USER MOD reduce.3.24.130724 H: found=0, std=0, add=206, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 206 hydrogens (0 hets) HEADER DNA 23-JUL-15 2N5P TITLE UNIVERSAL BASE CONTROL OLIGONUCLEOTIDE STRUCTURE COMPND MOL_ID: 1; COMPND 2 MOLECULE: DNA_(5'-D(*AP*TP*GP*GP*AP*GP*CP*TP*C)-3'); COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: DNA_(5'-D(*GP*AP*GP*CP*TP*CP*CP*AP*T)-3'); COMPND 7 CHAIN: B; COMPND 8 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; SOURCE 4 ORGANISM_TAXID: 32630; SOURCE 5 MOL_ID: 2; SOURCE 6 SYNTHETIC: YES; SOURCE 7 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; SOURCE 8 ORGANISM_TAXID: 32630 KEYWDS NUCLEIC ACID, DNA, UNIVERSAL BASE, SYNTHETIC BASE EXPDTA SOLUTION NMR AUTHOR A.M.SPRING-CONNELL,M.G.EVICH,F.SEELA,M.W.GERMANN REVDAT 1 07-SEP-16 2N5P 0 JRNL AUTH A.M.SPRING-CONNELL,M.G.EVICH,H.DEBELAK,F.SEELA,M.W.GERMANN JRNL TITL USING NMR AND MOLECULAR DYNAMICS TO LINK STRUCTURE AND JRNL TITL 2 DYNAMICS EFFECTS OF THE UNIVERSAL BASE 8-AZA, 7-DEAZA, N8 JRNL TITL 3 LINKED ADENOSINE ANALOG. JRNL REF NUCLEIC ACIDS RES. 2016 JRNL REFN ESSN 1362-4962 JRNL PMID 27566150 JRNL DOI 10.1093/NAR/GKW736 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : AMBER 9, CORMA, MARDIGRAS REMARK 3 AUTHORS : CASE, DARDEN, CHEATHAM, III, SIMMERLING, WANG, REMARK 3 DUKE, LUO, ... AND KOLLMAN (AMBER), THOMAS JAMES REMARK 3 (CORMA), THOMAS JAMES (MARDIGRAS) REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: AMBER 9 RESTRAINED MD SIMULATIONS, REMARK 3 MARDIGRAS, CORMA FOR COMPARISONS OF STRUCTURE TO NOE DATA (RX REMARK 3 VALUES). REMARK 4 REMARK 4 2N5P COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 27-JUL-15. REMARK 100 THE RCSB ID CODE IS RCSB104454. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 294 REMARK 210 PH : 6.79 REMARK 210 IONIC STRENGTH : 100 REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 1 MM DNA (5'-D(*AP*TP*GP*GP*AP* REMARK 210 GP*CP*TP*C)-3'), 1 MM DNA (5'-D(*GP*AP*GP*CP*TP*CP*CP*AP*T)-3'), REMARK 210 100 % 100% DEUTERIUM D2O, 100 MM SODIUM CHLORIDE, 10 MM SODIUM REMARK 210 PHOSPHATE, 100% D2O; 1 MM DNA (5'-D(*AP*TP*GP*GP*AP*GP*CP*TP*C)- REMARK 210 3'), 1 MM DNA (5'-D(*GP*AP*GP*CP*TP*CP*CP*AP*T)-3'), 100 MM REMARK 210 SODIUM CHLORIDE, 10 MM SODIUM PHOSPHATE, 90 % H2O, 10 % 100% REMARK 210 DEUTERIUM D2O, 90% H2O/10% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D 1H-1H NOESY 75 MS; 2D LOW REMARK 210 FLIP COSY; 2D 1H-13C HSQC; 2D 1H- REMARK 210 1H CONSTANT TIME NOESY; 2D 1H-1H REMARK 210 TOCSY; 2D 1H-31P CORR; 1D 1H; 1D REMARK 210 1H 1-1 JUMP AND RETURN; 1D 31P; REMARK 210 2D 1H-1H NOESY 150 MS; 2D 1H-1H REMARK 210 NOESY 250 MS REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ; 500 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : AMBER 9, SPARKY, XWINNMR, CORMA, REMARK 210 MARDIGRAS REMARK 210 METHOD USED : MOLECULAR DYNAMICS, MATRIX REMARK 210 RELAXATION, DISTANCE GEOMETRY REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 10 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : BACK CALCULATED DATA AGREE WITH REMARK 210 EXPERIMENTAL NOESY SPECTRUM REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 REMARK 210 REMARK 210 REMARK: NULL 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 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC 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 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 DA A 1 O4' - C1' - N9 ANGL. DEV. = 3.4 DEGREES REMARK 500 DA A 1 C4 - C5 - C6 ANGL. DEV. = -3.9 DEGREES REMARK 500 DA A 1 C5 - C6 - N1 ANGL. DEV. = 3.3 DEGREES REMARK 500 DA A 1 N1 - C6 - N6 ANGL. DEV. = -5.9 DEGREES REMARK 500 DT A 2 O4' - C1' - N1 ANGL. DEV. = 2.3 DEGREES REMARK 500 DG A 4 O4' - C4' - C3' ANGL. DEV. = 3.9 DEGREES REMARK 500 DA A 5 C4 - C5 - C6 ANGL. DEV. = -3.3 DEGREES REMARK 500 DA A 5 C5 - C6 - N1 ANGL. DEV. = 4.3 DEGREES REMARK 500 DA A 5 N1 - C6 - N6 ANGL. DEV. = -5.9 DEGREES REMARK 500 DG A 6 O4' - C1' - N9 ANGL. DEV. = 2.8 DEGREES REMARK 500 DC A 7 O4' - C4' - C3' ANGL. DEV. = 3.8 DEGREES REMARK 500 DC A 7 N3 - C2 - O2 ANGL. DEV. = -4.2 DEGREES REMARK 500 DT A 8 C6 - C5 - C7 ANGL. DEV. = -4.1 DEGREES REMARK 500 DC A 9 O4' - C1' - N1 ANGL. DEV. = 4.5 DEGREES REMARK 500 DC A 9 N3 - C2 - O2 ANGL. DEV. = -4.9 DEGREES REMARK 500 DA B 11 C4 - C5 - C6 ANGL. DEV. = -3.1 DEGREES REMARK 500 DA B 11 C5 - C6 - N1 ANGL. DEV. = 3.5 DEGREES REMARK 500 DA B 11 N1 - C6 - N6 ANGL. DEV. = -4.1 DEGREES REMARK 500 DG B 12 O4' - C1' - N9 ANGL. DEV. = 3.4 DEGREES REMARK 500 DT B 14 O4' - C4' - C3' ANGL. DEV. = 3.7 DEGREES REMARK 500 DC B 16 N3 - C2 - O2 ANGL. DEV. = -4.3 DEGREES REMARK 500 DA B 17 O4' - C4' - C3' ANGL. DEV. = 5.7 DEGREES REMARK 500 DA B 17 C4 - C5 - C6 ANGL. DEV. = -3.4 DEGREES REMARK 500 DA B 17 C5 - C6 - N1 ANGL. DEV. = 3.0 DEGREES REMARK 500 DA B 17 N1 - C6 - N6 ANGL. DEV. = -5.7 DEGREES REMARK 500 DT B 18 O4' - C1' - N1 ANGL. DEV. = 1.9 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 DG A 4 0.07 SIDE CHAIN REMARK 500 DT A 8 0.06 SIDE CHAIN REMARK 500 DC A 9 0.07 SIDE CHAIN REMARK 500 DT B 18 0.09 SIDE CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 25724 RELATED DB: BMRB REMARK 900 RELATED ID: 2N5O RELATED DB: PDB DBREF 2N5P A 1 9 PDB 2N5P 2N5P 1 9 DBREF 2N5P B 10 18 PDB 2N5P 2N5P 10 18 SEQRES 1 A 9 DA DT DG DG DA DG DC DT DC SEQRES 1 B 9 DG DA DG DC DT DC DC DA DT 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 Single : A 1 DA O5' : rot 180:sc= 0 USER MOD Single : A 2 DT C7 :methyl -30:sc= 0 (180deg=-0.868) USER MOD Single : A 8 DT C7 :methyl -30:sc=-0.00148 (180deg=-0.0174) USER MOD Single : A 9 DC O3' : rot 180:sc= 0 USER MOD Single : B 10 DG O5' : rot 36:sc= 0.424 USER MOD Single : B 14 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 18 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 18 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 20.923 31.888 10.923 1.00 0.00 O ATOM 2 C5' DA A 1 20.882 31.179 9.690 1.00 0.00 C ATOM 3 C4' DA A 1 21.457 29.750 9.754 1.00 0.00 C ATOM 4 O4' DA A 1 22.879 29.822 9.837 1.00 0.00 O ATOM 5 C3' DA A 1 20.975 28.910 10.946 1.00 0.00 C ATOM 6 O3' DA A 1 20.898 27.536 10.579 1.00 0.00 O ATOM 7 C2' DA A 1 22.066 29.167 11.979 1.00 0.00 C ATOM 8 C1' DA A 1 23.304 29.353 11.110 1.00 0.00 C ATOM 9 N9 DA A 1 24.266 30.281 11.741 1.00 0.00 N ATOM 10 C8 DA A 1 24.134 31.619 12.029 1.00 0.00 C ATOM 11 N7 DA A 1 25.164 32.144 12.650 1.00 0.00 N ATOM 12 C5 DA A 1 26.038 31.046 12.779 1.00 0.00 C ATOM 13 C6 DA A 1 27.338 30.837 13.306 1.00 0.00 C ATOM 14 N6 DA A 1 28.113 31.752 13.851 1.00 0.00 N ATOM 15 N1 DA A 1 27.912 29.633 13.264 1.00 0.00 N ATOM 16 C2 DA A 1 27.239 28.634 12.719 1.00 0.00 C ATOM 17 N3 DA A 1 26.031 28.665 12.183 1.00 0.00 N ATOM 18 C4 DA A 1 25.489 29.914 12.236 1.00 0.00 C ATOM 0 H5' DA A 1 21.435 31.746 8.941 1.00 0.00 H new ATOM 0 H5'' DA A 1 19.848 31.126 9.350 1.00 0.00 H new ATOM 0 H4' DA A 1 21.103 29.258 8.848 1.00 0.00 H new ATOM 0 H3' DA A 1 19.979 29.164 11.309 1.00 0.00 H new ATOM 0 H2' DA A 1 21.855 30.051 12.580 1.00 0.00 H new ATOM 0 H2'' DA A 1 22.176 28.331 12.669 1.00 0.00 H new ATOM 0 HO5' DA A 1 20.543 32.783 10.799 1.00 0.00 H new ATOM 0 H1' DA A 1 23.827 28.404 10.994 1.00 0.00 H new ATOM 0 H8 DA A 1 23.256 32.190 11.766 1.00 0.00 H new ATOM 0 H61 DA A 1 29.036 31.496 14.201 1.00 0.00 H new ATOM 0 H62 DA A 1 27.790 32.717 13.923 1.00 0.00 H new ATOM 0 H2 DA A 1 27.737 27.676 12.711 1.00 0.00 H new ATOM 31 P DT A 2 20.387 26.403 11.589 1.00 0.00 P ATOM 32 OP1 DT A 2 19.652 25.380 10.808 1.00 0.00 O ATOM 33 OP2 DT A 2 19.716 27.040 12.747 1.00 0.00 O ATOM 34 O5' DT A 2 21.740 25.741 12.124 1.00 0.00 O ATOM 35 C5' DT A 2 22.679 25.165 11.220 1.00 0.00 C ATOM 36 C4' DT A 2 23.865 24.462 11.901 1.00 0.00 C ATOM 37 O4' DT A 2 24.721 25.439 12.486 1.00 0.00 O ATOM 38 C3' DT A 2 23.522 23.429 12.983 1.00 0.00 C ATOM 39 O3' DT A 2 24.410 22.316 12.848 1.00 0.00 O ATOM 40 C2' DT A 2 23.773 24.219 14.260 1.00 0.00 C ATOM 41 C1' DT A 2 24.957 25.086 13.841 1.00 0.00 C ATOM 42 N1 DT A 2 25.158 26.299 14.670 1.00 0.00 N ATOM 43 C2 DT A 2 26.398 26.524 15.280 1.00 0.00 C ATOM 44 O2 DT A 2 27.332 25.720 15.248 1.00 0.00 O ATOM 45 N3 DT A 2 26.555 27.734 15.919 1.00 0.00 N ATOM 46 C4 DT A 2 25.613 28.734 16.004 1.00 0.00 C ATOM 47 O4 DT A 2 25.921 29.793 16.553 1.00 0.00 O ATOM 48 C5 DT A 2 24.327 28.413 15.385 1.00 0.00 C ATOM 49 C7 DT A 2 23.187 29.413 15.430 1.00 0.00 C ATOM 50 C6 DT A 2 24.149 27.222 14.751 1.00 0.00 C ATOM 0 H5' DT A 2 23.063 25.948 10.566 1.00 0.00 H new ATOM 0 H5'' DT A 2 22.161 24.446 10.586 1.00 0.00 H new ATOM 0 H4' DT A 2 24.337 23.899 11.095 1.00 0.00 H new ATOM 0 H3' DT A 2 22.514 23.016 12.944 1.00 0.00 H new ATOM 0 H2' DT A 2 22.909 24.815 14.552 1.00 0.00 H new ATOM 0 H2'' DT A 2 24.014 23.572 15.104 1.00 0.00 H new ATOM 0 H1' DT A 2 25.877 24.517 13.979 1.00 0.00 H new ATOM 0 H3 DT A 2 27.453 27.905 16.371 1.00 0.00 H new ATOM 0 H71 DT A 2 23.267 30.016 16.334 1.00 0.00 H new ATOM 0 H72 DT A 2 23.237 30.062 14.556 1.00 0.00 H new ATOM 0 H73 DT A 2 22.236 28.881 15.432 1.00 0.00 H new ATOM 0 H6 DT A 2 23.192 27.000 14.302 1.00 0.00 H new ATOM 63 P DG A 3 24.316 21.001 13.758 1.00 0.00 P ATOM 64 OP1 DG A 3 24.803 19.852 12.961 1.00 0.00 O ATOM 65 OP2 DG A 3 22.961 20.920 14.341 1.00 0.00 O ATOM 66 O5' DG A 3 25.360 21.219 14.956 1.00 0.00 O ATOM 67 C5' DG A 3 26.761 21.050 14.750 1.00 0.00 C ATOM 68 C4' DG A 3 27.594 21.088 16.041 1.00 0.00 C ATOM 69 O4' DG A 3 27.738 22.418 16.523 1.00 0.00 O ATOM 70 C3' DG A 3 27.047 20.209 17.179 1.00 0.00 C ATOM 71 O3' DG A 3 28.126 19.437 17.700 1.00 0.00 O ATOM 72 C2' DG A 3 26.531 21.247 18.171 1.00 0.00 C ATOM 73 C1' DG A 3 27.472 22.421 17.915 1.00 0.00 C ATOM 74 N9 DG A 3 26.947 23.750 18.306 1.00 0.00 N ATOM 75 C8 DG A 3 25.682 24.265 18.170 1.00 0.00 C ATOM 76 N7 DG A 3 25.554 25.500 18.580 1.00 0.00 N ATOM 77 C5 DG A 3 26.831 25.821 19.061 1.00 0.00 C ATOM 78 C6 DG A 3 27.351 27.010 19.688 1.00 0.00 C ATOM 79 O6 DG A 3 26.788 28.075 19.940 1.00 0.00 O ATOM 80 N1 DG A 3 28.662 26.890 20.087 1.00 0.00 N ATOM 81 C2 DG A 3 29.406 25.776 19.915 1.00 0.00 C ATOM 82 N2 DG A 3 30.622 25.816 20.368 1.00 0.00 N ATOM 83 N3 DG A 3 28.996 24.672 19.292 1.00 0.00 N ATOM 84 C4 DG A 3 27.683 24.747 18.907 1.00 0.00 C ATOM 0 H5' DG A 3 27.116 21.832 14.078 1.00 0.00 H new ATOM 0 H5'' DG A 3 26.931 20.097 14.248 1.00 0.00 H new ATOM 0 H4' DG A 3 28.561 20.676 15.751 1.00 0.00 H new ATOM 0 H3' DG A 3 26.270 19.496 16.902 1.00 0.00 H new ATOM 0 H2' DG A 3 25.490 21.509 17.983 1.00 0.00 H new ATOM 0 H2'' DG A 3 26.590 20.893 19.200 1.00 0.00 H new ATOM 0 H1' DG A 3 28.356 22.279 18.536 1.00 0.00 H new ATOM 0 H8 DG A 3 24.861 23.697 17.759 1.00 0.00 H new ATOM 0 H1 DG A 3 29.099 27.692 20.541 1.00 0.00 H new ATOM 0 H21 DG A 3 31.231 25.004 20.267 1.00 0.00 H new ATOM 0 H22 DG A 3 30.968 26.659 20.825 1.00 0.00 H new ATOM 96 P DG A 4 27.951 18.293 18.802 1.00 0.00 P ATOM 97 OP1 DG A 4 28.885 17.201 18.443 1.00 0.00 O ATOM 98 OP2 DG A 4 26.517 17.980 19.008 1.00 0.00 O ATOM 99 O5' DG A 4 28.476 18.962 20.140 1.00 0.00 O ATOM 100 C5' DG A 4 29.862 19.186 20.359 1.00 0.00 C ATOM 101 C4' DG A 4 30.102 20.010 21.629 1.00 0.00 C ATOM 102 O4' DG A 4 29.615 21.325 21.458 1.00 0.00 O ATOM 103 C3' DG A 4 29.498 19.388 22.898 1.00 0.00 C ATOM 104 O3' DG A 4 30.298 19.622 24.044 1.00 0.00 O ATOM 105 C2' DG A 4 28.275 20.262 23.069 1.00 0.00 C ATOM 106 C1' DG A 4 28.847 21.606 22.602 1.00 0.00 C ATOM 107 N9 DG A 4 27.818 22.595 22.266 1.00 0.00 N ATOM 108 C8 DG A 4 26.592 22.357 21.731 1.00 0.00 C ATOM 109 N7 DG A 4 25.785 23.391 21.732 1.00 0.00 N ATOM 110 C5 DG A 4 26.596 24.414 22.267 1.00 0.00 C ATOM 111 C6 DG A 4 26.340 25.801 22.566 1.00 0.00 C ATOM 112 O6 DG A 4 25.302 26.449 22.440 1.00 0.00 O ATOM 113 N1 DG A 4 27.438 26.469 23.069 1.00 0.00 N ATOM 114 C2 DG A 4 28.640 25.889 23.288 1.00 0.00 C ATOM 115 N2 DG A 4 29.594 26.636 23.754 1.00 0.00 N ATOM 116 N3 DG A 4 28.920 24.611 23.070 1.00 0.00 N ATOM 117 C4 DG A 4 27.854 23.930 22.557 1.00 0.00 C ATOM 0 H5' DG A 4 30.288 19.705 19.501 1.00 0.00 H new ATOM 0 H5'' DG A 4 30.378 18.229 20.441 1.00 0.00 H new ATOM 0 H4' DG A 4 31.182 20.024 21.779 1.00 0.00 H new ATOM 0 H3' DG A 4 29.358 18.311 22.808 1.00 0.00 H new ATOM 0 H2' DG A 4 27.436 19.930 22.458 1.00 0.00 H new ATOM 0 H2'' DG A 4 27.925 20.293 24.101 1.00 0.00 H new ATOM 0 H1' DG A 4 29.427 22.047 23.412 1.00 0.00 H new ATOM 0 H8 DG A 4 26.305 21.394 21.336 1.00 0.00 H new ATOM 0 H1 DG A 4 27.337 27.460 23.289 1.00 0.00 H new ATOM 0 H21 DG A 4 30.515 26.235 23.932 1.00 0.00 H new ATOM 0 H22 DG A 4 29.423 27.624 23.942 1.00 0.00 H new ATOM 129 P DA A 5 31.422 18.623 24.541 1.00 0.00 P ATOM 130 OP1 DA A 5 32.312 18.276 23.408 1.00 0.00 O ATOM 131 OP2 DA A 5 30.771 17.544 25.317 1.00 0.00 O ATOM 132 O5' DA A 5 32.194 19.589 25.550 1.00 0.00 O ATOM 133 C5' DA A 5 33.015 20.649 25.058 1.00 0.00 C ATOM 134 C4' DA A 5 33.332 21.767 26.073 1.00 0.00 C ATOM 135 O4' DA A 5 32.379 22.821 25.973 1.00 0.00 O ATOM 136 C3' DA A 5 33.357 21.299 27.532 1.00 0.00 C ATOM 137 O3' DA A 5 34.430 21.895 28.260 1.00 0.00 O ATOM 138 C2' DA A 5 31.963 21.693 28.015 1.00 0.00 C ATOM 139 C1' DA A 5 31.584 22.893 27.145 1.00 0.00 C ATOM 140 N9 DA A 5 30.155 22.964 26.735 1.00 0.00 N ATOM 141 C8 DA A 5 29.328 21.962 26.274 1.00 0.00 C ATOM 142 N7 DA A 5 28.126 22.362 25.935 1.00 0.00 N ATOM 143 C5 DA A 5 28.168 23.742 26.203 1.00 0.00 C ATOM 144 C6 DA A 5 27.245 24.813 26.103 1.00 0.00 C ATOM 145 N6 DA A 5 26.004 24.711 25.676 1.00 0.00 N ATOM 146 N1 DA A 5 27.563 26.057 26.470 1.00 0.00 N ATOM 147 C2 DA A 5 28.792 26.255 26.919 1.00 0.00 C ATOM 148 N3 DA A 5 29.767 25.366 27.089 1.00 0.00 N ATOM 149 C4 DA A 5 29.391 24.112 26.697 1.00 0.00 C ATOM 0 H5' DA A 5 32.523 21.095 24.194 1.00 0.00 H new ATOM 0 H5'' DA A 5 33.955 20.224 24.706 1.00 0.00 H new ATOM 0 H4' DA A 5 34.334 22.106 25.811 1.00 0.00 H new ATOM 0 H3' DA A 5 33.549 20.235 27.668 1.00 0.00 H new ATOM 0 H2' DA A 5 31.254 20.874 27.893 1.00 0.00 H new ATOM 0 H2'' DA A 5 31.968 21.955 29.073 1.00 0.00 H new ATOM 0 H1' DA A 5 31.756 23.784 27.749 1.00 0.00 H new ATOM 0 H8 DA A 5 29.644 20.932 26.198 1.00 0.00 H new ATOM 0 H61 DA A 5 25.408 25.538 25.637 1.00 0.00 H new ATOM 0 H62 DA A 5 25.638 23.805 25.384 1.00 0.00 H new ATOM 0 H2 DA A 5 29.036 27.274 27.182 1.00 0.00 H new ATOM 161 P DG A 6 34.833 21.391 29.731 1.00 0.00 P ATOM 162 OP1 DG A 6 36.231 21.803 29.986 1.00 0.00 O ATOM 163 OP2 DG A 6 34.496 19.959 29.873 1.00 0.00 O ATOM 164 O5' DG A 6 33.905 22.235 30.698 1.00 0.00 O ATOM 165 C5' DG A 6 34.069 23.646 30.779 1.00 0.00 C ATOM 166 C4' DG A 6 32.844 24.348 31.360 1.00 0.00 C ATOM 167 O4' DG A 6 31.735 24.262 30.474 1.00 0.00 O ATOM 168 C3' DG A 6 32.423 23.806 32.733 1.00 0.00 C ATOM 169 O3' DG A 6 32.321 24.926 33.593 1.00 0.00 O ATOM 170 C2' DG A 6 31.072 23.181 32.419 1.00 0.00 C ATOM 171 C1' DG A 6 30.591 24.065 31.296 1.00 0.00 C ATOM 172 N9 DG A 6 29.471 23.485 30.521 1.00 0.00 N ATOM 173 C8 DG A 6 29.250 22.185 30.140 1.00 0.00 C ATOM 174 N7 DG A 6 28.107 21.987 29.532 1.00 0.00 N ATOM 175 C5 DG A 6 27.512 23.258 29.539 1.00 0.00 C ATOM 176 C6 DG A 6 26.247 23.739 29.042 1.00 0.00 C ATOM 177 O6 DG A 6 25.367 23.139 28.417 1.00 0.00 O ATOM 178 N1 DG A 6 26.043 25.083 29.288 1.00 0.00 N ATOM 179 C2 DG A 6 26.965 25.895 29.859 1.00 0.00 C ATOM 180 N2 DG A 6 26.682 27.155 30.005 1.00 0.00 N ATOM 181 N3 DG A 6 28.151 25.512 30.301 1.00 0.00 N ATOM 182 C4 DG A 6 28.358 24.175 30.125 1.00 0.00 C ATOM 0 H5' DG A 6 34.272 24.042 29.784 1.00 0.00 H new ATOM 0 H5'' DG A 6 34.939 23.872 31.396 1.00 0.00 H new ATOM 0 H4' DG A 6 33.144 25.388 31.490 1.00 0.00 H new ATOM 0 H3' DG A 6 33.091 23.091 33.214 1.00 0.00 H new ATOM 0 H2' DG A 6 31.163 22.139 32.112 1.00 0.00 H new ATOM 0 H2'' DG A 6 30.400 23.203 33.277 1.00 0.00 H new ATOM 0 H1' DG A 6 30.184 24.996 31.691 1.00 0.00 H new ATOM 0 H8 DG A 6 29.959 21.392 30.326 1.00 0.00 H new ATOM 0 H1 DG A 6 25.145 25.488 29.024 1.00 0.00 H new ATOM 0 H21 DG A 6 27.362 27.784 30.432 1.00 0.00 H new ATOM 0 H22 DG A 6 25.780 27.515 29.692 1.00 0.00 H new ATOM 194 P DC A 7 32.259 24.835 35.178 1.00 0.00 P ATOM 195 OP1 DC A 7 33.498 25.437 35.721 1.00 0.00 O ATOM 196 OP2 DC A 7 31.875 23.469 35.596 1.00 0.00 O ATOM 197 O5' DC A 7 31.034 25.811 35.458 1.00 0.00 O ATOM 198 C5' DC A 7 31.158 27.205 35.196 1.00 0.00 C ATOM 199 C4' DC A 7 29.810 27.895 34.982 1.00 0.00 C ATOM 200 O4' DC A 7 29.130 27.363 33.851 1.00 0.00 O ATOM 201 C3' DC A 7 28.909 27.812 36.212 1.00 0.00 C ATOM 202 O3' DC A 7 29.047 28.996 36.995 1.00 0.00 O ATOM 203 C2' DC A 7 27.525 27.644 35.588 1.00 0.00 C ATOM 204 C1' DC A 7 27.739 27.301 34.112 1.00 0.00 C ATOM 205 N1 DC A 7 27.229 25.939 33.764 1.00 0.00 N ATOM 206 C2 DC A 7 25.950 25.817 33.207 1.00 0.00 C ATOM 207 O2 DC A 7 25.199 26.790 33.108 1.00 0.00 O ATOM 208 N3 DC A 7 25.495 24.623 32.757 1.00 0.00 N ATOM 209 C4 DC A 7 26.274 23.566 32.888 1.00 0.00 C ATOM 210 N4 DC A 7 25.835 22.456 32.372 1.00 0.00 N ATOM 211 C5 DC A 7 27.556 23.610 33.498 1.00 0.00 C ATOM 212 C6 DC A 7 28.003 24.816 33.935 1.00 0.00 C ATOM 0 H5' DC A 7 31.778 27.349 34.311 1.00 0.00 H new ATOM 0 H5'' DC A 7 31.675 27.681 36.029 1.00 0.00 H new ATOM 0 H4' DC A 7 30.033 28.947 34.802 1.00 0.00 H new ATOM 0 H3' DC A 7 29.138 27.003 36.906 1.00 0.00 H new ATOM 0 H2' DC A 7 26.968 26.853 36.091 1.00 0.00 H new ATOM 0 H2'' DC A 7 26.942 28.559 35.691 1.00 0.00 H new ATOM 0 H1' DC A 7 27.183 28.015 33.504 1.00 0.00 H new ATOM 0 H41 DC A 7 26.393 21.605 32.442 1.00 0.00 H new ATOM 0 H42 DC A 7 24.932 22.436 31.898 1.00 0.00 H new ATOM 0 H5 DC A 7 28.153 22.717 33.610 1.00 0.00 H new ATOM 0 H6 DC A 7 28.967 24.893 34.417 1.00 0.00 H new ATOM 224 P DT A 8 28.507 29.096 38.497 1.00 0.00 P ATOM 225 OP1 DT A 8 28.914 30.409 39.053 1.00 0.00 O ATOM 226 OP2 DT A 8 28.895 27.862 39.224 1.00 0.00 O ATOM 227 O5' DT A 8 26.922 29.100 38.364 1.00 0.00 O ATOM 228 C5' DT A 8 26.226 30.190 37.767 1.00 0.00 C ATOM 229 C4' DT A 8 24.723 29.894 37.695 1.00 0.00 C ATOM 230 O4' DT A 8 24.466 28.716 36.958 1.00 0.00 O ATOM 231 C3' DT A 8 24.108 29.747 39.090 1.00 0.00 C ATOM 232 O3' DT A 8 22.898 30.486 39.038 1.00 0.00 O ATOM 233 C2' DT A 8 23.865 28.243 39.196 1.00 0.00 C ATOM 234 C1' DT A 8 23.594 27.918 37.725 1.00 0.00 C ATOM 235 N1 DT A 8 23.829 26.500 37.349 1.00 0.00 N ATOM 236 C2 DT A 8 22.864 25.848 36.571 1.00 0.00 C ATOM 237 O2 DT A 8 21.768 26.339 36.287 1.00 0.00 O ATOM 238 N3 DT A 8 23.186 24.595 36.106 1.00 0.00 N ATOM 239 C4 DT A 8 24.379 23.939 36.322 1.00 0.00 C ATOM 240 O4 DT A 8 24.561 22.852 35.779 1.00 0.00 O ATOM 241 C5 DT A 8 25.333 24.660 37.164 1.00 0.00 C ATOM 242 C7 DT A 8 26.685 24.057 37.496 1.00 0.00 C ATOM 243 C6 DT A 8 25.035 25.897 37.639 1.00 0.00 C ATOM 0 H5' DT A 8 26.615 30.372 36.765 1.00 0.00 H new ATOM 0 H5'' DT A 8 26.396 31.098 38.345 1.00 0.00 H new ATOM 0 H4' DT A 8 24.265 30.745 37.191 1.00 0.00 H new ATOM 0 H3' DT A 8 24.696 30.102 39.936 1.00 0.00 H new ATOM 0 H2' DT A 8 24.729 27.707 39.590 1.00 0.00 H new ATOM 0 H2'' DT A 8 23.019 28.001 39.840 1.00 0.00 H new ATOM 0 H1' DT A 8 22.537 28.113 37.544 1.00 0.00 H new ATOM 0 H3 DT A 8 22.481 24.108 35.553 1.00 0.00 H new ATOM 0 H71 DT A 8 26.604 22.970 37.513 1.00 0.00 H new ATOM 0 H72 DT A 8 27.412 24.355 36.740 1.00 0.00 H new ATOM 0 H73 DT A 8 27.011 24.412 38.474 1.00 0.00 H new ATOM 0 H6 DT A 8 25.754 26.417 38.254 1.00 0.00 H new ATOM 256 P DC A 9 22.192 31.123 40.301 1.00 0.00 P ATOM 257 OP1 DC A 9 21.261 32.142 39.779 1.00 0.00 O ATOM 258 OP2 DC A 9 23.233 31.554 41.257 1.00 0.00 O ATOM 259 O5' DC A 9 21.329 29.941 40.940 1.00 0.00 O ATOM 260 C5' DC A 9 20.111 29.534 40.317 1.00 0.00 C ATOM 261 C4' DC A 9 19.628 28.128 40.703 1.00 0.00 C ATOM 262 O4' DC A 9 20.431 27.161 40.025 1.00 0.00 O ATOM 263 C3' DC A 9 19.677 27.813 42.212 1.00 0.00 C ATOM 264 O3' DC A 9 18.520 27.101 42.634 1.00 0.00 O ATOM 265 C2' DC A 9 20.908 26.923 42.253 1.00 0.00 C ATOM 266 C1' DC A 9 20.725 26.143 40.955 1.00 0.00 C ATOM 267 N1 DC A 9 21.873 25.294 40.537 1.00 0.00 N ATOM 268 C2 DC A 9 21.622 24.272 39.607 1.00 0.00 C ATOM 269 O2 DC A 9 20.544 24.174 39.012 1.00 0.00 O ATOM 270 N3 DC A 9 22.557 23.335 39.339 1.00 0.00 N ATOM 271 C4 DC A 9 23.699 23.388 39.992 1.00 0.00 C ATOM 272 N4 DC A 9 24.528 22.422 39.733 1.00 0.00 N ATOM 273 C5 DC A 9 24.037 24.420 40.907 1.00 0.00 C ATOM 274 C6 DC A 9 23.091 25.355 41.171 1.00 0.00 C ATOM 0 H5' DC A 9 20.242 29.574 39.236 1.00 0.00 H new ATOM 0 H5'' DC A 9 19.332 30.253 40.571 1.00 0.00 H new ATOM 0 H4' DC A 9 18.578 28.089 40.411 1.00 0.00 H new ATOM 0 H3' DC A 9 19.712 28.688 42.861 1.00 0.00 H new ATOM 0 H2' DC A 9 21.835 27.496 42.266 1.00 0.00 H new ATOM 0 H2'' DC A 9 20.922 26.274 43.129 1.00 0.00 H new ATOM 0 HO3' DC A 9 18.582 26.915 43.594 1.00 0.00 H new ATOM 0 H1' DC A 9 19.946 25.387 41.057 1.00 0.00 H new ATOM 0 H41 DC A 9 25.435 22.390 40.198 1.00 0.00 H new ATOM 0 H42 DC A 9 24.272 21.695 39.065 1.00 0.00 H new ATOM 0 H5 DC A 9 25.010 24.459 41.375 1.00 0.00 H new ATOM 0 H6 DC A 9 23.294 26.146 41.878 1.00 0.00 H new TER 287 DC A 9 ATOM 288 O5' DG B 10 21.361 14.405 34.879 1.00 0.00 O ATOM 289 C5' DG B 10 20.007 14.079 35.176 1.00 0.00 C ATOM 290 C4' DG B 10 18.978 15.181 34.848 1.00 0.00 C ATOM 291 O4' DG B 10 19.299 16.352 35.592 1.00 0.00 O ATOM 292 C3' DG B 10 18.868 15.576 33.368 1.00 0.00 C ATOM 293 O3' DG B 10 17.506 15.869 33.066 1.00 0.00 O ATOM 294 C2' DG B 10 19.772 16.803 33.294 1.00 0.00 C ATOM 295 C1' DG B 10 19.687 17.396 34.707 1.00 0.00 C ATOM 296 N9 DG B 10 20.955 17.980 35.224 1.00 0.00 N ATOM 297 C8 DG B 10 22.238 17.480 35.138 1.00 0.00 C ATOM 298 N7 DG B 10 23.139 18.173 35.783 1.00 0.00 N ATOM 299 C5 DG B 10 22.395 19.217 36.347 1.00 0.00 C ATOM 300 C6 DG B 10 22.792 20.292 37.215 1.00 0.00 C ATOM 301 O6 DG B 10 23.897 20.516 37.711 1.00 0.00 O ATOM 302 N1 DG B 10 21.763 21.146 37.542 1.00 0.00 N ATOM 303 C2 DG B 10 20.480 20.957 37.159 1.00 0.00 C ATOM 304 N2 DG B 10 19.610 21.829 37.592 1.00 0.00 N ATOM 305 N3 DG B 10 20.044 19.946 36.403 1.00 0.00 N ATOM 306 C4 DG B 10 21.061 19.111 36.009 1.00 0.00 C ATOM 0 H5' DG B 10 19.932 13.839 36.237 1.00 0.00 H new ATOM 0 H5'' DG B 10 19.738 13.178 34.625 1.00 0.00 H new ATOM 0 H4' DG B 10 18.013 14.751 35.117 1.00 0.00 H new ATOM 0 H3' DG B 10 19.165 14.810 32.652 1.00 0.00 H new ATOM 0 H2' DG B 10 20.795 16.533 33.033 1.00 0.00 H new ATOM 0 H2'' DG B 10 19.427 17.511 32.540 1.00 0.00 H new ATOM 0 HO5' DG B 10 21.514 15.357 35.055 1.00 0.00 H new ATOM 0 H1' DG B 10 18.972 18.217 34.652 1.00 0.00 H new ATOM 0 H8 DG B 10 22.479 16.586 34.581 1.00 0.00 H new ATOM 0 H1 DG B 10 21.981 21.968 38.105 1.00 0.00 H new ATOM 0 H21 DG B 10 18.627 21.739 37.336 1.00 0.00 H new ATOM 0 H22 DG B 10 19.914 22.601 38.186 1.00 0.00 H new ATOM 319 P DA B 11 16.976 16.247 31.606 1.00 0.00 P ATOM 320 OP1 DA B 11 15.694 15.540 31.385 1.00 0.00 O ATOM 321 OP2 DA B 11 18.054 16.043 30.611 1.00 0.00 O ATOM 322 O5' DA B 11 16.636 17.807 31.671 1.00 0.00 O ATOM 323 C5' DA B 11 15.520 18.263 32.439 1.00 0.00 C ATOM 324 C4' DA B 11 15.238 19.773 32.373 1.00 0.00 C ATOM 325 O4' DA B 11 16.250 20.483 33.080 1.00 0.00 O ATOM 326 C3' DA B 11 15.132 20.363 30.956 1.00 0.00 C ATOM 327 O3' DA B 11 14.139 21.384 30.942 1.00 0.00 O ATOM 328 C2' DA B 11 16.546 20.866 30.773 1.00 0.00 C ATOM 329 C1' DA B 11 16.958 21.314 32.176 1.00 0.00 C ATOM 330 N9 DA B 11 18.404 21.148 32.416 1.00 0.00 N ATOM 331 C8 DA B 11 19.203 20.143 31.950 1.00 0.00 C ATOM 332 N7 DA B 11 20.443 20.186 32.360 1.00 0.00 N ATOM 333 C5 DA B 11 20.459 21.355 33.139 1.00 0.00 C ATOM 334 C6 DA B 11 21.448 22.043 33.878 1.00 0.00 C ATOM 335 N6 DA B 11 22.704 21.651 33.984 1.00 0.00 N ATOM 336 N1 DA B 11 21.170 23.184 34.509 1.00 0.00 N ATOM 337 C2 DA B 11 19.927 23.647 34.435 1.00 0.00 C ATOM 338 N3 DA B 11 18.885 23.109 33.806 1.00 0.00 N ATOM 339 C4 DA B 11 19.225 21.952 33.171 1.00 0.00 C ATOM 0 H5' DA B 11 15.683 17.988 33.481 1.00 0.00 H new ATOM 0 H5'' DA B 11 14.630 17.731 32.104 1.00 0.00 H new ATOM 0 H4' DA B 11 14.255 19.892 32.828 1.00 0.00 H new ATOM 0 H3' DA B 11 14.822 19.690 30.157 1.00 0.00 H new ATOM 0 H2' DA B 11 17.203 20.083 30.394 1.00 0.00 H new ATOM 0 H2'' DA B 11 16.588 21.690 30.061 1.00 0.00 H new ATOM 0 H1' DA B 11 16.732 22.373 32.301 1.00 0.00 H new ATOM 0 H8 DA B 11 18.837 19.370 31.291 1.00 0.00 H new ATOM 0 H61 DA B 11 23.364 22.199 34.536 1.00 0.00 H new ATOM 0 H62 DA B 11 23.014 20.800 33.514 1.00 0.00 H new ATOM 0 H2 DA B 11 19.738 24.577 34.950 1.00 0.00 H new ATOM 351 P DG B 12 13.657 22.149 29.614 1.00 0.00 P ATOM 352 OP1 DG B 12 12.286 22.640 29.876 1.00 0.00 O ATOM 353 OP2 DG B 12 13.888 21.301 28.418 1.00 0.00 O ATOM 354 O5' DG B 12 14.627 23.410 29.508 1.00 0.00 O ATOM 355 C5' DG B 12 14.494 24.508 30.405 1.00 0.00 C ATOM 356 C4' DG B 12 15.730 25.413 30.397 1.00 0.00 C ATOM 357 O4' DG B 12 16.879 24.682 30.818 1.00 0.00 O ATOM 358 C3' DG B 12 16.055 26.116 29.062 1.00 0.00 C ATOM 359 O3' DG B 12 15.984 27.529 29.257 1.00 0.00 O ATOM 360 C2' DG B 12 17.472 25.630 28.779 1.00 0.00 C ATOM 361 C1' DG B 12 17.995 25.233 30.151 1.00 0.00 C ATOM 362 N9 DG B 12 19.125 24.277 30.091 1.00 0.00 N ATOM 363 C8 DG B 12 19.240 23.100 29.389 1.00 0.00 C ATOM 364 N7 DG B 12 20.412 22.518 29.498 1.00 0.00 N ATOM 365 C5 DG B 12 21.131 23.396 30.331 1.00 0.00 C ATOM 366 C6 DG B 12 22.484 23.360 30.831 1.00 0.00 C ATOM 367 O6 DG B 12 23.353 22.503 30.665 1.00 0.00 O ATOM 368 N1 DG B 12 22.821 24.457 31.595 1.00 0.00 N ATOM 369 C2 DG B 12 21.955 25.446 31.918 1.00 0.00 C ATOM 370 N2 DG B 12 22.413 26.418 32.656 1.00 0.00 N ATOM 371 N3 DG B 12 20.698 25.520 31.497 1.00 0.00 N ATOM 372 C4 DG B 12 20.343 24.465 30.700 1.00 0.00 C ATOM 0 H5' DG B 12 14.327 24.132 31.415 1.00 0.00 H new ATOM 0 H5'' DG B 12 13.615 25.093 30.133 1.00 0.00 H new ATOM 0 H4' DG B 12 15.471 26.212 31.092 1.00 0.00 H new ATOM 0 H3' DG B 12 15.378 25.898 28.236 1.00 0.00 H new ATOM 0 H2' DG B 12 17.476 24.786 28.089 1.00 0.00 H new ATOM 0 H2'' DG B 12 18.082 26.413 28.329 1.00 0.00 H new ATOM 0 H1' DG B 12 18.408 26.095 30.674 1.00 0.00 H new ATOM 0 H8 DG B 12 18.435 22.689 28.798 1.00 0.00 H new ATOM 0 H1 DG B 12 23.779 24.528 31.937 1.00 0.00 H new ATOM 0 H21 DG B 12 21.799 27.186 32.926 1.00 0.00 H new ATOM 0 H22 DG B 12 23.385 26.410 32.964 1.00 0.00 H new ATOM 384 P DC B 13 16.309 28.629 28.139 1.00 0.00 P ATOM 385 OP1 DC B 13 15.445 29.803 28.376 1.00 0.00 O ATOM 386 OP2 DC B 13 16.345 28.019 26.788 1.00 0.00 O ATOM 387 O5' DC B 13 17.785 29.104 28.531 1.00 0.00 O ATOM 388 C5' DC B 13 17.976 29.854 29.734 1.00 0.00 C ATOM 389 C4' DC B 13 19.435 30.170 30.066 1.00 0.00 C ATOM 390 O4' DC B 13 20.114 28.991 30.471 1.00 0.00 O ATOM 391 C3' DC B 13 20.221 30.795 28.913 1.00 0.00 C ATOM 392 O3' DC B 13 20.121 32.212 28.878 1.00 0.00 O ATOM 393 C2' DC B 13 21.636 30.319 29.202 1.00 0.00 C ATOM 394 C1' DC B 13 21.468 29.060 30.057 1.00 0.00 C ATOM 395 N1 DC B 13 21.812 27.847 29.263 1.00 0.00 N ATOM 396 C2 DC B 13 23.126 27.377 29.306 1.00 0.00 C ATOM 397 O2 DC B 13 24.007 27.996 29.907 1.00 0.00 O ATOM 398 N3 DC B 13 23.474 26.239 28.665 1.00 0.00 N ATOM 399 C4 DC B 13 22.570 25.629 27.928 1.00 0.00 C ATOM 400 N4 DC B 13 22.951 24.515 27.378 1.00 0.00 N ATOM 401 C5 DC B 13 21.237 26.098 27.777 1.00 0.00 C ATOM 402 C6 DC B 13 20.887 27.212 28.470 1.00 0.00 C ATOM 0 H5' DC B 13 17.541 29.299 30.565 1.00 0.00 H new ATOM 0 H5'' DC B 13 17.425 30.791 29.653 1.00 0.00 H new ATOM 0 H4' DC B 13 19.390 30.906 30.869 1.00 0.00 H new ATOM 0 H3' DC B 13 19.851 30.501 27.931 1.00 0.00 H new ATOM 0 H2' DC B 13 22.174 30.100 28.280 1.00 0.00 H new ATOM 0 H2'' DC B 13 22.208 31.081 29.731 1.00 0.00 H new ATOM 0 H1' DC B 13 22.132 29.104 30.920 1.00 0.00 H new ATOM 0 H41 DC B 13 22.303 23.987 26.793 1.00 0.00 H new ATOM 0 H42 DC B 13 23.898 24.168 27.531 1.00 0.00 H new ATOM 0 H5 DC B 13 20.531 25.589 27.137 1.00 0.00 H new ATOM 0 H6 DC B 13 19.881 27.599 28.398 1.00 0.00 H new ATOM 414 P DT B 14 20.600 33.050 27.598 1.00 0.00 P ATOM 415 OP1 DT B 14 20.127 34.439 27.787 1.00 0.00 O ATOM 416 OP2 DT B 14 20.190 32.319 26.377 1.00 0.00 O ATOM 417 O5' DT B 14 22.198 33.072 27.664 1.00 0.00 O ATOM 418 C5' DT B 14 22.878 33.788 28.688 1.00 0.00 C ATOM 419 C4' DT B 14 24.407 33.827 28.517 1.00 0.00 C ATOM 420 O4' DT B 14 24.962 32.510 28.561 1.00 0.00 O ATOM 421 C3' DT B 14 24.835 34.525 27.218 1.00 0.00 C ATOM 422 O3' DT B 14 25.859 35.496 27.469 1.00 0.00 O ATOM 423 C2' DT B 14 25.261 33.338 26.355 1.00 0.00 C ATOM 424 C1' DT B 14 25.629 32.215 27.337 1.00 0.00 C ATOM 425 N1 DT B 14 25.277 30.830 26.883 1.00 0.00 N ATOM 426 C2 DT B 14 26.219 29.792 27.029 1.00 0.00 C ATOM 427 O2 DT B 14 27.328 29.936 27.545 1.00 0.00 O ATOM 428 N3 DT B 14 25.855 28.541 26.571 1.00 0.00 N ATOM 429 C4 DT B 14 24.643 28.227 26.003 1.00 0.00 C ATOM 430 O4 DT B 14 24.444 27.076 25.631 1.00 0.00 O ATOM 431 C5 DT B 14 23.692 29.330 25.914 1.00 0.00 C ATOM 432 C7 DT B 14 22.306 29.095 25.339 1.00 0.00 C ATOM 433 C6 DT B 14 24.032 30.571 26.348 1.00 0.00 C ATOM 0 H5' DT B 14 22.642 33.335 29.651 1.00 0.00 H new ATOM 0 H5'' DT B 14 22.500 34.810 28.715 1.00 0.00 H new ATOM 0 H4' DT B 14 24.794 34.410 29.352 1.00 0.00 H new ATOM 0 H3' DT B 14 24.066 35.121 26.727 1.00 0.00 H new ATOM 0 H2' DT B 14 24.454 33.028 25.691 1.00 0.00 H new ATOM 0 H2'' DT B 14 26.110 33.599 25.724 1.00 0.00 H new ATOM 0 H1' DT B 14 26.715 32.199 27.432 1.00 0.00 H new ATOM 0 H3 DT B 14 26.540 27.790 26.661 1.00 0.00 H new ATOM 0 H71 DT B 14 21.598 29.782 25.803 1.00 0.00 H new ATOM 0 H72 DT B 14 22.325 29.265 24.263 1.00 0.00 H new ATOM 0 H73 DT B 14 21.999 28.068 25.538 1.00 0.00 H new ATOM 0 H6 DT B 14 23.312 31.373 26.273 1.00 0.00 H new ATOM 446 P DC B 15 26.584 36.339 26.294 1.00 0.00 P ATOM 447 OP1 DC B 15 27.105 37.600 26.868 1.00 0.00 O ATOM 448 OP2 DC B 15 25.679 36.413 25.120 1.00 0.00 O ATOM 449 O5' DC B 15 27.828 35.409 25.922 1.00 0.00 O ATOM 450 C5' DC B 15 28.824 35.109 26.898 1.00 0.00 C ATOM 451 C4' DC B 15 29.692 33.895 26.542 1.00 0.00 C ATOM 452 O4' DC B 15 28.877 32.771 26.250 1.00 0.00 O ATOM 453 C3' DC B 15 30.673 34.105 25.383 1.00 0.00 C ATOM 454 O3' DC B 15 31.993 33.917 25.884 1.00 0.00 O ATOM 455 C2' DC B 15 30.276 33.032 24.373 1.00 0.00 C ATOM 456 C1' DC B 15 29.486 32.028 25.215 1.00 0.00 C ATOM 457 N1 DC B 15 28.413 31.338 24.448 1.00 0.00 N ATOM 458 C2 DC B 15 28.429 29.946 24.324 1.00 0.00 C ATOM 459 O2 DC B 15 29.377 29.278 24.749 1.00 0.00 O ATOM 460 N3 DC B 15 27.394 29.293 23.733 1.00 0.00 N ATOM 461 C4 DC B 15 26.384 30.002 23.261 1.00 0.00 C ATOM 462 N4 DC B 15 25.389 29.356 22.722 1.00 0.00 N ATOM 463 C5 DC B 15 26.319 31.416 23.356 1.00 0.00 C ATOM 464 C6 DC B 15 27.359 32.055 23.945 1.00 0.00 C ATOM 0 H5' DC B 15 28.338 34.928 27.856 1.00 0.00 H new ATOM 0 H5'' DC B 15 29.468 35.979 27.027 1.00 0.00 H new ATOM 0 H4' DC B 15 30.301 33.729 27.431 1.00 0.00 H new ATOM 0 H3' DC B 15 30.646 35.095 24.929 1.00 0.00 H new ATOM 0 H2' DC B 15 29.670 33.444 23.566 1.00 0.00 H new ATOM 0 H2'' DC B 15 31.150 32.571 23.912 1.00 0.00 H new ATOM 0 H1' DC B 15 30.168 31.257 25.572 1.00 0.00 H new ATOM 0 H41 DC B 15 24.591 29.869 22.347 1.00 0.00 H new ATOM 0 H42 DC B 15 25.408 28.337 22.675 1.00 0.00 H new ATOM 0 H5 DC B 15 25.471 31.964 22.973 1.00 0.00 H new ATOM 0 H6 DC B 15 27.357 33.133 24.018 1.00 0.00 H new ATOM 476 P DC B 16 33.309 34.359 25.102 1.00 0.00 P ATOM 477 OP1 DC B 16 34.362 34.588 26.113 1.00 0.00 O ATOM 478 OP2 DC B 16 32.967 35.463 24.174 1.00 0.00 O ATOM 479 O5' DC B 16 33.738 33.084 24.246 1.00 0.00 O ATOM 480 C5' DC B 16 34.296 31.947 24.906 1.00 0.00 C ATOM 481 C4' DC B 16 34.624 30.783 23.966 1.00 0.00 C ATOM 482 O4' DC B 16 33.414 30.250 23.439 1.00 0.00 O ATOM 483 C3' DC B 16 35.550 31.145 22.799 1.00 0.00 C ATOM 484 O3' DC B 16 36.515 30.103 22.681 1.00 0.00 O ATOM 485 C2' DC B 16 34.571 31.224 21.630 1.00 0.00 C ATOM 486 C1' DC B 16 33.500 30.204 22.027 1.00 0.00 C ATOM 487 N1 DC B 16 32.119 30.385 21.482 1.00 0.00 N ATOM 488 C2 DC B 16 31.349 29.233 21.279 1.00 0.00 C ATOM 489 O2 DC B 16 31.824 28.106 21.442 1.00 0.00 O ATOM 490 N3 DC B 16 30.049 29.319 20.907 1.00 0.00 N ATOM 491 C4 DC B 16 29.520 30.514 20.740 1.00 0.00 C ATOM 492 N4 DC B 16 28.261 30.540 20.415 1.00 0.00 N ATOM 493 C5 DC B 16 30.242 31.724 20.933 1.00 0.00 C ATOM 494 C6 DC B 16 31.544 31.622 21.300 1.00 0.00 C ATOM 0 H5' DC B 16 33.596 31.601 25.667 1.00 0.00 H new ATOM 0 H5'' DC B 16 35.206 32.250 25.424 1.00 0.00 H new ATOM 0 H4' DC B 16 35.163 30.055 24.572 1.00 0.00 H new ATOM 0 H3' DC B 16 36.123 32.068 22.887 1.00 0.00 H new ATOM 0 H2' DC B 16 34.156 32.225 21.515 1.00 0.00 H new ATOM 0 H2'' DC B 16 35.047 30.966 20.684 1.00 0.00 H new ATOM 0 H1' DC B 16 33.828 29.258 21.596 1.00 0.00 H new ATOM 0 H41 DC B 16 27.790 31.433 20.271 1.00 0.00 H new ATOM 0 H42 DC B 16 27.745 29.667 20.304 1.00 0.00 H new ATOM 0 H5 DC B 16 29.772 32.686 20.793 1.00 0.00 H new ATOM 0 H6 DC B 16 32.132 32.515 21.450 1.00 0.00 H new ATOM 506 P DA B 17 37.693 30.102 21.604 1.00 0.00 P ATOM 507 OP1 DA B 17 38.802 29.275 22.140 1.00 0.00 O ATOM 508 OP2 DA B 17 37.966 31.484 21.147 1.00 0.00 O ATOM 509 O5' DA B 17 37.002 29.328 20.399 1.00 0.00 O ATOM 510 C5' DA B 17 36.621 27.963 20.501 1.00 0.00 C ATOM 511 C4' DA B 17 35.907 27.500 19.225 1.00 0.00 C ATOM 512 O4' DA B 17 34.546 27.888 19.182 1.00 0.00 O ATOM 513 C3' DA B 17 36.648 27.893 17.946 1.00 0.00 C ATOM 514 O3' DA B 17 37.212 26.667 17.469 1.00 0.00 O ATOM 515 C2' DA B 17 35.528 28.573 17.180 1.00 0.00 C ATOM 516 C1' DA B 17 34.228 28.095 17.829 1.00 0.00 C ATOM 517 N9 DA B 17 33.066 28.983 17.725 1.00 0.00 N ATOM 518 C8 DA B 17 33.087 30.336 17.753 1.00 0.00 C ATOM 519 N7 DA B 17 31.931 30.917 17.566 1.00 0.00 N ATOM 520 C5 DA B 17 31.072 29.814 17.399 1.00 0.00 C ATOM 521 C6 DA B 17 29.690 29.652 17.136 1.00 0.00 C ATOM 522 N6 DA B 17 28.804 30.616 16.983 1.00 0.00 N ATOM 523 N1 DA B 17 29.163 28.440 16.998 1.00 0.00 N ATOM 524 C2 DA B 17 29.948 27.385 17.117 1.00 0.00 C ATOM 525 N3 DA B 17 31.251 27.357 17.376 1.00 0.00 N ATOM 526 C4 DA B 17 31.756 28.626 17.498 1.00 0.00 C ATOM 0 H5' DA B 17 35.964 27.827 21.360 1.00 0.00 H new ATOM 0 H5'' DA B 17 37.503 27.346 20.674 1.00 0.00 H new ATOM 0 H4' DA B 17 35.922 26.411 19.270 1.00 0.00 H new ATOM 0 H3' DA B 17 37.498 28.576 17.948 1.00 0.00 H new ATOM 0 H2' DA B 17 35.618 29.658 17.237 1.00 0.00 H new ATOM 0 H2'' DA B 17 35.559 28.306 16.124 1.00 0.00 H new ATOM 0 H1' DA B 17 33.901 27.206 17.290 1.00 0.00 H new ATOM 0 H8 DA B 17 33.995 30.896 17.918 1.00 0.00 H new ATOM 0 H61 DA B 17 27.828 30.387 16.796 1.00 0.00 H new ATOM 0 H62 DA B 17 29.095 31.591 17.052 1.00 0.00 H new ATOM 0 H2 DA B 17 29.471 26.425 16.988 1.00 0.00 H new ATOM 538 P DT B 18 37.444 26.257 15.949 1.00 0.00 P ATOM 539 OP1 DT B 18 38.299 25.048 15.950 1.00 0.00 O ATOM 540 OP2 DT B 18 37.859 27.449 15.175 1.00 0.00 O ATOM 541 O5' DT B 18 35.996 25.807 15.469 1.00 0.00 O ATOM 542 C5' DT B 18 35.315 24.731 16.110 1.00 0.00 C ATOM 543 C4' DT B 18 33.957 24.433 15.465 1.00 0.00 C ATOM 544 O4' DT B 18 33.186 25.622 15.524 1.00 0.00 O ATOM 545 C3' DT B 18 34.072 24.006 13.990 1.00 0.00 C ATOM 546 O3' DT B 18 33.112 23.017 13.633 1.00 0.00 O ATOM 547 C2' DT B 18 33.720 25.298 13.265 1.00 0.00 C ATOM 548 C1' DT B 18 32.674 25.856 14.234 1.00 0.00 C ATOM 549 N1 DT B 18 32.319 27.287 14.075 1.00 0.00 N ATOM 550 C2 DT B 18 30.981 27.584 13.782 1.00 0.00 C ATOM 551 O2 DT B 18 30.137 26.744 13.453 1.00 0.00 O ATOM 552 N3 DT B 18 30.621 28.904 13.834 1.00 0.00 N ATOM 553 C4 DT B 18 31.475 29.967 13.962 1.00 0.00 C ATOM 554 O4 DT B 18 30.998 31.100 13.903 1.00 0.00 O ATOM 555 C5 DT B 18 32.883 29.603 14.106 1.00 0.00 C ATOM 556 C7 DT B 18 33.923 30.714 14.072 1.00 0.00 C ATOM 557 C6 DT B 18 33.259 28.292 14.193 1.00 0.00 C ATOM 0 H5' DT B 18 35.169 24.973 17.163 1.00 0.00 H new ATOM 0 H5'' DT B 18 35.937 23.837 16.071 1.00 0.00 H new ATOM 0 H4' DT B 18 33.500 23.605 16.008 1.00 0.00 H new ATOM 0 H3' DT B 18 35.047 23.577 13.760 1.00 0.00 H new ATOM 0 H2' DT B 18 34.578 25.960 13.149 1.00 0.00 H new ATOM 0 H2'' DT B 18 33.316 25.122 12.268 1.00 0.00 H new ATOM 0 HO3' DT B 18 33.223 22.779 12.689 1.00 0.00 H new ATOM 0 H1' DT B 18 31.731 25.349 14.028 1.00 0.00 H new ATOM 0 H3 DT B 18 29.625 29.115 13.772 1.00 0.00 H new ATOM 0 H71 DT B 18 34.779 30.430 14.684 1.00 0.00 H new ATOM 0 H72 DT B 18 34.249 30.876 13.045 1.00 0.00 H new ATOM 0 H73 DT B 18 33.487 31.633 14.463 1.00 0.00 H new ATOM 0 H6 DT B 18 34.297 28.040 14.355 1.00 0.00 H new TER 571 DT B 18 END