC C 21 15.232 -18.987 30.625 1.00 82.29 O ATOM 1922 O5' DC C 21 17.643 -18.811 29.826 1.00 86.17 O ATOM 1923 C5' DC C 21 18.730 -19.077 28.922 1.00 85.02 C ATOM 1924 C4' DC C 21 19.861 -18.079 29.122 1.00 84.29 C ATOM 1925 O4' DC C 21 19.604 -16.841 28.388 1.00 81.68 O ATOM 1926 C3' DC C 21 20.075 -17.675 30.582 1.00 84.63 C ATOM 1927 O3' DC C 21 21.440 -17.778 30.943 1.00 85.05 O ATOM 1928 C2' DC C 21 19.570 -16.233 30.640 1.00 83.45 C ATOM 1929 C1' DC C 21 19.860 -15.731 29.229 1.00 78.08 C ATOM 1930 N1 DC C 21 19.047 -14.537 28.812 1.00 73.60 N ATOM 1931 C2 DC C 21 19.638 -13.585 27.977 1.00 71.75 C ATOM 1932 O2 DC C 21 20.801 -13.756 27.605 1.00 70.07 O ATOM 1933 N3 DC C 21 18.914 -12.500 27.596 1.00 71.74 N ATOM 1934 C4 DC C 21 17.660 -12.352 28.017 1.00 72.46 C ATOM 1935 N4 DC C 21 17.000 -11.273 27.614 1.00 71.50 N ATOM 1936 C5 DC C 21 17.034 -13.304 28.877 1.00 71.46 C ATOM 1937 C6 DC C 21 17.755 -14.369 29.250 1.00 71.79 C ATOM 1938 P DA C 22 21.828 -17.856 32.478 1.00 85.17 P ATOM 1939 OP1 DA C 22 22.284 -19.248 32.683 1.00 85.39 O ATOM 1940 OP2 DA C 22 20.765 -17.239 33.305 1.00 80.60 O ATOM 1941 O5' DA C 22 23.117 -16.934 32.510 1.00 86.17 O ATOM 1942 C5' DA C 22 24.257 -17.333 31.769 1.00 86.75 C ATOM 1943 C4' DA C 22 25.175 -16.141 31.729 1.00 86.67 C ATOM 1944 O4' DA C 22 24.471 -15.114 31.002 1.00 84.54 O ATOM 1945 C3' DA C 22 25.514 -15.569 33.106 1.00 87.13 C ATOM 1946 O3' DA C 22 26.940 -15.457 33.214 1.00 90.53 O ATOM 1947 C2' DA C 22 24.715 -14.271 33.206 1.00 84.41 C ATOM 1948 C1' DA C 22 24.368 -13.930 31.758 1.00 79.06 C ATOM 1949 N9 DA C 22 23.029 -13.365 31.586 1.00 76.27 N ATOM 1950 C8 DA C 22 21.878 -13.730 32.224 1.00 73.71 C ATOM 1951 N7 DA C 22 20.829 -13.030 31.878 1.00 72.71 N ATOM 1952 C5 DA C 22 21.320 -12.139 30.943 1.00 73.55 C ATOM 1953 C6 DA C 22 20.707 -11.124 30.182 1.00 73.18 C ATOM 1954 N6 DA C 22 19.413 -10.789 30.218 1.00 71.66 N ATOM 1955 N1 DA C 22 21.515 -10.446 29.355 1.00 74.58 N ATOM 1956 C2 DA C 22 22.818 -10.746 29.272 1.00 73.52 C ATOM 1957 N3 DA C 22 23.502 -11.671 29.926 1.00 71.87 N ATOM 1958 C4 DA C 22 22.682 -12.334 30.753 1.00 74.27 C ATOM 1959 P DA C 23 27.790 -14.106 33.287 1.00 92.07 P ATOM 1960 OP1 DA C 23 29.217 -14.488 33.205 1.00 91.07 O ATOM 1961 OP2 DA C 23 27.267 -13.279 34.408 1.00 91.34 O ATOM 1962 O5' DA C 23 27.433 -13.410 31.901 1.00 86.83 O ATOM 1963 C5' DA C 23 28.376 -12.596 31.233 1.00 80.10 C ATOM 1964 C4' DA C 23 28.010 -11.125 31.339 1.00 74.61 C ATOM 1965 O4' DA C 23 26.585 -10.943 31.489 1.00 69.68 O ATOM 1966 C3' DA C 23 28.639 -10.384 32.510 1.00 72.02 C ATOM 1967 O3' DA C 23 29.483 -9.406 31.944 1.00 73.82 O ATOM 1968 C2' DA C 23 27.458 -9.817 33.300 1.00 69.97 C ATOM 1969 C1' DA C 23 26.350 -9.788 32.270 1.00 67.13 C ATOM 1970 N9 DA C 23 24.973 -9.913 32.749 1.00 65.75 N ATOM 1971 C8 DA C 23 24.471 -10.830 33.634 1.00 64.66 C ATOM 1972 N7 DA C 23 23.180 -10.734 33.837 1.00 62.81 N ATOM 1973 C5 DA C 23 22.820 -9.689 33.028 1.00 63.17 C ATOM 1974 C6 DA C 23 21.590 -9.087 32.793 1.00 64.12 C ATOM 1975 N6 DA C 23 20.474 -9.482 33.383 1.00 64.25 N ATOM 1976 N1 DA C 23 21.550 -8.062 31.927 1.00 64.88 N ATOM 1977 C2 DA C 23 22.679 -7.663 31.332 1.00 64.60 C ATOM 1978 N3 DA C 23 23.908 -8.147 31.480 1.00 63.75 N ATOM 1979 C4 DA C 23 23.900 -9.169 32.347 1.00 64.36 C ATOM 1980 P DA C 24 30.209 -8.290 32.820 1.00 77.83 P ATOM 1981 OP1 DA C 24 31.456 -7.876 32.129 1.00 78.69 O ATOM 1982 OP2 DA C 24 30.173 -8.733 34.226 1.00 79.40 O ATOM 1983 O5' DA C 24 29.233 -7.054 32.673 1.00 74.04 O ATOM 1984 C5' DA C 24 28.909 -6.592 31.387 1.00 67.44 C ATOM 1985 C4' DA C 24 27.925 -5.458 31.540 1.00 64.41 C ATOM 1986 O4' DA C 24 26.666 -5.976 32.036 1.00 61.77 O ATOM 1987 C3' DA C 24 28.357 -4.368 32.516 1.00 62.43 C ATOM 1988 O3' DA C 24 28.269 -3.125 31.863 1.00 60.35 O ATOM 1989 C2' DA C 24 27.395 -4.499 33.695 1.00 62.30 C ATOM 1990 C1' DA C 24 26.175 -5.072 33.002 1.00 61.64 C ATOM 1991 N9 DA C 24 25.275 -5.887 33.803 1.00 62.73 N ATOM 1992 C8 DA C 24 25.554 -7.033 34.512 1.00 62.49 C ATOM 1993 N7 DA C 24 24.498 -7.551 35.106 1.00 61.81 N ATOM 1994 C5 DA C 24 23.475 -6.681 34.753 1.00 61.81 C ATOM 1995 C6 DA C 24 22.100 -6.626 35.038 1.00 59.69 C ATOM 1996 N6 DA C 24 21.458 -7.507 35.773 1.00 59.56 N ATOM 1997 N1 DA C 24 21.364 -5.633 34.535 1.00 59.82 N ATOM 1998 C2 DA C 24 21.963 -4.732 33.775 1.00 61.05 C ATOM 1999 N3 DA C 24 23.242 -4.657 33.431 1.00 61.60 N ATOM 2000 C4 DA C 24 23.940 -5.666 33.952 1.00 62.26 C ATOM 2001 P DT C 25 28.859 -1.798 32.516 1.00 59.62 P ATOM 2002 OP1 DT C 25 29.660 -1.010 31.561 1.00 55.62 O ATOM 2003 OP2 DT C 25 29.427 -2.190 33.822 1.00 59.38 O ATOM 2004 O5' DT C 25 27.505 -1.001 32.780 1.00 59.62 O ATOM 2005 C5' DT C 25 26.461 -1.039 31.845 1.00 58.90 C ATOM 2006 C4' DT C 25 25.166 -0.545 32.454 1.00 57.86 C ATOM 2007 O4' DT C 25 24.565 -1.605 33.235 1.00 56.24 O ATOM 2008 C3' DT C 25 25.328 0.661 33.363 1.00 56.59 C ATOM 2009 O3' DT C 25 24.578 1.764 32.824 1.00 56.72 O ATOM 2010 C2' DT C 25 24.852 0.127 34.717 1.00 56.44 C ATOM 2011 C1' DT C 25 23.913 -0.987 34.314 1.00 56.28 C ATOM 2012 N1 DT C 25 23.701 -2.019 35.357 1.00 57.46 N ATOM 2013 C2 DT C 25 22.425 -2.261 35.864 1.00 57.35 C ATOM 2014 O2 DT C 25 21.409 -1.672 35.528 1.00 56.08 O ATOM 2015 N3 DT C 25 22.382 -3.250 36.812 1.00 56.67 N ATOM 2016 C4 DT C 25 23.445 -4.000 37.296 1.00 56.02 C ATOM 2017 O4 DT C 25 23.302 -4.859 38.145 1.00 55.20 O ATOM 2018 C5 DT C 25 24.743 -3.707 36.741 1.00 56.15 C ATOM 2019 C7 DT C 25 25.955 -4.438 37.249 1.00 49.06 C ATOM 2020 C6 DT C 25 24.808 -2.739 35.805 1.00 57.86 C ATOM 2021 P DT C 26 24.367 3.028 33.791 1.00 60.20 P ATOM 2022 OP1 DT C 26 24.039 4.264 33.062 1.00 60.14 O ATOM 2023 OP2 DT C 26 25.484 3.023 34.749 1.00 60.01 O ATOM 2024 O5' DT C 26 23.015 2.588 34.531 1.00 58.18 O ATOM 2025 C5' DT C 26 21.895 2.202 33.721 1.00 55.44 C ATOM 2026 C4' DT C 26 20.564 2.320 34.453 1.00 51.70 C ATOM 2027 O4' DT C 26 20.475 1.277 35.446 1.00 52.43 O ATOM 2028 C3' DT C 26 20.328 3.617 35.224 1.00 47.45 C ATOM 2029 O3' DT C 26 18.946 3.949 35.165 1.00 41.76 O ATOM 2030 C2' DT C 26 20.807 3.299 36.644 1.00 47.24 C ATOM 2031 C1' DT C 26 20.376 1.848 36.763 1.00 49.62 C ATOM 2032 N1 DT C 26 21.176 0.926 37.617 1.00 48.75 N ATOM 2033 C2 DT C 26 20.514 0.013 38.402 1.00 45.90 C ATOM 2034 O2 DT C 26 19.305 -0.040 38.507 1.00 43.24 O ATOM 2035 N3 DT C 26 21.338 -0.834 39.087 1.00 48.09 N ATOM 2036 C4 DT C 26 22.721 -0.867 39.066 1.00 48.98 C ATOM 2037 O4 DT C 26 23.382 -1.665 39.723 1.00 48.06 O ATOM 2038 C5 DT C 26 23.346 0.100 38.215 1.00 48.60 C ATOM 2039 C7 DT C 26 24.833 0.105 38.092 1.00 48.30 C ATOM 2040 C6 DT C 26 22.557 0.932 37.522 1.00 50.42 C ATOM 2041 P DT C 27 18.446 5.279 35.911 1.00 48.65 P ATOM 2042 OP1 DT C 27 17.268 5.743 35.145 1.00 49.99 O ATOM 2043 OP2 DT C 27 19.609 6.146 36.265 1.00 42.62 O ATOM 2044 O5' DT C 27 17.757 4.751 37.242 1.00 52.10 O ATOM 2045 C5' DT C 27 16.769 3.720 37.066 1.00 52.70 C ATOM 2046 C4' DT C 27 16.268 3.214 38.398 1.00 50.35 C ATOM 2047 O4' DT C 27 17.183 2.230 38.947 1.00 47.03 O ATOM 2048 C3' DT C 27 16.155 4.361 39.374 1.00 49.78 C ATOM 2049 O3' DT C 27 14.789 4.606 39.550 1.00 52.27 O ATOM 2050 C2' DT C 27 16.890 3.887 40.622 1.00 48.65 C ATOM 2051 C1' DT C 27 17.290 2.444 40.326 1.00 47.48 C ATOM 2052 N1 DT C 27 18.671 2.092 40.703 1.00 46.65 N ATOM 2053 C2 DT C 27 18.893 0.991 41.488 1.00 47.96 C ATOM 2054 O2 DT C 27 18.028 0.251 41.914 1.00 48.30 O ATOM 2055 N3 DT C 27 20.199 0.754 41.764 1.00 48.82 N ATOM 2056 C4 DT C 27 21.289 1.480 41.356 1.00 49.07 C ATOM 2057 O4 DT C 27 22.431 1.150 41.678 1.00 48.46 O ATOM 2058 C5 DT C 27 20.980 2.625 40.541 1.00 47.44 C ATOM 2059 C7 DT C 27 22.058 3.571 40.128 1.00 46.59 C ATOM 2060 C6 DT C 27 19.704 2.863 40.256 1.00 45.85 C TER 2061 DT C 27 ATOM 2062 O5' DA D 1 21.033 -5.222 50.380 1.00 65.09 O ATOM 2063 C5' DA D 1 20.652 -6.522 49.931 1.00 65.54 C ATOM 2064 C4' DA D 1 19.638 -6.481 48.797 1.00 64.85 C ATOM 2065 O4' DA D 1 19.886 -5.312 47.973 1.00 65.36 O ATOM 2066 C3' DA D 1 19.736 -7.644 47.818 1.00 64.88 C ATOM 2067 O3' DA D 1 18.609 -7.800 46.960 1.00 63.50 O ATOM 2068 C2' DA D 1 20.853 -7.110 46.939 1.00 64.94 C ATOM 2069 C1' DA D 1 20.193 -5.760 46.664 1.00 62.58 C ATOM 2070 N9 DA D 1 20.967 -4.807 45.876 1.00 60.25 N ATOM 2071 C8 DA D 1 22.307 -4.817 45.585 1.00 58.50 C ATOM 2072 N7 DA D 1 22.692 -3.813 44.834 1.00 58.24 N ATOM 2073 C5 DA D 1 21.513 -3.117 44.600 1.00 60.01 C ATOM 2074 C6 DA D 1 21.218 -1.948 43.874 1.00 59.70 C ATOM 2075 N6 DA D 1 22.142 -1.265 43.214 1.00 58.37 N ATOM 2076 N1 DA D 1 19.934 -1.510 43.850 1.00 61.45 N ATOM 2077 C2 DA D 1 18.989 -2.198 44.510 1.00 61.37 C ATOM 2078 N3 DA D 1 19.139 -3.315 45.234 1.00 61.45 N ATOM 2079 C4 DA D 1 20.434 -3.718 45.236 1.00 61.28 C ATOM 2080 P DA D 2 17.233 -8.495 47.310 1.00 61.27 P ATOM 2081 OP1 DA D 2 16.847 -8.137 48.679 1.00 63.15 O ATOM 2082 OP2 DA D 2 17.339 -9.884 46.853 1.00 59.75 O ATOM 2083 O5' DA D 2 16.168 -7.736 46.417 1.00 58.96 O ATOM 2084 C5' DA D 2 16.466 -6.420 46.032 1.00 57.96 C ATOM 2085 C4' DA D 2 15.427 -5.831 45.105 1.00 56.60 C ATOM 2086 O4' DA D 2 16.065 -4.840 44.247 1.00 54.54 O ATOM 2087 C3' DA D 2 14.768 -6.820 44.156 1.00 54.82 C ATOM 2088 O3' DA D 2 13.527 -6.273 43.776 1.00 56.15 O ATOM 2089 C2' DA D 2 15.811 -6.912 43.051 1.00 52.54 C ATOM 2090 C1' DA D 2 16.364 -5.483 43.023 1.00 50.71 C ATOM 2091 N9 DA D 2 17.793 -5.440 42.751 1.00 48.73 N ATOM 2092 C8 DA D 2 18.748 -6.366 43.064 1.00 45.95 C ATOM 2093 N7 DA D 2 19.949 -6.048 42.643 1.00 44.25 N ATOM 2094 C5 DA D 2 19.748 -4.840 42.006 1.00 46.69 C ATOM 2095 C6 DA D 2 20.617 -3.988 41.336 1.00 46.64 C ATOM 2096 N6 DA D 2 21.902 -4.244 41.227 1.00 47.82 N ATOM 2097 N1 DA D 2 20.123 -2.869 40.792 1.00 46.81 N ATOM 2098 C2 DA D 2 18.813 -2.605 40.904 1.00 47.08 C ATOM 2099 N3 DA D 2 17.874 -3.329 41.509 1.00 47.90 N ATOM 2100 C4 DA D 2 18.425 -4.444 42.047 1.00 48.65 C ATOM 2101 P DA D 3 12.649 -6.791 42.556 1.00 59.11 P ATOM 2102 OP1 DA D 3 11.282 -6.369 42.925 1.00 54.55 O ATOM 2103 OP2 DA D 3 13.037 -8.142 42.083 1.00 56.75 O ATOM 2104 O5' DA D 3 13.105 -5.811 41.389 1.00 61.12 O ATOM 2105 C5' DA D 3 13.030 -4.395 41.606 1.00 58.79 C ATOM 2106 C4' DA D 3 13.381 -3.676 40.331 1.00 54.60 C ATOM 2107 O4' DA D 3 14.808 -3.728 40.076 1.00 49.35 O ATOM 2108 C3' DA D 3 12.704 -4.311 39.134 1.00 54.69 C ATOM 2109 O3' DA D 3 12.238 -3.236 38.318 1.00 59.90 O ATOM 2110 C2' DA D 3 13.797 -5.172 38.506 1.00 51.63 C ATOM 2111 C1' DA D 3 15.016 -4.316 38.816 1.00 48.97 C ATOM 2112 N9 DA D 3 16.252 -5.050 38.903 1.00 46.90 N ATOM 2113 C8 DA D 3 16.419 -6.291 39.417 1.00 48.31 C ATOM 2114 N7 DA D 3 17.660 -6.696 39.351 1.00 49.95 N ATOM 2115 C5 DA D 3 18.337 -5.646 38.759 1.00 47.17 C ATOM 2116 C6 DA D 3 19.683 -5.446 38.420 1.00 47.68 C ATOM 2117 N6 DA D 3 20.639 -6.332 38.645 1.00 47.07 N ATOM 2118 N1 DA D 3 20.023 -4.290 37.834 1.00 48.79 N ATOM 2119 C2 DA D 3 19.076 -3.370 37.618 1.00 47.96 C ATOM 2120 N3 DA D 3 17.776 -3.450 37.900 1.00 45.95 N ATOM 2121 C4 DA D 3 17.475 -4.623 38.476 1.00 45.44 C ATOM 2122 P DT D 4 11.423 -3.511 36.962 1.00 57.58 P ATOM 2123 OP1 DT D 4 10.267 -2.570 37.012 1.00 52.88 O ATOM 2124 OP2 DT D 4 11.289 -4.979 36.794 1.00 55.45 O ATOM 2125 O5' DT D 4 12.494 -3.044 35.873 1.00 54.19 O ATOM 2126 C5' DT D 4 13.081 -1.765 36.005 1.00 54.81 C ATOM 2127 C4' DT D 4 14.269 -1.781 35.092 1.00 56.39 C ATOM 2128 O4' DT D 4 15.214 -2.787 35.545 1.00 55.44 O ATOM 2129 C3' DT D 4 13.922 -2.162 33.647 1.00 57.58 C ATOM 2130 O3' DT D 4 14.024 -0.983 32.878 1.00 57.38 O ATOM 2131 C2' DT D 4 14.923 -3.274 33.286 1.00 57.20 C ATOM 2132 C1' DT D 4 15.960 -3.119 34.394 1.00 54.51 C ATOM 2133 N1 DT D 4 16.723 -4.309 34.739 1.00 50.09 N ATOM 2134 C2 DT D 4 18.095 -4.274 34.612 1.00 51.53 C ATOM 2135 O2 DT D 4 18.735 -3.306 34.213 1.00 51.41 O ATOM 2136 N3 DT D 4 18.719 -5.428 34.995 1.00 53.37 N ATOM 2137 C4 DT D 4 18.091 -6.572 35.457 1.00 52.17 C ATOM 2138 O4 DT D 4 18.731 -7.563 35.772 1.00 51.18 O ATOM 2139 C5 DT D 4 16.656 -6.537 35.570 1.00 49.78 C ATOM 2140 C7 DT D 4 15.926 -7.709 36.166 1.00 44.41 C ATOM 2141 C6 DT D 4 16.041 -5.405 35.204 1.00 48.38 C ATOM 2142 P DT D 5 13.871 -0.965 31.291 1.00 54.27 P ATOM 2143 OP1 DT D 5 13.634 0.492 31.047 1.00 54.64 O ATOM 2144 OP2 DT D 5 12.966 -2.040 30.805 1.00 50.54 O ATOM 2145 O5' DT D 5 15.334 -1.405 30.796 1.00 44.33 O ATOM 2146 C5' DT D 5 16.382 -0.493 31.174 1.00 44.99 C ATOM 2147 C4' DT D 5 17.696 -1.021 30.660 1.00 49.10 C ATOM 2148 O4' DT D 5 17.964 -2.269 31.357 1.00 49.44 O ATOM 2149 C3' DT D 5 17.697 -1.316 29.141 1.00 51.93 C ATOM 2150 O3' DT D 5 18.795 -0.671 28.503 1.00 50.98 O ATOM 2151 C2' DT D 5 17.776 -2.839 29.072 1.00 51.95 C ATOM 2152 C1' DT D 5 18.521 -3.136 30.378 1.00 50.18 C ATOM 2153 N1 DT D 5 18.408 -4.530 30.885 1.00 47.80 N ATOM 2154 C2 DT D 5 19.565 -5.259 31.076 1.00 44.90 C ATOM 2155 O2 DT D 5 20.693 -4.841 30.848 1.00 42.29 O ATOM 2156 N3 DT D 5 19.332 -6.512 31.559 1.00 45.80 N ATOM 2157 C4 DT D 5 18.106 -7.074 31.850 1.00 47.36 C ATOM 2158 O4 DT D 5 18.050 -8.214 32.283 1.00 48.41 O ATOM 2159 C5 DT D 5 16.932 -6.265 31.631 1.00 45.43 C ATOM 2160 C7 DT D 5 15.551 -6.790 31.929 1.00 41.89 C ATOM 2161 C6 DT D 5 17.141 -5.032 31.159 1.00 47.26 C ATOM 2162 P DT D 6 18.894 -0.526 26.920 1.00 53.78 P ATOM 2163 OP1 DT D 6 19.210 0.900 26.614 1.00 51.81 O ATOM 2164 OP2 DT D 6 17.799 -1.307 26.278 1.00 51.59 O ATOM 2165 O5' DT D 6 20.217 -1.373 26.636 1.00 56.18 O ATOM 2166 C5' DT D 6 21.455 -1.129 27.343 1.00 53.69 C ATOM 2167 C4' DT D 6 22.269 -2.407 27.372 1.00 52.21 C ATOM 2168 O4' DT D 6 21.437 -3.479 27.866 1.00 53.00 O ATOM 2169 C3' DT D 6 22.703 -2.919 26.017 1.00 54.87 C ATOM 2170 O3' DT D 6 24.108 -2.851 25.916 1.00 59.20 O ATOM 2171 C2' DT D 6 22.181 -4.359 25.912 1.00 54.31 C ATOM 2172 C1' DT D 6 21.891 -4.707 27.349 1.00 52.74 C ATOM 2173 N1 DT D 6 20.818 -5.732 27.617 1.00 52.44 N ATOM 2174 C2 DT D 6 21.201 -6.997 27.953 1.00 52.64 C ATOM 2175 O2 DT D 6 22.361 -7.326 28.016 1.00 54.02 O ATOM 2176 N3 DT D 6 20.176 -7.862 28.208 1.00 53.81 N ATOM 2177 C4 DT D 6 18.819 -7.598 28.179 1.00 54.35 C ATOM 2178 O4 DT D 6 17.970 -8.460 28.434 1.00 55.03 O ATOM 2179 C5 DT D 6 18.470 -6.242 27.824 1.00 52.78 C ATOM 2180 C7 DT D 6 17.022 -5.817 27.805 1.00 52.54 C ATOM 2181 C6 DT D 6 19.476 -5.383 27.564 1.00 51.56 C ATOM 2182 P DG D 7 24.764 -2.715 24.461 1.00 64.11 P ATOM 2183 OP1 DG D 7 25.989 -1.931 24.675 1.00 67.04 O ATOM 2184 OP2 DG D 7 23.703 -2.288 23.517 1.00 60.67 O ATOM 2185 O5' DG D 7 25.240 -4.172 24.035 1.00 64.36 O ATOM 2186 C5' DG D 7 26.219 -4.861 24.784 1.00 66.33 C ATOM 2187 C4' DG D 7 26.058 -6.336 24.495 1.00 69.07 C ATOM 2188 O4' DG D 7 24.785 -6.809 25.012 1.00 67.60 O ATOM 2189 C3' DG D 7 26.050 -6.686 23.000 1.00 71.50 C ATOM 2190 O3' DG D 7 27.108 -7.590 22.737 1.00 76.74 O ATOM 2191 C2' DG D 7 24.660 -7.289 22.738 1.00 68.74 C ATOM 2192 C1' DG D 7 24.285 -7.793 24.120 1.00 65.44 C ATOM 2193 N9 DG D 7 22.866 -7.954 24.402 1.00 63.99 N ATOM 2194 C8 DG D 7 21.841 -7.070 24.199 1.00 62.68 C ATOM 2195 N7 DG D 7 20.683 -7.515 24.597 1.00 62.50 N ATOM 2196 C5 DG D 7 20.951 -8.770 25.114 1.00 63.10 C ATOM 2197 C6 DG D 7 20.105 -9.748 25.683 1.00 62.33 C ATOM 2198 O6 DG D 7 18.897 -9.724 25.869 1.00 62.90 O ATOM 2199 N1 DG D 7 20.783 -10.894 26.062 1.00 62.74 N ATOM 2200 C2 DG D 7 22.143 -11.062 25.915 1.00 63.71 C ATOM 2201 N2 DG D 7 22.643 -12.228 26.344 1.00 63.37 N ATOM 2202 N3 DG D 7 22.961 -10.164 25.380 1.00 64.36 N ATOM 2203 C4 DG D 7 22.295 -9.046 25.002 1.00 64.60 C ATOM 2204 P DC D 8 27.482 -8.015 21.245 1.00 81.17 P ATOM 2205 OP1 DC D 8 28.934 -8.271 21.297 1.00 83.75 O ATOM 2206 OP2 DC D 8 26.910 -7.069 20.265 1.00 80.42 O ATOM 2207 O5' DC D 8 26.729 -9.406 21.065 1.00 76.61 O ATOM 2208 C5' DC D 8 27.027 -10.399 22.020 1.00 74.06 C ATOM 2209 C4' DC D 8 25.891 -11.378 22.058 1.00 71.35 C ATOM 2210 O4' DC D 8 24.672 -10.705 22.399 1.00 68.34 O ATOM 2211 C3' DC D 8 25.497 -11.998 20.744 1.00 70.14 C ATOM 2212 O3' DC D 8 26.358 -13.056 20.422 1.00 75.54 O ATOM 2213 C2' DC D 8 24.104 -12.508 21.063 1.00 67.07 C ATOM 2214 C1' DC D 8 23.704 -11.728 22.297 1.00 65.02 C ATOM 2215 N1 DC D 8 22.357 -11.109 22.256 1.00 63.71 N ATOM 2216 C2 DC D 8 21.211 -11.855 22.578 1.00 61.61 C ATOM 2217 O2 DC D 8 21.349 -13.043 22.880 1.00 59.22 O ATOM 2218 N3 DC D 8 19.985 -11.253 22.545 1.00 60.46 N ATOM 2219 C4 DC D 8 19.895 -9.966 22.215 1.00 61.63 C ATOM 2220 N4 DC D 8 18.697 -9.378 22.177 1.00 62.24 N ATOM 2221 C5 DC D 8 21.053 -9.199 21.898 1.00 62.10 C ATOM 2222 C6 DC D 8 22.253 -9.790 21.925 1.00 63.04 C ATOM 2223 P DT D 9 26.286 -13.801 19.004 1.00 80.34 P ATOM 2224 OP1 DT D 9 27.693 -13.923 18.577 1.00 81.66 O ATOM 2225 OP2 DT D 9 25.268 -13.186 18.098 1.00 79.00 O ATOM 2226 O5' DT D 9 25.793 -15.241 19.420 1.00 73.08 O ATOM 2227 C5' DT D 9 24.891 -15.824 18.621 1.00 71.49 C ATOM 2228 C4' DT D 9 24.061 -16.641 19.532 1.00 72.56 C ATOM 2229 O4' DT D 9 23.361 -15.820 20.463 1.00 71.21 O ATOM 2230 C3' DT D 9 23.028 -17.366 18.733 1.00 75.64 C ATOM 2231 O3' DT D 9 23.670 -18.562 18.381 1.00 80.28 O ATOM 2232 C2' DT D 9 21.858 -17.483 19.696 1.00 73.87 C ATOM 2233 C1' DT D 9 22.005 -16.246 20.555 1.00 71.67 C ATOM 2234 N1 DT D 9 21.055 -15.095 20.217 1.00 71.26 N ATOM 2235 C2 DT D 9 19.678 -15.160 20.470 1.00 68.84 C ATOM 2236 O2 DT D 9 19.067 -16.099 20.935 1.00 68.19 O ATOM 2237 N3 DT D 9 18.979 -14.042 20.130 1.00 66.63 N ATOM 2238 C4 DT D 9 19.506 -12.890 19.599 1.00 66.27 C ATOM 2239 O4 DT D 9 18.795 -11.952 19.343 1.00 67.78 O ATOM 2240 C5 DT D 9 20.916 -12.849 19.358 1.00 66.42 C ATOM 2241 C7 DT D 9 21.572 -11.614 18.806 1.00 61.05 C ATOM 2242 C6 DT D 9 21.616 -13.945 19.673 1.00 70.39 C ATOM 2243 P DC D 10 22.837 -19.784 17.831 1.00 83.04 P ATOM 2244 OP1 DC D 10 23.831 -20.854 17.676 1.00 83.91 O ATOM 2245 OP2 DC D 10 22.037 -19.277 16.699 1.00 83.55 O ATOM 2246 O5' DC D 10 21.826 -20.187 19.003 1.00 85.08 O ATOM 2247 C5' DC D 10 21.079 -21.387 18.979 1.00 85.40 C ATOM 2248 C4' DC D 10 19.646 -21.108 18.585 1.00 84.62 C ATOM 2249 O4' DC D 10 19.290 -19.745 18.909 1.00 81.98 O ATOM 2250 C3' DC D 10 19.395 -21.282 17.094 1.00 84.98 C ATOM 2251 O3' DC D 10 19.007 -22.639 16.879 1.00 87.36 O ATOM 2252 C2' DC D 10 18.355 -20.200 16.788 1.00 83.42 C ATOM 2253 C1' DC D 10 18.206 -19.400 18.083 1.00 78.55 C ATOM 2254 N1 DC D 10 18.181 -17.923 17.829 1.00 75.03 N ATOM 2255 C2 DC D 10 17.074 -17.181 18.231 1.00 72.66 C ATOM 2256 O2 DC D 10 16.154 -17.756 18.806 1.00 70.88 O ATOM 2257 N3 DC D 10 17.053 -15.849 17.986 1.00 72.64 N ATOM 2258 C4 DC D 10 18.078 -15.263 17.358 1.00 72.97 C ATOM 2259 N4 DC D 10 17.997 -13.953 17.148 1.00 69.96 N ATOM 2260 C5 DC D 10 19.220 -16.001 16.926 1.00 72.74 C ATOM 2261 C6 DC D 10 19.222 -17.314 17.177 1.00 74.04 C ATOM 2262 P DA D 11 17.642 -23.086 16.184 1.00 90.63 P ATOM 2263 OP1 DA D 11 17.523 -24.536 16.362 1.00 91.57 O ATOM 2264 OP2 DA D 11 17.693 -22.500 14.829 1.00 91.91 O ATOM 2265 O5' DA D 11 16.436 -22.456 17.032 1.00 89.85 O ATOM 2266 C5' DA D 11 15.114 -23.011 17.050 1.00 86.51 C ATOM 2267 C4' DA D 11 14.147 -22.231 16.170 1.00 84.06 C ATOM 2268 O4' DA D 11 14.434 -20.805 16.244 1.00 80.83 O ATOM 2269 C3' DA D 11 14.170 -22.619 14.679 1.00 82.05 C ATOM 2270 O3' DA D 11 12.903 -22.799 14.030 1.00 83.19 O ATOM 2271 C2' DA D 11 14.852 -21.421 14.046 1.00 79.83 C ATOM 2272 C1' DA D 11 14.340 -20.295 14.935 1.00 74.62 C ATOM 2273 N9 DA D 11 15.070 -19.043 14.787 1.00 71.16 N ATOM 2274 C8 DA D 11 16.329 -18.863 14.279 1.00 68.91 C ATOM 2275 N7 DA D 11 16.708 -17.617 14.261 1.00 68.57 N ATOM 2276 C5 DA D 11 15.616 -16.949 14.780 1.00 68.68 C ATOM 2277 C6 DA D 11 15.384 -15.594 15.010 1.00 69.42 C ATOM 2278 N6 DA D 11 16.315 -14.685 14.720 1.00 69.06 N ATOM 2279 N1 DA D 11 14.184 -15.237 15.541 1.00 69.91 N ATOM 2280 C2 DA D 11 13.268 -16.174 15.814 1.00 68.59 C ATOM 2281 N3 DA D 11 13.385 -17.487 15.640 1.00 68.30 N ATOM 2282 C4 DA D 11 14.589 -17.803 15.112 1.00 69.19 C ATOM 2283 P DA D 12 11.511 -23.065 14.773 1.00 84.43 P ATOM 2284 OP1 DA D 12 11.765 -23.963 15.906 1.00 86.20 O ATOM 2285 OP2 DA D 12 10.511 -23.486 13.771 1.00 84.92 O ATOM 2286 O5' DA D 12 11.140 -21.617 15.353 1.00 83.89 O ATOM 2287 C5' DA D 12 9.842 -21.303 15.867 1.00 80.64 C ATOM 2288 C4' DA D 12 9.108 -20.304 14.986 1.00 76.78 C ATOM 2289 O4' DA D 12 9.995 -19.211 14.627 1.00 72.72 O ATOM 2290 C3' DA D 12 8.623 -20.881 13.656 1.00 74.11 C ATOM 2291 O3' DA D 12 7.577 -20.157 13.094 1.00 73.98 O ATOM 2292 C2' DA D 12 9.810 -20.594 12.762 1.00 72.26 C ATOM 2293 C1' DA D 12 10.059 -19.159 13.207 1.00 67.52 C ATOM 2294 N9 DA D 12 11.315 -18.575 12.751 1.00 64.80 N ATOM 2295 C8 DA D 12 12.443 -19.198 12.284 1.00 63.64 C ATOM 2296 N7 DA D 12 13.399 -18.374 11.953 1.00 62.95 N ATOM 2297 C5 DA D 12 12.840 -17.137 12.211 1.00 61.50 C ATOM 2298 C6 DA D 12 13.334 -15.843 12.071 1.00 61.50 C ATOM 2299 N6 DA D 12 14.550 -15.572 11.625 1.00 61.28 N ATOM 2300 N1 DA D 12 12.522 -14.829 12.413 1.00 64.57 N ATOM 2301 C2 DA D 12 11.285 -15.078 12.872 1.00 64.27 C ATOM 2302 N3 DA D 12 10.705 -16.254 13.049 1.00 62.16 N ATOM 2303 C4 DA D 12 11.555 -17.237 12.694 1.00 62.46 C ATOM 2304 P DA D 13 6.069 -20.222 13.564 1.00 73.85 P ATOM 2305 OP1 DA D 13 6.039 -20.348 15.036 1.00 71.97 O ATOM 2306 OP2 DA D 13 5.434 -21.185 12.648 1.00 72.89 O ATOM 2307 O5' DA D 13 5.474 -18.772 13.217 1.00 71.31 O ATOM 2308 C5' DA D 13 5.741 -17.655 14.085 1.00 65.90 C ATOM 2309 C4' DA D 13 5.728 -16.322 13.364 1.00 59.92 C ATOM 2310 O4' DA D 13 7.028 -16.068 12.780 1.00 54.72 O ATOM 2311 C3' DA D 13 4.717 -16.245 12.231 1.00 57.70 C ATOM 2312 O3' DA D 13 3.996 -15.025 12.341 1.00 57.82 O ATOM 2313 C2' DA D 13 5.584 -16.418 10.981 1.00 54.88 C ATOM 2314 C1' DA D 13 6.863 -15.734 11.414 1.00 51.76 C ATOM 2315 N9 DA D 13 8.083 -16.134 10.724 1.00 49.95 N ATOM 2316 C8 DA D 13 8.464 -17.385 10.349 1.00 49.25 C ATOM 2317 N7 DA D 13 9.643 -17.436 9.766 1.00 49.28 N ATOM 2318 C5 DA D 13 10.061 -16.128 9.753 1.00 47.59 C ATOM 2319 C6 DA D 13 11.224 -15.508 9.271 1.00 46.73 C ATOM 2320 N6 DA D 13 12.226 -16.132 8.678 1.00 45.31 N ATOM 2321 N1 DA D 13 11.332 -14.178 9.415 1.00 48.43 N ATOM 2322 C2 DA D 13 10.329 -13.516 10.004 1.00 49.39 C ATOM 2323 N3 DA D 13 9.184 -13.993 10.494 1.00 48.08 N ATOM 2324 C4 DA D 13 9.111 -15.316 10.334 1.00 48.78 C ATOM 2325 P DA D 14 2.932 -14.640 11.215 1.00 60.95 P ATOM 2326 OP1 DA D 14 1.858 -13.756 11.751 1.00 57.87 O ATOM 2327 OP2 DA D 14 2.636 -15.862 10.420 1.00 57.99 O ATOM 2328 O5' DA D 14 3.863 -13.707 10.318 1.00 61.88 O ATOM 2329 C5' DA D 14 4.502 -12.587 10.917 1.00 58.83 C ATOM 2330 C4' DA D 14 5.271 -11.835 9.862 1.00 56.06 C ATOM 2331 O4' DA D 14 6.376 -12.660 9.408 1.00 54.76 O ATOM 2332 C3' DA D 14 4.464 -11.468 8.635 1.00 53.26 C ATOM 2333 O3' DA D 14 4.647 -10.090 8.453 1.00 54.95 O ATOM 2334 C2' DA D 14 5.104 -12.321 7.543 1.00 53.63 C ATOM 2335 C1' DA D 14 6.533 -12.462 8.037 1.00 52.62 C ATOM 2336 N9 DA D 14 7.285 -13.612 7.589 1.00 51.76 N ATOM 2337 C8 DA D 14 6.897 -14.922 7.614 1.00 53.25 C ATOM 2338 N7 DA D 14 7.791 -15.761 7.142 1.00 52.20 N ATOM 2339 C5 DA D 14 8.831 -14.923 6.803 1.00 52.40 C ATOM 2340 C6 DA D 14 10.096 -15.172 6.238 1.00 53.33 C ATOM 2341 N6 DA D 14 10.525 -16.392 5.935 1.00 51.49 N ATOM 2342 N1 DA D 14 10.912 -14.097 6.018 1.00 54.30 N ATOM 2343 C2 DA D 14 10.495 -12.847 6.330 1.00 52.23 C ATOM 2344 N3 DA D 14 9.317 -12.495 6.859 1.00 50.40 N ATOM 2345 C4 DA D 14 8.541 -13.589 7.075 1.00 51.56 C ATOM 2346 P DT D 15 3.832 -9.201 7.389 1.00 58.29 P ATOM 2347 OP1 DT D 15 3.473 -7.934 8.077 1.00 53.89 O ATOM 2348 OP2 DT D 15 2.875 -10.098 6.683 1.00 57.42 O ATOM 2349 O5' DT D 15 4.971 -8.760 6.368 1.00 51.82 O ATOM 2350 C5' DT D 15 6.218 -8.365 6.939 1.00 47.79 C ATOM 2351 C4' DT D 15 7.287 -8.351 5.877 1.00 47.04 C ATOM 2352 O4' DT D 15 7.828 -9.664 5.572 1.00 47.20 O ATOM 2353 C3' DT D 15 6.785 -7.797 4.542 1.00 48.75 C ATOM 2354 O3' DT D 15 7.768 -6.836 4.227 1.00 47.88 O ATOM 2355 C2' DT D 15 6.678 -9.013 3.606 1.00 47.19 C ATOM 2356 C1' DT D 15 7.840 -9.832 4.159 1.00 45.35 C ATOM 2357 N1 DT D 15 7.800 -11.276 3.929 1.00 43.68 N ATOM 2358 C2 DT D 15 8.947 -11.905 3.490 1.00 42.48 C ATOM 2359 O2 DT D 15 9.998 -11.329 3.271 1.00 40.13 O ATOM 2360 N3 DT D 15 8.820 -13.265 3.331 1.00 43.94 N ATOM 2361 C4 DT D 15 7.672 -14.021 3.563 1.00 43.89 C ATOM 2362 O4 DT D 15 7.668 -15.241 3.389 1.00 43.08 O ATOM 2363 C5 DT D 15 6.504 -13.292 4.026 1.00 42.28 C ATOM 2364 C7 DT D 15 5.181 -13.948 4.153 1.00 42.26 C ATOM 2365 C6 DT D 15 6.630 -11.969 4.191 1.00 42.90 C ATOM 2366 P DT D 16 7.680 -5.855 2.997 1.00 42.21 P ATOM 2367 OP1 DT D 16 8.269 -4.562 3.470 1.00 41.99 O ATOM 2368 OP2 DT D 16 6.397 -6.021 2.273 1.00 37.33 O ATOM 2369 O5' DT D 16 8.759 -6.585 2.064 1.00 37.52 O ATOM 2370 C5' DT D 16 10.135 -6.426 2.355 1.00 32.23 C ATOM 2371 C4' DT D 16 10.899 -7.225 1.335 1.00 33.47 C ATOM 2372 O4' DT D 16 10.455 -8.606 1.395 1.00 36.23 O ATOM 2373 C3' DT D 16 10.682 -6.738 -0.094 1.00 35.23 C ATOM 2374 O3' DT D 16 11.958 -6.384 -0.628 1.00 34.14 O ATOM 2375 C2' DT D 16 9.998 -7.923 -0.785 1.00 37.89 C ATOM 2376 C1' DT D 16 10.456 -9.096 0.077 1.00 38.19 C ATOM 2377 N1 DT D 16 9.577 -10.268 0.067 1.00 38.29 N ATOM 2378 C2 DT D 16 10.100 -11.497 -0.277 1.00 37.03 C ATOM 2379 O2 DT D 16 11.279 -11.683 -0.579 1.00 34.50 O ATOM 2380 N3 DT D 16 9.168 -12.507 -0.235 1.00 37.43 N ATOM 2381 C4 DT D 16 7.816 -12.390 0.079 1.00 38.37 C ATOM 2382 O4 DT D 16 7.075 -13.371 0.070 1.00 38.22 O ATOM 2383 C5 DT D 16 7.342 -11.066 0.426 1.00 38.17 C ATOM 2384 C7 DT D 16 5.897 -10.782 0.760 1.00 35.42 C ATOM 2385 C6 DT D 16 8.248 -10.081 0.406 1.00 39.44 C ATOM 2386 P DC D 17 12.122 -5.824 -2.113 1.00 33.52 P ATOM 2387 OP1 DC D 17 13.371 -5.011 -2.191 1.00 33.69 O ATOM 2388 OP2 DC D 17 10.808 -5.245 -2.501 1.00 24.63 O ATOM 2389 O5' DC D 17 12.372 -7.200 -2.901 1.00 34.29 O ATOM 2390 C5' DC D 17 13.590 -7.887 -2.688 1.00 37.36 C ATOM 2391 C4' DC D 17 13.578 -9.251 -3.344 1.00 38.25 C ATOM 2392 O4' DC D 17 12.512 -10.069 -2.831 1.00 37.84 O ATOM 2393 C3' DC D 17 13.296 -9.140 -4.808 1.00 42.23 C ATOM 2394 O3' DC D 17 14.541 -9.074 -5.489 1.00 49.91 O ATOM 2395 C2' DC D 17 12.480 -10.379 -5.158 1.00 41.41 C ATOM 2396 C1' DC D 17 12.103 -10.972 -3.821 1.00 38.48 C ATOM 2397 N1 DC D 17 10.660 -11.156 -3.677 1.00 37.99 N ATOM 2398 C2 DC D 17 10.108 -12.433 -3.700 1.00 39.05 C ATOM 2399 O2 DC D 17 10.864 -13.391 -3.854 1.00 40.45 O ATOM 2400 N3 DC D 17 8.766 -12.575 -3.560 1.00 39.69 N ATOM 2401 C4 DC D 17 8.007 -11.481 -3.404 1.00 41.39 C ATOM 2402 N4 DC D 17 6.697 -11.622 -3.256 1.00 40.99 N ATOM 2403 C5 DC D 17 8.541 -10.160 -3.375 1.00 41.13 C ATOM 2404 C6 DC D 17 9.869 -10.058 -3.523 1.00 40.44 C ATOM 2405 P DA D 18 14.518 -8.644 -7.043 1.00 58.32 P ATOM 2406 OP1 DA D 18 15.783 -7.916 -7.284 1.00 61.21 O ATOM 2407 OP2 DA D 18 13.189 -8.048 -7.399 1.00 48.70 O ATOM 2408 O5' DA D 18 14.633 -10.049 -7.788 1.00 60.51 O ATOM 2409 C5' DA D 18 15.524 -11.062 -7.364 1.00 59.79 C ATOM 2410 C4' DA D 18 15.075 -12.253 -8.169 1.00 59.85 C ATOM 2411 O4' DA D 18 13.850 -12.773 -7.566 1.00 57.37 O ATOM 2412 C3' DA D 18 14.795 -11.868 -9.632 1.00 58.53 C ATOM 2413 O3' DA D 18 15.752 -12.495 -10.496 1.00 63.18 O ATOM 2414 C2' DA D 18 13.323 -12.235 -9.822 1.00 57.04 C ATOM 2415 C1' DA D 18 12.934 -13.070 -8.599 1.00 54.31 C ATOM 2416 N9 DA D 18 11.588 -12.779 -8.138 1.00 52.07 N ATOM 2417 C8 DA D 18 11.034 -11.549 -7.946 1.00 51.92 C ATOM 2418 N7 DA D 18 9.800 -11.572 -7.530 1.00 51.15 N ATOM 2419 C5 DA D 18 9.521 -12.911 -7.455 1.00 51.30 C ATOM 2420 C6 DA D 18 8.358 -13.589 -7.069 1.00 52.37 C ATOM 2421 N6 DA D 18 7.250 -12.961 -6.666 1.00 51.23 N ATOM 2422 N1 DA D 18 8.400 -14.940 -7.113 1.00 52.74 N ATOM 2423 C2 DA D 18 9.536 -15.553 -7.502 1.00 52.09 C ATOM 2424 N3 DA D 18 10.703 -15.019 -7.879 1.00 51.61 N ATOM 2425 C4 DA D 18 10.615 -13.676 -7.828 1.00 51.70 C ATOM 2426 P DA D 19 15.455 -13.621 -11.615 1.00 70.33 P ATOM 2427 OP1 DA D 19 16.792 -14.146 -11.931 1.00 69.92 O ATOM 2428 OP2 DA D 19 14.579 -13.043 -12.678 1.00 67.37 O ATOM 2429 O5' DA D 19 14.683 -14.831 -10.882 1.00 68.69 O ATOM 2430 C5' DA D 19 14.551 -16.117 -11.475 1.00 67.33 C ATOM 2431 C4' DA D 19 13.183 -16.347 -12.099 1.00 65.75 C ATOM 2432 O4' DA D 19 12.138 -15.777 -11.283 1.00 63.36 O ATOM 2433 C3' DA D 19 12.966 -15.742 -13.491 1.00 66.57 C ATOM 2434 O3' DA D 19 13.288 -16.668 -14.576 1.00 70.25 O ATOM 2435 C2' DA D 19 11.494 -15.329 -13.515 1.00 64.37 C ATOM 2436 C1' DA D 19 10.994 -15.620 -12.112 1.00 59.09 C ATOM 2437 N9 DA D 19 10.146 -14.538 -11.649 1.00 56.96 N ATOM 2438 C8 DA D 19 10.425 -13.197 -11.701 1.00 57.39 C ATOM 2439 N7 DA D 19 9.484 -12.441 -11.181 1.00 58.31 N ATOM 2440 C5 DA D 19 8.526 -13.352 -10.771 1.00 56.12 C ATOM 2441 C6 DA D 19 7.276 -13.192 -10.164 1.00 55.16 C ATOM 2442 N6 DA D 19 6.760 -12.008 -9.860 1.00 55.94 N ATOM 2443 N1 DA D 19 6.573 -14.294 -9.884 1.00 54.94 N ATOM 2444 C2 DA D 19 7.083 -15.471 -10.217 1.00 54.39 C ATOM 2445 N3 DA D 19 8.244 -15.752 -10.799 1.00 52.39 N ATOM 2446 C4 DA D 19 8.920 -14.642 -11.055 1.00 54.29 C ATOM 2447 P DA D 20 12.338 -17.865 -15.078 1.00 71.18 P ATOM 2448 OP1 DA D 20 11.653 -18.553 -13.953 1.00 72.49 O ATOM 2449 OP2 DA D 20 13.183 -18.684 -15.955 1.00 71.90 O ATOM 2450 O5' DA D 20 11.242 -17.081 -15.930 1.00 65.66 O ATOM 2451 C5' DA D 20 10.233 -17.827 -16.585 1.00 64.11 C ATOM 2452 C4' DA D 20 8.991 -18.142 -15.764 1.00 62.35 C ATOM 2453 O4' DA D 20 8.767 -17.137 -14.775 1.00 61.06 O ATOM 2454 C3' DA D 20 7.715 -18.129 -16.599 1.00 63.44 C ATOM 2455 O3' DA D 20 7.332 -19.456 -16.879 1.00 65.55 O ATOM 2456 C2' DA D 20 6.644 -17.419 -15.785 1.00 60.68 C ATOM 2457 C1' DA D 20 7.383 -16.955 -14.548 1.00 55.51 C ATOM 2458 N9 DA D 20 7.139 -15.543 -14.233 1.00 53.50 N ATOM 2459 C8 DA D 20 7.979 -14.473 -14.431 1.00 50.84 C ATOM 2460 N7 DA D 20 7.477 -13.325 -14.035 1.00 49.02 N ATOM 2461 C5 DA D 20 6.239 -13.683 -13.548 1.00 48.37 C ATOM 2462 C6 DA D 20 5.222 -12.937 -12.983 1.00 48.99 C ATOM 2463 N6 DA D 20 5.342 -11.629 -12.828 1.00 50.38 N ATOM 2464 N1 DA D 20 4.104 -13.585 -12.587 1.00 50.66 N ATOM 2465 C2 DA D 20 3.996 -14.902 -12.739 1.00 48.81 C ATOM 2466 N3 DA D 20 4.902 -15.714 -13.265 1.00 48.97 N ATOM 2467 C4 DA D 20 6.005 -15.036 -13.644 1.00 50.23 C ATOM 2468 P DC D 21 7.095 -19.896 -18.383 1.00 65.43 P ATOM 2469 OP1 DC D 21 6.743 -21.323 -18.305 1.00 67.09 O ATOM 2470 OP2 DC D 21 8.203 -19.431 -19.249 1.00 64.29 O ATOM 2471 O5' DC D 21 5.801 -19.046 -18.738 1.00 61.25 O ATOM 2472 C5' DC D 21 4.567 -19.568 -18.319 1.00 61.22 C ATOM 2473 C4' DC D 21 3.513 -18.517 -18.489 1.00 61.05 C ATOM 2474 O4' DC D 21 3.673 -17.564 -17.422 1.00 60.06 O ATOM 2475 C3' DC D 21 3.658 -17.674 -19.750 1.00 62.09 C ATOM 2476 O3' DC D 21 3.174 -18.342 -20.928 1.00 64.46 O ATOM 2477 C2' DC D 21 2.894 -16.419 -19.368 1.00 60.84 C ATOM 2478 C1' DC D 21 3.022 -16.378 -17.846 1.00 56.64 C ATOM 2479 N1 DC D 21 3.771 -15.172 -17.394 1.00 52.73 N ATOM 2480 C2 DC D 21 3.104 -14.188 -16.682 1.00 52.36 C ATOM 2481 O2 DC D 21 1.919 -14.363 -16.441 1.00 51.65 O ATOM 2482 N3 DC D 21 3.763 -13.083 -16.255 1.00 51.78 N ATOM 2483 C4 DC D 21 5.040 -12.947 -16.540 1.00 49.79 C ATOM 2484 N4 DC D 21 5.619 -11.855 -16.092 1.00 49.74 N ATOM 2485 C5 DC D 21 5.755 -13.929 -17.278 1.00 50.31 C ATOM 2486 C6 DC D 21 5.088 -15.017 -17.688 1.00 51.10 C ATOM 2487 P DA D 22 1.655 -18.448 -21.430 1.00 63.15 P ATOM 2488 OP1 DA D 22 1.495 -19.853 -21.842 1.00 62.47 O ATOM 2489 OP2 DA D 22 1.460 -17.326 -22.379 1.00 62.29 O ATOM 2490 O5' DA D 22 0.682 -18.219 -20.188 1.00 60.06 O ATOM 2491 C5' DA D 22 -0.707 -18.460 -20.336 1.00 59.07 C ATOM 2492 C4' DA D 22 -1.577 -17.228 -20.108 1.00 59.60 C ATOM 2493 O4' DA D 22 -0.863 -16.085 -19.567 1.00 59.18 O ATOM 2494 C3' DA D 22 -2.250 -16.666 -21.342 1.00 60.58 C ATOM 2495 O3' DA D 22 -3.596 -16.499 -20.978 1.00 65.46 O ATOM 2496 C2' DA D 22 -1.517 -15.348 -21.634 1.00 58.79 C ATOM 2497 C1' DA D 22 -1.169 -14.877 -20.242 1.00 54.86 C ATOM 2498 N9 DA D 22 0.015 -14.027 -20.116 1.00 54.16 N ATOM 2499 C8 DA D 22 1.228 -14.194 -20.728 1.00 53.32 C ATOM 2500 N7 DA D 22 2.136 -13.299 -20.401 1.00 53.17 N ATOM 2501 C5 DA D 22 1.469 -12.500 -19.512 1.00 50.39 C ATOM 2502 C6 DA D 22 1.872 -11.386 -18.819 1.00 49.96 C ATOM 2503 N6 DA D 22 3.095 -10.902 -18.943 1.00 51.66 N ATOM 2504 N1 DA D 22 0.986 -10.788 -18.006 1.00 52.66 N ATOM 2505 C2 DA D 22 -0.237 -11.287 -17.891 1.00 52.85 C ATOM 2506 N3 DA D 22 -0.737 -12.350 -18.503 1.00 53.26 N ATOM 2507 C4 DA D 22 0.176 -12.919 -19.309 1.00 53.27 C ATOM 2508 P DA D 23 -4.625 -15.846 -22.006 1.00 71.48 P ATOM 2509 OP1 DA D 23 -5.936 -16.492 -21.757 1.00 69.55 O ATOM 2510 OP2 DA D 23 -3.982 -15.786 -23.348 1.00 67.99 O ATOM 2511 O5' DA D 23 -4.736 -14.360 -21.427 1.00 70.56 O ATOM 2512 C5' DA D 23 -5.306 -14.137 -20.126 1.00 65.75 C ATOM 2513 C4' DA D 23 -5.458 -12.644 -19.927 1.00 61.33 C ATOM 2514 O4' DA D 23 -4.141 -12.038 -19.892 1.00 57.72 O ATOM 2515 C3' DA D 23 -6.209 -11.922 -21.046 1.00 57.80 C ATOM 2516 O3' DA D 23 -7.059 -10.954 -20.432 1.00 58.15 O ATOM 2517 C2' DA D 23 -5.092 -11.360 -21.937 1.00 55.27 C ATOM 2518 C1' DA D 23 -4.022 -11.049 -20.911 1.00 53.66 C ATOM 2519 N9 DA D 23 -2.629 -11.081 -21.369 1.00 53.29 N ATOM 2520 C8 DA D 23 -2.010 -12.019 -22.157 1.00 51.33 C ATOM 2521 N7 DA D 23 -0.727 -11.780 -22.334 1.00 50.47 N ATOM 2522 C5 DA D 23 -0.499 -10.616 -21.617 1.00 49.95 C ATOM 2523 C6 DA D 23 0.635 -9.834 -21.398 1.00 49.72 C ATOM 2524 N6 DA D 23 1.826 -10.095 -21.898 1.00 49.04 N ATOM 2525 N1 DA D 23 0.508 -8.739 -20.635 1.00 51.99 N ATOM 2526 C2 DA D 23 -0.667 -8.434 -20.089 1.00 51.16 C ATOM 2527 N3 DA D 23 -1.806 -9.088 -20.216 1.00 50.38 N ATOM 2528 C4 DA D 23 -1.652 -10.174 -21.004 1.00 51.71 C ATOM 2529 P DA D 24 -7.853 -9.871 -21.304 1.00 62.16 P ATOM 2530 OP1 DA D 24 -9.102 -9.461 -20.610 1.00 62.91 O ATOM 2531 OP2 DA D 24 -7.824 -10.282 -22.724 1.00 61.70 O ATOM 2532 O5' DA D 24 -6.868 -8.636 -21.192 1.00 59.57 O ATOM 2533 C5' DA D 24 -6.656 -8.046 -19.927 1.00 52.58 C ATOM 2534 C4' DA D 24 -5.884 -6.769 -20.144 1.00 47.28 C ATOM 2535 O4' DA D 24 -4.575 -7.172 -20.617 1.00 42.90 O ATOM 2536 C3' DA D 24 -6.486 -5.816 -21.175 1.00 43.41 C ATOM 2537 O3' DA D 24 -6.959 -4.644 -20.513 1.00 40.28 O ATOM 2538 C2' DA D 24 -5.338 -5.659 -22.196 1.00 44.54 C ATOM 2539 C1' DA D 24 -4.102 -6.191 -21.493 1.00 43.79 C ATOM 2540 N9 DA D 24 -3.131 -6.891 -22.315 1.00 44.68 N ATOM 2541 C8 DA D 24 -3.332 -8.029 -23.055 1.00 45.81 C ATOM 2542 N7 DA D 24 -2.260 -8.458 -23.687 1.00 45.25 N ATOM 2543 C5 DA D 24 -1.297 -7.541 -23.322 1.00 45.49 C ATOM 2544 C6 DA D 24 0.065 -7.426 -23.644 1.00 45.31 C ATOM 2545 N6 DA D 24 0.706 -8.274 -24.443 1.00 42.56 N ATOM 2546 N1 DA D 24 0.747 -6.396 -23.098 1.00 45.74 N ATOM 2547 C2 DA D 24 0.112 -5.534 -22.299 1.00 44.47 C ATOM 2548 N3 DA D 24 -1.161 -5.532 -21.922 1.00 43.48 N ATOM 2549 C4 DA D 24 -1.810 -6.571 -22.471 1.00 44.62 C ATOM 2550 P DT D 25 -6.869 -3.183 -21.164 1.00 53.09 P ATOM 2551 OP1 DT D 25 -7.595 -2.214 -20.298 1.00 50.56 O ATOM 2552 OP2 DT D 25 -7.168 -3.306 -22.622 1.00 53.90 O ATOM 2553 O5' DT D 25 -5.291 -2.901 -21.015 1.00 49.67 O ATOM 2554 C5' DT D 25 -4.753 -1.680 -20.522 1.00 45.46 C ATOM 2555 C4' DT D 25 -3.560 -1.297 -21.352 1.00 43.71 C ATOM 2556 O4' DT D 25 -2.889 -2.480 -21.821 1.00 43.31 O ATOM 2557 C3' DT D 25 -3.979 -0.591 -22.623 1.00 46.61 C ATOM 2558 O3' DT D 25 -4.183 0.814 -22.469 1.00 47.81 O ATOM 2559 C2' DT D 25 -2.861 -0.936 -23.589 1.00 47.87 C ATOM 2560 C1' DT D 25 -2.112 -2.066 -22.919 1.00 47.00 C ATOM 2561 N1 DT D 25 -1.902 -3.126 -23.918 1.00 48.25 N ATOM 2562 C2 DT D 25 -0.654 -3.262 -24.493 1.00 48.34 C ATOM 2563 O2 DT D 25 0.294 -2.579 -24.196 1.00 49.20 O ATOM 2564 N3 DT D 25 -0.553 -4.253 -25.431 1.00 49.50 N ATOM 2565 C4 DT D 25 -1.573 -5.097 -25.851 1.00 49.30 C ATOM 2566 O4 DT D 25 -1.391 -5.964 -26.681 1.00 47.21 O ATOM 2567 C5 DT D 25 -2.871 -4.898 -25.238 1.00 50.26 C ATOM 2568 C7 DT D 25 -3.989 -5.835 -25.555 1.00 44.30 C ATOM 2569 C6 DT D 25 -2.979 -3.914 -24.312 1.00 51.15 C ATOM 2570 P DT D 26 -3.041 1.820 -22.019 1.00 48.91 P ATOM 2571 OP1 DT D 26 -2.794 1.527 -20.587 1.00 53.43 O ATOM 2572 OP2 DT D 26 -3.398 3.175 -22.486 1.00 46.96 O ATOM 2573 O5' DT D 26 -1.725 1.453 -22.840 1.00 45.23 O ATOM 2574 C5' DT D 26 -0.497 1.502 -22.135 1.00 44.57 C ATOM 2575 C4' DT D 26 0.685 1.593 -23.075 1.00 42.64 C ATOM 2576 O4' DT D 26 0.634 0.497 -24.026 1.00 40.97 O ATOM 2577 C3' DT D 26 0.766 2.884 -23.891 1.00 39.02 C ATOM 2578 O3' DT D 26 2.125 3.250 -23.892 1.00 32.32 O ATOM 2579 C2' DT D 26 0.242 2.445 -25.250 1.00 39.80 C ATOM 2580 C1' DT D 26 0.844 1.046 -25.298 1.00 39.90 C ATOM 2581 N1 DT D 26 0.239 0.056 -26.151 1.00 38.74 N ATOM 2582 C2 DT D 26 1.067 -0.817 -26.830 1.00 40.63 C ATOM 2583 O2 DT D 26 2.289 -0.788 -26.785 1.00 38.34 O ATOM 2584 N3 DT D 26 0.398 -1.734 -27.601 1.00 42.61 N ATOM 2585 C4 DT D 26 -0.973 -1.862 -27.743 1.00 41.15 C ATOM 2586 O4 DT D 26 -1.463 -2.723 -28.454 1.00 40.10 O ATOM 2587 C5 DT D 26 -1.772 -0.916 -26.992 1.00 38.63 C ATOM 2588 C7 DT D 26 -3.260 -0.900 -27.138 1.00 30.52 C ATOM 2589 C6 DT D 26 -1.133 -0.012 -26.235 1.00 38.50 C ATOM 2590 P DT D 27 2.623 4.676 -24.396 1.00 40.88 P ATOM 2591 OP1 DT D 27 3.738 5.103 -23.498 1.00 31.82 O ATOM 2592 OP2 DT D 27 1.448 5.541 -24.674 1.00 37.72 O ATOM 2593 O5' DT D 27 3.288 4.206 -25.787 1.00 45.35 O ATOM 2594 C5' DT D 27 4.546 3.453 -25.712 1.00 44.79 C ATOM 2595 C4' DT D 27 5.038 2.936 -27.050 1.00 43.73 C ATOM 2596 O4' DT D 27 4.150 1.880 -27.532 1.00 40.33 O ATOM 2597 C3' DT D 27 5.069 4.035 -28.112 1.00 45.07 C ATOM 2598 O3' DT D 27 6.366 4.196 -28.644 1.00 45.82 O ATOM 2599 C2' DT D 27 4.079 3.553 -29.164 1.00 43.96 C ATOM 2600 C1' DT D 27 3.974 2.054 -28.909 1.00 40.23 C ATOM 2601 N1 DT D 27 2.668 1.509 -29.320 1.00 39.80 N ATOM 2602 C2 DT D 27 2.611 0.369 -30.091 1.00 41.34 C ATOM 2603 O2 DT D 27 3.623 -0.248 -30.445 1.00 42.11 O ATOM 2604 N3 DT D 27 1.331 -0.034 -30.426 1.00 37.60 N ATOM 2605 C4 DT D 27 0.156 0.590 -30.073 1.00 37.98 C ATOM 2606 O4 DT D 27 -0.940 0.155 -30.418 1.00 38.45 O ATOM 2607 C5 DT D 27 0.305 1.788 -29.274 1.00 39.06 C ATOM 2608 C7 DT D 27 -0.881 2.590 -28.809 1.00 37.52 C ATOM 2609 C6 DT D 27 1.533 2.177 -28.949 1.00 38.77 C TER 2610 DT D 27 HETATM 2611 O HOH A 99 16.017 3.764 -13.520 1.00 27.55 O HETATM 2612 O HOH A 100 6.756 21.816 14.370 1.00 30.97 O HETATM 2613 O HOH A 101 19.242 15.045 18.149 1.00 44.95 O HETATM 2614 O HOH A 102 16.978 -2.433 9.716 1.00 23.09 O HETATM 2615 O HOH B 99 26.236 19.155 -0.134 1.00 22.84 O HETATM 2616 O HOH B 100 13.339 22.153 -2.170 1.00 21.30 O HETATM 2617 O HOH B 101 24.899 13.783 4.961 1.00 22.06 O HETATM 2618 O HOH B 102 15.628 17.987 -3.184 1.00 6.66 O HETATM 2619 O HOH B 103 25.240 12.490 -2.112 1.00 19.92 O HETATM 2620 O HOH B 104 15.805 1.185 -2.720 1.00 24.86 O HETATM 2621 O HOH B 105 35.829 17.152 -10.049 1.00 39.75 O HETATM 2622 O HOH C 28 16.856 -0.777 37.497 1.00 44.91 O MASTER 417 0 0 9 4 0 0 6 2618 4 0 22 END
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Related entries of code: 3iv5
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3jr9
RCSB PDB
PDBbind
27aa, >3JR9_3|Chain... at 96%
3jrb
RCSB PDB
PDBbind
27aa, >3JRB_3|Chain... at 92%
3jrf
RCSB PDB
PDBbind
27aa, >3JRF_3|Chain... at 96%
4ihx
RCSB PDB
PDBbind
27aa, >4IHX_3|Chain... at 92%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
3jrc
RCSB PDB
PDBbind
27-mer
Entry Information
PDB ID
3iv5
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
DNA-binding protein fis
Ligand Name
27-mer
EC.Number
E.C.-.-.-.-
Resolution
2.9(Å)
Affinity (Kd/Ki/IC50)
Kd=0.2nM
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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