Browse entries in the PDBbind-CN Database
HEADER TRANSCRIPTION/DNA 29-OCT-08 3F27 TITLE STRUCTURE OF SOX17 BOUND TO DNA COMPND MOL_ID: 1; COMPND 2 MOLECULE: DNA (5'- COMPND 3 D(*DGP*DTP*DCP*DTP*DCP*DTP*DAP*DTP*DTP*DGP*DTP*DCP*DCP*DTP*DGP*DG)- COMPND 4 3'); COMPND 5 CHAIN: A; COMPND 6 ENGINEERED: YES; COMPND 7 OTHER_DETAILS: LAMA1; COMPND 8 MOL_ID: 2; COMPND 9 MOLECULE: DNA (5'- COMPND 10 D(*DCP*DCP*DAP*DGP*DGP*DAP*DCP*DAP*DAP*DTP*DAP*DGP*DAP*DGP*DAP*DC)- COMPND 11 3'); COMPND 12 CHAIN: B; COMPND 13 ENGINEERED: YES; COMPND 14 OTHER_DETAILS: LAMA1; COMPND 15 MOL_ID: 3; COMPND 16 MOLECULE: TRANSCRIPTION FACTOR SOX-17; COMPND 17 CHAIN: D; COMPND 18 FRAGMENT: HMG BOX, RESIDUES 66-144; COMPND 19 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 MOL_ID: 2; SOURCE 4 SYNTHETIC: YES; SOURCE 5 MOL_ID: 3; SOURCE 6 ORGANISM_SCIENTIFIC: MUS MUSCULUS; SOURCE 7 ORGANISM_COMMON: MOUSE; SOURCE 8 ORGANISM_TAXID: 10090; SOURCE 9 GENE: SOX-17, SOX17; SOURCE 10 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 11 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 12 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 13 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 14 EXPRESSION_SYSTEM_PLASMID: PETG20A KEYWDS PROTEIN-DNA COMPLEX, HMG DOMAIN, ENDODERMAL, ACTIVATOR, DNA-BINDING, KEYWDS 2 NUCLEUS, TRANSCRIPTION, TRANSCRIPTION REGULATION, TRANSCRIPTION-DNA KEYWDS 3 COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR P.PALASINGAM,R.JAUCH,C.K.L.NG,P.R.KOLATKAR REVDAT 3 13-JUL-11 3F27 1 VERSN REVDAT 2 28-APR-09 3F27 1 JRNL REVDAT 1 07-APR-09 3F27 0 JRNL AUTH P.PALASINGAM,R.JAUCH,C.K.L.NG,P.R.KOLATKAR JRNL TITL THE STRUCTURE OF SOX17 BOUND TO DNA REVEALS A CONSERVED JRNL TITL 2 BENDING TOPOLOGY BUT SELECTIVE PROTEIN INTERACTION PLATFORMS JRNL REF J.MOL.BIOL. V. 388 619 2009 JRNL REFN ISSN 0022-2836 JRNL PMID 19328208 JRNL DOI 10.1016/J.JMB.2009.03.055 REMARK 2 REMARK 2 RESOLUTION. 2.75 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) : 2.75 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 20.73 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.5 REMARK 3 NUMBER OF REFLECTIONS : 4703 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING + TEST SET) : 0.243 REMARK 3 R VALUE (WORKING SET) : 0.242 REMARK 3 FREE R VALUE : 0.265 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.600 REMARK 3 FREE R VALUE TEST SET COUNT : 228 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) : 2.75 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.82 REMARK 3 REFLECTION IN BIN (WORKING SET) : 328 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 100.00 REMARK 3 BIN R VALUE (WORKING SET) : 0.2530 REMARK 3 BIN FREE R VALUE SET COUNT : 24 REMARK 3 BIN FREE R VALUE : 0.4300 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 633 REMARK 3 NUCLEIC ACID ATOMS : 650 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 0 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) : 25.70 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 2.25000 REMARK 3 B22 (A**2) : 2.25000 REMARK 3 B33 (A**2) : -3.38000 REMARK 3 B12 (A**2) : 1.13000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): NULL REMARK 3 ESU BASED ON FREE R VALUE (A): 0.388 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.305 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 32.153 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.917 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.922 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 1376 ; 0.012 ; 0.021 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 1988 ; 1.861 ; 2.542 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 73 ; 4.808 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 36 ;37.735 ;21.944 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 128 ;21.173 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 10 ;27.490 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 211 ; 0.091 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 826 ; 0.006 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 492 ; 0.246 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): 847 ; 0.310 ; 0.200 REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 38 ; 0.159 ; 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): 23 ; 0.225 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 1 ; 0.214 ; 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): 386 ; 0.562 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 599 ; 1.004 ; 2.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 1330 ; 1.262 ; 3.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 1389 ; 1.977 ; 4.500 REMARK 3 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 NCS RESTRAINTS STATISTICS REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : 2 REMARK 3 REMARK 3 TLS GROUP : 1 REMARK 3 NUMBER OF COMPONENTS GROUP : 2 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 1 A 16 REMARK 3 RESIDUE RANGE : B 1 B 16 REMARK 3 ORIGIN FOR THE GROUP (A): 25.0085 -11.5796 -1.7137 REMARK 3 T TENSOR REMARK 3 T11: 0.0383 T22: 0.2546 REMARK 3 T33: 0.3792 T12: 0.1902 REMARK 3 T13: 0.1510 T23: 0.1423 REMARK 3 L TENSOR REMARK 3 L11: 2.3504 L22: 5.3848 REMARK 3 L33: 5.4475 L12: 1.6149 REMARK 3 L13: -1.3506 L23: 0.8553 REMARK 3 S TENSOR REMARK 3 S11: 0.0069 S12: 0.2600 S13: -0.8129 REMARK 3 S21: -0.4882 S22: -0.1643 S23: -1.2346 REMARK 3 S31: 0.3837 S32: 0.6207 S33: 0.1574 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 : D 67 D 141 REMARK 3 ORIGIN FOR THE GROUP (A): 13.1432 -4.6958 -0.9446 REMARK 3 T TENSOR REMARK 3 T11: -0.0439 T22: 0.2693 REMARK 3 T33: -0.0721 T12: 0.1113 REMARK 3 T13: 0.0220 T23: 0.0628 REMARK 3 L TENSOR REMARK 3 L11: 4.8203 L22: 5.8270 REMARK 3 L33: 4.1348 L12: 1.9245 REMARK 3 L13: -2.4766 L23: -1.5973 REMARK 3 S TENSOR REMARK 3 S11: -0.0770 S12: 0.5033 S13: -0.1479 REMARK 3 S21: -0.4991 S22: -0.2235 S23: -0.2488 REMARK 3 S31: 0.1549 S32: -0.3818 S33: 0.3005 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 3F27 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 04-NOV-08. REMARK 100 THE RCSB ID CODE IS RCSB050053. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : NULL REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 7.4 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N REMARK 200 RADIATION SOURCE : ROTATING ANODE REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : RIGAKU REMARK 200 MONOCHROMATIC OR LAUE (M/L) : NULL REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : PLATINUM REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : RIGAKU RAXIS REMARK 200 INTENSITY-INTEGRATION SOFTWARE : NULL REMARK 200 DATA SCALING SOFTWARE : SAINT REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 4970 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.750 REMARK 200 RESOLUTION RANGE LOW (A) : 66.330 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.9 REMARK 200 DATA REDUNDANCY : 9.860 REMARK 200 R MERGE (I) : 0.06900 REMARK 200 R SYM (I) : NULL REMARK 200
FOR THE DATA SET : 22.7500 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.75 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.85 REMARK 200 COMPLETENESS FOR SHELL (%) : NULL REMARK 200 DATA REDUNDANCY IN SHELL : 7.60 REMARK 200 R MERGE FOR SHELL (I) : 0.38700 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200
FOR SHELL : 3.750 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: NULL REMARK 200 STARTING MODEL: PDB ENTRY 1GT0 REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 45.96 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.28 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 30% PEG 3350, 0.2M MGCL2, PH 7.4, REMARK 280 VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 298K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 32 2 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+2/3 REMARK 290 3555 -X+Y,-X,Z+1/3 REMARK 290 4555 Y,X,-Z REMARK 290 5555 X-Y,-Y,-Z+1/3 REMARK 290 6555 -X,-X+Y,-Z+2/3 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 44.21933 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 22.10967 REMARK 290 SMTRY1 4 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 4 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 5 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 22.10967 REMARK 290 SMTRY1 6 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 44.21933 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1, 2, 3 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TRIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TRIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 4030 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 9820 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -10.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B, 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 350 REMARK 350 BIOMOLECULE: 2 REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 1390 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 6030 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -8.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 REMARK 350 BIOMOLECULE: 3 REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 APPLY THE FOLLOWING TO CHAINS: 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 GLY D 62 REMARK 465 SER D 63 REMARK 465 PHE D 64 REMARK 465 THR D 65 REMARK 465 SER D 66 REMARK 465 ARG D 67 REMARK 465 ARG D 142 REMARK 465 LYS D 143 REMARK 465 GLN D 144 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION REMARK 500 DG A 10 O3' DG A 10 C3' -0.072 REMARK 500 DC A 12 O3' DC A 12 C3' -0.040 REMARK 500 DT B 10 O3' DT B 10 C3' -0.038 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 DT A 2 C1' - O4' - C4' ANGL. DEV. = -7.4 DEGREES REMARK 500 DT A 2 O4' - C1' - N1 ANGL. DEV. = 6.9 DEGREES REMARK 500 DC A 3 O4' - C1' - N1 ANGL. DEV. = 7.4 DEGREES REMARK 500 DT A 4 O4' - C1' - N1 ANGL. DEV. = 2.4 DEGREES REMARK 500 DC A 5 O4' - C1' - N1 ANGL. DEV. = 1.8 DEGREES REMARK 500 DT A 6 O4' - C1' - N1 ANGL. DEV. = 4.4 DEGREES REMARK 500 DA A 7 O4' - C4' - C3' ANGL. DEV. = -3.6 DEGREES REMARK 500 DA A 7 C1' - O4' - C4' ANGL. DEV. = -7.8 DEGREES REMARK 500 DA A 7 O4' - C1' - N9 ANGL. DEV. = 4.8 DEGREES REMARK 500 DT A 9 O5' - C5' - C4' ANGL. DEV. = -5.5 DEGREES REMARK 500 DT A 11 C4 - C5 - C7 ANGL. DEV. = 5.5 DEGREES REMARK 500 DT A 11 C6 - C5 - C7 ANGL. DEV. = -5.8 DEGREES REMARK 500 DC B 2 C3' - C2' - C1' ANGL. DEV. = -6.4 DEGREES REMARK 500 DC B 2 O4' - C1' - N1 ANGL. DEV. = 1.9 DEGREES REMARK 500 DC B 1 C3' - O3' - P ANGL. DEV. = 8.0 DEGREES REMARK 500 DG B 5 O4' - C1' - N9 ANGL. DEV. = 6.3 DEGREES REMARK 500 DT B 10 O4' - C4' - C3' ANGL. DEV. = -3.2 DEGREES REMARK 500 DT B 10 O4' - C1' - N1 ANGL. DEV. = 2.4 DEGREES REMARK 500 DG B 14 O4' - C1' - N9 ANGL. DEV. = 1.8 DEGREES REMARK 500 DC B 16 O4' - C4' - C3' ANGL. DEV. = -2.5 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ARG D 70 152.43 -41.13 REMARK 500 GLU D 82 -38.55 -35.73 REMARK 500 REMARK 500 REMARK: NULL DBREF 3F27 A 1 16 PDB 3F27 3F27 1 16 DBREF 3F27 B 1 16 PDB 3F27 3F27 1 16 DBREF 3F27 D 66 144 UNP Q61473 SOX17_MOUSE 66 144 SEQADV 3F27 GLY D 62 UNP Q61473 EXPRESSION TAG SEQADV 3F27 SER D 63 UNP Q61473 EXPRESSION TAG SEQADV 3F27 PHE D 64 UNP Q61473 EXPRESSION TAG SEQADV 3F27 THR D 65 UNP Q61473 EXPRESSION TAG SEQRES 1 A 16 DG DT DC DT DC DT DA DT DT DG DT DC DC SEQRES 2 A 16 DT DG DG SEQRES 1 B 16 DC DC DA DG DG DA DC DA DA DT DA DG DA SEQRES 2 B 16 DG DA DC SEQRES 1 D 83 GLY SER PHE THR SER ARG ILE ARG ARG PRO MET ASN ALA SEQRES 2 D 83 PHE MET VAL TRP ALA LYS ASP GLU ARG LYS ARG LEU ALA SEQRES 3 D 83 GLN GLN ASN PRO ASP LEU HIS ASN ALA GLU LEU SER LYS SEQRES 4 D 83 MET LEU GLY LYS SER TRP LYS ALA LEU THR LEU ALA GLU SEQRES 5 D 83 LYS ARG PRO PHE VAL GLU GLU ALA GLU ARG LEU ARG VAL SEQRES 6 D 83 GLN HIS MET GLN ASP HIS PRO ASN TYR LYS TYR ARG PRO SEQRES 7 D 83 ARG ARG ARG LYS GLN HELIX 1 1 ASN D 73 ASN D 90 1 18 HELIX 2 2 HIS D 94 LEU D 109 1 16 HELIX 3 3 THR D 110 HIS D 132 1 23 CRYST1 68.753 68.753 66.329 90.00 90.00 120.00 P 32 2 1 6 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 0.014545 0.008397 0.000000 0.00000 SCALE2 0.000000 0.016795 0.000000 0.00000 SCALE3 0.000000 0.000000 0.015076 0.00000 ATOM 1 O5' DG A 1 29.136 -11.567 -30.626 1.00 33.53 O ATOM 2 C5' DG A 1 28.153 -11.816 -29.616 1.00 33.00 C ATOM 3 C4' DG A 1 28.750 -12.589 -28.456 1.00 33.36 C ATOM 4 O4' DG A 1 29.799 -11.803 -27.834 1.00 32.94 O ATOM 5 C3' DG A 1 27.796 -12.989 -27.326 1.00 34.13 C ATOM 6 O3' DG A 1 28.064 -14.351 -26.967 1.00 35.87 O ATOM 7 C2' DG A 1 28.185 -12.030 -26.202 1.00 33.62 C ATOM 8 C1' DG A 1 29.686 -12.035 -26.440 1.00 33.64 C ATOM 9 N9 DG A 1 30.504 -11.063 -25.714 1.00 33.80 N ATOM 10 C8 DG A 1 30.478 -9.688 -25.810 1.00 33.90 C ATOM 11 N7 DG A 1 31.358 -9.090 -25.048 1.00 33.81 N ATOM 12 C5 DG A 1 32.019 -10.134 -24.409 1.00 33.89 C ATOM 13 C6 DG A 1 33.082 -10.113 -23.465 1.00 33.67 C ATOM 14 O6 DG A 1 33.663 -9.128 -22.992 1.00 33.56 O ATOM 15 N1 DG A 1 33.463 -11.398 -23.066 1.00 33.60 N ATOM 16 C2 DG A 1 32.885 -12.558 -23.536 1.00 33.67 C ATOM 17 N2 DG A 1 33.367 -13.708 -23.046 1.00 33.89 N ATOM 18 N3 DG A 1 31.894 -12.593 -24.421 1.00 33.63 N ATOM 19 C4 DG A 1 31.510 -11.353 -24.816 1.00 33.82 C ATOM 20 P DT A 2 27.126 -15.217 -25.995 1.00 37.09 P ATOM 21 OP1 DT A 2 26.106 -15.876 -26.842 1.00 36.91 O ATOM 22 OP2 DT A 2 26.762 -14.380 -24.835 1.00 36.46 O ATOM 23 O5' DT A 2 28.067 -16.374 -25.425 1.00 38.69 O ATOM 24 C5' DT A 2 27.563 -17.219 -24.394 1.00 39.68 C ATOM 25 C4' DT A 2 27.977 -16.717 -23.023 1.00 40.41 C ATOM 26 O4' DT A 2 28.821 -15.540 -23.115 1.00 39.96 O ATOM 27 C3' DT A 2 26.824 -16.322 -22.085 1.00 42.10 C ATOM 28 O3' DT A 2 26.581 -17.281 -21.056 1.00 43.62 O ATOM 29 C2' DT A 2 27.295 -15.026 -21.435 1.00 42.11 C ATOM 30 C1' DT A 2 28.781 -15.028 -21.803 1.00 41.28 C ATOM 31 N1 DT A 2 29.419 -13.688 -21.622 1.00 41.37 N ATOM 32 C2 DT A 2 30.404 -13.558 -20.658 1.00 41.43 C ATOM 33 O2 DT A 2 30.799 -14.482 -19.960 1.00 41.16 O ATOM 34 N3 DT A 2 30.915 -12.285 -20.540 1.00 41.50 N ATOM 35 C4 DT A 2 30.544 -11.157 -21.264 1.00 41.21 C ATOM 36 O4 DT A 2 31.069 -10.062 -21.074 1.00 40.93 O ATOM 37 C5 DT A 2 29.494 -11.360 -22.244 1.00 41.18 C ATOM 38 C7 DT A 2 28.747 -10.179 -22.799 1.00 40.19 C ATOM 39 C6 DT A 2 28.994 -12.603 -22.374 1.00 41.31 C ATOM 40 P DC A 3 27.743 -18.234 -20.491 1.00 44.80 P ATOM 41 OP1 DC A 3 28.958 -17.420 -20.265 1.00 45.14 O ATOM 42 OP2 DC A 3 27.816 -19.434 -21.365 1.00 44.44 O ATOM 43 O5' DC A 3 27.202 -18.647 -19.048 1.00 44.04 O ATOM 44 C5' DC A 3 27.137 -17.653 -18.061 1.00 43.59 C ATOM 45 C4' DC A 3 28.463 -17.515 -17.336 1.00 42.88 C ATOM 46 O4' DC A 3 29.218 -16.403 -17.896 1.00 41.61 O ATOM 47 C3' DC A 3 28.214 -17.203 -15.867 1.00 43.50 C ATOM 48 O3' DC A 3 29.179 -17.787 -14.992 1.00 43.51 O ATOM 49 C2' DC A 3 28.329 -15.689 -15.867 1.00 43.50 C ATOM 50 C1' DC A 3 29.458 -15.466 -16.864 1.00 43.06 C ATOM 51 N1 DC A 3 29.405 -14.023 -17.271 1.00 43.37 N ATOM 52 C2 DC A 3 30.357 -13.117 -16.754 1.00 43.62 C ATOM 53 O2 DC A 3 31.259 -13.521 -16.005 1.00 43.56 O ATOM 54 N3 DC A 3 30.278 -11.802 -17.103 1.00 43.48 N ATOM 55 C4 DC A 3 29.297 -11.384 -17.913 1.00 43.25 C ATOM 56 N4 DC A 3 29.262 -10.088 -18.232 1.00 42.97 N ATOM 57 C5 DC A 3 28.310 -12.281 -18.434 1.00 43.42 C ATOM 58 C6 DC A 3 28.393 -13.573 -18.081 1.00 43.39 C ATOM 59 P DT A 4 29.343 -17.251 -13.479 1.00 42.40 P ATOM 60 OP1 DT A 4 29.992 -18.348 -12.725 1.00 42.94 O ATOM 61 OP2 DT A 4 28.057 -16.662 -13.013 1.00 42.16 O ATOM 62 O5' DT A 4 30.417 -16.067 -13.603 1.00 40.93 O ATOM 63 C5' DT A 4 31.732 -16.199 -13.047 1.00 37.91 C ATOM 64 C4' DT A 4 32.039 -15.064 -12.080 1.00 35.75 C ATOM 65 O4' DT A 4 31.712 -13.778 -12.678 1.00 33.47 O ATOM 66 C3' DT A 4 31.300 -15.091 -10.742 1.00 35.42 C ATOM 67 O3' DT A 4 32.232 -14.562 -9.795 1.00 37.31 O ATOM 68 C2' DT A 4 30.080 -14.219 -11.035 1.00 32.13 C ATOM 69 C1' DT A 4 30.721 -13.130 -11.897 1.00 29.88 C ATOM 70 N1 DT A 4 29.793 -12.297 -12.782 1.00 28.26 N ATOM 71 C2 DT A 4 30.084 -10.954 -12.963 1.00 27.30 C ATOM 72 O2 DT A 4 31.054 -10.389 -12.464 1.00 26.64 O ATOM 73 N3 DT A 4 29.190 -10.286 -13.772 1.00 26.57 N ATOM 74 C4 DT A 4 28.065 -10.791 -14.410 1.00 26.73 C ATOM 75 O4 DT A 4 27.337 -10.090 -15.117 1.00 26.34 O ATOM 76 C5 DT A 4 27.816 -12.196 -14.185 1.00 26.25 C ATOM 77 C7 DT A 4 26.646 -12.880 -14.855 1.00 24.95 C ATOM 78 C6 DT A 4 28.680 -12.866 -13.397 1.00 27.39 C ATOM 79 P DC A 5 31.887 -13.916 -8.367 1.00 39.66 P ATOM 80 OP1 DC A 5 32.194 -14.931 -7.332 1.00 38.42 O ATOM 81 OP2 DC A 5 30.550 -13.246 -8.347 1.00 39.97 O ATOM 82 O5' DC A 5 33.011 -12.754 -8.365 1.00 39.67 O ATOM 83 C5' DC A 5 33.012 -11.685 -9.368 1.00 37.92 C ATOM 84 C4' DC A 5 32.787 -10.283 -8.804 1.00 35.71 C ATOM 85 O4' DC A 5 31.820 -9.534 -9.593 1.00 34.66 O ATOM 86 C3' DC A 5 32.296 -10.188 -7.359 1.00 36.24 C ATOM 87 O3' DC A 5 33.211 -9.278 -6.714 1.00 37.65 O ATOM 88 C2' DC A 5 30.816 -9.761 -7.430 1.00 33.64 C ATOM 89 C1' DC A 5 30.690 -9.122 -8.818 1.00 30.88 C ATOM 90 N1 DC A 5 29.383 -9.357 -9.615 1.00 29.35 N ATOM 91 C2 DC A 5 28.865 -8.285 -10.385 1.00 27.95 C ATOM 92 O2 DC A 5 29.461 -7.205 -10.377 1.00 27.07 O ATOM 93 N3 DC A 5 27.723 -8.440 -11.117 1.00 26.35 N ATOM 94 C4 DC A 5 27.096 -9.619 -11.097 1.00 27.59 C ATOM 95 N4 DC A 5 25.988 -9.707 -11.834 1.00 27.00 N ATOM 96 C5 DC A 5 27.584 -10.741 -10.331 1.00 27.31 C ATOM 97 C6 DC A 5 28.716 -10.570 -9.617 1.00 28.50 C ATOM 98 P DT A 6 32.802 -8.116 -5.692 1.00 38.40 P ATOM 99 OP1 DT A 6 34.099 -7.547 -5.223 1.00 37.08 O ATOM 100 OP2 DT A 6 31.786 -8.641 -4.730 1.00 37.69 O ATOM 101 O5' DT A 6 32.051 -7.060 -6.657 1.00 36.97 O ATOM 102 C5' DT A 6 32.352 -5.652 -6.703 1.00 34.25 C ATOM 103 C4' DT A 6 31.064 -4.861 -6.641 1.00 32.93 C ATOM 104 O4' DT A 6 30.074 -5.511 -7.478 1.00 32.31 O ATOM 105 C3' DT A 6 30.447 -4.824 -5.243 1.00 32.80 C ATOM 106 O3' DT A 6 30.344 -3.508 -4.761 1.00 32.38 O ATOM 107 C2' DT A 6 29.035 -5.356 -5.416 1.00 32.71 C ATOM 108 C1' DT A 6 28.803 -5.279 -6.913 1.00 31.72 C ATOM 109 N1 DT A 6 27.783 -6.289 -7.350 1.00 31.48 N ATOM 110 C2 DT A 6 26.728 -5.885 -8.131 1.00 30.58 C ATOM 111 O2 DT A 6 26.598 -4.751 -8.505 1.00 31.06 O ATOM 112 N3 DT A 6 25.825 -6.852 -8.472 1.00 30.73 N ATOM 113 C4 DT A 6 25.869 -8.181 -8.097 1.00 31.69 C ATOM 114 O4 DT A 6 25.002 -8.961 -8.471 1.00 31.93 O ATOM 115 C5 DT A 6 26.992 -8.566 -7.260 1.00 32.16 C ATOM 116 C7 DT A 6 27.147 -9.967 -6.715 1.00 32.88 C ATOM 117 C6 DT A 6 27.871 -7.605 -6.928 1.00 32.57 C ATOM 118 P DA A 7 31.414 -2.938 -3.724 1.00 33.34 P ATOM 119 OP1 DA A 7 32.160 -1.857 -4.415 1.00 31.06 O ATOM 120 OP2 DA A 7 32.064 -4.113 -3.078 1.00 33.13 O ATOM 121 O5' DA A 7 30.551 -2.273 -2.541 1.00 32.92 O ATOM 122 C5' DA A 7 29.648 -1.208 -2.756 1.00 28.71 C ATOM 123 C4' DA A 7 28.234 -1.688 -2.517 1.00 25.96 C ATOM 124 O4' DA A 7 27.914 -2.831 -3.335 1.00 25.64 O ATOM 125 C3' DA A 7 27.947 -2.234 -1.136 1.00 24.45 C ATOM 126 O3' DA A 7 27.623 -1.151 -0.321 1.00 22.60 O ATOM 127 C2' DA A 7 26.708 -3.085 -1.376 1.00 24.86 C ATOM 128 C1' DA A 7 26.628 -3.157 -2.901 1.00 26.52 C ATOM 129 N9 DA A 7 26.183 -4.462 -3.366 1.00 27.10 N ATOM 130 C8 DA A 7 26.621 -5.683 -2.940 1.00 27.65 C ATOM 131 N7 DA A 7 26.002 -6.684 -3.506 1.00 28.19 N ATOM 132 C5 DA A 7 25.084 -6.083 -4.354 1.00 27.89 C ATOM 133 C6 DA A 7 24.120 -6.603 -5.255 1.00 28.10 C ATOM 134 N6 DA A 7 23.918 -7.916 -5.462 1.00 27.69 N ATOM 135 N1 DA A 7 23.368 -5.718 -5.954 1.00 27.37 N ATOM 136 C2 DA A 7 23.580 -4.414 -5.765 1.00 27.25 C ATOM 137 N3 DA A 7 24.447 -3.808 -4.955 1.00 27.62 N ATOM 138 C4 DA A 7 25.178 -4.709 -4.270 1.00 27.88 C ATOM 139 P DT A 8 27.403 -1.320 1.253 1.00 21.33 P ATOM 140 OP1 DT A 8 28.006 -0.131 1.875 1.00 22.51 O ATOM 141 OP2 DT A 8 27.728 -2.679 1.720 1.00 22.11 O ATOM 142 O5' DT A 8 25.811 -1.261 1.397 1.00 21.88 O ATOM 143 C5' DT A 8 25.089 -0.082 1.130 1.00 20.64 C ATOM 144 C4' DT A 8 23.656 -0.476 0.944 1.00 21.02 C ATOM 145 O4' DT A 8 23.553 -1.471 -0.102 1.00 21.03 O ATOM 146 C3' DT A 8 23.124 -1.183 2.163 1.00 21.92 C ATOM 147 O3' DT A 8 22.725 -0.207 3.118 1.00 20.84 O ATOM 148 C2' DT A 8 22.006 -2.067 1.585 1.00 21.96 C ATOM 149 C1' DT A 8 22.357 -2.202 0.102 1.00 21.74 C ATOM 150 N1 DT A 8 22.556 -3.568 -0.497 1.00 21.80 N ATOM 151 C2 DT A 8 21.683 -4.062 -1.459 1.00 21.70 C ATOM 152 O2 DT A 8 20.704 -3.469 -1.835 1.00 23.32 O ATOM 153 N3 DT A 8 21.944 -5.300 -1.961 1.00 21.05 N ATOM 154 C4 DT A 8 23.041 -6.075 -1.617 1.00 23.85 C ATOM 155 O4 DT A 8 23.247 -7.187 -2.111 1.00 23.72 O ATOM 156 C5 DT A 8 23.937 -5.508 -0.626 1.00 24.00 C ATOM 157 C7 DT A 8 25.014 -6.354 0.009 1.00 23.61 C ATOM 158 C6 DT A 8 23.647 -4.297 -0.130 1.00 23.30 C ATOM 159 P DT A 9 22.533 -0.707 4.603 1.00 22.06 P ATOM 160 OP1 DT A 9 22.537 0.417 5.563 1.00 25.91 O ATOM 161 OP2 DT A 9 23.390 -1.858 4.860 1.00 24.64 O ATOM 162 O5' DT A 9 21.024 -1.264 4.497 1.00 23.34 O ATOM 163 C5' DT A 9 19.915 -0.401 4.614 1.00 18.06 C ATOM 164 C4' DT A 9 18.749 -1.328 4.727 1.00 19.15 C ATOM 165 O4' DT A 9 18.926 -2.460 3.851 1.00 20.16 O ATOM 166 C3' DT A 9 18.579 -1.916 6.122 1.00 19.19 C ATOM 167 O3' DT A 9 17.260 -1.569 6.468 1.00 20.14 O ATOM 168 C2' DT A 9 18.801 -3.428 6.016 1.00 17.89 C ATOM 169 C1' DT A 9 18.630 -3.690 4.534 1.00 19.25 C ATOM 170 N1 DT A 9 19.495 -4.705 3.888 1.00 18.53 N ATOM 171 C2 DT A 9 18.895 -5.690 3.150 1.00 19.88 C ATOM 172 O2 DT A 9 17.696 -5.826 3.036 1.00 21.02 O ATOM 173 N3 DT A 9 19.757 -6.557 2.534 1.00 20.59 N ATOM 174 C4 DT A 9 21.141 -6.552 2.569 1.00 19.76 C ATOM 175 O4 DT A 9 21.800 -7.398 1.960 1.00 20.22 O ATOM 176 C5 DT A 9 21.734 -5.496 3.355 1.00 19.20 C ATOM 177 C7 DT A 9 23.180 -5.618 3.771 1.00 15.55 C ATOM 178 C6 DT A 9 20.883 -4.620 3.945 1.00 18.76 C ATOM 179 P DG A 10 16.609 -2.110 7.805 1.00 24.49 P ATOM 180 OP1 DG A 10 15.476 -1.218 8.197 1.00 24.89 O ATOM 181 OP2 DG A 10 17.763 -2.331 8.761 1.00 25.13 O ATOM 182 O5' DG A 10 15.988 -3.512 7.347 1.00 19.93 O ATOM 183 C5' DG A 10 14.763 -3.620 6.642 1.00 20.71 C ATOM 184 C4' DG A 10 14.473 -5.112 6.462 1.00 22.76 C ATOM 185 O4' DG A 10 15.578 -5.830 5.805 1.00 21.86 O ATOM 186 C3' DG A 10 14.199 -5.831 7.782 1.00 19.05 C ATOM 187 O3' DG A 10 13.169 -6.664 7.536 1.00 17.83 O ATOM 188 C2' DG A 10 15.484 -6.613 7.992 1.00 19.77 C ATOM 189 C1' DG A 10 15.903 -6.964 6.578 1.00 20.99 C ATOM 190 N9 DG A 10 17.330 -7.272 6.391 1.00 21.91 N ATOM 191 C8 DG A 10 18.421 -6.671 6.977 1.00 21.19 C ATOM 192 N7 DG A 10 19.572 -7.172 6.601 1.00 20.70 N ATOM 193 C5 DG A 10 19.208 -8.173 5.696 1.00 20.77 C ATOM 194 C6 DG A 10 20.014 -9.071 4.948 1.00 21.17 C ATOM 195 O6 DG A 10 21.260 -9.170 4.950 1.00 21.91 O ATOM 196 N1 DG A 10 19.258 -9.922 4.148 1.00 20.02 N ATOM 197 C2 DG A 10 17.895 -9.954 4.107 1.00 20.14 C ATOM 198 N2 DG A 10 17.352 -10.857 3.281 1.00 19.07 N ATOM 199 N3 DG A 10 17.125 -9.118 4.803 1.00 21.70 N ATOM 200 C4 DG A 10 17.846 -8.256 5.567 1.00 21.01 C ATOM 201 P DT A 11 12.201 -7.279 8.656 1.00 20.51 P ATOM 202 OP1 DT A 11 10.790 -7.115 8.199 1.00 22.59 O ATOM 203 OP2 DT A 11 12.616 -6.884 10.002 1.00 20.76 O ATOM 204 O5' DT A 11 12.516 -8.829 8.479 1.00 20.02 O ATOM 205 C5' DT A 11 12.142 -9.514 7.289 1.00 15.29 C ATOM 206 C4' DT A 11 12.714 -10.918 7.358 1.00 16.73 C ATOM 207 O4' DT A 11 14.139 -10.883 7.040 1.00 17.84 O ATOM 208 C3' DT A 11 12.625 -11.650 8.696 1.00 15.29 C ATOM 209 O3' DT A 11 12.328 -12.987 8.403 1.00 15.93 O ATOM 210 C2' DT A 11 14.046 -11.525 9.215 1.00 16.57 C ATOM 211 C1' DT A 11 14.840 -11.716 7.918 1.00 18.05 C ATOM 212 N1 DT A 11 16.296 -11.313 7.963 1.00 18.69 N ATOM 213 C2 DT A 11 17.238 -11.964 7.201 1.00 19.02 C ATOM 214 O2 DT A 11 16.943 -12.869 6.462 1.00 19.77 O ATOM 215 N3 DT A 11 18.543 -11.523 7.322 1.00 19.87 N ATOM 216 C4 DT A 11 19.015 -10.493 8.144 1.00 19.10 C ATOM 217 O4 DT A 11 20.214 -10.171 8.155 1.00 16.28 O ATOM 218 C5 DT A 11 17.955 -9.833 8.922 1.00 19.25 C ATOM 219 C7 DT A 11 18.180 -8.678 9.856 1.00 15.70 C ATOM 220 C6 DT A 11 16.688 -10.275 8.784 1.00 20.32 C ATOM 221 P DC A 12 11.603 -13.986 9.414 1.00 17.82 P ATOM 222 OP1 DC A 12 10.217 -14.262 8.953 1.00 18.38 O ATOM 223 OP2 DC A 12 11.859 -13.534 10.813 1.00 15.37 O ATOM 224 O5' DC A 12 12.432 -15.307 9.093 1.00 18.54 O ATOM 225 C5' DC A 12 12.317 -15.970 7.862 1.00 18.54 C ATOM 226 C4' DC A 12 13.651 -16.664 7.673 1.00 20.60 C ATOM 227 O4' DC A 12 14.749 -15.713 7.786 1.00 20.97 O ATOM 228 C3' DC A 12 13.907 -17.678 8.755 1.00 18.72 C ATOM 229 O3' DC A 12 13.754 -18.896 8.127 1.00 17.67 O ATOM 230 C2' DC A 12 15.344 -17.412 9.212 1.00 18.77 C ATOM 231 C1' DC A 12 15.892 -16.387 8.222 1.00 19.55 C ATOM 232 N1 DC A 12 16.817 -15.386 8.872 1.00 20.13 N ATOM 233 C2 DC A 12 18.175 -15.365 8.568 1.00 19.94 C ATOM 234 O2 DC A 12 18.618 -16.162 7.745 1.00 21.85 O ATOM 235 N3 DC A 12 18.997 -14.483 9.180 1.00 20.35 N ATOM 236 C4 DC A 12 18.502 -13.637 10.069 1.00 21.24 C ATOM 237 N4 DC A 12 19.352 -12.786 10.640 1.00 20.42 N ATOM 238 C5 DC A 12 17.117 -13.627 10.411 1.00 21.90 C ATOM 239 C6 DC A 12 16.329 -14.508 9.796 1.00 21.46 C ATOM 240 P DC A 13 14.105 -20.184 8.986 1.00 19.55 P ATOM 241 OP1 DC A 13 13.437 -21.333 8.343 1.00 20.76 O ATOM 242 OP2 DC A 13 13.858 -19.883 10.422 1.00 19.49 O ATOM 243 O5' DC A 13 15.672 -20.351 8.788 1.00 17.71 O ATOM 244 C5' DC A 13 16.192 -20.563 7.499 1.00 17.80 C ATOM 245 C4' DC A 13 17.648 -20.961 7.632 1.00 19.12 C ATOM 246 O4' DC A 13 18.452 -19.891 8.196 1.00 19.73 O ATOM 247 C3' DC A 13 17.881 -22.124 8.563 1.00 19.44 C ATOM 248 O3' DC A 13 18.975 -22.802 8.010 1.00 20.38 O ATOM 249 C2' DC A 13 18.208 -21.428 9.881 1.00 19.67 C ATOM 250 C1' DC A 13 19.107 -20.328 9.359 1.00 20.36 C ATOM 251 N1 DC A 13 19.226 -19.134 10.212 1.00 21.71 N ATOM 252 C2 DC A 13 20.466 -18.488 10.355 1.00 22.52 C ATOM 253 O2 DC A 13 21.474 -18.935 9.784 1.00 21.73 O ATOM 254 N3 DC A 13 20.524 -17.371 11.136 1.00 22.33 N ATOM 255 C4 DC A 13 19.427 -16.902 11.753 1.00 22.20 C ATOM 256 N4 DC A 13 19.542 -15.805 12.526 1.00 22.91 N ATOM 257 C5 DC A 13 18.163 -17.533 11.608 1.00 22.03 C ATOM 258 C6 DC A 13 18.120 -18.627 10.835 1.00 23.30 C ATOM 259 P DT A 14 19.397 -24.273 8.483 1.00 21.54 P ATOM 260 OP1 DT A 14 19.837 -24.959 7.242 1.00 21.08 O ATOM 261 OP2 DT A 14 18.388 -24.860 9.409 1.00 18.85 O ATOM 262 O5' DT A 14 20.724 -23.933 9.262 1.00 20.52 O ATOM 263 C5' DT A 14 21.698 -23.289 8.443 1.00 21.08 C ATOM 264 C4' DT A 14 23.025 -23.345 9.149 1.00 20.91 C ATOM 265 O4' DT A 14 23.166 -22.192 10.011 1.00 19.65 O ATOM 266 C3' DT A 14 23.171 -24.548 10.061 1.00 21.49 C ATOM 267 O3' DT A 14 24.549 -24.729 10.195 1.00 23.26 O ATOM 268 C2' DT A 14 22.557 -24.057 11.370 1.00 21.19 C ATOM 269 C1' DT A 14 23.088 -22.616 11.360 1.00 21.53 C ATOM 270 N1 DT A 14 22.349 -21.578 12.158 1.00 21.51 N ATOM 271 C2 DT A 14 23.109 -20.513 12.574 1.00 21.73 C ATOM 272 O2 DT A 14 24.293 -20.392 12.323 1.00 22.22 O ATOM 273 N3 DT A 14 22.433 -19.578 13.300 1.00 21.64 N ATOM 274 C4 DT A 14 21.102 -19.600 13.655 1.00 21.16 C ATOM 275 O4 DT A 14 20.644 -18.678 14.322 1.00 21.50 O ATOM 276 C5 DT A 14 20.340 -20.745 13.192 1.00 21.02 C ATOM 277 C7 DT A 14 18.868 -20.859 13.479 1.00 20.37 C ATOM 278 C6 DT A 14 20.996 -21.673 12.472 1.00 21.36 C ATOM 279 P DG A 15 25.124 -26.173 10.505 1.00 24.24 P ATOM 280 OP1 DG A 15 25.138 -26.862 9.197 1.00 24.37 O ATOM 281 OP2 DG A 15 24.374 -26.788 11.638 1.00 22.71 O ATOM 282 O5' DG A 15 26.616 -25.781 10.974 1.00 24.99 O ATOM 283 C5' DG A 15 27.569 -25.199 10.071 1.00 25.39 C ATOM 284 C4' DG A 15 28.582 -24.325 10.784 1.00 25.29 C ATOM 285 O4' DG A 15 27.912 -23.291 11.537 1.00 26.67 O ATOM 286 C3' DG A 15 29.423 -25.055 11.800 1.00 24.95 C ATOM 287 O3' DG A 15 30.719 -24.503 11.842 1.00 22.95 O ATOM 288 C2' DG A 15 28.669 -24.827 13.112 1.00 26.55 C ATOM 289 C1' DG A 15 28.139 -23.428 12.926 1.00 28.74 C ATOM 290 N9 DG A 15 26.850 -23.212 13.576 1.00 30.36 N ATOM 291 C8 DG A 15 25.735 -24.007 13.434 1.00 30.63 C ATOM 292 N7 DG A 15 24.694 -23.591 14.110 1.00 30.94 N ATOM 293 C5 DG A 15 25.137 -22.436 14.740 1.00 30.56 C ATOM 294 C6 DG A 15 24.436 -21.556 15.608 1.00 30.10 C ATOM 295 O6 DG A 15 23.256 -21.646 15.980 1.00 29.71 O ATOM 296 N1 DG A 15 25.242 -20.498 16.050 1.00 29.91 N ATOM 297 C2 DG A 15 26.558 -20.317 15.685 1.00 29.89 C ATOM 298 N2 DG A 15 27.171 -19.245 16.206 1.00 30.01 N ATOM 299 N3 DG A 15 27.223 -21.130 14.863 1.00 30.28 N ATOM 300 C4 DG A 15 26.461 -22.176 14.423 1.00 30.88 C ATOM 301 P DG A 16 31.770 -25.142 12.868 1.00 21.60 P ATOM 302 OP1 DG A 16 33.124 -25.091 12.275 1.00 21.47 O ATOM 303 OP2 DG A 16 31.239 -26.458 13.262 1.00 21.60 O ATOM 304 O5' DG A 16 31.710 -24.182 14.147 1.00 20.97 O ATOM 305 C5' DG A 16 32.557 -24.501 15.250 1.00 21.94 C ATOM 306 C4' DG A 16 32.651 -23.379 16.267 1.00 22.35 C ATOM 307 O4' DG A 16 31.378 -22.708 16.319 1.00 23.41 O ATOM 308 C3' DG A 16 32.992 -23.806 17.694 1.00 23.31 C ATOM 309 O3' DG A 16 34.103 -23.067 18.196 1.00 22.98 O ATOM 310 C2' DG A 16 31.729 -23.540 18.518 1.00 23.48 C ATOM 311 C1' DG A 16 30.829 -22.704 17.619 1.00 23.98 C ATOM 312 N9 DG A 16 29.449 -23.189 17.506 1.00 24.71 N ATOM 313 C8 DG A 16 29.017 -24.307 16.818 1.00 24.84 C ATOM 314 N7 DG A 16 27.725 -24.496 16.882 1.00 24.98 N ATOM 315 C5 DG A 16 27.259 -23.434 17.660 1.00 24.43 C ATOM 316 C6 DG A 16 25.937 -23.108 18.083 1.00 23.93 C ATOM 317 O6 DG A 16 24.885 -23.709 17.837 1.00 24.09 O ATOM 318 N1 DG A 16 25.885 -21.948 18.865 1.00 24.16 N ATOM 319 C2 DG A 16 26.995 -21.197 19.209 1.00 24.56 C ATOM 320 N2 DG A 16 26.762 -20.106 19.969 1.00 24.44 N ATOM 321 N3 DG A 16 28.244 -21.497 18.827 1.00 23.94 N ATOM 322 C4 DG A 16 28.308 -22.620 18.052 1.00 24.29 C TER 323 DG A 16 ATOM 324 O5' DC B 1 20.091 -19.337 26.196 1.00 35.86 O ATOM 325 C5' DC B 1 19.794 -18.761 24.895 1.00 34.16 C ATOM 326 C4' DC B 1 20.929 -17.847 24.438 1.00 34.11 C ATOM 327 O4' DC B 1 21.888 -18.546 23.599 1.00 33.41 O ATOM 328 C3' DC B 1 20.555 -16.601 23.638 1.00 33.86 C ATOM 329 O3' DC B 1 21.480 -15.614 24.119 1.00 34.44 O ATOM 330 C2' DC B 1 20.718 -17.070 22.191 1.00 32.77 C ATOM 331 C1' DC B 1 21.923 -18.001 22.292 1.00 32.96 C ATOM 332 N1 DC B 1 21.968 -19.200 21.407 1.00 32.94 N ATOM 333 C2 DC B 1 23.217 -19.645 20.917 1.00 32.90 C ATOM 334 O2 DC B 1 24.247 -19.024 21.202 1.00 33.90 O ATOM 335 N3 DC B 1 23.276 -20.756 20.139 1.00 32.95 N ATOM 336 C4 DC B 1 22.142 -21.415 19.839 1.00 33.66 C ATOM 337 N4 DC B 1 22.248 -22.502 19.060 1.00 32.96 N ATOM 338 C5 DC B 1 20.852 -20.980 20.325 1.00 34.05 C ATOM 339 C6 DC B 1 20.814 -19.884 21.104 1.00 33.92 C ATOM 340 P DC B 2 22.193 -14.456 23.284 1.00 34.68 P ATOM 341 OP1 DC B 2 22.662 -13.481 24.295 1.00 34.67 O ATOM 342 OP2 DC B 2 21.310 -13.993 22.180 1.00 33.87 O ATOM 343 O5' DC B 2 23.451 -15.243 22.677 1.00 36.08 O ATOM 344 C5' DC B 2 24.749 -14.624 22.614 1.00 37.56 C ATOM 345 C4' DC B 2 25.286 -14.565 21.196 1.00 36.77 C ATOM 346 O4' DC B 2 24.976 -15.785 20.464 1.00 36.50 O ATOM 347 C3' DC B 2 24.705 -13.446 20.339 1.00 36.49 C ATOM 348 O3' DC B 2 25.727 -13.043 19.435 1.00 37.97 O ATOM 349 C2' DC B 2 23.569 -14.130 19.592 1.00 34.38 C ATOM 350 C1' DC B 2 24.343 -15.393 19.246 1.00 33.96 C ATOM 351 N1 DC B 2 23.572 -16.540 18.671 1.00 33.04 N ATOM 352 C2 DC B 2 24.288 -17.580 18.028 1.00 32.69 C ATOM 353 O2 DC B 2 25.530 -17.535 17.949 1.00 32.90 O ATOM 354 N3 DC B 2 23.606 -18.627 17.496 1.00 31.55 N ATOM 355 C4 DC B 2 22.277 -18.669 17.591 1.00 32.01 C ATOM 356 N4 DC B 2 21.666 -19.725 17.051 1.00 32.14 N ATOM 357 C5 DC B 2 21.527 -17.625 18.238 1.00 33.00 C ATOM 358 C6 DC B 2 22.206 -16.585 18.760 1.00 32.72 C ATOM 359 P DA B 3 26.217 -11.523 19.396 1.00 38.23 P ATOM 360 OP1 DA B 3 26.513 -11.077 20.784 1.00 39.24 O ATOM 361 OP2 DA B 3 25.231 -10.838 18.523 1.00 37.65 O ATOM 362 O5' DA B 3 27.646 -11.572 18.678 1.00 37.68 O ATOM 363 C5' DA B 3 28.570 -12.651 18.894 1.00 36.56 C ATOM 364 C4' DA B 3 29.050 -13.149 17.533 1.00 34.67 C ATOM 365 O4' DA B 3 28.079 -14.060 16.964 1.00 33.66 O ATOM 366 C3' DA B 3 29.201 -12.097 16.439 1.00 33.66 C ATOM 367 O3' DA B 3 30.136 -12.586 15.472 1.00 33.52 O ATOM 368 C2' DA B 3 27.790 -12.013 15.849 1.00 32.77 C ATOM 369 C1' DA B 3 27.504 -13.503 15.785 1.00 30.86 C ATOM 370 N9 DA B 3 26.104 -13.906 15.722 1.00 30.16 N ATOM 371 C8 DA B 3 24.990 -13.240 16.153 1.00 30.02 C ATOM 372 N7 DA B 3 23.879 -13.915 15.951 1.00 30.10 N ATOM 373 C5 DA B 3 24.288 -15.098 15.349 1.00 29.21 C ATOM 374 C6 DA B 3 23.607 -16.241 14.872 1.00 29.00 C ATOM 375 N6 DA B 3 22.288 -16.414 14.927 1.00 29.32 N ATOM 376 N1 DA B 3 24.333 -17.234 14.320 1.00 29.74 N ATOM 377 C2 DA B 3 25.664 -17.105 14.251 1.00 30.23 C ATOM 378 N3 DA B 3 26.418 -16.083 14.663 1.00 29.83 N ATOM 379 C4 DA B 3 25.661 -15.102 15.202 1.00 29.87 C ATOM 380 P DG B 4 30.843 -11.620 14.404 1.00 33.65 P ATOM 381 OP1 DG B 4 32.304 -11.732 14.682 1.00 33.79 O ATOM 382 OP2 DG B 4 30.123 -10.322 14.342 1.00 31.25 O ATOM 383 O5' DG B 4 30.609 -12.312 12.996 1.00 34.04 O ATOM 384 C5' DG B 4 31.252 -13.542 12.724 1.00 33.78 C ATOM 385 C4' DG B 4 30.332 -14.254 11.769 1.00 33.58 C ATOM 386 O4' DG B 4 28.980 -14.233 12.289 1.00 33.95 O ATOM 387 C3' DG B 4 30.251 -13.509 10.449 1.00 33.68 C ATOM 388 O3' DG B 4 30.576 -14.440 9.445 1.00 33.46 O ATOM 389 C2' DG B 4 28.811 -12.984 10.366 1.00 33.37 C ATOM 390 C1' DG B 4 28.130 -14.072 11.178 1.00 34.03 C ATOM 391 N9 DG B 4 26.789 -13.785 11.639 1.00 33.86 N ATOM 392 C8 DG B 4 26.364 -12.687 12.346 1.00 34.63 C ATOM 393 N7 DG B 4 25.088 -12.696 12.616 1.00 34.43 N ATOM 394 C5 DG B 4 24.628 -13.887 12.057 1.00 35.17 C ATOM 395 C6 DG B 4 23.313 -14.461 12.030 1.00 35.15 C ATOM 396 O6 DG B 4 22.246 -14.026 12.518 1.00 34.25 O ATOM 397 N1 DG B 4 23.299 -15.687 11.356 1.00 34.51 N ATOM 398 C2 DG B 4 24.399 -16.285 10.780 1.00 34.43 C ATOM 399 N2 DG B 4 24.160 -17.457 10.180 1.00 34.14 N ATOM 400 N3 DG B 4 25.634 -15.769 10.797 1.00 34.63 N ATOM 401 C4 DG B 4 25.677 -14.573 11.454 1.00 34.98 C ATOM 402 P DG B 5 31.115 -13.899 8.042 1.00 34.56 P ATOM 403 OP1 DG B 5 31.963 -14.975 7.461 1.00 32.14 O ATOM 404 OP2 DG B 5 31.650 -12.522 8.201 1.00 32.82 O ATOM 405 O5' DG B 5 29.742 -13.751 7.235 1.00 32.33 O ATOM 406 C5' DG B 5 29.690 -14.472 6.043 1.00 31.54 C ATOM 407 C4' DG B 5 28.768 -15.669 6.140 1.00 30.72 C ATOM 408 O4' DG B 5 27.880 -15.610 7.294 1.00 29.62 O ATOM 409 C3' DG B 5 27.893 -15.613 4.898 1.00 30.71 C ATOM 410 O3' DG B 5 27.859 -16.852 4.202 1.00 30.24 O ATOM 411 C2' DG B 5 26.517 -15.137 5.358 1.00 29.56 C ATOM 412 C1' DG B 5 26.518 -15.471 6.850 1.00 29.04 C ATOM 413 N9 DG B 5 25.735 -14.458 7.580 1.00 27.82 N ATOM 414 C8 DG B 5 26.194 -13.283 8.118 1.00 27.56 C ATOM 415 N7 DG B 5 25.275 -12.569 8.697 1.00 27.57 N ATOM 416 C5 DG B 5 24.113 -13.322 8.540 1.00 28.61 C ATOM 417 C6 DG B 5 22.775 -13.059 8.971 1.00 28.81 C ATOM 418 O6 DG B 5 22.358 -12.067 9.607 1.00 28.23 O ATOM 419 N1 DG B 5 21.884 -14.077 8.598 1.00 28.01 N ATOM 420 C2 DG B 5 22.246 -15.217 7.910 1.00 27.87 C ATOM 421 N2 DG B 5 21.269 -16.095 7.643 1.00 27.15 N ATOM 422 N3 DG B 5 23.492 -15.475 7.509 1.00 28.00 N ATOM 423 C4 DG B 5 24.377 -14.487 7.844 1.00 28.26 C ATOM 424 P DA B 6 27.600 -16.697 2.630 1.00 29.93 P ATOM 425 OP1 DA B 6 28.386 -17.775 1.992 1.00 28.33 O ATOM 426 OP2 DA B 6 27.758 -15.264 2.261 1.00 27.70 O ATOM 427 O5' DA B 6 26.031 -16.970 2.447 1.00 28.12 O ATOM 428 C5' DA B 6 25.428 -18.215 2.817 1.00 26.49 C ATOM 429 C4' DA B 6 23.956 -18.132 2.423 1.00 25.93 C ATOM 430 O4' DA B 6 23.161 -17.352 3.358 1.00 25.57 O ATOM 431 C3' DA B 6 23.649 -17.546 1.058 1.00 24.85 C ATOM 432 O3' DA B 6 22.635 -18.341 0.544 1.00 25.26 O ATOM 433 C2' DA B 6 23.132 -16.141 1.328 1.00 23.56 C ATOM 434 C1' DA B 6 22.523 -16.255 2.720 1.00 22.36 C ATOM 435 N9 DA B 6 22.665 -15.062 3.565 1.00 21.45 N ATOM 436 C8 DA B 6 23.794 -14.300 3.740 1.00 21.47 C ATOM 437 N7 DA B 6 23.633 -13.275 4.564 1.00 20.96 N ATOM 438 C5 DA B 6 22.308 -13.362 4.962 1.00 20.29 C ATOM 439 C6 DA B 6 21.522 -12.576 5.830 1.00 21.33 C ATOM 440 N6 DA B 6 21.987 -11.495 6.471 1.00 22.33 N ATOM 441 N1 DA B 6 20.234 -12.927 6.019 1.00 20.49 N ATOM 442 C2 DA B 6 19.791 -14.008 5.374 1.00 20.99 C ATOM 443 N3 DA B 6 20.436 -14.830 4.537 1.00 20.41 N ATOM 444 C4 DA B 6 21.701 -14.453 4.358 1.00 20.31 C ATOM 445 P DC B 7 22.496 -18.527 -1.031 1.00 25.24 P ATOM 446 OP1 DC B 7 21.988 -19.893 -1.344 1.00 25.90 O ATOM 447 OP2 DC B 7 23.767 -18.033 -1.640 1.00 25.23 O ATOM 448 O5' DC B 7 21.306 -17.522 -1.301 1.00 20.93 O ATOM 449 C5' DC B 7 20.047 -17.715 -0.668 1.00 19.90 C ATOM 450 C4' DC B 7 19.188 -16.454 -0.762 1.00 17.65 C ATOM 451 O4' DC B 7 19.582 -15.506 0.255 1.00 15.14 O ATOM 452 C3' DC B 7 19.284 -15.699 -2.084 1.00 16.54 C ATOM 453 O3' DC B 7 18.010 -15.223 -2.413 1.00 18.83 O ATOM 454 C2' DC B 7 20.192 -14.533 -1.745 1.00 15.86 C ATOM 455 C1' DC B 7 19.700 -14.242 -0.346 1.00 15.03 C ATOM 456 N1 DC B 7 20.536 -13.343 0.509 1.00 15.06 N ATOM 457 C2 DC B 7 19.895 -12.736 1.606 1.00 16.93 C ATOM 458 O2 DC B 7 18.697 -12.973 1.845 1.00 15.66 O ATOM 459 N3 DC B 7 20.621 -11.910 2.407 1.00 17.77 N ATOM 460 C4 DC B 7 21.907 -11.682 2.148 1.00 16.10 C ATOM 461 N4 DC B 7 22.524 -10.848 2.984 1.00 16.13 N ATOM 462 C5 DC B 7 22.587 -12.298 1.052 1.00 14.19 C ATOM 463 C6 DC B 7 21.860 -13.109 0.273 1.00 13.54 C ATOM 464 P DA B 8 16.979 -16.237 -3.079 1.00 21.18 P ATOM 465 OP1 DA B 8 16.840 -17.414 -2.191 1.00 20.47 O ATOM 466 OP2 DA B 8 17.339 -16.474 -4.491 1.00 21.54 O ATOM 467 O5' DA B 8 15.683 -15.297 -3.093 1.00 22.56 O ATOM 468 C5' DA B 8 15.682 -14.133 -3.924 1.00 21.55 C ATOM 469 C4' DA B 8 15.025 -13.002 -3.179 1.00 20.96 C ATOM 470 O4' DA B 8 15.835 -12.769 -2.022 1.00 21.50 O ATOM 471 C3' DA B 8 15.030 -11.670 -3.897 1.00 20.59 C ATOM 472 O3' DA B 8 13.792 -11.432 -4.468 1.00 19.43 O ATOM 473 C2' DA B 8 15.197 -10.630 -2.814 1.00 19.70 C ATOM 474 C1' DA B 8 15.830 -11.398 -1.690 1.00 20.98 C ATOM 475 N9 DA B 8 17.204 -10.989 -1.474 1.00 22.18 N ATOM 476 C8 DA B 8 18.325 -11.415 -2.133 1.00 21.90 C ATOM 477 N7 DA B 8 19.423 -10.851 -1.674 1.00 23.42 N ATOM 478 C5 DA B 8 19.000 -10.017 -0.651 1.00 22.74 C ATOM 479 C6 DA B 8 19.664 -9.146 0.239 1.00 22.08 C ATOM 480 N6 DA B 8 20.977 -8.953 0.259 1.00 21.21 N ATOM 481 N1 DA B 8 18.910 -8.454 1.127 1.00 22.45 N ATOM 482 C2 DA B 8 17.581 -8.631 1.144 1.00 22.02 C ATOM 483 N3 DA B 8 16.847 -9.436 0.369 1.00 21.77 N ATOM 484 C4 DA B 8 17.622 -10.093 -0.516 1.00 22.91 C ATOM 485 P DA B 9 13.787 -11.379 -6.045 1.00 22.18 P ATOM 486 OP1 DA B 9 12.383 -11.368 -6.513 1.00 25.41 O ATOM 487 OP2 DA B 9 14.699 -12.446 -6.512 1.00 20.58 O ATOM 488 O5' DA B 9 14.348 -9.902 -6.353 1.00 21.30 O ATOM 489 C5' DA B 9 13.915 -8.778 -5.603 1.00 17.96 C ATOM 490 C4' DA B 9 13.940 -7.551 -6.493 1.00 19.38 C ATOM 491 O4' DA B 9 15.091 -6.724 -6.207 1.00 17.63 O ATOM 492 C3' DA B 9 14.014 -7.848 -7.992 1.00 20.24 C ATOM 493 O3' DA B 9 13.339 -6.781 -8.714 1.00 21.48 O ATOM 494 C2' DA B 9 15.526 -7.949 -8.238 1.00 20.40 C ATOM 495 C1' DA B 9 16.129 -7.059 -7.141 1.00 21.34 C ATOM 496 N9 DA B 9 17.211 -7.674 -6.357 1.00 21.82 N ATOM 497 C8 DA B 9 17.354 -9.006 -6.046 1.00 22.01 C ATOM 498 N7 DA B 9 18.379 -9.272 -5.282 1.00 22.02 N ATOM 499 C5 DA B 9 18.956 -8.019 -5.080 1.00 22.37 C ATOM 500 C6 DA B 9 20.100 -7.602 -4.359 1.00 21.49 C ATOM 501 N6 DA B 9 20.841 -8.487 -3.699 1.00 21.75 N ATOM 502 N1 DA B 9 20.436 -6.285 -4.329 1.00 20.29 N ATOM 503 C2 DA B 9 19.653 -5.423 -4.988 1.00 20.55 C ATOM 504 N3 DA B 9 18.549 -5.691 -5.704 1.00 21.49 N ATOM 505 C4 DA B 9 18.254 -7.019 -5.728 1.00 22.27 C ATOM 506 P DT B 10 13.581 -6.479 -10.288 1.00 25.06 P ATOM 507 OP1 DT B 10 12.656 -5.380 -10.698 1.00 22.76 O ATOM 508 OP2 DT B 10 13.638 -7.784 -10.996 1.00 23.08 O ATOM 509 O5' DT B 10 15.067 -5.905 -10.310 1.00 23.61 O ATOM 510 C5' DT B 10 15.268 -4.527 -10.179 1.00 22.59 C ATOM 511 C4' DT B 10 16.740 -4.259 -10.305 1.00 23.36 C ATOM 512 O4' DT B 10 17.417 -5.074 -9.328 1.00 22.49 O ATOM 513 C3' DT B 10 17.378 -4.752 -11.599 1.00 22.84 C ATOM 514 O3' DT B 10 17.214 -3.824 -12.609 1.00 23.56 O ATOM 515 C2' DT B 10 18.847 -4.873 -11.222 1.00 22.69 C ATOM 516 C1' DT B 10 18.786 -4.997 -9.687 1.00 21.20 C ATOM 517 N1 DT B 10 19.565 -6.121 -9.059 1.00 19.78 N ATOM 518 C2 DT B 10 20.637 -5.799 -8.244 1.00 20.04 C ATOM 519 O2 DT B 10 20.988 -4.662 -8.014 1.00 19.90 O ATOM 520 N3 DT B 10 21.312 -6.850 -7.676 1.00 20.25 N ATOM 521 C4 DT B 10 21.031 -8.185 -7.863 1.00 20.93 C ATOM 522 O4 DT B 10 21.711 -9.045 -7.322 1.00 20.72 O ATOM 523 C5 DT B 10 19.900 -8.479 -8.735 1.00 21.38 C ATOM 524 C7 DT B 10 19.445 -9.905 -8.944 1.00 20.12 C ATOM 525 C6 DT B 10 19.231 -7.438 -9.287 1.00 20.80 C ATOM 526 P DA B 11 16.913 -4.343 -14.104 1.00 24.75 P ATOM 527 OP1 DA B 11 15.570 -3.813 -14.451 1.00 25.89 O ATOM 528 OP2 DA B 11 17.162 -5.800 -14.151 1.00 22.47 O ATOM 529 O5' DA B 11 17.960 -3.558 -15.020 1.00 21.75 O ATOM 530 C5' DA B 11 18.502 -2.309 -14.631 1.00 22.26 C ATOM 531 C4' DA B 11 19.984 -2.314 -14.943 1.00 22.51 C ATOM 532 O4' DA B 11 20.659 -3.146 -13.963 1.00 22.40 O ATOM 533 C3' DA B 11 20.356 -2.914 -16.296 1.00 22.51 C ATOM 534 O3' DA B 11 21.526 -2.268 -16.772 1.00 22.95 O ATOM 535 C2' DA B 11 20.652 -4.369 -15.919 1.00 21.75 C ATOM 536 C1' DA B 11 21.431 -4.124 -14.632 1.00 20.31 C ATOM 537 N9 DA B 11 21.655 -5.256 -13.728 1.00 20.53 N ATOM 538 C8 DA B 11 21.014 -6.478 -13.690 1.00 19.71 C ATOM 539 N7 DA B 11 21.440 -7.276 -12.734 1.00 18.83 N ATOM 540 C5 DA B 11 22.425 -6.534 -12.080 1.00 20.18 C ATOM 541 C6 DA B 11 23.284 -6.809 -10.970 1.00 20.04 C ATOM 542 N6 DA B 11 23.297 -7.970 -10.293 1.00 19.29 N ATOM 543 N1 DA B 11 24.142 -5.830 -10.576 1.00 19.65 N ATOM 544 C2 DA B 11 24.164 -4.665 -11.260 1.00 19.66 C ATOM 545 N3 DA B 11 23.431 -4.299 -12.323 1.00 20.38 N ATOM 546 C4 DA B 11 22.569 -5.282 -12.686 1.00 20.84 C ATOM 547 P DG B 12 21.606 -1.508 -18.185 1.00 23.90 P ATOM 548 OP1 DG B 12 20.516 -0.505 -18.209 1.00 23.22 O ATOM 549 OP2 DG B 12 21.742 -2.475 -19.321 1.00 22.37 O ATOM 550 O5' DG B 12 23.011 -0.753 -17.996 1.00 21.86 O ATOM 551 C5' DG B 12 23.356 -0.101 -16.768 1.00 21.27 C ATOM 552 C4' DG B 12 24.848 -0.230 -16.513 1.00 19.51 C ATOM 553 O4' DG B 12 25.055 -1.327 -15.588 1.00 19.54 O ATOM 554 C3' DG B 12 25.642 -0.524 -17.776 1.00 18.10 C ATOM 555 O3' DG B 12 26.636 0.515 -18.061 1.00 20.95 O ATOM 556 C2' DG B 12 26.169 -1.940 -17.594 1.00 16.23 C ATOM 557 C1' DG B 12 25.993 -2.248 -16.111 1.00 15.39 C ATOM 558 N9 DG B 12 25.468 -3.599 -15.903 1.00 14.06 N ATOM 559 C8 DG B 12 24.527 -4.176 -16.719 1.00 13.78 C ATOM 560 N7 DG B 12 24.213 -5.390 -16.371 1.00 14.66 N ATOM 561 C5 DG B 12 24.984 -5.647 -15.235 1.00 14.62 C ATOM 562 C6 DG B 12 25.033 -6.821 -14.407 1.00 14.47 C ATOM 563 O6 DG B 12 24.397 -7.890 -14.532 1.00 13.62 O ATOM 564 N1 DG B 12 25.945 -6.687 -13.353 1.00 13.83 N ATOM 565 C2 DG B 12 26.699 -5.560 -13.131 1.00 13.84 C ATOM 566 N2 DG B 12 27.511 -5.645 -12.075 1.00 13.14 N ATOM 567 N3 DG B 12 26.647 -4.450 -13.883 1.00 14.72 N ATOM 568 C4 DG B 12 25.777 -4.550 -14.934 1.00 14.10 C ATOM 569 P DA B 13 28.204 0.426 -17.705 1.00 22.99 P ATOM 570 OP1 DA B 13 28.754 1.788 -17.829 1.00 21.57 O ATOM 571 OP2 DA B 13 28.853 -0.676 -18.460 1.00 21.46 O ATOM 572 O5' DA B 13 28.091 0.055 -16.131 1.00 25.28 O ATOM 573 C5' DA B 13 28.998 0.637 -15.215 1.00 27.85 C ATOM 574 C4' DA B 13 30.139 -0.322 -14.911 1.00 29.87 C ATOM 575 O4' DA B 13 29.656 -1.692 -14.870 1.00 31.52 O ATOM 576 C3' DA B 13 31.333 -0.348 -15.840 1.00 29.99 C ATOM 577 O3' DA B 13 32.448 -0.379 -14.978 1.00 31.83 O ATOM 578 C2' DA B 13 31.158 -1.675 -16.573 1.00 30.15 C ATOM 579 C1' DA B 13 30.599 -2.557 -15.472 1.00 30.48 C ATOM 580 N9 DA B 13 29.801 -3.708 -15.890 1.00 30.91 N ATOM 581 C8 DA B 13 28.882 -3.716 -16.912 1.00 31.11 C ATOM 582 N7 DA B 13 28.263 -4.861 -17.082 1.00 31.15 N ATOM 583 C5 DA B 13 28.812 -5.666 -16.090 1.00 31.14 C ATOM 584 C6 DA B 13 28.588 -7.013 -15.737 1.00 30.28 C ATOM 585 N6 DA B 13 27.705 -7.773 -16.387 1.00 30.43 N ATOM 586 N1 DA B 13 29.297 -7.541 -14.705 1.00 30.11 N ATOM 587 C2 DA B 13 30.183 -6.768 -14.058 1.00 30.31 C ATOM 588 N3 DA B 13 30.482 -5.485 -14.310 1.00 31.83 N ATOM 589 C4 DA B 13 29.761 -4.978 -15.341 1.00 31.29 C ATOM 590 P DG B 14 33.986 -0.380 -15.457 1.00 36.06 P ATOM 591 OP1 DG B 14 34.597 0.884 -14.991 1.00 35.56 O ATOM 592 OP2 DG B 14 34.190 -0.726 -16.899 1.00 34.40 O ATOM 593 O5' DG B 14 34.473 -1.587 -14.520 1.00 35.40 O ATOM 594 C5' DG B 14 35.859 -1.906 -14.464 1.00 35.84 C ATOM 595 C4' DG B 14 36.076 -3.405 -14.352 1.00 35.37 C ATOM 596 O4' DG B 14 34.851 -4.137 -14.651 1.00 34.76 O ATOM 597 C3' DG B 14 37.150 -3.938 -15.293 1.00 35.48 C ATOM 598 O3' DG B 14 38.094 -4.724 -14.555 1.00 35.98 O ATOM 599 C2' DG B 14 36.334 -4.731 -16.314 1.00 35.10 C ATOM 600 C1' DG B 14 35.168 -5.241 -15.473 1.00 33.84 C ATOM 601 N9 DG B 14 34.020 -5.593 -16.307 1.00 33.71 N ATOM 602 C8 DG B 14 33.443 -4.773 -17.256 1.00 33.97 C ATOM 603 N7 DG B 14 32.437 -5.307 -17.889 1.00 34.07 N ATOM 604 C5 DG B 14 32.342 -6.576 -17.331 1.00 33.82 C ATOM 605 C6 DG B 14 31.423 -7.610 -17.633 1.00 33.53 C ATOM 606 O6 DG B 14 30.515 -7.577 -18.479 1.00 33.30 O ATOM 607 N1 DG B 14 31.657 -8.756 -16.863 1.00 33.43 N ATOM 608 C2 DG B 14 32.651 -8.874 -15.912 1.00 33.36 C ATOM 609 N2 DG B 14 32.715 -10.048 -15.267 1.00 33.25 N ATOM 610 N3 DG B 14 33.517 -7.900 -15.615 1.00 33.27 N ATOM 611 C4 DG B 14 33.308 -6.777 -16.358 1.00 33.50 C ATOM 612 P DA B 15 38.897 -5.991 -15.174 1.00 36.88 P ATOM 613 OP1 DA B 15 40.204 -6.126 -14.475 1.00 35.81 O ATOM 614 OP2 DA B 15 38.957 -5.888 -16.659 1.00 36.68 O ATOM 615 O5' DA B 15 37.878 -7.174 -14.735 1.00 34.08 O ATOM 616 C5' DA B 15 38.267 -8.279 -13.904 1.00 30.01 C ATOM 617 C4' DA B 15 38.472 -9.565 -14.711 1.00 26.56 C ATOM 618 O4' DA B 15 37.310 -9.810 -15.547 1.00 24.83 O ATOM 619 C3' DA B 15 39.685 -9.665 -15.635 1.00 24.16 C ATOM 620 O3' DA B 15 40.101 -11.005 -15.614 1.00 23.22 O ATOM 621 C2' DA B 15 39.117 -9.328 -17.007 1.00 23.24 C ATOM 622 C1' DA B 15 37.689 -9.877 -16.899 1.00 22.59 C ATOM 623 N9 DA B 15 36.689 -9.166 -17.703 1.00 21.74 N ATOM 624 C8 DA B 15 36.752 -7.872 -18.156 1.00 21.57 C ATOM 625 N7 DA B 15 35.724 -7.514 -18.886 1.00 21.34 N ATOM 626 C5 DA B 15 34.926 -8.651 -18.913 1.00 20.65 C ATOM 627 C6 DA B 15 33.688 -8.932 -19.528 1.00 20.88 C ATOM 628 N6 DA B 15 33.021 -8.034 -20.248 1.00 21.21 N ATOM 629 N1 DA B 15 33.157 -10.169 -19.377 1.00 21.14 N ATOM 630 C2 DA B 15 33.836 -11.069 -18.660 1.00 21.34 C ATOM 631 N3 DA B 15 35.012 -10.922 -18.039 1.00 20.97 N ATOM 632 C4 DA B 15 35.507 -9.679 -18.200 1.00 20.73 C ATOM 633 P DC B 16 41.602 -11.417 -15.982 1.00 23.73 P ATOM 634 OP1 DC B 16 42.449 -11.065 -14.822 1.00 23.71 O ATOM 635 OP2 DC B 16 41.956 -10.923 -17.330 1.00 24.06 O ATOM 636 O5' DC B 16 41.520 -13.009 -16.109 1.00 23.11 O ATOM 637 C5' DC B 16 40.287 -13.655 -16.416 1.00 21.22 C ATOM 638 C4' DC B 16 40.063 -13.829 -17.911 1.00 19.87 C ATOM 639 O4' DC B 16 38.943 -13.012 -18.296 1.00 19.03 O ATOM 640 C3' DC B 16 41.136 -13.391 -18.911 1.00 19.26 C ATOM 641 O3' DC B 16 42.202 -14.338 -18.997 1.00 18.92 O ATOM 642 C2' DC B 16 40.330 -13.312 -20.206 1.00 18.22 C ATOM 643 C1' DC B 16 38.893 -13.129 -19.701 1.00 18.12 C ATOM 644 N1 DC B 16 38.176 -11.951 -20.291 1.00 17.98 N ATOM 645 C2 DC B 16 36.857 -12.127 -20.853 1.00 17.25 C ATOM 646 O2 DC B 16 36.289 -13.246 -20.843 1.00 17.46 O ATOM 647 N3 DC B 16 36.223 -11.062 -21.404 1.00 16.46 N ATOM 648 C4 DC B 16 36.850 -9.864 -21.403 1.00 16.62 C ATOM 649 N4 DC B 16 36.180 -8.857 -21.960 1.00 16.89 N ATOM 650 C5 DC B 16 38.182 -9.652 -20.835 1.00 17.39 C ATOM 651 C6 DC B 16 38.799 -10.714 -20.298 1.00 18.06 C TER 652 DC B 16 ATOM 653 N ILE D 68 12.317 -21.734 -5.468 1.00 26.58 N ATOM 654 CA ILE D 68 11.439 -20.700 -4.819 1.00 26.89 C ATOM 655 C ILE D 68 12.293 -19.529 -4.320 1.00 26.59 C ATOM 656 O ILE D 68 13.234 -19.737 -3.550 1.00 26.65 O ATOM 657 CB ILE D 68 10.650 -21.270 -3.583 1.00 26.81 C ATOM 658 CG1 ILE D 68 10.268 -22.745 -3.767 1.00 27.14 C ATOM 659 CG2 ILE D 68 9.426 -20.396 -3.265 1.00 26.61 C ATOM 660 CD1 ILE D 68 9.693 -23.397 -2.492 1.00 27.53 C ATOM 661 N ARG D 69 11.983 -18.301 -4.723 1.00 25.99 N ATOM 662 CA ARG D 69 12.790 -17.197 -4.205 1.00 25.83 C ATOM 663 C ARG D 69 12.182 -16.493 -2.997 1.00 24.66 C ATOM 664 O ARG D 69 10.992 -16.228 -2.976 1.00 24.89 O ATOM 665 CB ARG D 69 13.237 -16.221 -5.301 1.00 26.12 C ATOM 666 CG ARG D 69 12.262 -15.965 -6.433 1.00 28.14 C ATOM 667 CD ARG D 69 13.039 -15.883 -7.770 1.00 30.74 C ATOM 668 NE ARG D 69 14.341 -15.238 -7.567 1.00 33.25 N ATOM 669 CZ ARG D 69 15.489 -15.593 -8.163 1.00 35.08 C ATOM 670 NH1 ARG D 69 15.538 -16.609 -9.034 1.00 36.44 N ATOM 671 NH2 ARG D 69 16.610 -14.926 -7.885 1.00 34.66 N ATOM 672 N ARG D 70 13.009 -16.239 -1.977 1.00 23.77 N ATOM 673 CA ARG D 70 12.618 -15.494 -0.759 1.00 21.87 C ATOM 674 C ARG D 70 11.740 -14.300 -1.119 1.00 21.53 C ATOM 675 O ARG D 70 11.868 -13.753 -2.246 1.00 21.04 O ATOM 676 CB ARG D 70 13.844 -14.917 -0.058 1.00 21.50 C ATOM 677 CG ARG D 70 14.903 -15.882 0.403 1.00 19.04 C ATOM 678 CD ARG D 70 15.794 -15.158 1.418 1.00 15.95 C ATOM 679 NE ARG D 70 15.157 -15.072 2.739 1.00 14.70 N ATOM 680 CZ ARG D 70 15.703 -14.524 3.833 1.00 13.39 C ATOM 681 NH1 ARG D 70 16.917 -13.974 3.790 1.00 11.49 N ATOM 682 NH2 ARG D 70 15.032 -14.536 4.987 1.00 9.75 N ATOM 683 N PRO D 71 10.858 -13.880 -0.172 1.00 20.95 N ATOM 684 CA PRO D 71 9.977 -12.724 -0.361 1.00 20.52 C ATOM 685 C PRO D 71 10.726 -11.458 -0.059 1.00 20.25 C ATOM 686 O PRO D 71 11.654 -11.476 0.738 1.00 20.22 O ATOM 687 CB PRO D 71 8.878 -12.930 0.690 1.00 20.28 C ATOM 688 CG PRO D 71 9.272 -14.062 1.506 1.00 19.61 C ATOM 689 CD PRO D 71 10.641 -14.494 1.150 1.00 21.02 C ATOM 690 N MET D 72 10.325 -10.358 -0.676 1.00 20.90 N ATOM 691 CA MET D 72 11.081 -9.104 -0.531 1.00 21.30 C ATOM 692 C MET D 72 10.815 -8.465 0.790 1.00 20.60 C ATOM 693 O MET D 72 9.672 -8.454 1.243 1.00 21.71 O ATOM 694 CB MET D 72 10.718 -8.140 -1.629 1.00 21.25 C ATOM 695 CG MET D 72 11.583 -8.314 -2.821 1.00 20.80 C ATOM 696 SD MET D 72 11.313 -6.874 -3.836 1.00 22.94 S ATOM 697 CE MET D 72 9.713 -7.278 -4.567 1.00 21.38 C ATOM 698 N ASN D 73 11.865 -7.989 1.449 1.00 19.88 N ATOM 699 CA ASN D 73 11.651 -7.299 2.704 1.00 18.16 C ATOM 700 C ASN D 73 11.297 -5.851 2.383 1.00 18.77 C ATOM 701 O ASN D 73 11.302 -5.448 1.195 1.00 18.60 O ATOM 702 CB ASN D 73 12.846 -7.421 3.629 1.00 17.13 C ATOM 703 CG ASN D 73 14.051 -6.674 3.138 1.00 16.91 C ATOM 704 OD1 ASN D 73 13.967 -5.501 2.835 1.00 15.03 O ATOM 705 ND2 ASN D 73 15.213 -7.355 3.090 1.00 18.41 N ATOM 706 N ALA D 74 10.964 -5.085 3.426 1.00 18.42 N ATOM 707 CA ALA D 74 10.660 -3.668 3.322 1.00 17.97 C ATOM 708 C ALA D 74 11.601 -2.877 2.409 1.00 18.39 C ATOM 709 O ALA D 74 11.136 -2.052 1.570 1.00 17.99 O ATOM 710 CB ALA D 74 10.655 -3.058 4.691 1.00 18.28 C ATOM 711 N PHE D 75 12.908 -3.117 2.578 1.00 17.95 N ATOM 712 CA PHE D 75 13.909 -2.369 1.871 1.00 18.27 C ATOM 713 C PHE D 75 13.766 -2.771 0.425 1.00 19.22 C ATOM 714 O PHE D 75 13.427 -1.973 -0.458 1.00 19.35 O ATOM 715 CB PHE D 75 15.302 -2.656 2.427 1.00 18.73 C ATOM 716 CG PHE D 75 16.423 -2.076 1.584 1.00 19.08 C ATOM 717 CD1 PHE D 75 16.722 -0.721 1.633 1.00 17.90 C ATOM 718 CD2 PHE D 75 17.167 -2.892 0.737 1.00 20.28 C ATOM 719 CE1 PHE D 75 17.731 -0.183 0.865 1.00 18.37 C ATOM 720 CE2 PHE D 75 18.203 -2.356 -0.067 1.00 20.50 C ATOM 721 CZ PHE D 75 18.475 -1.002 -0.007 1.00 19.37 C ATOM 722 N MET D 76 13.923 -4.053 0.183 1.00 20.05 N ATOM 723 CA MET D 76 13.840 -4.523 -1.167 1.00 20.60 C ATOM 724 C MET D 76 12.630 -3.933 -1.916 1.00 21.19 C ATOM 725 O MET D 76 12.763 -3.491 -3.052 1.00 22.21 O ATOM 726 CB MET D 76 13.871 -6.034 -1.143 1.00 20.48 C ATOM 727 CG MET D 76 15.102 -6.550 -0.432 1.00 20.29 C ATOM 728 SD MET D 76 16.683 -5.894 -1.090 1.00 20.02 S ATOM 729 CE MET D 76 16.811 -6.836 -2.589 1.00 21.70 C ATOM 730 N VAL D 77 11.474 -3.868 -1.268 1.00 21.46 N ATOM 731 CA VAL D 77 10.234 -3.339 -1.900 1.00 21.25 C ATOM 732 C VAL D 77 10.356 -1.869 -2.311 1.00 20.91 C ATOM 733 O VAL D 77 9.906 -1.481 -3.381 1.00 20.62 O ATOM 734 CB VAL D 77 8.995 -3.515 -0.952 1.00 20.84 C ATOM 735 CG1 VAL D 77 7.900 -2.493 -1.240 1.00 19.95 C ATOM 736 CG2 VAL D 77 8.454 -4.930 -1.030 1.00 22.09 C ATOM 737 N TRP D 78 10.958 -1.077 -1.424 1.00 21.03 N ATOM 738 CA TRP D 78 11.147 0.347 -1.594 1.00 20.66 C ATOM 739 C TRP D 78 12.227 0.557 -2.631 1.00 21.18 C ATOM 740 O TRP D 78 12.044 1.317 -3.593 1.00 21.73 O ATOM 741 CB TRP D 78 11.612 0.927 -0.270 1.00 20.40 C ATOM 742 CG TRP D 78 12.023 2.321 -0.384 1.00 20.28 C ATOM 743 CD1 TRP D 78 11.208 3.404 -0.582 1.00 19.92 C ATOM 744 CD2 TRP D 78 13.363 2.819 -0.337 1.00 17.27 C ATOM 745 NE1 TRP D 78 11.974 4.546 -0.652 1.00 20.15 N ATOM 746 CE2 TRP D 78 13.294 4.212 -0.494 1.00 16.41 C ATOM 747 CE3 TRP D 78 14.617 2.214 -0.196 1.00 17.62 C ATOM 748 CZ2 TRP D 78 14.431 5.019 -0.513 1.00 19.38 C ATOM 749 CZ3 TRP D 78 15.758 3.016 -0.182 1.00 18.76 C ATOM 750 CH2 TRP D 78 15.657 4.404 -0.353 1.00 20.50 C ATOM 751 N ALA D 79 13.341 -0.149 -2.427 1.00 21.41 N ATOM 752 CA ALA D 79 14.496 -0.160 -3.310 1.00 21.73 C ATOM 753 C ALA D 79 14.072 -0.501 -4.709 1.00 22.64 C ATOM 754 O ALA D 79 14.433 0.189 -5.666 1.00 23.58 O ATOM 755 CB ALA D 79 15.483 -1.179 -2.832 1.00 21.58 C ATOM 756 N LYS D 80 13.309 -1.583 -4.816 1.00 23.30 N ATOM 757 CA LYS D 80 12.779 -2.072 -6.070 1.00 23.89 C ATOM 758 C LYS D 80 12.426 -0.917 -6.990 1.00 24.07 C ATOM 759 O LYS D 80 12.939 -0.860 -8.098 1.00 24.87 O ATOM 760 CB LYS D 80 11.563 -2.958 -5.792 1.00 24.30 C ATOM 761 CG LYS D 80 10.559 -3.046 -6.890 1.00 23.99 C ATOM 762 CD LYS D 80 10.786 -4.237 -7.731 1.00 24.52 C ATOM 763 CE LYS D 80 9.547 -4.523 -8.585 1.00 24.22 C ATOM 764 NZ LYS D 80 9.920 -5.612 -9.517 1.00 24.30 N ATOM 765 N ASP D 81 11.600 0.022 -6.539 1.00 23.61 N ATOM 766 CA ASP D 81 11.268 1.159 -7.398 1.00 23.50 C ATOM 767 C ASP D 81 12.366 2.208 -7.337 1.00 23.41 C ATOM 768 O ASP D 81 13.029 2.448 -8.325 1.00 24.07 O ATOM 769 CB ASP D 81 9.897 1.742 -7.070 1.00 23.41 C ATOM 770 CG ASP D 81 8.806 0.689 -7.082 1.00 23.98 C ATOM 771 OD1 ASP D 81 8.805 -0.167 -7.999 1.00 25.37 O ATOM 772 OD2 ASP D 81 7.953 0.714 -6.169 1.00 24.24 O ATOM 773 N GLU D 82 12.594 2.802 -6.179 1.00 23.39 N ATOM 774 CA GLU D 82 13.638 3.823 -6.023 1.00 23.64 C ATOM 775 C GLU D 82 14.930 3.655 -6.819 1.00 23.36 C ATOM 776 O GLU D 82 15.495 4.625 -7.284 1.00 23.48 O ATOM 777 CB GLU D 82 13.996 3.996 -4.553 1.00 23.75 C ATOM 778 CG GLU D 82 13.211 5.100 -3.894 1.00 25.13 C ATOM 779 CD GLU D 82 13.749 6.466 -4.223 1.00 25.21 C ATOM 780 OE1 GLU D 82 14.980 6.633 -4.130 1.00 25.86 O ATOM 781 OE2 GLU D 82 12.938 7.360 -4.571 1.00 26.66 O ATOM 782 N ARG D 83 15.422 2.437 -6.958 1.00 23.14 N ATOM 783 CA ARG D 83 16.637 2.236 -7.729 1.00 22.83 C ATOM 784 C ARG D 83 16.418 2.584 -9.189 1.00 22.23 C ATOM 785 O ARG D 83 17.276 3.195 -9.829 1.00 22.20 O ATOM 786 CB ARG D 83 17.069 0.795 -7.610 1.00 23.40 C ATOM 787 CG ARG D 83 17.659 0.234 -8.872 1.00 24.87 C ATOM 788 CD ARG D 83 18.436 -0.995 -8.515 1.00 28.00 C ATOM 789 NE ARG D 83 19.484 -0.717 -7.536 1.00 27.89 N ATOM 790 CZ ARG D 83 19.696 -1.442 -6.449 1.00 28.45 C ATOM 791 NH1 ARG D 83 18.908 -2.480 -6.204 1.00 31.99 N ATOM 792 NH2 ARG D 83 20.686 -1.135 -5.610 1.00 27.55 N ATOM 793 N LYS D 84 15.262 2.172 -9.700 1.00 21.38 N ATOM 794 CA LYS D 84 14.830 2.471 -11.044 1.00 20.82 C ATOM 795 C LYS D 84 14.747 3.982 -11.126 1.00 20.44 C ATOM 796 O LYS D 84 15.127 4.579 -12.120 1.00 19.88 O ATOM 797 CB LYS D 84 13.460 1.832 -11.276 1.00 20.66 C ATOM 798 CG LYS D 84 13.002 1.790 -12.693 1.00 20.98 C ATOM 799 CD LYS D 84 11.604 1.168 -12.847 1.00 21.59 C ATOM 800 CE LYS D 84 11.168 1.265 -14.341 1.00 25.19 C ATOM 801 NZ LYS D 84 9.681 1.418 -14.620 1.00 25.39 N ATOM 802 N ARG D 85 14.283 4.599 -10.042 1.00 20.29 N ATOM 803 CA ARG D 85 14.082 6.038 -10.007 1.00 20.08 C ATOM 804 C ARG D 85 15.443 6.674 -10.069 1.00 19.01 C ATOM 805 O ARG D 85 15.753 7.414 -11.007 1.00 18.56 O ATOM 806 CB ARG D 85 13.364 6.438 -8.727 1.00 20.71 C ATOM 807 CG ARG D 85 12.428 7.601 -8.880 1.00 24.48 C ATOM 808 CD ARG D 85 13.081 8.909 -8.465 1.00 31.15 C ATOM 809 NE ARG D 85 13.179 9.025 -7.005 1.00 35.74 N ATOM 810 CZ ARG D 85 13.905 9.950 -6.374 1.00 38.24 C ATOM 811 NH1 ARG D 85 14.609 10.851 -7.058 1.00 39.38 N ATOM 812 NH2 ARG D 85 13.940 9.969 -5.050 1.00 39.30 N ATOM 813 N LEU D 86 16.273 6.337 -9.090 1.00 18.01 N ATOM 814 CA LEU D 86 17.634 6.836 -9.016 1.00 17.73 C ATOM 815 C LEU D 86 18.423 6.592 -10.282 1.00 17.99 C ATOM 816 O LEU D 86 19.211 7.448 -10.664 1.00 18.35 O ATOM 817 CB LEU D 86 18.377 6.262 -7.811 1.00 17.65 C ATOM 818 CG LEU D 86 17.956 6.849 -6.453 1.00 18.94 C ATOM 819 CD1 LEU D 86 18.782 6.310 -5.308 1.00 19.76 C ATOM 820 CD2 LEU D 86 17.973 8.390 -6.439 1.00 19.74 C ATOM 821 N ALA D 87 18.213 5.454 -10.943 1.00 17.90 N ATOM 822 CA ALA D 87 18.919 5.163 -12.196 1.00 18.28 C ATOM 823 C ALA D 87 18.510 6.073 -13.356 1.00 18.89 C ATOM 824 O ALA D 87 19.257 6.221 -14.330 1.00 19.10 O ATOM 825 CB ALA D 87 18.734 3.706 -12.585 1.00 18.33 C ATOM 826 N GLN D 88 17.315 6.655 -13.268 1.00 19.75 N ATOM 827 CA GLN D 88 16.784 7.509 -14.329 1.00 20.43 C ATOM 828 C GLN D 88 17.343 8.905 -14.126 1.00 21.13 C ATOM 829 O GLN D 88 17.809 9.545 -15.068 1.00 21.09 O ATOM 830 CB GLN D 88 15.247 7.543 -14.299 1.00 20.39 C ATOM 831 CG GLN D 88 14.536 6.210 -14.597 1.00 20.43 C ATOM 832 CD GLN D 88 13.101 6.154 -14.072 1.00 20.63 C ATOM 833 OE1 GLN D 88 12.550 7.151 -13.588 1.00 21.95 O ATOM 834 NE2 GLN D 88 12.489 4.982 -14.171 1.00 21.67 N ATOM 835 N GLN D 89 17.305 9.360 -12.875 1.00 22.46 N ATOM 836 CA GLN D 89 17.843 10.662 -12.510 1.00 23.62 C ATOM 837 C GLN D 89 19.358 10.615 -12.608 1.00 23.87 C ATOM 838 O GLN D 89 19.995 11.644 -12.835 1.00 24.22 O ATOM 839 CB GLN D 89 17.424 11.077 -11.095 1.00 23.71 C ATOM 840 CG GLN D 89 15.902 11.090 -10.805 1.00 26.04 C ATOM 841 CD GLN D 89 15.151 12.339 -11.350 1.00 28.84 C ATOM 842 OE1 GLN D 89 15.750 13.272 -11.917 1.00 30.31 O ATOM 843 NE2 GLN D 89 13.827 12.340 -11.180 1.00 28.46 N ATOM 844 N ASN D 90 19.931 9.421 -12.457 1.00 24.07 N ATOM 845 CA ASN D 90 21.384 9.243 -12.601 1.00 24.60 C ATOM 846 C ASN D 90 21.794 8.018 -13.445 1.00 24.92 C ATOM 847 O ASN D 90 22.312 7.044 -12.878 1.00 25.01 O ATOM 848 CB ASN D 90 22.105 9.183 -11.226 1.00 24.45 C ATOM 849 CG ASN D 90 21.424 10.034 -10.122 1.00 24.90 C ATOM 850 OD1 ASN D 90 21.901 11.119 -9.764 1.00 24.48 O ATOM 851 ND2 ASN D 90 20.329 9.517 -9.560 1.00 25.30 N ATOM 852 N PRO D 91 21.609 8.066 -14.792 1.00 25.51 N ATOM 853 CA PRO D 91 22.066 6.948 -15.656 1.00 26.27 C ATOM 854 C PRO D 91 23.575 6.749 -15.539 1.00 26.90 C ATOM 855 O PRO D 91 24.105 5.687 -15.860 1.00 27.24 O ATOM 856 CB PRO D 91 21.735 7.415 -17.086 1.00 26.00 C ATOM 857 CG PRO D 91 20.848 8.580 -16.957 1.00 25.84 C ATOM 858 CD PRO D 91 21.026 9.168 -15.580 1.00 25.74 C ATOM 859 N ASP D 92 24.240 7.795 -15.070 1.00 27.82 N ATOM 860 CA ASP D 92 25.684 7.865 -14.928 1.00 28.53 C ATOM 861 C ASP D 92 26.178 6.871 -13.913 1.00 28.68 C ATOM 862 O ASP D 92 27.059 6.064 -14.209 1.00 29.02 O ATOM 863 CB ASP D 92 26.085 9.283 -14.476 1.00 29.07 C ATOM 864 CG ASP D 92 24.952 10.018 -13.708 1.00 28.69 C ATOM 865 OD1 ASP D 92 23.949 10.396 -14.355 1.00 28.91 O ATOM 866 OD2 ASP D 92 25.071 10.240 -12.479 1.00 27.14 O ATOM 867 N LEU D 93 25.578 6.940 -12.725 1.00 28.71 N ATOM 868 CA LEU D 93 26.051 6.240 -11.533 1.00 28.72 C ATOM 869 C LEU D 93 25.984 4.735 -11.655 1.00 28.76 C ATOM 870 O LEU D 93 25.005 4.188 -12.185 1.00 28.74 O ATOM 871 CB LEU D 93 25.290 6.717 -10.290 1.00 28.15 C ATOM 872 CG LEU D 93 25.767 8.105 -9.842 1.00 28.59 C ATOM 873 CD1 LEU D 93 24.858 8.706 -8.779 1.00 27.84 C ATOM 874 CD2 LEU D 93 27.241 8.115 -9.372 1.00 28.97 C ATOM 875 N HIS D 94 27.033 4.068 -11.168 1.00 28.60 N ATOM 876 CA HIS D 94 27.057 2.617 -11.197 1.00 28.41 C ATOM 877 C HIS D 94 26.038 2.131 -10.189 1.00 27.46 C ATOM 878 O HIS D 94 25.515 2.929 -9.418 1.00 27.40 O ATOM 879 CB HIS D 94 28.441 2.060 -10.890 1.00 29.09 C ATOM 880 CG HIS D 94 28.507 0.561 -10.955 1.00 31.76 C ATOM 881 ND1 HIS D 94 28.627 -0.133 -12.144 1.00 33.76 N ATOM 882 CD2 HIS D 94 28.451 -0.379 -9.978 1.00 33.59 C ATOM 883 CE1 HIS D 94 28.648 -1.432 -11.897 1.00 34.40 C ATOM 884 NE2 HIS D 94 28.541 -1.609 -10.590 1.00 35.09 N ATOM 885 N ASN D 95 25.739 0.834 -10.220 1.00 26.52 N ATOM 886 CA ASN D 95 24.704 0.225 -9.377 1.00 24.79 C ATOM 887 C ASN D 95 25.129 0.152 -7.933 1.00 23.84 C ATOM 888 O ASN D 95 24.357 0.467 -7.043 1.00 23.89 O ATOM 889 CB ASN D 95 24.375 -1.175 -9.890 1.00 24.86 C ATOM 890 CG ASN D 95 23.048 -1.675 -9.401 1.00 24.54 C ATOM 891 OD1 ASN D 95 22.024 -1.004 -9.543 1.00 25.01 O ATOM 892 ND2 ASN D 95 23.046 -2.876 -8.839 1.00 23.68 N ATOM 893 N ALA D 96 26.362 -0.275 -7.700 1.00 23.06 N ATOM 894 CA ALA D 96 26.932 -0.233 -6.364 1.00 22.46 C ATOM 895 C ALA D 96 26.595 1.117 -5.713 1.00 22.19 C ATOM 896 O ALA D 96 26.128 1.156 -4.573 1.00 22.12 O ATOM 897 CB ALA D 96 28.421 -0.450 -6.414 1.00 21.70 C ATOM 898 N GLU D 97 26.795 2.209 -6.453 1.00 21.60 N ATOM 899 CA GLU D 97 26.555 3.541 -5.914 1.00 21.50 C ATOM 900 C GLU D 97 25.085 3.766 -5.638 1.00 20.60 C ATOM 901 O GLU D 97 24.709 4.232 -4.548 1.00 20.71 O ATOM 902 CB GLU D 97 27.071 4.618 -6.845 1.00 22.07 C ATOM 903 CG GLU D 97 27.316 5.931 -6.144 1.00 25.28 C ATOM 904 CD GLU D 97 28.539 5.880 -5.270 1.00 28.83 C ATOM 905 OE1 GLU D 97 28.394 5.568 -4.066 1.00 31.29 O ATOM 906 OE2 GLU D 97 29.642 6.140 -5.799 1.00 31.44 O ATOM 907 N LEU D 98 24.248 3.425 -6.614 1.00 18.84 N ATOM 908 CA LEU D 98 22.830 3.328 -6.351 1.00 17.49 C ATOM 909 C LEU D 98 22.558 2.611 -5.008 1.00 17.89 C ATOM 910 O LEU D 98 21.788 3.120 -4.202 1.00 18.00 O ATOM 911 CB LEU D 98 22.104 2.658 -7.513 1.00 16.37 C ATOM 912 CG LEU D 98 22.149 3.451 -8.824 1.00 14.95 C ATOM 913 CD1 LEU D 98 21.257 2.837 -9.913 1.00 11.41 C ATOM 914 CD2 LEU D 98 21.798 4.932 -8.610 1.00 13.15 C ATOM 915 N SER D 99 23.197 1.462 -4.749 1.00 17.85 N ATOM 916 CA SER D 99 22.988 0.742 -3.475 1.00 17.92 C ATOM 917 C SER D 99 23.430 1.539 -2.238 1.00 18.09 C ATOM 918 O SER D 99 22.749 1.543 -1.216 1.00 17.73 O ATOM 919 CB SER D 99 23.710 -0.595 -3.479 1.00 17.60 C ATOM 920 OG SER D 99 23.092 -1.509 -4.353 1.00 17.70 O ATOM 921 N LYS D 100 24.561 2.227 -2.342 1.00 18.27 N ATOM 922 CA LYS D 100 25.016 3.074 -1.253 1.00 19.11 C ATOM 923 C LYS D 100 24.022 4.200 -0.950 1.00 19.67 C ATOM 924 O LYS D 100 23.745 4.472 0.212 1.00 20.68 O ATOM 925 CB LYS D 100 26.448 3.583 -1.499 1.00 19.22 C ATOM 926 CG LYS D 100 27.504 2.455 -1.456 1.00 19.38 C ATOM 927 CD LYS D 100 28.906 2.904 -1.874 1.00 18.70 C ATOM 928 CE LYS D 100 29.891 2.816 -0.716 1.00 17.51 C ATOM 929 NZ LYS D 100 31.305 3.056 -1.147 1.00 15.82 N ATOM 930 N MET D 101 23.457 4.807 -1.988 1.00 20.10 N ATOM 931 CA MET D 101 22.472 5.878 -1.847 1.00 20.65 C ATOM 932 C MET D 101 21.128 5.398 -1.308 1.00 21.04 C ATOM 933 O MET D 101 20.504 6.057 -0.474 1.00 21.91 O ATOM 934 CB MET D 101 22.245 6.565 -3.187 1.00 20.66 C ATOM 935 CG MET D 101 23.374 7.509 -3.633 1.00 21.70 C ATOM 936 SD MET D 101 22.987 8.294 -5.226 1.00 20.89 S ATOM 937 CE MET D 101 23.700 7.101 -6.341 1.00 19.58 C ATOM 938 N LEU D 102 20.652 4.265 -1.798 1.00 20.98 N ATOM 939 CA LEU D 102 19.403 3.730 -1.297 1.00 20.60 C ATOM 940 C LEU D 102 19.587 3.474 0.197 1.00 21.17 C ATOM 941 O LEU D 102 18.689 3.766 1.008 1.00 21.96 O ATOM 942 CB LEU D 102 19.015 2.447 -2.041 1.00 20.04 C ATOM 943 CG LEU D 102 18.581 2.607 -3.511 1.00 18.09 C ATOM 944 CD1 LEU D 102 18.910 1.361 -4.322 1.00 16.34 C ATOM 945 CD2 LEU D 102 17.122 2.917 -3.618 1.00 14.90 C ATOM 946 N GLY D 103 20.766 2.965 0.560 1.00 20.51 N ATOM 947 CA GLY D 103 21.046 2.635 1.944 1.00 20.38 C ATOM 948 C GLY D 103 20.980 3.884 2.789 1.00 20.23 C ATOM 949 O GLY D 103 20.289 3.919 3.803 1.00 19.86 O ATOM 950 N LYS D 104 21.674 4.919 2.333 1.00 20.30 N ATOM 951 CA LYS D 104 21.720 6.196 3.041 1.00 21.07 C ATOM 952 C LYS D 104 20.342 6.821 3.243 1.00 20.55 C ATOM 953 O LYS D 104 20.029 7.295 4.341 1.00 21.18 O ATOM 954 CB LYS D 104 22.633 7.214 2.318 1.00 21.61 C ATOM 955 CG LYS D 104 23.996 6.695 1.873 1.00 22.66 C ATOM 956 CD LYS D 104 25.144 7.214 2.710 1.00 26.69 C ATOM 957 CE LYS D 104 26.365 7.429 1.788 1.00 28.33 C ATOM 958 NZ LYS D 104 27.441 8.217 2.439 1.00 29.08 N ATOM 959 N SER D 105 19.514 6.823 2.207 1.00 20.04 N ATOM 960 CA SER D 105 18.249 7.535 2.318 1.00 20.40 C ATOM 961 C SER D 105 17.145 6.677 2.900 1.00 21.19 C ATOM 962 O SER D 105 16.089 7.192 3.232 1.00 21.41 O ATOM 963 CB SER D 105 17.831 8.188 0.995 1.00 19.88 C ATOM 964 OG SER D 105 17.627 7.225 -0.008 1.00 18.87 O ATOM 965 N TRP D 106 17.385 5.374 3.024 1.00 22.32 N ATOM 966 CA TRP D 106 16.479 4.509 3.775 1.00 23.15 C ATOM 967 C TRP D 106 16.565 4.890 5.238 1.00 23.48 C ATOM 968 O TRP D 106 15.529 5.118 5.870 1.00 24.15 O ATOM 969 CB TRP D 106 16.894 3.064 3.642 1.00 23.65 C ATOM 970 CG TRP D 106 16.014 2.080 4.358 1.00 24.10 C ATOM 971 CD1 TRP D 106 16.378 1.241 5.383 1.00 23.80 C ATOM 972 CD2 TRP D 106 14.637 1.771 4.056 1.00 23.90 C ATOM 973 NE1 TRP D 106 15.299 0.450 5.759 1.00 23.73 N ATOM 974 CE2 TRP D 106 14.223 0.762 4.961 1.00 24.68 C ATOM 975 CE3 TRP D 106 13.706 2.282 3.150 1.00 22.84 C ATOM 976 CZ2 TRP D 106 12.919 0.244 4.957 1.00 25.39 C ATOM 977 CZ3 TRP D 106 12.425 1.786 3.157 1.00 23.01 C ATOM 978 CH2 TRP D 106 12.042 0.765 4.049 1.00 24.29 C ATOM 979 N LYS D 107 17.798 4.952 5.765 1.00 23.14 N ATOM 980 CA LYS D 107 18.078 5.364 7.153 1.00 22.58 C ATOM 981 C LYS D 107 17.529 6.776 7.472 1.00 22.21 C ATOM 982 O LYS D 107 17.127 7.065 8.596 1.00 21.33 O ATOM 983 CB LYS D 107 19.592 5.283 7.441 1.00 22.84 C ATOM 984 CG LYS D 107 20.072 6.007 8.733 1.00 21.64 C ATOM 985 CD LYS D 107 21.580 5.877 8.944 1.00 22.89 C ATOM 986 CE LYS D 107 22.265 7.168 9.552 1.00 24.84 C ATOM 987 NZ LYS D 107 22.994 8.095 8.581 1.00 24.19 N ATOM 988 N ALA D 108 17.524 7.651 6.465 1.00 21.81 N ATOM 989 CA ALA D 108 16.938 8.974 6.627 1.00 20.48 C ATOM 990 C ALA D 108 15.396 8.914 6.557 1.00 19.93 C ATOM 991 O ALA D 108 14.720 9.793 7.098 1.00 20.47 O ATOM 992 CB ALA D 108 17.515 9.941 5.613 1.00 19.09 C ATOM 993 N LEU D 109 14.836 7.895 5.908 1.00 18.93 N ATOM 994 CA LEU D 109 13.382 7.755 5.894 1.00 19.19 C ATOM 995 C LEU D 109 12.895 7.440 7.318 1.00 18.96 C ATOM 996 O LEU D 109 13.429 6.555 8.001 1.00 17.80 O ATOM 997 CB LEU D 109 12.908 6.688 4.895 1.00 19.57 C ATOM 998 CG LEU D 109 12.852 7.090 3.407 1.00 21.34 C ATOM 999 CD1 LEU D 109 12.150 6.029 2.554 1.00 21.64 C ATOM 1000 CD2 LEU D 109 12.194 8.443 3.193 1.00 21.30 C ATOM 1001 N THR D 110 11.922 8.215 7.769 1.00 18.62 N ATOM 1002 CA THR D 110 11.337 8.037 9.092 1.00 19.20 C ATOM 1003 C THR D 110 10.559 6.699 9.145 1.00 20.17 C ATOM 1004 O THR D 110 10.191 6.155 8.086 1.00 21.06 O ATOM 1005 CB THR D 110 10.516 9.299 9.443 1.00 18.54 C ATOM 1006 OG1 THR D 110 11.269 10.090 10.363 1.00 16.79 O ATOM 1007 CG2 THR D 110 9.161 8.988 10.008 1.00 17.65 C ATOM 1008 N LEU D 111 10.384 6.125 10.333 1.00 20.50 N ATOM 1009 CA LEU D 111 9.581 4.897 10.462 1.00 21.46 C ATOM 1010 C LEU D 111 8.165 5.061 9.920 1.00 21.66 C ATOM 1011 O LEU D 111 7.666 4.183 9.233 1.00 22.46 O ATOM 1012 CB LEU D 111 9.538 4.388 11.905 1.00 21.17 C ATOM 1013 CG LEU D 111 10.729 3.492 12.283 1.00 22.75 C ATOM 1014 CD1 LEU D 111 10.903 3.348 13.808 1.00 22.31 C ATOM 1015 CD2 LEU D 111 10.676 2.118 11.604 1.00 22.78 C ATOM 1016 N ALA D 112 7.523 6.176 10.219 1.00 22.19 N ATOM 1017 CA ALA D 112 6.208 6.458 9.650 1.00 23.16 C ATOM 1018 C ALA D 112 6.310 6.432 8.134 1.00 23.48 C ATOM 1019 O ALA D 112 5.444 5.869 7.465 1.00 24.04 O ATOM 1020 CB ALA D 112 5.636 7.814 10.150 1.00 22.34 C ATOM 1021 N GLU D 113 7.384 7.016 7.607 1.00 23.96 N ATOM 1022 CA GLU D 113 7.604 7.091 6.166 1.00 23.83 C ATOM 1023 C GLU D 113 7.745 5.696 5.601 1.00 24.50 C ATOM 1024 O GLU D 113 7.104 5.354 4.610 1.00 25.08 O ATOM 1025 CB GLU D 113 8.822 7.944 5.841 1.00 23.06 C ATOM 1026 CG GLU D 113 8.664 9.386 6.290 1.00 23.55 C ATOM 1027 CD GLU D 113 9.619 10.361 5.593 1.00 23.78 C ATOM 1028 OE1 GLU D 113 10.851 10.155 5.586 1.00 22.22 O ATOM 1029 OE2 GLU D 113 9.127 11.370 5.076 1.00 25.50 O ATOM 1030 N LYS D 114 8.553 4.875 6.255 1.00 25.34 N ATOM 1031 CA LYS D 114 8.742 3.479 5.848 1.00 25.90 C ATOM 1032 C LYS D 114 7.479 2.597 5.954 1.00 26.51 C ATOM 1033 O LYS D 114 7.344 1.642 5.184 1.00 26.86 O ATOM 1034 CB LYS D 114 9.876 2.842 6.648 1.00 25.99 C ATOM 1035 CG LYS D 114 11.202 3.610 6.615 1.00 26.34 C ATOM 1036 CD LYS D 114 12.208 3.001 7.583 1.00 25.44 C ATOM 1037 CE LYS D 114 13.585 3.613 7.394 1.00 23.76 C ATOM 1038 NZ LYS D 114 14.425 3.456 8.619 1.00 27.07 N ATOM 1039 N ARG D 115 6.562 2.918 6.876 1.00 26.69 N ATOM 1040 CA ARG D 115 5.366 2.081 7.137 1.00 27.18 C ATOM 1041 C ARG D 115 4.669 1.466 5.891 1.00 26.87 C ATOM 1042 O ARG D 115 4.452 0.244 5.854 1.00 27.43 O ATOM 1043 CB ARG D 115 4.340 2.815 8.037 1.00 27.03 C ATOM 1044 CG ARG D 115 2.952 2.121 8.182 1.00 27.26 C ATOM 1045 CD ARG D 115 1.965 2.840 9.167 1.00 29.33 C ATOM 1046 NE ARG D 115 2.067 4.302 9.095 1.00 34.77 N ATOM 1047 CZ ARG D 115 1.712 5.044 8.042 1.00 37.06 C ATOM 1048 NH1 ARG D 115 1.192 4.491 6.940 1.00 36.04 N ATOM 1049 NH2 ARG D 115 1.882 6.357 8.093 1.00 39.09 N ATOM 1050 N PRO D 116 4.318 2.283 4.875 1.00 26.19 N ATOM 1051 CA PRO D 116 3.486 1.695 3.804 1.00 25.82 C ATOM 1052 C PRO D 116 4.235 0.585 3.085 1.00 25.31 C ATOM 1053 O PRO D 116 3.632 -0.248 2.394 1.00 25.71 O ATOM 1054 CB PRO D 116 3.257 2.871 2.839 1.00 25.51 C ATOM 1055 CG PRO D 116 3.547 4.097 3.646 1.00 25.72 C ATOM 1056 CD PRO D 116 4.628 3.696 4.603 1.00 26.12 C ATOM 1057 N PHE D 117 5.550 0.585 3.256 1.00 24.35 N ATOM 1058 CA PHE D 117 6.388 -0.381 2.610 1.00 23.37 C ATOM 1059 C PHE D 117 6.403 -1.637 3.426 1.00 24.40 C ATOM 1060 O PHE D 117 6.201 -2.730 2.857 1.00 24.98 O ATOM 1061 CB PHE D 117 7.759 0.212 2.315 1.00 22.24 C ATOM 1062 CG PHE D 117 7.688 1.339 1.318 1.00 20.25 C ATOM 1063 CD1 PHE D 117 7.789 2.658 1.724 1.00 17.23 C ATOM 1064 CD2 PHE D 117 7.428 1.076 -0.029 1.00 19.87 C ATOM 1065 CE1 PHE D 117 7.677 3.702 0.796 1.00 14.88 C ATOM 1066 CE2 PHE D 117 7.288 2.131 -0.970 1.00 17.80 C ATOM 1067 CZ PHE D 117 7.419 3.434 -0.545 1.00 16.79 C ATOM 1068 N VAL D 118 6.560 -1.495 4.751 1.00 24.31 N ATOM 1069 CA VAL D 118 6.499 -2.641 5.632 1.00 24.51 C ATOM 1070 C VAL D 118 5.197 -3.330 5.302 1.00 25.29 C ATOM 1071 O VAL D 118 5.124 -4.555 5.177 1.00 26.48 O ATOM 1072 CB VAL D 118 6.501 -2.273 7.160 1.00 25.19 C ATOM 1073 CG1 VAL D 118 6.549 -3.541 8.025 1.00 23.84 C ATOM 1074 CG2 VAL D 118 7.688 -1.347 7.548 1.00 24.68 C ATOM 1075 N GLU D 119 4.155 -2.532 5.127 1.00 25.83 N ATOM 1076 CA GLU D 119 2.817 -3.084 4.929 1.00 25.26 C ATOM 1077 C GLU D 119 2.797 -3.832 3.612 1.00 25.25 C ATOM 1078 O GLU D 119 2.256 -4.935 3.532 1.00 25.06 O ATOM 1079 CB GLU D 119 1.746 -1.986 5.027 1.00 24.98 C ATOM 1080 CG GLU D 119 1.653 -1.381 6.450 1.00 24.11 C ATOM 1081 CD GLU D 119 0.590 -0.277 6.619 1.00 24.50 C ATOM 1082 OE1 GLU D 119 0.192 0.394 5.633 1.00 21.70 O ATOM 1083 OE2 GLU D 119 0.157 -0.074 7.776 1.00 24.92 O ATOM 1084 N GLU D 120 3.437 -3.263 2.593 1.00 25.51 N ATOM 1085 CA GLU D 120 3.554 -3.982 1.320 1.00 26.08 C ATOM 1086 C GLU D 120 4.395 -5.261 1.457 1.00 25.66 C ATOM 1087 O GLU D 120 3.986 -6.321 0.968 1.00 25.88 O ATOM 1088 CB GLU D 120 4.077 -3.098 0.181 1.00 26.20 C ATOM 1089 CG GLU D 120 4.443 -3.903 -1.051 1.00 27.75 C ATOM 1090 CD GLU D 120 4.454 -3.099 -2.345 1.00 30.99 C ATOM 1091 OE1 GLU D 120 3.977 -3.652 -3.381 1.00 32.17 O ATOM 1092 OE2 GLU D 120 4.958 -1.944 -2.338 1.00 31.28 O ATOM 1093 N ALA D 121 5.549 -5.171 2.119 1.00 24.92 N ATOM 1094 CA ALA D 121 6.375 -6.359 2.317 1.00 25.01 C ATOM 1095 C ALA D 121 5.592 -7.502 2.978 1.00 24.92 C ATOM 1096 O ALA D 121 5.923 -8.668 2.757 1.00 25.28 O ATOM 1097 CB ALA D 121 7.644 -6.032 3.111 1.00 25.17 C ATOM 1098 N GLU D 122 4.566 -7.162 3.778 1.00 24.68 N ATOM 1099 CA GLU D 122 3.729 -8.147 4.502 1.00 24.28 C ATOM 1100 C GLU D 122 2.685 -8.786 3.603 1.00 24.11 C ATOM 1101 O GLU D 122 2.476 -10.013 3.639 1.00 24.42 O ATOM 1102 CB GLU D 122 3.018 -7.515 5.691 1.00 23.92 C ATOM 1103 CG GLU D 122 3.616 -7.837 7.039 1.00 26.15 C ATOM 1104 CD GLU D 122 3.356 -9.278 7.519 1.00 28.32 C ATOM 1105 OE1 GLU D 122 2.149 -9.705 7.621 1.00 25.66 O ATOM 1106 OE2 GLU D 122 4.382 -9.959 7.810 1.00 25.71 O ATOM 1107 N ARG D 123 1.998 -7.960 2.816 1.00 23.53 N ATOM 1108 CA ARG D 123 1.077 -8.485 1.816 1.00 22.81 C ATOM 1109 C ARG D 123 1.795 -9.563 1.019 1.00 22.64 C ATOM 1110 O ARG D 123 1.287 -10.680 0.855 1.00 22.23 O ATOM 1111 CB ARG D 123 0.596 -7.365 0.903 1.00 22.81 C ATOM 1112 CG ARG D 123 -0.790 -6.861 1.229 1.00 22.82 C ATOM 1113 CD ARG D 123 -1.104 -5.611 0.457 1.00 23.85 C ATOM 1114 NE ARG D 123 -0.708 -4.450 1.235 1.00 25.49 N ATOM 1115 CZ ARG D 123 0.135 -3.519 0.812 1.00 27.54 C ATOM 1116 NH1 ARG D 123 0.662 -3.587 -0.412 1.00 28.44 N ATOM 1117 NH2 ARG D 123 0.431 -2.504 1.612 1.00 28.76 N ATOM 1118 N LEU D 124 3.003 -9.217 0.568 1.00 22.91 N ATOM 1119 CA LEU D 124 3.902 -10.139 -0.120 1.00 22.88 C ATOM 1120 C LEU D 124 4.216 -11.387 0.695 1.00 22.39 C ATOM 1121 O LEU D 124 4.084 -12.484 0.168 1.00 22.36 O ATOM 1122 CB LEU D 124 5.197 -9.426 -0.491 1.00 22.92 C ATOM 1123 CG LEU D 124 5.309 -8.877 -1.920 1.00 24.71 C ATOM 1124 CD1 LEU D 124 4.042 -8.082 -2.420 1.00 24.30 C ATOM 1125 CD2 LEU D 124 6.581 -8.030 -1.999 1.00 23.85 C ATOM 1126 N ARG D 125 4.597 -11.225 1.968 1.00 21.49 N ATOM 1127 CA ARG D 125 4.971 -12.376 2.786 1.00 21.76 C ATOM 1128 C ARG D 125 3.770 -13.264 2.967 1.00 21.63 C ATOM 1129 O ARG D 125 3.891 -14.479 2.906 1.00 22.42 O ATOM 1130 CB ARG D 125 5.551 -11.969 4.152 1.00 22.13 C ATOM 1131 CG ARG D 125 6.423 -13.055 4.857 1.00 22.81 C ATOM 1132 CD ARG D 125 5.783 -13.693 6.081 1.00 23.77 C ATOM 1133 NE ARG D 125 4.946 -12.733 6.808 1.00 25.95 N ATOM 1134 CZ ARG D 125 3.960 -13.076 7.642 1.00 24.97 C ATOM 1135 NH1 ARG D 125 3.702 -14.360 7.872 1.00 26.18 N ATOM 1136 NH2 ARG D 125 3.219 -12.149 8.228 1.00 20.49 N ATOM 1137 N VAL D 126 2.605 -12.662 3.176 1.00 21.47 N ATOM 1138 CA VAL D 126 1.381 -13.435 3.305 1.00 21.33 C ATOM 1139 C VAL D 126 1.133 -14.177 2.004 1.00 21.83 C ATOM 1140 O VAL D 126 0.921 -15.393 2.017 1.00 22.08 O ATOM 1141 CB VAL D 126 0.161 -12.557 3.679 1.00 21.16 C ATOM 1142 CG1 VAL D 126 -1.142 -13.235 3.277 1.00 18.98 C ATOM 1143 CG2 VAL D 126 0.189 -12.184 5.177 1.00 20.43 C ATOM 1144 N GLN D 127 1.175 -13.441 0.888 1.00 22.06 N ATOM 1145 CA GLN D 127 0.825 -13.983 -0.424 1.00 21.98 C ATOM 1146 C GLN D 127 1.715 -15.150 -0.736 1.00 22.11 C ATOM 1147 O GLN D 127 1.237 -16.201 -1.189 1.00 21.89 O ATOM 1148 CB GLN D 127 0.993 -12.917 -1.504 1.00 22.42 C ATOM 1149 CG GLN D 127 0.518 -13.313 -2.905 1.00 22.37 C ATOM 1150 CD GLN D 127 -0.838 -14.027 -2.911 1.00 23.46 C ATOM 1151 OE1 GLN D 127 -0.966 -15.124 -3.468 1.00 23.10 O ATOM 1152 NE2 GLN D 127 -1.849 -13.412 -2.281 1.00 23.01 N ATOM 1153 N HIS D 128 3.014 -14.940 -0.493 1.00 22.12 N ATOM 1154 CA HIS D 128 4.039 -15.981 -0.560 1.00 22.24 C ATOM 1155 C HIS D 128 3.586 -17.216 0.213 1.00 22.84 C ATOM 1156 O HIS D 128 3.576 -18.332 -0.325 1.00 23.26 O ATOM 1157 CB HIS D 128 5.351 -15.444 0.009 1.00 22.16 C ATOM 1158 CG HIS D 128 6.561 -16.275 -0.317 1.00 21.49 C ATOM 1159 ND1 HIS D 128 6.826 -17.486 0.291 1.00 21.47 N ATOM 1160 CD2 HIS D 128 7.598 -16.045 -1.154 1.00 19.30 C ATOM 1161 CE1 HIS D 128 7.962 -17.974 -0.175 1.00 19.25 C ATOM 1162 NE2 HIS D 128 8.453 -17.116 -1.047 1.00 18.90 N ATOM 1163 N MET D 129 3.166 -17.006 1.463 1.00 23.60 N ATOM 1164 CA MET D 129 2.644 -18.091 2.288 1.00 23.36 C ATOM 1165 C MET D 129 1.583 -18.910 1.540 1.00 23.45 C ATOM 1166 O MET D 129 1.634 -20.140 1.591 1.00 23.69 O ATOM 1167 CB MET D 129 2.130 -17.559 3.628 1.00 23.32 C ATOM 1168 CG MET D 129 3.201 -17.236 4.681 1.00 23.32 C ATOM 1169 SD MET D 129 2.457 -17.271 6.359 1.00 23.40 S ATOM 1170 CE MET D 129 3.845 -17.677 7.436 1.00 25.08 C ATOM 1171 N GLN D 130 0.643 -18.251 0.840 1.00 24.08 N ATOM 1172 CA GLN D 130 -0.408 -18.978 0.060 1.00 24.67 C ATOM 1173 C GLN D 130 0.222 -19.756 -1.087 1.00 25.17 C ATOM 1174 O GLN D 130 0.005 -20.961 -1.224 1.00 25.26 O ATOM 1175 CB GLN D 130 -1.497 -18.061 -0.536 1.00 24.35 C ATOM 1176 CG GLN D 130 -2.260 -17.190 0.425 1.00 24.90 C ATOM 1177 CD GLN D 130 -3.217 -17.972 1.322 1.00 26.94 C ATOM 1178 OE1 GLN D 130 -4.311 -18.345 0.903 1.00 26.04 O ATOM 1179 NE2 GLN D 130 -2.813 -18.192 2.582 1.00 27.82 N ATOM 1180 N ASP D 131 1.017 -19.068 -1.903 1.00 25.82 N ATOM 1181 CA ASP D 131 1.587 -19.696 -3.092 1.00 26.68 C ATOM 1182 C ASP D 131 2.443 -20.913 -2.753 1.00 27.44 C ATOM 1183 O ASP D 131 2.444 -21.899 -3.494 1.00 27.58 O ATOM 1184 CB ASP D 131 2.355 -18.678 -3.952 1.00 26.43 C ATOM 1185 CG ASP D 131 1.439 -17.628 -4.571 1.00 25.15 C ATOM 1186 OD1 ASP D 131 0.282 -17.963 -4.888 1.00 24.54 O ATOM 1187 OD2 ASP D 131 1.860 -16.468 -4.734 1.00 23.63 O ATOM 1188 N HIS D 132 3.153 -20.859 -1.630 1.00 28.10 N ATOM 1189 CA HIS D 132 4.029 -21.965 -1.272 1.00 28.92 C ATOM 1190 C HIS D 132 3.955 -22.290 0.207 1.00 29.18 C ATOM 1191 O HIS D 132 4.631 -21.656 1.013 1.00 29.58 O ATOM 1192 CB HIS D 132 5.461 -21.655 -1.689 1.00 29.19 C ATOM 1193 CG HIS D 132 5.556 -20.916 -2.986 1.00 29.44 C ATOM 1194 ND1 HIS D 132 5.353 -21.527 -4.205 1.00 30.02 N ATOM 1195 CD2 HIS D 132 5.807 -19.612 -3.253 1.00 29.10 C ATOM 1196 CE1 HIS D 132 5.487 -20.633 -5.169 1.00 30.15 C ATOM 1197 NE2 HIS D 132 5.765 -19.463 -4.619 1.00 29.72 N ATOM 1198 N PRO D 133 3.122 -23.283 0.568 1.00 29.35 N ATOM 1199 CA PRO D 133 2.929 -23.690 1.961 1.00 29.54 C ATOM 1200 C PRO D 133 4.169 -24.376 2.507 1.00 30.01 C ATOM 1201 O PRO D 133 4.616 -24.047 3.604 1.00 29.89 O ATOM 1202 CB PRO D 133 1.785 -24.709 1.889 1.00 29.24 C ATOM 1203 CG PRO D 133 1.239 -24.627 0.501 1.00 29.24 C ATOM 1204 CD PRO D 133 2.324 -24.096 -0.365 1.00 29.25 C ATOM 1205 N ASN D 134 4.733 -25.291 1.713 1.00 30.76 N ATOM 1206 CA ASN D 134 5.830 -26.172 2.138 1.00 31.06 C ATOM 1207 C ASN D 134 7.238 -25.611 2.072 1.00 31.09 C ATOM 1208 O ASN D 134 8.210 -26.356 2.253 1.00 31.12 O ATOM 1209 CB ASN D 134 5.766 -27.493 1.378 1.00 31.14 C ATOM 1210 CG ASN D 134 4.836 -28.476 2.036 1.00 31.61 C ATOM 1211 OD1 ASN D 134 3.911 -28.080 2.753 1.00 32.04 O ATOM 1212 ND2 ASN D 134 5.079 -29.767 1.818 1.00 31.92 N ATOM 1213 N TYR D 135 7.327 -24.300 1.850 1.00 31.04 N ATOM 1214 CA TYR D 135 8.588 -23.585 1.688 1.00 31.18 C ATOM 1215 C TYR D 135 9.413 -23.428 2.973 1.00 31.28 C ATOM 1216 O TYR D 135 9.009 -22.752 3.916 1.00 31.46 O ATOM 1217 CB TYR D 135 8.309 -22.212 1.049 1.00 31.26 C ATOM 1218 CG TYR D 135 9.501 -21.280 0.968 1.00 31.05 C ATOM 1219 CD1 TYR D 135 10.628 -21.620 0.213 1.00 31.18 C ATOM 1220 CD2 TYR D 135 9.498 -20.051 1.637 1.00 30.25 C ATOM 1221 CE1 TYR D 135 11.735 -20.757 0.133 1.00 31.46 C ATOM 1222 CE2 TYR D 135 10.595 -19.182 1.562 1.00 30.83 C ATOM 1223 CZ TYR D 135 11.707 -19.546 0.803 1.00 31.15 C ATOM 1224 OH TYR D 135 12.792 -18.719 0.712 1.00 30.94 O ATOM 1225 N LYS D 136 10.573 -24.067 3.002 1.00 31.54 N ATOM 1226 CA LYS D 136 11.572 -23.781 4.017 1.00 31.90 C ATOM 1227 C LYS D 136 12.638 -22.960 3.329 1.00 31.94 C ATOM 1228 O LYS D 136 13.089 -23.342 2.238 1.00 31.96 O ATOM 1229 CB LYS D 136 12.207 -25.071 4.522 1.00 32.39 C ATOM 1230 CG LYS D 136 11.631 -25.606 5.805 1.00 33.56 C ATOM 1231 CD LYS D 136 12.125 -24.808 7.003 1.00 36.47 C ATOM 1232 CE LYS D 136 11.856 -25.569 8.299 1.00 38.16 C ATOM 1233 NZ LYS D 136 11.871 -24.650 9.470 1.00 40.03 N ATOM 1234 N TYR D 137 13.048 -21.844 3.941 1.00 31.75 N ATOM 1235 CA TYR D 137 14.173 -21.069 3.405 1.00 31.50 C ATOM 1236 C TYR D 137 15.479 -21.883 3.512 1.00 31.64 C ATOM 1237 O TYR D 137 15.951 -22.172 4.609 1.00 31.58 O ATOM 1238 CB TYR D 137 14.275 -19.692 4.088 1.00 31.38 C ATOM 1239 CG TYR D 137 15.575 -18.952 3.817 1.00 31.08 C ATOM 1240 CD1 TYR D 137 16.117 -18.892 2.527 1.00 32.70 C ATOM 1241 CD2 TYR D 137 16.271 -18.326 4.848 1.00 30.05 C ATOM 1242 CE1 TYR D 137 17.325 -18.238 2.274 1.00 32.55 C ATOM 1243 CE2 TYR D 137 17.469 -17.660 4.612 1.00 29.88 C ATOM 1244 CZ TYR D 137 17.994 -17.615 3.318 1.00 31.62 C ATOM 1245 OH TYR D 137 19.187 -16.965 3.061 1.00 30.34 O ATOM 1246 N ARG D 138 16.036 -22.272 2.366 1.00 31.95 N ATOM 1247 CA ARG D 138 17.211 -23.168 2.337 1.00 32.86 C ATOM 1248 C ARG D 138 18.449 -22.508 1.707 1.00 33.01 C ATOM 1249 O ARG D 138 18.562 -22.421 0.483 1.00 32.77 O ATOM 1250 CB ARG D 138 16.892 -24.508 1.635 1.00 32.71 C ATOM 1251 CG ARG D 138 15.945 -25.442 2.402 1.00 33.23 C ATOM 1252 CD ARG D 138 15.368 -26.535 1.489 1.00 33.74 C ATOM 1253 NE ARG D 138 14.245 -27.266 2.091 1.00 35.57 N ATOM 1254 CZ ARG D 138 14.332 -28.483 2.630 1.00 36.29 C ATOM 1255 NH1 ARG D 138 15.493 -29.128 2.654 1.00 35.17 N ATOM 1256 NH2 ARG D 138 13.252 -29.062 3.148 1.00 36.68 N ATOM 1257 N PRO D 139 19.366 -22.007 2.551 1.00 33.45 N ATOM 1258 CA PRO D 139 20.609 -21.389 2.104 1.00 33.88 C ATOM 1259 C PRO D 139 21.673 -22.428 1.745 1.00 34.60 C ATOM 1260 O PRO D 139 21.354 -23.612 1.628 1.00 35.02 O ATOM 1261 CB PRO D 139 21.033 -20.559 3.323 1.00 34.09 C ATOM 1262 CG PRO D 139 19.870 -20.636 4.306 1.00 33.27 C ATOM 1263 CD PRO D 139 19.238 -21.934 4.013 1.00 33.41 C ATOM 1264 N ARG D 140 22.922 -22.000 1.558 1.00 35.00 N ATOM 1265 CA ARG D 140 23.982 -22.907 1.123 1.00 35.37 C ATOM 1266 C ARG D 140 25.317 -22.616 1.823 1.00 35.92 C ATOM 1267 O ARG D 140 25.353 -21.810 2.748 1.00 36.27 O ATOM 1268 CB ARG D 140 24.113 -22.837 -0.404 1.00 35.29 C ATOM 1269 CG ARG D 140 23.226 -23.827 -1.140 1.00 35.10 C ATOM 1270 CD ARG D 140 23.621 -25.269 -0.747 1.00 36.03 C ATOM 1271 NE ARG D 140 22.747 -26.316 -1.290 1.00 35.74 N ATOM 1272 CZ ARG D 140 21.466 -26.501 -0.962 1.00 35.12 C ATOM 1273 NH1 ARG D 140 20.850 -25.689 -0.108 1.00 35.63 N ATOM 1274 NH2 ARG D 140 20.784 -27.491 -1.516 1.00 34.51 N ATOM 1275 N ARG D 141 26.396 -23.282 1.405 1.00 36.25 N ATOM 1276 CA ARG D 141 27.752 -22.959 1.865 1.00 36.62 C ATOM 1277 C ARG D 141 28.824 -23.618 1.005 1.00 36.69 C ATOM 1278 O ARG D 141 29.982 -23.202 1.021 1.00 36.74 O ATOM 1279 CB ARG D 141 27.953 -23.359 3.324 1.00 36.85 C ATOM 1280 CG ARG D 141 27.611 -22.257 4.302 1.00 37.66 C ATOM 1281 CD ARG D 141 27.597 -22.744 5.745 1.00 39.29 C ATOM 1282 NE ARG D 141 27.189 -24.145 5.890 1.00 39.96 N ATOM 1283 CZ ARG D 141 26.455 -24.623 6.900 1.00 40.01 C ATOM 1284 NH1 ARG D 141 26.016 -23.822 7.865 1.00 39.62 N ATOM 1285 NH2 ARG D 141 26.146 -25.911 6.942 1.00 39.48 N TER 1286 ARG D 141 MASTER 392 0 0 3 0 0 0 6 1283 3 0 11 END
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Entry Information
PDB ID
3f27
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
Transcription factor SOX-17
Ligand Name
16-mer
EC.Number
E.C.-.-.-.-
Resolution
2.75(Å)
Affinity (Kd/Ki/IC50)
Kd=2.6nM
Release Year
2009
Protein/NA Sequence
Check fasta file
Primary Reference
(2009) J.Mol.Biol. Vol. 388: pp. 619-630
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):
Q61473
Entrez Gene ID
NCBI Entrez Gene ID:
20671
ASD
Information of known allosteric effects of PDB entries
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