USER MOD reduce.3.24.130724 H: found=0, std=0, add=228, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 228 hydrogens (24 hets) HEADER DNA 20-JUL-99 1QKG TITLE DNA DECAMER DUPLEX CONTAINING T-T DEWAR PHOTOPRODUCT COMPND MOL_ID: 1; COMPND 2 MOLECULE: DNA (5'-D(*CP*GP*CP*AP*(HYD)TP*+TP*AP*CP*GP*C)- COMPND 3 3'); COMPND 4 CHAIN: A; COMPND 5 OTHER_DETAILS: BOND FORMED BETWEEN C6(T5) AND C4(T6) BOND COMPND 6 FORMED BETWEEN N3(T6) AND C6(T6); COMPND 7 MOL_ID: 2; COMPND 8 MOLECULE: DNA (5'-D(*GP*CP*GP*TP*GP*AP*TP*GP*CP*G)-3'); COMPND 9 CHAIN: B SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 MOL_ID: 2; SOURCE 4 SYNTHETIC: YES KEYWDS DEOXYRIBONUCLEIC ACID, DNA PHOTOPRODUCT, DEWAR PRODUCT, KEYWDS 2 (6-4) ADDUCT, MUTAGENESIS, TRANSLESION REPLICATION EXPDTA SOLUTION NMR MDLTYP MINIMIZED AVERAGE AUTHOR J.-H.LEE,S.-H.BAE,Y.-J.CHOI,B.-S.CHOI REVDAT 6 02-FEB-10 1QKG 1 KEYWDS REMARK HETATM ATOM REVDAT 6 2 TER CONECT MASTER REVDAT 5 02-JUN-09 1QKG 1 FORMUL REVDAT 4 24-FEB-09 1QKG 1 VERSN REVDAT 3 14-JUN-06 1QKG 1 ATOM REVDAT 2 24-MAY-00 1QKG 1 JRNL REVDAT 1 11-MAY-00 1QKG 0 JRNL AUTH J.-H.LEE,S.-H.BAE,B.-S.CHOI JRNL TITL THE DEWAR PHOTOPRODUCT OF THYMIDYLYL(3'-->5')- JRNL TITL 2 THYMIDINE (DEWAR PRODUCT) EXHIBITS MUTAGENIC JRNL TITL 3 BEHAVIOR IN ACCORDANCE WITH THE "A RULE". JRNL REF PROC.NATL.ACAD.SCI.USA V. 97 4591 2000 JRNL REFN ISSN 0027-8424 JRNL PMID 10758155 JRNL DOI 10.1073/PNAS.080057097 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.1 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: RESTRAINED MOLECULAR DYNAMICS WITH REMARK 3 NMR-DERIVEN DISTANCE RESTRAINTS AND THEN FULL RELAXATION REMARK 3 MATRIX REFINEMENT WITH NOE VOLUME ITENSITY RESTRAINTS REMARK 4 REMARK 4 1QKG COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 20-JUL-99. REMARK 100 THE PDBE ID CODE IS EBI-2961. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 274.0 REMARK 210 PH : 6.6 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : 100% D2O, 10% WATER/90% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ REMARK 210 SPECTROMETER MODEL : DMX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : X-PLOR REMARK 210 METHOD USED : SIMULATED ANNEALING AND FULL REMARK 210 RELAXATION MATRIX REFINEMENT REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 8 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : LEAST RESTRAINT VIOLATION REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: MEAN STRUCTURE. THE STRUCTURE WAS DETERMINED USING REMARK 210 SA METHOD WITH DISTANCE RESTRAINTS AND FULL RELAXATION REMARK 210 MATRIX REFINEMENT WITH NOE INTENSITY RESTRAINTS OF 50, 80, REMARK 210 160 MS MIXING TIMES REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. 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 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 1890 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 3760 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: 2 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 400 REMARK 400 COMPOUND REMARK 400 MISMATCHED BASE PAIRING OF 3'-T OF DEWAR PRODUCT WITH G RESIDUE 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 DA A 4 N9 DA A 4 C4 0.039 REMARK 500 DT B 17 N1 DT B 17 C2 0.053 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 DC A 1 O4' - C1' - N1 ANGL. DEV. = 3.3 DEGREES REMARK 500 DC A 3 N1 - C2 - O2 ANGL. DEV. = 3.7 DEGREES REMARK 500 DC A 3 C3' - O3' - P ANGL. DEV. = 12.6 DEGREES REMARK 500 DA A 4 O4' - C1' - N9 ANGL. DEV. = 1.9 DEGREES REMARK 500 DA A 4 C3' - O3' - P ANGL. DEV. = 21.5 DEGREES REMARK 500 DC A 8 N1 - C2 - O2 ANGL. DEV. = 4.0 DEGREES REMARK 500 DC A 8 C3' - O3' - P ANGL. DEV. = 8.9 DEGREES REMARK 500 DG A 9 C2 - N3 - C4 ANGL. DEV. = 3.1 DEGREES REMARK 500 DG A 9 C3' - O3' - P ANGL. DEV. = 8.2 DEGREES REMARK 500 DC A 10 C3' - O3' - P ANGL. DEV. = 16.5 DEGREES REMARK 500 DG B 11 C1' - O4' - C4' ANGL. DEV. = -7.3 DEGREES REMARK 500 DG B 11 C2 - N3 - C4 ANGL. DEV. = 3.0 DEGREES REMARK 500 DG B 11 O4' - C1' - N9 ANGL. DEV. = 3.0 DEGREES REMARK 500 DC B 12 C3' - O3' - P ANGL. DEV. = 17.0 DEGREES REMARK 500 DG B 13 O4' - C1' - C2' ANGL. DEV. = -5.9 DEGREES REMARK 500 DG B 13 O4' - C1' - N9 ANGL. DEV. = 4.5 DEGREES REMARK 500 DG B 13 C3' - O3' - P ANGL. DEV. = 8.6 DEGREES REMARK 500 DT B 14 P - O5' - C5' ANGL. DEV. = 10.0 DEGREES REMARK 500 DT B 14 C3' - O3' - P ANGL. DEV. = 11.2 DEGREES REMARK 500 DG B 15 N3 - C2 - N2 ANGL. DEV. = 7.4 DEGREES REMARK 500 DA B 16 C1' - O4' - C4' ANGL. DEV. = -6.8 DEGREES REMARK 500 DA B 16 O4' - C1' - N9 ANGL. DEV. = 5.4 DEGREES REMARK 500 DA B 16 C3' - O3' - P ANGL. DEV. = 7.4 DEGREES REMARK 500 DT B 17 C3' - O3' - P ANGL. DEV. = 15.7 DEGREES REMARK 500 DG B 18 C2 - N3 - C4 ANGL. DEV. = 3.4 DEGREES REMARK 500 DG B 18 C3' - O3' - P ANGL. DEV. = 18.4 DEGREES REMARK 500 DC B 19 C3' - O3' - P ANGL. DEV. = 17.6 DEGREES REMARK 500 DG B 20 O4' - C1' - N9 ANGL. DEV. = 2.0 DEGREES REMARK 500 DG B 20 C3' - O3' - P ANGL. DEV. = 7.7 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1CFL RELATED DB: PDB REMARK 900 DNA DECAMER DUPLEX CONTAINING T5-T6 PHOTOADDUCT DBREF 1QKG A 1 10 PDB 1QKG 1QKG 1 10 DBREF 1QKG B 11 20 PDB 1QKG 1QKG 11 20 SEQRES 1 A 10 DC DG DC DA 64T TA3 DA DC DG DC SEQRES 1 B 10 DG DC DG DT DG DA DT DG DC DG MODRES 1QKG 64T A 5 T CHEMICAL BOND C6(T5)-C4(T6) MODRES 1QKG TA3 A 6 T CHEMICAL BOND C6(T5)-C4(T6) HET 64T A 5 34 HET TA3 A 6 30 HETNAM 64T 5-HYDROXY-THYMIDINE-5'-MONOPHOSPHATE HETNAM TA3 (4S,5R)-3-(2-DEOXY-5-O-PHOSPHONO-BETA-D- HETNAM 2 TA3 ERYTHRO-PENTOFURANOSYL)-5-METHYL-1,3- HETNAM 3 TA3 DIAZABICYCLO[2.2.0]HEXAN-2-ONE FORMUL 1 64T C10 H17 N2 O9 P FORMUL 1 TA3 C10 H17 N2 O7 P LINK O3' DA A 4 P 64T A 5 1555 1555 1.61 LINK O3' 64T A 5 P TA3 A 6 1555 1555 1.61 LINK C6 64T A 5 C4 TA3 A 6 1555 1555 1.50 LINK O3' TA3 A 6 P DA A 7 1555 1555 1.60 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 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 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 5 64T H61 : A 5 64T C6 : A 6 TA3 C4 :(H bumps) USER MOD NoAdj-H: A 6 TA3 H5 : A 6 TA3 C5 : A 6 TA3 C5M :(H bumps) USER MOD NoAdj-H: A 6 TA3 H42 : A 6 TA3 C4 : A 5 64T C6 :(H bumps) USER MOD NoAdj-H: A 6 TA3 H41 : A 6 TA3 C4 : A 5 64T C6 :(H bumps) USER MOD Single : A 1 DC O5' : rot 180:sc= 0 USER MOD Single : A 5 64T O5 : rot 180:sc= 0 USER MOD Single : A 10 DC O3' : rot 180:sc= 0 USER MOD Single : B 11 DG O5' : rot 180:sc= 0 USER MOD Single : B 14 DT C7 :methyl -30:sc= 0 (180deg=-0.217) USER MOD Single : B 17 DT C7 :methyl 150:sc= -0.0202 (180deg=-0.0202) USER MOD Single : B 20 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 -1.697 11.984 3.058 1.00 0.99 O ATOM 2 C5' DC A 1 -2.486 12.558 4.100 1.00 0.94 C ATOM 3 C4' DC A 1 -1.698 12.488 5.387 1.00 0.84 C ATOM 4 O4' DC A 1 -2.477 12.982 6.513 1.00 0.78 O ATOM 5 C3' DC A 1 -1.440 11.026 5.707 1.00 0.79 C ATOM 6 O3' DC A 1 -0.075 10.698 5.403 1.00 0.78 O ATOM 7 C2' DC A 1 -1.764 10.886 7.202 1.00 0.69 C ATOM 8 C1' DC A 1 -1.985 12.316 7.669 1.00 0.70 C ATOM 9 N1 DC A 1 -2.950 12.380 8.784 1.00 0.62 N ATOM 10 C2 DC A 1 -2.532 12.857 10.062 1.00 0.57 C ATOM 11 O2 DC A 1 -1.370 13.238 10.270 1.00 0.59 O ATOM 12 N3 DC A 1 -3.453 12.892 11.081 1.00 0.52 N ATOM 13 C4 DC A 1 -4.719 12.478 10.889 1.00 0.51 C ATOM 14 N4 DC A 1 -5.587 12.536 11.921 1.00 0.47 N ATOM 15 C5 DC A 1 -5.132 11.991 9.594 1.00 0.56 C ATOM 16 C6 DC A 1 -4.237 11.962 8.615 1.00 0.61 C ATOM 0 H5' DC A 1 -3.429 12.020 4.202 1.00 0.94 H new ATOM 0 H5'' DC A 1 -2.734 13.593 3.862 1.00 0.94 H new ATOM 0 H4' DC A 1 -0.791 13.078 5.252 1.00 0.84 H new ATOM 0 H3' DC A 1 -2.048 10.339 5.119 1.00 0.79 H new ATOM 0 H2' DC A 1 -2.651 10.273 7.362 1.00 0.69 H new ATOM 0 H2'' DC A 1 -0.946 10.411 7.744 1.00 0.69 H new ATOM 0 HO5' DC A 1 -2.194 12.019 2.214 1.00 0.99 H new ATOM 0 H1' DC A 1 -1.075 12.773 8.057 1.00 0.70 H new ATOM 0 H41 DC A 1 -6.551 12.227 11.795 1.00 0.47 H new ATOM 0 H42 DC A 1 -5.279 12.889 12.827 1.00 0.47 H new ATOM 0 H5 DC A 1 -6.146 11.658 9.426 1.00 0.56 H new ATOM 0 H6 DC A 1 -4.540 11.593 7.646 1.00 0.61 H new ATOM 29 P DG A 2 0.593 9.236 5.453 1.00 0.77 P ATOM 30 OP1 DG A 2 1.819 9.260 4.625 1.00 0.82 O ATOM 31 OP2 DG A 2 -0.462 8.258 5.100 1.00 0.82 O ATOM 32 O5' DG A 2 0.987 9.080 7.008 1.00 0.67 O ATOM 33 C5' DG A 2 2.055 9.774 7.694 1.00 0.61 C ATOM 34 C4' DG A 2 2.121 9.470 9.198 1.00 0.53 C ATOM 35 O4' DG A 2 0.934 9.979 9.895 1.00 0.49 O ATOM 36 C3' DG A 2 2.156 7.964 9.495 1.00 0.53 C ATOM 37 O3' DG A 2 3.178 7.674 10.477 1.00 0.52 O ATOM 38 C2' DG A 2 0.754 7.718 10.063 1.00 0.50 C ATOM 39 C1' DG A 2 0.596 9.002 10.863 1.00 0.44 C ATOM 40 N9 DG A 2 -0.764 9.277 11.382 1.00 0.41 N ATOM 41 C8 DG A 2 -1.932 9.208 10.707 1.00 0.44 C ATOM 42 N7 DG A 2 -3.004 9.507 11.409 1.00 0.42 N ATOM 43 C5 DG A 2 -2.504 9.804 12.661 1.00 0.35 C ATOM 44 C6 DG A 2 -3.186 10.193 13.833 1.00 0.31 C ATOM 45 O6 DG A 2 -4.406 10.350 13.948 1.00 0.32 O ATOM 46 N1 DG A 2 -2.300 10.397 14.910 1.00 0.27 N ATOM 47 C2 DG A 2 -0.919 10.250 14.863 1.00 0.28 C ATOM 48 N2 DG A 2 -0.294 10.496 16.020 1.00 0.27 N ATOM 49 N3 DG A 2 -0.292 9.878 13.735 1.00 0.31 N ATOM 50 C4 DG A 2 -1.115 9.671 12.680 1.00 0.35 C ATOM 0 H5' DG A 2 1.928 10.847 7.554 1.00 0.61 H new ATOM 0 H5'' DG A 2 3.006 9.503 7.235 1.00 0.61 H new ATOM 0 H4' DG A 2 3.037 9.952 9.541 1.00 0.53 H new ATOM 0 H3' DG A 2 2.389 7.339 8.633 1.00 0.53 H new ATOM 0 H2' DG A 2 -0.003 7.610 9.286 1.00 0.50 H new ATOM 0 H2'' DG A 2 0.702 6.825 10.685 1.00 0.50 H new ATOM 0 H1' DG A 2 1.202 8.969 11.768 1.00 0.44 H new ATOM 0 H8 DG A 2 -1.982 8.927 9.665 1.00 0.44 H new ATOM 0 H1 DG A 2 -2.708 10.677 15.802 1.00 0.27 H new ATOM 0 H21 DG A 2 0.721 10.413 16.079 1.00 0.27 H new ATOM 0 H22 DG A 2 -0.832 10.767 16.843 1.00 0.27 H new ATOM 62 P DC A 3 3.701 6.295 11.121 1.00 0.52 P ATOM 63 OP1 DC A 3 5.139 6.128 10.811 1.00 0.56 O ATOM 64 OP2 DC A 3 2.777 5.204 10.730 1.00 0.57 O ATOM 65 O5' DC A 3 3.534 6.589 12.699 1.00 0.45 O ATOM 66 C5' DC A 3 4.341 7.419 13.579 1.00 0.41 C ATOM 67 C4' DC A 3 4.066 7.176 15.081 1.00 0.39 C ATOM 68 O4' DC A 3 2.718 7.607 15.422 1.00 0.33 O ATOM 69 C3' DC A 3 4.168 5.688 15.399 1.00 0.45 C ATOM 70 O3' DC A 3 5.116 5.380 16.438 1.00 0.52 O ATOM 71 C2' DC A 3 2.734 5.249 15.771 1.00 0.43 C ATOM 72 C1' DC A 3 2.007 6.578 16.095 1.00 0.35 C ATOM 73 N1 DC A 3 0.606 6.680 15.591 1.00 0.31 N ATOM 74 C2 DC A 3 -0.464 6.829 16.519 1.00 0.27 C ATOM 75 O2 DC A 3 -0.283 6.871 17.746 1.00 0.28 O ATOM 76 N3 DC A 3 -1.740 6.930 16.024 1.00 0.24 N ATOM 77 C4 DC A 3 -1.994 6.891 14.724 1.00 0.28 C ATOM 78 N4 DC A 3 -3.281 6.991 14.376 1.00 0.28 N ATOM 79 C5 DC A 3 -0.934 6.748 13.770 1.00 0.33 C ATOM 80 C6 DC A 3 0.316 6.651 14.238 1.00 0.34 C ATOM 0 H5' DC A 3 4.154 8.468 13.349 1.00 0.41 H new ATOM 0 H5'' DC A 3 5.395 7.232 13.376 1.00 0.41 H new ATOM 0 H4' DC A 3 4.802 7.741 15.653 1.00 0.39 H new ATOM 0 H3' DC A 3 4.553 5.142 14.538 1.00 0.45 H new ATOM 0 H2' DC A 3 2.252 4.721 14.948 1.00 0.43 H new ATOM 0 H2'' DC A 3 2.733 4.574 16.627 1.00 0.43 H new ATOM 0 H1' DC A 3 1.974 6.647 17.182 1.00 0.35 H new ATOM 0 H41 DC A 3 -3.546 6.968 13.391 1.00 0.28 H new ATOM 0 H42 DC A 3 -3.997 7.090 15.095 1.00 0.28 H new ATOM 0 H5 DC A 3 -1.137 6.719 12.710 1.00 0.33 H new ATOM 0 H6 DC A 3 1.128 6.546 13.534 1.00 0.34 H new ATOM 92 P DA A 4 5.467 5.748 17.970 1.00 0.75 P ATOM 93 OP1 DA A 4 5.130 7.170 18.227 1.00 1.10 O ATOM 94 OP2 DA A 4 6.862 5.324 18.239 1.00 1.21 O ATOM 95 O5' DA A 4 4.437 4.825 18.810 1.00 0.63 O ATOM 96 C5' DA A 4 3.921 5.239 20.096 1.00 0.57 C ATOM 97 C4' DA A 4 2.746 4.414 20.618 1.00 0.48 C ATOM 98 O4' DA A 4 1.552 4.587 19.781 1.00 0.44 O ATOM 99 C3' DA A 4 3.023 2.915 20.656 1.00 0.49 C ATOM 100 O3' DA A 4 2.711 2.361 21.951 1.00 0.50 O ATOM 101 C2' DA A 4 2.102 2.361 19.573 1.00 0.48 C ATOM 102 C1' DA A 4 0.913 3.326 19.661 1.00 0.41 C ATOM 103 N9 DA A 4 -0.093 3.360 18.548 1.00 0.39 N ATOM 104 C8 DA A 4 -0.040 2.808 17.298 1.00 0.41 C ATOM 105 N7 DA A 4 -1.103 3.011 16.546 1.00 0.39 N ATOM 106 C5 DA A 4 -1.932 3.759 17.355 1.00 0.34 C ATOM 107 C6 DA A 4 -3.224 4.290 17.118 1.00 0.30 C ATOM 108 N6 DA A 4 -3.886 4.116 15.951 1.00 0.32 N ATOM 109 N1 DA A 4 -3.789 4.990 18.130 1.00 0.26 N ATOM 110 C2 DA A 4 -3.124 5.146 19.275 1.00 0.26 C ATOM 111 N3 DA A 4 -1.918 4.695 19.611 1.00 0.31 N ATOM 112 C4 DA A 4 -1.355 3.995 18.591 1.00 0.34 C ATOM 0 H5' DA A 4 3.611 6.282 20.027 1.00 0.57 H new ATOM 0 H5'' DA A 4 4.729 5.194 20.826 1.00 0.57 H new ATOM 0 H4' DA A 4 2.589 4.785 21.631 1.00 0.48 H new ATOM 0 H3' DA A 4 4.071 2.668 20.486 1.00 0.49 H new ATOM 0 H2' DA A 4 2.570 2.376 18.589 1.00 0.48 H new ATOM 0 H2'' DA A 4 1.809 1.330 19.771 1.00 0.48 H new ATOM 0 H1' DA A 4 0.275 3.001 20.483 1.00 0.41 H new ATOM 0 H8 DA A 4 0.814 2.245 16.951 1.00 0.41 H new ATOM 0 H61 DA A 4 -4.815 4.518 15.827 1.00 0.32 H new ATOM 0 H62 DA A 4 -3.456 3.583 15.195 1.00 0.32 H new ATOM 0 H2 DA A 4 -3.635 5.718 20.035 1.00 0.26 H new HETATM 124 P 64T A 5 3.298 1.029 22.646 1.00 0.57 P HETATM 125 OP1 64T A 5 3.354 1.241 24.111 1.00 0.93 O HETATM 126 OP2 64T A 5 4.553 0.633 21.964 1.00 1.01 O HETATM 127 O3' 64T A 5 -1.639 0.205 24.732 1.00 0.47 O HETATM 128 O5' 64T A 5 2.167 -0.077 22.321 1.00 0.42 O HETATM 129 C5' 64T A 5 0.931 -0.438 22.973 1.00 0.37 C HETATM 130 C4' 64T A 5 -0.170 0.605 22.780 1.00 0.39 C HETATM 131 O4' 64T A 5 -0.435 0.800 21.363 1.00 0.38 O HETATM 132 C3' 64T A 5 -1.496 0.108 23.301 1.00 0.41 C HETATM 133 C2' 64T A 5 -2.427 1.090 22.599 1.00 0.44 C HETATM 134 C1' 64T A 5 -1.765 1.271 21.211 1.00 0.42 C HETATM 135 N1 64T A 5 -2.427 0.607 20.029 1.00 0.41 N HETATM 136 C2 64T A 5 -3.650 1.274 19.648 1.00 0.47 C HETATM 137 O2 64T A 5 -4.004 2.369 20.091 1.00 0.55 O HETATM 138 N3 64T A 5 -4.472 0.578 18.718 1.00 0.48 N HETATM 139 C4 64T A 5 -4.245 -0.724 18.174 1.00 0.43 C HETATM 140 O4 64T A 5 -5.079 -1.210 17.408 1.00 0.46 O HETATM 141 C5 64T A 5 -2.843 -1.173 18.272 1.00 0.38 C HETATM 142 C5M 64T A 5 -2.009 -0.522 17.138 1.00 0.42 C HETATM 143 O5 64T A 5 -2.710 -2.570 18.045 1.00 0.35 O HETATM 144 C6 64T A 5 -2.287 -0.788 19.771 1.00 0.35 C HETATM 0 H5'' 64T A 5 0.588 -1.397 22.585 1.00 0.37 H new HETATM 0 H2'' 64T A 5 -3.439 0.695 22.514 1.00 0.44 H new HETATM 0 HO5 64T A 5 -1.766 -2.825 18.117 1.00 0.35 H new HETATM 0 H73 64T A 5 -2.417 -0.817 16.171 1.00 0.42 H new HETATM 0 H72 64T A 5 -2.049 0.563 17.234 1.00 0.42 H new HETATM 0 H71 64T A 5 -0.973 -0.854 17.211 1.00 0.42 H new HETATM 0 H62 64T A 5 -1.239 -1.073 19.857 1.00 0.35 H new HETATM 0 H5' 64T A 5 1.114 -0.573 24.039 1.00 0.37 H new HETATM 0 H4' 64T A 5 0.178 1.501 23.293 1.00 0.39 H new HETATM 0 H3' 64T A 5 -1.668 -0.951 23.111 1.00 0.41 H new HETATM 0 H3 64T A 5 -5.315 1.061 18.406 1.00 0.48 H new HETATM 0 H2' 64T A 5 -2.497 2.035 23.138 1.00 0.44 H new HETATM 0 H1' 64T A 5 -1.849 2.326 20.950 1.00 0.42 H new HETATM 158 OP1 TA3 A 6 -1.880 -0.497 27.144 1.00 0.59 O HETATM 159 OP2 TA3 A 6 -1.359 -2.210 25.347 1.00 0.42 O HETATM 160 P TA3 A 6 -2.059 -0.970 25.752 1.00 0.48 P HETATM 161 O5' TA3 A 6 -3.630 -1.148 25.461 1.00 0.47 O HETATM 162 C5' TA3 A 6 -4.753 -0.280 25.749 1.00 0.56 C HETATM 163 C4' TA3 A 6 -6.099 -0.804 25.200 1.00 0.54 C HETATM 164 O4' TA3 A 6 -6.039 -0.968 23.758 1.00 0.47 O HETATM 165 C3' TA3 A 6 -6.507 -2.150 25.745 1.00 0.52 C HETATM 166 O3' TA3 A 6 -7.939 -2.248 25.875 1.00 0.55 O HETATM 167 C2' TA3 A 6 -5.985 -3.099 24.711 1.00 0.41 C HETATM 168 C1' TA3 A 6 -6.330 -2.329 23.446 1.00 0.40 C HETATM 169 N1 TA3 A 6 -5.518 -2.822 22.279 1.00 0.33 N HETATM 170 C2 TA3 A 6 -5.610 -2.132 21.045 1.00 0.35 C HETATM 171 O2 TA3 A 6 -6.386 -2.307 20.098 1.00 0.35 O HETATM 172 N3 TA3 A 6 -4.384 -1.344 21.382 1.00 0.36 N HETATM 173 C4 TA3 A 6 -3.016 -1.578 20.819 1.00 0.32 C HETATM 174 C5 TA3 A 6 -3.079 -2.907 21.155 1.00 0.28 C HETATM 175 C5M TA3 A 6 -2.194 -4.058 21.011 1.00 0.26 C HETATM 176 C6 TA3 A 6 -4.019 -2.526 22.329 1.00 0.31 C HETATM 0 H5'' TA3 A 6 -4.836 -0.153 26.828 1.00 0.56 H new HETATM 0 H2'' TA3 A 6 -4.914 -3.277 24.811 1.00 0.41 H new HETATM 0 H73 TA3 A 6 -1.990 -4.230 19.954 1.00 0.26 H new HETATM 0 H72 TA3 A 6 -1.258 -3.865 21.535 1.00 0.26 H new HETATM 0 H71 TA3 A 6 -2.672 -4.940 21.436 1.00 0.26 H new HETATM 0 H6 TA3 A 6 -3.593 -2.750 23.307 1.00 0.31 H new HETATM 0 H5' TA3 A 6 -4.557 0.705 25.326 1.00 0.56 H new HETATM 0 H4' TA3 A 6 -6.824 -0.052 25.512 1.00 0.54 H new HETATM 0 H3' TA3 A 6 -6.118 -2.348 26.744 1.00 0.52 H new HETATM 0 H2' TA3 A 6 -6.475 -4.072 24.753 1.00 0.41 H new HETATM 0 H1' TA3 A 6 -7.371 -2.458 23.151 1.00 0.40 H new ATOM 188 P DA A 7 -8.821 -3.482 26.386 1.00 0.51 P ATOM 189 OP1 DA A 7 -10.105 -2.948 26.898 1.00 0.57 O ATOM 190 OP2 DA A 7 -8.006 -4.314 27.298 1.00 0.57 O ATOM 191 O5' DA A 7 -9.083 -4.283 25.015 1.00 0.41 O ATOM 192 C5' DA A 7 -10.072 -3.920 24.030 1.00 0.41 C ATOM 193 C4' DA A 7 -10.218 -4.931 22.894 1.00 0.33 C ATOM 194 O4' DA A 7 -9.215 -4.696 21.839 1.00 0.33 O ATOM 195 C3' DA A 7 -10.000 -6.385 23.337 1.00 0.32 C ATOM 196 O3' DA A 7 -10.936 -7.242 22.673 1.00 0.41 O ATOM 197 C2' DA A 7 -8.598 -6.708 22.819 1.00 0.33 C ATOM 198 C1' DA A 7 -8.654 -5.959 21.471 1.00 0.29 C ATOM 199 N9 DA A 7 -7.383 -5.735 20.721 1.00 0.29 N ATOM 200 C8 DA A 7 -6.085 -5.631 21.151 1.00 0.32 C ATOM 201 N7 DA A 7 -5.199 -5.431 20.201 1.00 0.33 N ATOM 202 C5 DA A 7 -5.953 -5.387 19.058 1.00 0.30 C ATOM 203 C6 DA A 7 -5.567 -5.195 17.716 1.00 0.31 C ATOM 204 N6 DA A 7 -4.283 -5.009 17.338 1.00 0.34 N ATOM 205 N1 DA A 7 -6.559 -5.211 16.806 1.00 0.31 N ATOM 206 C2 DA A 7 -7.821 -5.401 17.183 1.00 0.31 C ATOM 207 N3 DA A 7 -8.301 -5.590 18.413 1.00 0.29 N ATOM 208 C4 DA A 7 -7.298 -5.572 19.328 1.00 0.29 C ATOM 0 H5' DA A 7 -9.810 -2.950 23.608 1.00 0.41 H new ATOM 0 H5'' DA A 7 -11.036 -3.803 24.524 1.00 0.41 H new ATOM 0 H4' DA A 7 -11.240 -4.791 22.541 1.00 0.33 H new ATOM 0 H3' DA A 7 -10.120 -6.520 24.412 1.00 0.32 H new ATOM 0 H2' DA A 7 -7.811 -6.335 23.475 1.00 0.33 H new ATOM 0 H2'' DA A 7 -8.431 -7.778 22.698 1.00 0.33 H new ATOM 0 H1' DA A 7 -9.211 -6.575 20.765 1.00 0.29 H new ATOM 0 H8 DA A 7 -5.811 -5.708 22.193 1.00 0.32 H new ATOM 0 H61 DA A 7 -4.056 -4.874 16.353 1.00 0.34 H new ATOM 0 H62 DA A 7 -3.541 -5.003 18.038 1.00 0.34 H new ATOM 0 H2 DA A 7 -8.553 -5.402 16.389 1.00 0.31 H new ATOM 220 P DC A 8 -11.458 -8.689 23.120 1.00 0.41 P ATOM 221 OP1 DC A 8 -12.452 -8.530 24.202 1.00 0.77 O ATOM 222 OP2 DC A 8 -10.286 -9.562 23.376 1.00 0.71 O ATOM 223 O5' DC A 8 -12.211 -9.173 21.790 1.00 0.47 O ATOM 224 C5' DC A 8 -13.001 -8.402 20.858 1.00 0.45 C ATOM 225 C4' DC A 8 -12.625 -8.727 19.415 1.00 0.46 C ATOM 226 O4' DC A 8 -11.240 -8.350 19.152 1.00 0.46 O ATOM 227 C3' DC A 8 -12.704 -10.230 19.170 1.00 0.52 C ATOM 228 O3' DC A 8 -13.436 -10.525 17.965 1.00 0.58 O ATOM 229 C2' DC A 8 -11.238 -10.658 19.050 1.00 0.52 C ATOM 230 C1' DC A 8 -10.673 -9.389 18.386 1.00 0.48 C ATOM 231 N1 DC A 8 -9.190 -9.163 18.356 1.00 0.44 N ATOM 232 C2 DC A 8 -8.588 -8.722 17.126 1.00 0.44 C ATOM 233 O2 DC A 8 -9.239 -8.539 16.083 1.00 0.49 O ATOM 234 N3 DC A 8 -7.234 -8.495 17.100 1.00 0.40 N ATOM 235 C4 DC A 8 -6.487 -8.677 18.177 1.00 0.37 C ATOM 236 N4 DC A 8 -5.182 -8.429 18.041 1.00 0.35 N ATOM 237 C5 DC A 8 -7.049 -9.105 19.420 1.00 0.37 C ATOM 238 C6 DC A 8 -8.373 -9.330 19.471 1.00 0.40 C ATOM 0 H5' DC A 8 -12.853 -7.338 21.044 1.00 0.45 H new ATOM 0 H5'' DC A 8 -14.059 -8.609 21.016 1.00 0.45 H new ATOM 0 H4' DC A 8 -13.316 -8.181 18.773 1.00 0.46 H new ATOM 0 H3' DC A 8 -13.231 -10.758 19.964 1.00 0.52 H new ATOM 0 H2' DC A 8 -10.780 -10.868 20.016 1.00 0.52 H new ATOM 0 H2'' DC A 8 -11.108 -11.549 18.436 1.00 0.52 H new ATOM 0 H1' DC A 8 -10.916 -9.459 17.326 1.00 0.48 H new ATOM 0 H41 DC A 8 -4.554 -8.551 18.836 1.00 0.35 H new ATOM 0 H42 DC A 8 -4.813 -8.118 17.142 1.00 0.35 H new ATOM 0 H5 DC A 8 -6.428 -9.243 20.292 1.00 0.37 H new ATOM 0 H6 DC A 8 -8.816 -9.649 20.403 1.00 0.40 H new ATOM 250 P DG A 9 -14.102 -11.921 17.531 1.00 0.66 P ATOM 251 OP1 DG A 9 -15.493 -11.674 17.074 1.00 0.82 O ATOM 252 OP2 DG A 9 -13.901 -12.912 18.613 1.00 0.75 O ATOM 253 O5' DG A 9 -13.182 -12.303 16.269 1.00 0.51 O ATOM 254 C5' DG A 9 -13.292 -11.636 14.993 1.00 0.48 C ATOM 255 C4' DG A 9 -12.142 -11.952 14.046 1.00 0.39 C ATOM 256 O4' DG A 9 -10.888 -11.387 14.547 1.00 0.34 O ATOM 257 C3' DG A 9 -11.892 -13.462 13.909 1.00 0.40 C ATOM 258 O3' DG A 9 -11.945 -13.843 12.518 1.00 0.43 O ATOM 259 C2' DG A 9 -10.499 -13.652 14.543 1.00 0.39 C ATOM 260 C1' DG A 9 -9.868 -12.308 14.222 1.00 0.32 C ATOM 261 N9 DG A 9 -8.625 -11.967 14.951 1.00 0.30 N ATOM 262 C8 DG A 9 -8.337 -12.065 16.271 1.00 0.31 C ATOM 263 N7 DG A 9 -7.121 -11.683 16.602 1.00 0.30 N ATOM 264 C5 DG A 9 -6.560 -11.291 15.404 1.00 0.28 C ATOM 265 C6 DG A 9 -5.273 -10.782 15.130 1.00 0.29 C ATOM 266 O6 DG A 9 -4.374 -10.587 15.953 1.00 0.31 O ATOM 267 N1 DG A 9 -5.092 -10.506 13.760 1.00 0.30 N ATOM 268 C2 DG A 9 -6.066 -10.701 12.763 1.00 0.30 C ATOM 269 N2 DG A 9 -5.751 -10.382 11.496 1.00 0.34 N ATOM 270 N3 DG A 9 -7.274 -11.183 13.065 1.00 0.29 N ATOM 271 C4 DG A 9 -7.469 -11.455 14.367 1.00 0.28 C ATOM 0 H5' DG A 9 -13.333 -10.559 15.156 1.00 0.48 H new ATOM 0 H5'' DG A 9 -14.232 -11.923 14.521 1.00 0.48 H new ATOM 0 H4' DG A 9 -12.432 -11.525 13.086 1.00 0.39 H new ATOM 0 H3' DG A 9 -12.635 -14.091 14.399 1.00 0.40 H new ATOM 0 H2' DG A 9 -10.553 -13.840 15.615 1.00 0.39 H new ATOM 0 H2'' DG A 9 -9.951 -14.484 14.101 1.00 0.39 H new ATOM 0 H1' DG A 9 -9.536 -12.305 13.184 1.00 0.32 H new ATOM 0 H8 DG A 9 -9.050 -12.429 16.996 1.00 0.31 H new ATOM 0 H1 DG A 9 -4.187 -10.137 13.469 1.00 0.30 H new ATOM 0 H21 DG A 9 -6.436 -10.512 10.752 1.00 0.34 H new ATOM 0 H22 DG A 9 -4.827 -10.010 11.279 1.00 0.34 H new ATOM 283 P DC A 10 -11.444 -15.092 11.636 1.00 0.49 P ATOM 284 OP1 DC A 10 -12.453 -15.393 10.598 1.00 0.62 O ATOM 285 OP2 DC A 10 -10.995 -16.199 12.512 1.00 0.54 O ATOM 286 O5' DC A 10 -10.147 -14.469 10.915 1.00 0.49 O ATOM 287 C5' DC A 10 -10.078 -13.468 9.874 1.00 0.47 C ATOM 288 C4' DC A 10 -8.735 -13.464 9.119 1.00 0.45 C ATOM 289 O4' DC A 10 -7.647 -13.048 10.005 1.00 0.43 O ATOM 290 C3' DC A 10 -8.341 -14.847 8.603 1.00 0.50 C ATOM 291 O3' DC A 10 -7.640 -14.755 7.365 1.00 0.53 O ATOM 292 C2' DC A 10 -7.383 -15.363 9.667 1.00 0.50 C ATOM 293 C1' DC A 10 -6.660 -14.075 10.067 1.00 0.45 C ATOM 294 N1 DC A 10 -6.094 -14.088 11.446 1.00 0.42 N ATOM 295 C2 DC A 10 -4.707 -13.789 11.618 1.00 0.43 C ATOM 296 O2 DC A 10 -3.966 -13.534 10.653 1.00 0.47 O ATOM 297 N3 DC A 10 -4.184 -13.795 12.889 1.00 0.41 N ATOM 298 C4 DC A 10 -4.956 -14.073 13.950 1.00 0.39 C ATOM 299 N4 DC A 10 -4.407 -14.073 15.180 1.00 0.39 N ATOM 300 C5 DC A 10 -6.347 -14.375 13.805 1.00 0.39 C ATOM 301 C6 DC A 10 -6.870 -14.371 12.562 1.00 0.40 C ATOM 0 H5' DC A 10 -10.242 -12.484 10.314 1.00 0.47 H new ATOM 0 H5'' DC A 10 -10.886 -13.638 9.163 1.00 0.47 H new ATOM 0 H4' DC A 10 -8.878 -12.777 8.285 1.00 0.45 H new ATOM 0 H3' DC A 10 -9.210 -15.482 8.433 1.00 0.50 H new ATOM 0 H2' DC A 10 -7.908 -15.818 10.507 1.00 0.50 H new ATOM 0 H2'' DC A 10 -6.698 -16.114 9.274 1.00 0.50 H new ATOM 0 HO3' DC A 10 -7.398 -15.654 7.058 1.00 0.53 H new ATOM 0 H1' DC A 10 -5.812 -13.934 9.397 1.00 0.45 H new ATOM 0 H41 DC A 10 -4.983 -14.283 15.995 1.00 0.39 H new ATOM 0 H42 DC A 10 -3.416 -13.863 15.296 1.00 0.39 H new ATOM 0 H5 DC A 10 -6.960 -14.599 14.665 1.00 0.39 H new ATOM 0 H6 DC A 10 -7.919 -14.594 12.431 1.00 0.40 H new TER 314 DC A 10 ATOM 315 O5' DG B 11 7.740 -11.748 11.018 1.00 0.76 O ATOM 316 C5' DG B 11 6.898 -12.440 11.939 1.00 0.72 C ATOM 317 C4' DG B 11 5.499 -11.887 11.799 1.00 0.64 C ATOM 318 O4' DG B 11 4.570 -12.490 12.730 1.00 0.59 O ATOM 319 C3' DG B 11 5.492 -10.405 12.170 1.00 0.62 C ATOM 320 O3' DG B 11 5.435 -9.630 10.955 1.00 0.62 O ATOM 321 C2' DG B 11 4.254 -10.270 13.111 1.00 0.55 C ATOM 322 C1' DG B 11 3.516 -11.557 12.768 1.00 0.52 C ATOM 323 N9 DG B 11 2.442 -11.996 13.688 1.00 0.48 N ATOM 324 C8 DG B 11 2.432 -12.126 15.041 1.00 0.49 C ATOM 325 N7 DG B 11 1.283 -12.542 15.539 1.00 0.46 N ATOM 326 C5 DG B 11 0.472 -12.708 14.433 1.00 0.43 C ATOM 327 C6 DG B 11 -0.875 -13.141 14.338 1.00 0.41 C ATOM 328 O6 DG B 11 -1.613 -13.468 15.277 1.00 0.42 O ATOM 329 N1 DG B 11 -1.320 -13.164 13.000 1.00 0.41 N ATOM 330 C2 DG B 11 -0.564 -12.814 11.892 1.00 0.41 C ATOM 331 N2 DG B 11 -1.199 -12.925 10.722 1.00 0.42 N ATOM 332 N3 DG B 11 0.704 -12.415 12.015 1.00 0.43 N ATOM 333 C4 DG B 11 1.166 -12.376 13.277 1.00 0.44 C ATOM 0 H5' DG B 11 7.260 -12.308 12.959 1.00 0.72 H new ATOM 0 H5'' DG B 11 6.907 -13.510 11.733 1.00 0.72 H new ATOM 0 H4' DG B 11 5.205 -12.084 10.768 1.00 0.64 H new ATOM 0 H3' DG B 11 6.378 -10.035 12.686 1.00 0.62 H new ATOM 0 H2' DG B 11 4.534 -10.219 14.163 1.00 0.55 H new ATOM 0 H2'' DG B 11 3.662 -9.381 12.895 1.00 0.55 H new ATOM 0 HO5' DG B 11 8.656 -12.089 11.092 1.00 0.76 H new ATOM 0 H1' DG B 11 2.946 -11.429 11.848 1.00 0.52 H new ATOM 0 H8 DG B 11 3.292 -11.907 15.657 1.00 0.49 H new ATOM 0 H1 DG B 11 -2.281 -13.464 12.833 1.00 0.41 H new ATOM 0 H21 DG B 11 -0.716 -12.688 9.855 1.00 0.42 H new ATOM 0 H22 DG B 11 -2.166 -13.247 10.695 1.00 0.42 H new ATOM 346 P DC B 12 4.574 -8.382 10.395 1.00 0.59 P ATOM 347 OP1 DC B 12 5.283 -7.841 9.216 1.00 0.65 O ATOM 348 OP2 DC B 12 4.299 -7.457 11.519 1.00 0.59 O ATOM 349 O5' DC B 12 3.203 -9.090 9.934 1.00 0.51 O ATOM 350 C5' DC B 12 2.936 -9.997 8.835 1.00 0.50 C ATOM 351 C4' DC B 12 1.456 -10.066 8.394 1.00 0.45 C ATOM 352 O4' DC B 12 0.600 -10.468 9.499 1.00 0.40 O ATOM 353 C3' DC B 12 0.901 -8.739 7.907 1.00 0.44 C ATOM 354 O3' DC B 12 -0.127 -8.967 6.918 1.00 0.43 O ATOM 355 C2' DC B 12 0.300 -8.155 9.191 1.00 0.41 C ATOM 356 C1' DC B 12 -0.339 -9.428 9.747 1.00 0.36 C ATOM 357 N1 DC B 12 -0.695 -9.501 11.195 1.00 0.34 N ATOM 358 C2 DC B 12 -1.997 -9.958 11.578 1.00 0.31 C ATOM 359 O2 DC B 12 -2.866 -10.273 10.746 1.00 0.31 O ATOM 360 N3 DC B 12 -2.289 -10.046 12.918 1.00 0.31 N ATOM 361 C4 DC B 12 -1.402 -9.715 13.846 1.00 0.33 C ATOM 362 N4 DC B 12 -1.807 -9.835 15.118 1.00 0.33 N ATOM 363 C5 DC B 12 -0.086 -9.265 13.490 1.00 0.36 C ATOM 364 C6 DC B 12 0.214 -9.181 12.182 1.00 0.37 C ATOM 0 H5' DC B 12 3.262 -10.997 9.121 1.00 0.50 H new ATOM 0 H5'' DC B 12 3.541 -9.697 7.980 1.00 0.50 H new ATOM 0 H4' DC B 12 1.452 -10.789 7.578 1.00 0.45 H new ATOM 0 H3' DC B 12 1.638 -8.089 7.434 1.00 0.44 H new ATOM 0 H2' DC B 12 1.054 -7.735 9.857 1.00 0.41 H new ATOM 0 H2'' DC B 12 -0.428 -7.367 8.996 1.00 0.41 H new ATOM 0 H1' DC B 12 -1.307 -9.489 9.249 1.00 0.36 H new ATOM 0 H41 DC B 12 -1.172 -9.596 15.880 1.00 0.33 H new ATOM 0 H42 DC B 12 -2.750 -10.165 15.324 1.00 0.33 H new ATOM 0 H5 DC B 12 0.638 -9.003 14.247 1.00 0.36 H new ATOM 0 H6 DC B 12 1.201 -8.851 11.894 1.00 0.37 H new ATOM 376 P DG B 13 -0.700 -7.940 5.824 1.00 0.45 P ATOM 377 OP1 DG B 13 -1.196 -8.720 4.664 1.00 0.48 O ATOM 378 OP2 DG B 13 0.316 -6.898 5.552 1.00 0.49 O ATOM 379 O5' DG B 13 -1.947 -7.297 6.620 1.00 0.43 O ATOM 380 C5' DG B 13 -3.302 -7.794 6.680 1.00 0.43 C ATOM 381 C4' DG B 13 -4.178 -7.060 7.708 1.00 0.41 C ATOM 382 O4' DG B 13 -3.929 -7.541 9.076 1.00 0.38 O ATOM 383 C3' DG B 13 -3.904 -5.540 7.756 1.00 0.44 C ATOM 384 O3' DG B 13 -5.138 -4.788 7.721 1.00 0.45 O ATOM 385 C2' DG B 13 -3.257 -5.392 9.137 1.00 0.43 C ATOM 386 C1' DG B 13 -4.118 -6.405 9.891 1.00 0.38 C ATOM 387 N9 DG B 13 -3.768 -6.652 11.316 1.00 0.37 N ATOM 388 C8 DG B 13 -2.554 -6.591 11.919 1.00 0.38 C ATOM 389 N7 DG B 13 -2.557 -6.847 13.209 1.00 0.37 N ATOM 390 C5 DG B 13 -3.876 -7.101 13.492 1.00 0.37 C ATOM 391 C6 DG B 13 -4.467 -7.433 14.718 1.00 0.38 C ATOM 392 O6 DG B 13 -3.868 -7.569 15.788 1.00 0.38 O ATOM 393 N1 DG B 13 -5.858 -7.611 14.613 1.00 0.42 N ATOM 394 C2 DG B 13 -6.594 -7.487 13.427 1.00 0.44 C ATOM 395 N2 DG B 13 -7.917 -7.702 13.512 1.00 0.50 N ATOM 396 N3 DG B 13 -5.997 -7.164 12.268 1.00 0.41 N ATOM 397 C4 DG B 13 -4.660 -6.986 12.350 1.00 0.37 C ATOM 0 H5' DG B 13 -3.281 -8.856 6.925 1.00 0.43 H new ATOM 0 H5'' DG B 13 -3.758 -7.703 5.694 1.00 0.43 H new ATOM 0 H4' DG B 13 -5.199 -7.260 7.383 1.00 0.41 H new ATOM 0 H3' DG B 13 -3.303 -5.178 6.921 1.00 0.44 H new ATOM 0 H2' DG B 13 -2.198 -5.650 9.139 1.00 0.43 H new ATOM 0 H2'' DG B 13 -3.340 -4.382 9.539 1.00 0.43 H new ATOM 0 H1' DG B 13 -5.146 -6.065 10.016 1.00 0.38 H new ATOM 0 H8 DG B 13 -1.651 -6.350 11.379 1.00 0.38 H new ATOM 0 H1 DG B 13 -6.369 -7.848 15.463 1.00 0.42 H new ATOM 0 H21 DG B 13 -8.501 -7.625 12.679 1.00 0.50 H new ATOM 0 H22 DG B 13 -8.338 -7.942 14.409 1.00 0.50 H new ATOM 409 P DT B 14 -5.432 -3.262 7.293 1.00 0.45 P ATOM 410 OP1 DT B 14 -5.272 -3.130 5.828 1.00 0.64 O ATOM 411 OP2 DT B 14 -4.630 -2.368 8.168 1.00 0.46 O ATOM 412 O5' DT B 14 -6.989 -3.084 7.670 1.00 0.49 O ATOM 413 C5' DT B 14 -8.109 -3.995 7.534 1.00 0.47 C ATOM 414 C4' DT B 14 -8.881 -4.168 8.852 1.00 0.42 C ATOM 415 O4' DT B 14 -7.944 -4.494 9.925 1.00 0.42 O ATOM 416 C3' DT B 14 -9.578 -2.866 9.247 1.00 0.41 C ATOM 417 O3' DT B 14 -11.018 -3.011 9.272 1.00 0.53 O ATOM 418 C2' DT B 14 -9.059 -2.591 10.691 1.00 0.48 C ATOM 419 C1' DT B 14 -8.422 -3.944 11.126 1.00 0.43 C ATOM 420 N1 DT B 14 -7.269 -3.804 12.079 1.00 0.36 N ATOM 421 C2 DT B 14 -7.490 -4.234 13.415 1.00 0.40 C ATOM 422 O2 DT B 14 -8.543 -4.711 13.855 1.00 0.51 O ATOM 423 N3 DT B 14 -6.379 -4.083 14.246 1.00 0.35 N ATOM 424 C4 DT B 14 -5.120 -3.573 13.926 1.00 0.32 C ATOM 425 C5 DT B 14 -4.970 -3.149 12.541 1.00 0.34 C ATOM 426 C6 DT B 14 -6.023 -3.277 11.695 1.00 0.34 C ATOM 427 O4 DT B 14 -4.239 -3.510 14.798 1.00 0.34 O ATOM 440 C7 DT B 14 -3.666 -2.586 12.096 1.00 0.45 C ATOM 0 H5' DT B 14 -7.746 -4.966 7.197 1.00 0.47 H new ATOM 0 H5'' DT B 14 -8.786 -3.623 6.765 1.00 0.47 H new ATOM 0 H4' DT B 14 -9.616 -4.960 8.707 1.00 0.42 H new ATOM 0 H3' DT B 14 -9.365 -2.065 8.539 1.00 0.41 H new ATOM 0 H2' DT B 14 -8.328 -1.783 10.705 1.00 0.48 H new ATOM 0 H2'' DT B 14 -9.870 -2.299 11.358 1.00 0.48 H new ATOM 0 H1' DT B 14 -9.161 -4.547 11.654 1.00 0.43 H new ATOM 0 H3 DT B 14 -6.503 -4.384 15.212 1.00 0.35 H new ATOM 0 H71 DT B 14 -3.180 -2.087 12.934 1.00 0.45 H new ATOM 0 H72 DT B 14 -3.027 -3.391 11.733 1.00 0.45 H new ATOM 0 H73 DT B 14 -3.835 -1.867 11.294 1.00 0.45 H new ATOM 0 H6 DT B 14 -5.897 -2.957 10.671 1.00 0.34 H new ATOM 441 P DG B 15 -12.096 -1.826 9.476 1.00 0.48 P ATOM 442 OP1 DG B 15 -13.189 -1.975 8.488 1.00 0.51 O ATOM 443 OP2 DG B 15 -11.389 -0.528 9.557 1.00 0.51 O ATOM 444 O5' DG B 15 -12.655 -2.105 10.954 1.00 0.43 O ATOM 445 C5' DG B 15 -13.420 -3.215 11.468 1.00 0.43 C ATOM 446 C4' DG B 15 -13.658 -3.178 12.988 1.00 0.40 C ATOM 447 O4' DG B 15 -12.398 -3.057 13.697 1.00 0.36 O ATOM 448 C3' DG B 15 -14.491 -2.018 13.503 1.00 0.40 C ATOM 449 O3' DG B 15 -15.175 -2.354 14.723 1.00 0.40 O ATOM 450 C2' DG B 15 -13.482 -0.942 13.731 1.00 0.38 C ATOM 451 C1' DG B 15 -12.355 -1.793 14.357 1.00 0.36 C ATOM 452 N9 DG B 15 -10.957 -1.347 14.192 1.00 0.34 N ATOM 453 C8 DG B 15 -10.347 -0.811 13.099 1.00 0.36 C ATOM 454 N7 DG B 15 -9.071 -0.544 13.262 1.00 0.36 N ATOM 455 C5 DG B 15 -8.808 -0.936 14.551 1.00 0.34 C ATOM 456 C6 DG B 15 -7.604 -0.877 15.266 1.00 0.34 C ATOM 457 O6 DG B 15 -6.524 -0.452 14.837 1.00 0.37 O ATOM 458 N1 DG B 15 -7.755 -1.375 16.575 1.00 0.34 N ATOM 459 C2 DG B 15 -8.919 -1.872 17.134 1.00 0.34 C ATOM 460 N2 DG B 15 -8.729 -2.263 18.406 1.00 0.37 N ATOM 461 N3 DG B 15 -10.060 -1.919 16.432 1.00 0.33 N ATOM 462 C4 DG B 15 -9.953 -1.444 15.162 1.00 0.33 C ATOM 0 H5' DG B 15 -12.905 -4.142 11.216 1.00 0.43 H new ATOM 0 H5'' DG B 15 -14.385 -3.239 10.963 1.00 0.43 H new ATOM 0 H4' DG B 15 -14.195 -4.109 13.169 1.00 0.40 H new ATOM 0 H3' DG B 15 -15.278 -1.727 12.808 1.00 0.40 H new ATOM 0 H2' DG B 15 -13.175 -0.451 12.808 1.00 0.38 H new ATOM 0 H2'' DG B 15 -13.843 -0.162 14.402 1.00 0.38 H new ATOM 0 H1' DG B 15 -12.559 -1.757 15.427 1.00 0.36 H new ATOM 0 H8 DG B 15 -10.870 -0.621 12.173 1.00 0.36 H new ATOM 0 H1 DG B 15 -6.925 -1.369 17.169 1.00 0.34 H new ATOM 0 H21 DG B 15 -9.506 -2.651 18.942 1.00 0.37 H new ATOM 0 H22 DG B 15 -7.808 -2.172 18.835 1.00 0.37 H new ATOM 474 P DA B 16 -16.348 -1.530 15.428 1.00 0.39 P ATOM 475 OP1 DA B 16 -17.063 -2.438 16.354 1.00 0.44 O ATOM 476 OP2 DA B 16 -17.160 -0.862 14.386 1.00 0.42 O ATOM 477 O5' DA B 16 -15.545 -0.430 16.287 1.00 0.36 O ATOM 478 C5' DA B 16 -14.977 -0.633 17.598 1.00 0.43 C ATOM 479 C4' DA B 16 -14.024 0.483 18.027 1.00 0.47 C ATOM 480 O4' DA B 16 -12.724 0.353 17.379 1.00 0.44 O ATOM 481 C3' DA B 16 -14.507 1.909 17.671 1.00 0.50 C ATOM 482 O3' DA B 16 -14.724 2.690 18.870 1.00 0.61 O ATOM 483 C2' DA B 16 -13.366 2.449 16.789 1.00 0.49 C ATOM 484 C1' DA B 16 -12.224 1.660 17.397 1.00 0.47 C ATOM 485 N9 DA B 16 -10.869 1.787 16.820 1.00 0.47 N ATOM 486 C8 DA B 16 -10.462 1.915 15.531 1.00 0.49 C ATOM 487 N7 DA B 16 -9.162 2.028 15.375 1.00 0.52 N ATOM 488 C5 DA B 16 -8.675 1.968 16.656 1.00 0.52 C ATOM 489 C6 DA B 16 -7.355 2.029 17.141 1.00 0.55 C ATOM 490 N6 DA B 16 -6.305 2.173 16.311 1.00 0.59 N ATOM 491 N1 DA B 16 -7.194 1.941 18.478 1.00 0.57 N ATOM 492 C2 DA B 16 -8.266 1.802 19.261 1.00 0.56 C ATOM 493 N3 DA B 16 -9.547 1.724 18.910 1.00 0.53 N ATOM 494 C4 DA B 16 -9.689 1.819 17.572 1.00 0.50 C ATOM 0 H5' DA B 16 -14.442 -1.582 17.611 1.00 0.43 H new ATOM 0 H5'' DA B 16 -15.784 -0.712 18.327 1.00 0.43 H new ATOM 0 H4' DA B 16 -13.974 0.367 19.110 1.00 0.47 H new ATOM 0 H3' DA B 16 -15.467 1.942 17.155 1.00 0.50 H new ATOM 0 H2' DA B 16 -13.512 2.236 15.730 1.00 0.49 H new ATOM 0 H2'' DA B 16 -13.233 3.527 16.882 1.00 0.49 H new ATOM 0 H1' DA B 16 -11.986 2.061 18.382 1.00 0.47 H new ATOM 0 H8 DA B 16 -11.152 1.923 14.700 1.00 0.49 H new ATOM 0 H61 DA B 16 -5.358 2.214 16.689 1.00 0.59 H new ATOM 0 H62 DA B 16 -6.456 2.241 15.305 1.00 0.59 H new ATOM 0 H2 DA B 16 -8.067 1.745 20.321 1.00 0.56 H new ATOM 506 P DT B 17 -14.543 4.241 19.280 1.00 0.67 P ATOM 507 OP1 DT B 17 -15.423 4.539 20.432 1.00 0.80 O ATOM 508 OP2 DT B 17 -14.703 5.089 18.073 1.00 0.80 O ATOM 509 O5' DT B 17 -13.024 4.277 19.796 1.00 0.47 O ATOM 510 C5' DT B 17 -12.588 3.740 21.071 1.00 0.41 C ATOM 511 C4' DT B 17 -11.315 4.397 21.588 1.00 0.33 C ATOM 512 O4' DT B 17 -10.239 4.260 20.612 1.00 0.32 O ATOM 513 C3' DT B 17 -11.485 5.885 21.843 1.00 0.32 C ATOM 514 O3' DT B 17 -10.902 6.164 23.123 1.00 0.56 O ATOM 515 C2' DT B 17 -10.635 6.560 20.747 1.00 0.23 C ATOM 516 C1' DT B 17 -9.543 5.478 20.522 1.00 0.25 C ATOM 517 N1 DT B 17 -8.790 5.440 19.215 1.00 0.23 N ATOM 518 C2 DT B 17 -7.363 5.433 19.293 1.00 0.24 C ATOM 519 O2 DT B 17 -6.707 5.472 20.343 1.00 0.26 O ATOM 520 N3 DT B 17 -6.717 5.390 18.057 1.00 0.25 N ATOM 521 C4 DT B 17 -7.304 5.342 16.782 1.00 0.25 C ATOM 522 C5 DT B 17 -8.764 5.338 16.784 1.00 0.24 C ATOM 523 C6 DT B 17 -9.428 5.383 17.964 1.00 0.22 C ATOM 524 O4 DT B 17 -6.602 5.294 15.761 1.00 0.28 O ATOM 537 C7 DT B 17 -9.501 5.300 15.492 1.00 0.26 C ATOM 0 H5' DT B 17 -12.422 2.668 20.970 1.00 0.41 H new ATOM 0 H5'' DT B 17 -13.383 3.872 21.805 1.00 0.41 H new ATOM 0 H4' DT B 17 -11.081 3.891 22.525 1.00 0.33 H new ATOM 0 H3' DT B 17 -12.522 6.222 21.829 1.00 0.32 H new ATOM 0 H2' DT B 17 -11.210 6.762 19.843 1.00 0.23 H new ATOM 0 H2'' DT B 17 -10.214 7.510 21.076 1.00 0.23 H new ATOM 0 H1' DT B 17 -8.765 5.695 21.254 1.00 0.25 H new ATOM 0 H3 DT B 17 -5.697 5.394 18.082 1.00 0.25 H new ATOM 0 H71 DT B 17 -10.453 4.787 15.631 1.00 0.26 H new ATOM 0 H72 DT B 17 -9.684 6.318 15.147 1.00 0.26 H new ATOM 0 H73 DT B 17 -8.907 4.767 14.750 1.00 0.26 H new ATOM 0 H6 DT B 17 -10.508 5.375 17.942 1.00 0.22 H new ATOM 538 P DG B 18 -11.082 7.226 24.312 1.00 0.45 P ATOM 539 OP1 DG B 18 -10.726 6.539 25.581 1.00 0.85 O ATOM 540 OP2 DG B 18 -12.425 7.844 24.234 1.00 0.96 O ATOM 541 O5' DG B 18 -9.940 8.312 23.941 1.00 0.41 O ATOM 542 C5' DG B 18 -8.590 8.265 24.456 1.00 0.39 C ATOM 543 C4' DG B 18 -7.567 9.069 23.644 1.00 0.35 C ATOM 544 O4' DG B 18 -7.414 8.551 22.295 1.00 0.29 O ATOM 545 C3' DG B 18 -7.937 10.546 23.448 1.00 0.37 C ATOM 546 O3' DG B 18 -7.116 11.384 24.291 1.00 0.42 O ATOM 547 C2' DG B 18 -7.721 10.787 21.932 1.00 0.32 C ATOM 548 C1' DG B 18 -6.834 9.611 21.567 1.00 0.27 C ATOM 549 N9 DG B 18 -6.783 9.253 20.135 1.00 0.21 N ATOM 550 C8 DG B 18 -7.766 9.254 19.204 1.00 0.19 C ATOM 551 N7 DG B 18 -7.383 8.874 18.001 1.00 0.17 N ATOM 552 C5 DG B 18 -6.041 8.597 18.155 1.00 0.16 C ATOM 553 C6 DG B 18 -5.094 8.148 17.215 1.00 0.16 C ATOM 554 O6 DG B 18 -5.319 7.909 16.025 1.00 0.18 O ATOM 555 N1 DG B 18 -3.810 7.995 17.781 1.00 0.17 N ATOM 556 C2 DG B 18 -3.491 8.245 19.125 1.00 0.20 C ATOM 557 N2 DG B 18 -2.234 8.050 19.540 1.00 0.23 N ATOM 558 N3 DG B 18 -4.417 8.662 19.982 1.00 0.21 N ATOM 559 C4 DG B 18 -5.646 8.822 19.465 1.00 0.18 C ATOM 0 H5' DG B 18 -8.266 7.225 24.495 1.00 0.39 H new ATOM 0 H5'' DG B 18 -8.593 8.636 25.481 1.00 0.39 H new ATOM 0 H4' DG B 18 -6.659 8.977 24.240 1.00 0.35 H new ATOM 0 H3' DG B 18 -8.960 10.790 23.736 1.00 0.37 H new ATOM 0 H2' DG B 18 -8.659 10.782 21.377 1.00 0.32 H new ATOM 0 H2'' DG B 18 -7.238 11.744 21.733 1.00 0.32 H new ATOM 0 H1' DG B 18 -5.795 9.848 21.797 1.00 0.27 H new ATOM 0 H8 DG B 18 -8.782 9.543 19.429 1.00 0.19 H new ATOM 0 H1 DG B 18 -3.058 7.679 17.168 1.00 0.17 H new ATOM 0 H21 DG B 18 -1.985 8.227 20.513 1.00 0.23 H new ATOM 0 H22 DG B 18 -1.525 7.725 18.883 1.00 0.23 H new ATOM 571 P DC B 19 -6.332 12.785 24.164 1.00 0.47 P ATOM 572 OP1 DC B 19 -6.087 13.314 25.524 1.00 0.54 O ATOM 573 OP2 DC B 19 -7.044 13.670 23.210 1.00 0.48 O ATOM 574 O5' DC B 19 -4.927 12.335 23.524 1.00 0.42 O ATOM 575 C5' DC B 19 -3.903 11.531 24.159 1.00 0.42 C ATOM 576 C4' DC B 19 -2.590 11.475 23.364 1.00 0.40 C ATOM 577 O4' DC B 19 -2.827 10.933 22.034 1.00 0.34 O ATOM 578 C3' DC B 19 -1.966 12.852 23.176 1.00 0.44 C ATOM 579 O3' DC B 19 -0.533 12.776 23.283 1.00 0.49 O ATOM 580 C2' DC B 19 -2.384 13.225 21.750 1.00 0.40 C ATOM 581 C1' DC B 19 -2.325 11.850 21.079 1.00 0.34 C ATOM 582 N1 DC B 19 -3.142 11.713 19.841 1.00 0.29 N ATOM 583 C2 DC B 19 -2.520 11.256 18.638 1.00 0.26 C ATOM 584 O2 DC B 19 -1.312 10.976 18.591 1.00 0.26 O ATOM 585 N3 DC B 19 -3.290 11.123 17.501 1.00 0.25 N ATOM 586 C4 DC B 19 -4.601 11.428 17.525 1.00 0.27 C ATOM 587 N4 DC B 19 -5.337 11.296 16.404 1.00 0.29 N ATOM 588 C5 DC B 19 -5.239 11.883 18.726 1.00 0.29 C ATOM 589 C6 DC B 19 -4.493 12.006 19.829 1.00 0.30 C ATOM 0 H5' DC B 19 -4.280 10.517 24.295 1.00 0.42 H new ATOM 0 H5'' DC B 19 -3.701 11.932 25.152 1.00 0.42 H new ATOM 0 H4' DC B 19 -1.914 10.844 23.941 1.00 0.40 H new ATOM 0 H3' DC B 19 -2.285 13.579 23.923 1.00 0.44 H new ATOM 0 H2' DC B 19 -3.381 13.664 21.711 1.00 0.40 H new ATOM 0 H2'' DC B 19 -1.702 13.941 21.291 1.00 0.40 H new ATOM 0 H1' DC B 19 -1.294 11.677 20.771 1.00 0.34 H new ATOM 0 H41 DC B 19 -6.331 11.526 16.416 1.00 0.29 H new ATOM 0 H42 DC B 19 -4.900 10.966 15.543 1.00 0.29 H new ATOM 0 H5 DC B 19 -6.293 12.120 18.739 1.00 0.29 H new ATOM 0 H6 DC B 19 -4.962 12.346 20.741 1.00 0.30 H new ATOM 601 P DG B 20 0.498 13.994 23.459 1.00 0.62 P ATOM 602 OP1 DG B 20 1.733 13.508 24.120 1.00 0.77 O ATOM 603 OP2 DG B 20 -0.189 15.157 24.064 1.00 0.72 O ATOM 604 O5' DG B 20 0.824 14.304 21.920 1.00 0.53 O ATOM 605 C5' DG B 20 1.648 13.451 21.106 1.00 0.57 C ATOM 606 C4' DG B 20 1.779 13.947 19.674 1.00 0.44 C ATOM 607 O4' DG B 20 0.633 13.512 18.882 1.00 0.48 O ATOM 608 C3' DG B 20 1.777 15.475 19.571 1.00 0.63 C ATOM 609 O3' DG B 20 2.930 15.967 18.878 1.00 0.99 O ATOM 610 C2' DG B 20 0.553 15.798 18.704 1.00 0.54 C ATOM 611 C1' DG B 20 0.382 14.516 17.923 1.00 0.49 C ATOM 612 N9 DG B 20 -0.952 14.329 17.325 1.00 0.46 N ATOM 613 C8 DG B 20 -2.180 14.477 17.883 1.00 0.47 C ATOM 614 N7 DG B 20 -3.188 14.248 17.066 1.00 0.45 N ATOM 615 C5 DG B 20 -2.581 13.919 15.875 1.00 0.45 C ATOM 616 C6 DG B 20 -3.158 13.573 14.637 1.00 0.45 C ATOM 617 O6 DG B 20 -4.369 13.495 14.390 1.00 0.46 O ATOM 618 N1 DG B 20 -2.174 13.314 13.662 1.00 0.46 N ATOM 619 C2 DG B 20 -0.803 13.374 13.858 1.00 0.46 C ATOM 620 N2 DG B 20 -0.069 13.082 12.777 1.00 0.48 N ATOM 621 N3 DG B 20 -0.279 13.705 15.043 1.00 0.45 N ATOM 622 C4 DG B 20 -1.195 13.963 16.003 1.00 0.45 C ATOM 0 H5' DG B 20 1.227 12.446 21.100 1.00 0.57 H new ATOM 0 H5'' DG B 20 2.640 13.379 21.552 1.00 0.57 H new ATOM 0 H4' DG B 20 2.725 13.542 19.315 1.00 0.44 H new ATOM 0 H3' DG B 20 1.768 15.924 20.564 1.00 0.63 H new ATOM 0 H2' DG B 20 -0.325 16.030 19.306 1.00 0.54 H new ATOM 0 H2'' DG B 20 0.728 16.654 18.052 1.00 0.54 H new ATOM 0 HO3' DG B 20 2.891 16.945 18.832 1.00 0.99 H new ATOM 0 H1' DG B 20 1.050 14.505 17.062 1.00 0.49 H new ATOM 0 H8 DG B 20 -2.320 14.760 18.916 1.00 0.47 H new ATOM 0 H1 DG B 20 -2.499 13.060 12.729 1.00 0.46 H new ATOM 0 H21 DG B 20 0.949 13.102 12.831 1.00 0.48 H new ATOM 0 H22 DG B 20 -0.528 12.840 11.899 1.00 0.48 H new TER 635 DG B 20 CONECT 100 124 CONECT 124 100 125 126 128 CONECT 125 124 CONECT 126 124 CONECT 127 132 160 CONECT 128 124 129 CONECT 129 128 130 145 146 CONECT 130 129 131 132 147 CONECT 131 130 134 CONECT 132 127 130 133 148 CONECT 133 132 134 149 150 CONECT 134 131 133 135 151 CONECT 135 134 136 144 CONECT 136 135 137 138 CONECT 137 136 CONECT 138 136 139 152 CONECT 139 138 140 141 CONECT 140 139 CONECT 141 139 142 143 144 CONECT 142 141 153 154 155 CONECT 143 141 156 CONECT 144 135 141 157 173 CONECT 145 129 CONECT 146 129 CONECT 147 130 CONECT 148 132 CONECT 149 133 CONECT 150 133 CONECT 151 134 CONECT 152 138 CONECT 153 142 CONECT 154 142 CONECT 155 142 CONECT 156 143 CONECT 157 144 CONECT 158 160 CONECT 159 160 CONECT 160 127 158 159 161 CONECT 161 160 162 CONECT 162 161 163 177 178 CONECT 163 162 164 165 179 CONECT 164 163 168 CONECT 165 163 166 167 180 CONECT 166 165 188 CONECT 167 165 168 181 182 CONECT 168 164 167 169 183 CONECT 169 168 170 176 CONECT 170 169 171 172 CONECT 171 170 CONECT 172 170 173 176 CONECT 173 144 172 174 CONECT 174 173 175 176 CONECT 175 174 184 185 186 CONECT 176 169 172 174 187 CONECT 177 162 CONECT 178 162 CONECT 179 163 CONECT 180 165 CONECT 181 167 CONECT 182 167 CONECT 183 168 CONECT 184 175 CONECT 185 175 CONECT 186 175 CONECT 187 176 CONECT 188 166 END