USER MOD reduce.3.24.130724 H: found=0, std=0, add=173, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 173 hydrogens (0 hets) HEADER DNA 11-APR-96 1QDF TITLE THE NMR STUDY OF DNA QUADRUPLEX STRUCTURE, APTAMER (15MER) TITLE 2 DNA COMPND MOL_ID: 1; COMPND 2 MOLECULE: DNA (5'- COMPND 3 D(*GP*GP*TP*TP*GP*GP*TP*GP*TP*GP*GP*TP*TP*GP*G)-3'); COMPND 4 CHAIN: A; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES KEYWDS QUDRAPLEX DNA, THROMBIN INHIBITOR, MN BINDING DNA, TELOMERE KEYWDS 2 DNA EXPDTA SOLUTION NMR AUTHOR V.M.MARATHIAS,K.Y.WANG,S.KUMAR,S.SWAMINATHAN,P.H.BOLTON REVDAT 2 24-FEB-09 1QDF 1 VERSN REVDAT 1 08-NOV-96 1QDF 0 JRNL AUTH V.M.MARATHIAS,K.Y.WANG,S.KUMAR,T.Q.PHAM, JRNL AUTH 2 S.SWAMINATHAN,P.H.BOLTON JRNL TITL DETERMINATION OF THE NUMBER AND LOCATION OF THE JRNL TITL 2 MANGANESE BINDING SITES OF DNA QUADRUPLEXES IN JRNL TITL 3 SOLUTION BY EPR AND NMR IN THE PRESENCE AND JRNL TITL 4 ABSENCE OF THROMBIN. JRNL REF J.MOL.BIOL. V. 260 378 1996 JRNL REFN ISSN 0022-2836 JRNL PMID 8757801 JRNL DOI 10.1006/JMBI.1996.0408 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1QDF COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : NULL REMARK 210 PH : NULL REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : NULL REMARK 210 SPECTROMETER FIELD STRENGTH : NULL REMARK 210 SPECTROMETER MODEL : NULL REMARK 210 SPECTROMETER MANUFACTURER : NULL REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NULL REMARK 210 METHOD USED : NULL REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : MINIMIZED AVERAGE REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL 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 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 DT A 3 C5 DT A 3 C7 0.036 REMARK 500 DT A 7 C5 DT A 7 C7 0.037 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 DG A 1 O4' - C1' - N9 ANGL. DEV. = 3.4 DEGREES REMARK 500 DG A 2 O4' - C1' - N9 ANGL. DEV. = 4.6 DEGREES REMARK 500 DT A 3 O4' - C1' - N1 ANGL. DEV. = 3.4 DEGREES REMARK 500 DT A 3 C6 - C5 - C7 ANGL. DEV. = -3.8 DEGREES REMARK 500 DT A 4 O4' - C1' - N1 ANGL. DEV. = 5.8 DEGREES REMARK 500 DT A 4 C6 - C5 - C7 ANGL. DEV. = -3.7 DEGREES REMARK 500 DG A 5 O4' - C1' - N9 ANGL. DEV. = 3.0 DEGREES REMARK 500 DG A 6 O4' - C1' - N9 ANGL. DEV. = 5.0 DEGREES REMARK 500 DG A 5 C3' - O3' - P ANGL. DEV. = 7.2 DEGREES REMARK 500 DT A 7 O4' - C1' - N1 ANGL. DEV. = 6.1 DEGREES REMARK 500 DG A 8 O4' - C1' - N9 ANGL. DEV. = 3.6 DEGREES REMARK 500 DT A 7 C3' - O3' - P ANGL. DEV. = 8.4 DEGREES REMARK 500 DT A 9 O4' - C1' - N1 ANGL. DEV. = 5.2 DEGREES REMARK 500 DG A 10 O4' - C1' - N9 ANGL. DEV. = 5.2 DEGREES REMARK 500 DT A 9 C3' - O3' - P ANGL. DEV. = 8.0 DEGREES REMARK 500 DG A 11 O4' - C1' - N9 ANGL. DEV. = 4.0 DEGREES REMARK 500 DT A 12 O4' - C1' - N1 ANGL. DEV. = 4.2 DEGREES REMARK 500 DT A 12 C6 - C5 - C7 ANGL. DEV. = -3.7 DEGREES REMARK 500 DT A 13 O4' - C1' - N1 ANGL. DEV. = 5.6 DEGREES REMARK 500 DG A 14 O4' - C1' - N9 ANGL. DEV. = 4.2 DEGREES REMARK 500 DG A 14 C3' - O3' - P ANGL. DEV. = 8.0 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1C32 RELATED DB: PDB REMARK 900 ENSEMBLE OF 10 STRUCTURES REMARK 900 RELATED ID: 1QDG RELATED DB: PDB REMARK 900 THEORETICAL MODEL REMARK 900 RELATED ID: 1QDH RELATED DB: PDB REMARK 900 MINIMIZED AVERAGE STRUCTURE DBREF 1QDF A 1 15 PDB 1QDF 1QDF 1 15 SEQRES 1 A 15 DG DG DT DT DG DG DT DG DT DG DG DT DT SEQRES 2 A 15 DG DG 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 DG O5' : rot -14:sc= 1.18 USER MOD Single : A 3 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 4 DT C7 :methyl -30:sc= 0 (180deg=-0.237) USER MOD Single : A 7 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 9 DT C7 :methyl 150:sc= -1.77! (180deg=-1.77!) USER MOD Single : A 12 DT C7 :methyl 150:sc= -0.0149 (180deg=-0.0149) USER MOD Single : A 13 DT C7 :methyl -30:sc= -0.726 (180deg=-1.03) USER MOD Single : A 15 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 7.349 0.405 -8.689 1.00 0.00 O ATOM 2 C5' DG A 1 6.506 0.416 -9.847 1.00 0.00 C ATOM 3 C4' DG A 1 7.197 0.121 -11.176 1.00 0.00 C ATOM 4 O4' DG A 1 8.511 0.705 -11.218 1.00 0.00 O ATOM 5 C3' DG A 1 7.375 -1.374 -11.473 1.00 0.00 C ATOM 6 O3' DG A 1 6.245 -2.007 -12.094 1.00 0.00 O ATOM 7 C2' DG A 1 8.572 -1.344 -12.384 1.00 0.00 C ATOM 8 C1' DG A 1 9.400 -0.135 -11.987 1.00 0.00 C ATOM 9 N9 DG A 1 10.550 -0.608 -11.174 1.00 0.00 N ATOM 10 C8 DG A 1 11.874 -0.645 -11.520 1.00 0.00 C ATOM 11 N7 DG A 1 12.654 -1.140 -10.601 1.00 0.00 N ATOM 12 C5 DG A 1 11.788 -1.456 -9.562 1.00 0.00 C ATOM 13 C6 DG A 1 12.048 -2.120 -8.332 1.00 0.00 C ATOM 14 O6 DG A 1 13.129 -2.475 -7.874 1.00 0.00 O ATOM 15 N1 DG A 1 10.887 -2.353 -7.621 1.00 0.00 N ATOM 16 C2 DG A 1 9.622 -1.997 -8.034 1.00 0.00 C ATOM 17 N2 DG A 1 8.623 -2.312 -7.218 1.00 0.00 N ATOM 18 N3 DG A 1 9.372 -1.373 -9.189 1.00 0.00 N ATOM 19 C4 DG A 1 10.498 -1.135 -9.900 1.00 0.00 C ATOM 0 H5' DG A 1 6.029 1.394 -9.916 1.00 0.00 H new ATOM 0 H5'' DG A 1 5.712 -0.316 -9.702 1.00 0.00 H new ATOM 0 H4' DG A 1 6.532 0.554 -11.923 1.00 0.00 H new ATOM 0 H3' DG A 1 7.490 -1.968 -10.566 1.00 0.00 H new ATOM 0 H2' DG A 1 9.155 -2.260 -12.286 1.00 0.00 H new ATOM 0 H2'' DG A 1 8.262 -1.274 -13.427 1.00 0.00 H new ATOM 0 HO5' DG A 1 8.209 -0.006 -8.915 1.00 0.00 H new ATOM 0 H1' DG A 1 9.801 0.418 -12.836 1.00 0.00 H new ATOM 0 H8 DG A 1 12.241 -0.294 -12.473 1.00 0.00 H new ATOM 0 H1 DG A 1 10.973 -2.825 -6.721 1.00 0.00 H new ATOM 0 H21 DG A 1 7.664 -2.074 -7.470 1.00 0.00 H new ATOM 0 H22 DG A 1 8.815 -2.792 -6.339 1.00 0.00 H new ATOM 32 P DG A 2 6.048 -3.618 -12.063 1.00 0.00 P ATOM 33 OP1 DG A 2 5.003 -4.004 -13.041 1.00 0.00 O ATOM 34 OP2 DG A 2 5.927 -4.041 -10.652 1.00 0.00 O ATOM 35 O5' DG A 2 7.464 -4.168 -12.601 1.00 0.00 O ATOM 36 C5' DG A 2 7.785 -4.204 -13.997 1.00 0.00 C ATOM 37 C4' DG A 2 9.278 -4.443 -14.231 1.00 0.00 C ATOM 38 O4' DG A 2 10.074 -3.791 -13.223 1.00 0.00 O ATOM 39 C3' DG A 2 9.646 -5.926 -14.249 1.00 0.00 C ATOM 40 O3' DG A 2 9.941 -6.379 -15.577 1.00 0.00 O ATOM 41 C2' DG A 2 10.857 -6.038 -13.350 1.00 0.00 C ATOM 42 C1' DG A 2 11.023 -4.699 -12.643 1.00 0.00 C ATOM 43 N9 DG A 2 10.858 -4.849 -11.178 1.00 0.00 N ATOM 44 C8 DG A 2 9.716 -4.785 -10.414 1.00 0.00 C ATOM 45 N7 DG A 2 9.925 -4.974 -9.143 1.00 0.00 N ATOM 46 C5 DG A 2 11.296 -5.178 -9.049 1.00 0.00 C ATOM 47 C6 DG A 2 12.103 -5.440 -7.909 1.00 0.00 C ATOM 48 O6 DG A 2 11.757 -5.541 -6.736 1.00 0.00 O ATOM 49 N1 DG A 2 13.435 -5.587 -8.250 1.00 0.00 N ATOM 50 C2 DG A 2 13.940 -5.494 -9.530 1.00 0.00 C ATOM 51 N2 DG A 2 15.253 -5.667 -9.645 1.00 0.00 N ATOM 52 N3 DG A 2 13.185 -5.249 -10.607 1.00 0.00 N ATOM 53 C4 DG A 2 11.876 -5.103 -10.288 1.00 0.00 C ATOM 0 H5' DG A 2 7.490 -3.263 -14.462 1.00 0.00 H new ATOM 0 H5'' DG A 2 7.210 -4.993 -14.482 1.00 0.00 H new ATOM 0 H4' DG A 2 9.491 -4.021 -15.213 1.00 0.00 H new ATOM 0 H3' DG A 2 8.822 -6.551 -13.905 1.00 0.00 H new ATOM 0 H2' DG A 2 10.724 -6.841 -12.625 1.00 0.00 H new ATOM 0 H2'' DG A 2 11.747 -6.278 -13.932 1.00 0.00 H new ATOM 0 H1' DG A 2 12.029 -4.302 -12.781 1.00 0.00 H new ATOM 0 H8 DG A 2 8.737 -4.596 -10.830 1.00 0.00 H new ATOM 0 H1 DG A 2 14.095 -5.779 -7.497 1.00 0.00 H new ATOM 0 H21 DG A 2 15.696 -5.612 -10.562 1.00 0.00 H new ATOM 0 H22 DG A 2 15.817 -5.855 -8.816 1.00 0.00 H new ATOM 65 P DT A 3 8.891 -7.250 -16.445 1.00 0.00 P ATOM 66 OP1 DT A 3 9.584 -7.740 -17.657 1.00 0.00 O ATOM 67 OP2 DT A 3 7.643 -6.465 -16.580 1.00 0.00 O ATOM 68 O5' DT A 3 8.575 -8.520 -15.500 1.00 0.00 O ATOM 69 C5' DT A 3 9.602 -9.250 -14.812 1.00 0.00 C ATOM 70 C4' DT A 3 9.039 -10.219 -13.765 1.00 0.00 C ATOM 71 O4' DT A 3 8.960 -11.541 -14.330 1.00 0.00 O ATOM 72 C3' DT A 3 7.641 -9.853 -13.245 1.00 0.00 C ATOM 73 O3' DT A 3 7.669 -9.155 -11.991 1.00 0.00 O ATOM 74 C2' DT A 3 6.939 -11.191 -13.150 1.00 0.00 C ATOM 75 C1' DT A 3 7.658 -12.113 -14.124 1.00 0.00 C ATOM 76 N1 DT A 3 6.902 -12.237 -15.403 1.00 0.00 N ATOM 77 C2 DT A 3 6.342 -13.470 -15.722 1.00 0.00 C ATOM 78 O2 DT A 3 6.442 -14.461 -15.000 1.00 0.00 O ATOM 79 N3 DT A 3 5.649 -13.530 -16.919 1.00 0.00 N ATOM 80 C4 DT A 3 5.467 -12.489 -17.813 1.00 0.00 C ATOM 81 O4 DT A 3 4.828 -12.664 -18.848 1.00 0.00 O ATOM 82 C5 DT A 3 6.083 -11.245 -17.402 1.00 0.00 C ATOM 83 C7 DT A 3 5.971 -10.005 -18.295 1.00 0.00 C ATOM 84 C6 DT A 3 6.762 -11.158 -16.242 1.00 0.00 C ATOM 0 H5' DT A 3 10.277 -8.547 -14.324 1.00 0.00 H new ATOM 0 H5'' DT A 3 10.193 -9.809 -15.538 1.00 0.00 H new ATOM 0 H4' DT A 3 9.725 -10.164 -12.920 1.00 0.00 H new ATOM 0 H3' DT A 3 7.128 -9.152 -13.904 1.00 0.00 H new ATOM 0 H2' DT A 3 6.985 -11.584 -12.134 1.00 0.00 H new ATOM 0 H2'' DT A 3 5.884 -11.097 -13.408 1.00 0.00 H new ATOM 0 H1' DT A 3 7.739 -13.125 -13.727 1.00 0.00 H new ATOM 0 H3 DT A 3 5.232 -14.428 -17.166 1.00 0.00 H new ATOM 0 H71 DT A 3 5.986 -9.108 -17.676 1.00 0.00 H new ATOM 0 H72 DT A 3 6.810 -9.980 -18.990 1.00 0.00 H new ATOM 0 H73 DT A 3 5.037 -10.044 -18.856 1.00 0.00 H new ATOM 0 H6 DT A 3 7.208 -10.215 -15.964 1.00 0.00 H new ATOM 97 P DT A 4 7.135 -7.630 -11.852 1.00 0.00 P ATOM 98 OP1 DT A 4 7.149 -7.012 -13.195 1.00 0.00 O ATOM 99 OP2 DT A 4 7.868 -6.989 -10.739 1.00 0.00 O ATOM 100 O5' DT A 4 5.590 -7.763 -11.399 1.00 0.00 O ATOM 101 C5' DT A 4 5.026 -8.951 -10.826 1.00 0.00 C ATOM 102 C4' DT A 4 5.160 -9.029 -9.297 1.00 0.00 C ATOM 103 O4' DT A 4 6.294 -9.815 -8.888 1.00 0.00 O ATOM 104 C3' DT A 4 5.285 -7.679 -8.598 1.00 0.00 C ATOM 105 O3' DT A 4 4.000 -7.117 -8.322 1.00 0.00 O ATOM 106 C2' DT A 4 6.052 -8.035 -7.340 1.00 0.00 C ATOM 107 C1' DT A 4 6.800 -9.327 -7.629 1.00 0.00 C ATOM 108 N1 DT A 4 8.268 -9.082 -7.618 1.00 0.00 N ATOM 109 C2 DT A 4 8.888 -8.908 -6.382 1.00 0.00 C ATOM 110 O2 DT A 4 8.282 -8.944 -5.312 1.00 0.00 O ATOM 111 N3 DT A 4 10.250 -8.683 -6.417 1.00 0.00 N ATOM 112 C4 DT A 4 11.040 -8.617 -7.551 1.00 0.00 C ATOM 113 O4 DT A 4 12.247 -8.409 -7.453 1.00 0.00 O ATOM 114 C5 DT A 4 10.315 -8.809 -8.787 1.00 0.00 C ATOM 115 C7 DT A 4 11.063 -8.765 -10.121 1.00 0.00 C ATOM 116 C6 DT A 4 8.987 -9.030 -8.785 1.00 0.00 C ATOM 0 H5' DT A 4 5.511 -9.821 -11.268 1.00 0.00 H new ATOM 0 H5'' DT A 4 3.970 -9.005 -11.092 1.00 0.00 H new ATOM 0 H4' DT A 4 4.222 -9.496 -8.995 1.00 0.00 H new ATOM 0 H3' DT A 4 5.785 -6.914 -9.192 1.00 0.00 H new ATOM 0 H2' DT A 4 6.746 -7.238 -7.073 1.00 0.00 H new ATOM 0 H2'' DT A 4 5.373 -8.162 -6.497 1.00 0.00 H new ATOM 0 H1' DT A 4 6.638 -10.089 -6.867 1.00 0.00 H new ATOM 0 H3 DT A 4 10.719 -8.553 -5.521 1.00 0.00 H new ATOM 0 H71 DT A 4 11.921 -8.098 -10.035 1.00 0.00 H new ATOM 0 H72 DT A 4 11.407 -9.767 -10.379 1.00 0.00 H new ATOM 0 H73 DT A 4 10.395 -8.399 -10.901 1.00 0.00 H new ATOM 0 H6 DT A 4 8.475 -9.170 -9.726 1.00 0.00 H new ATOM 129 P DG A 5 3.826 -5.672 -7.633 1.00 0.00 P ATOM 130 OP1 DG A 5 2.417 -5.252 -7.819 1.00 0.00 O ATOM 131 OP2 DG A 5 4.928 -4.791 -8.088 1.00 0.00 O ATOM 132 O5' DG A 5 4.060 -5.994 -6.072 1.00 0.00 O ATOM 133 C5' DG A 5 2.987 -6.390 -5.206 1.00 0.00 C ATOM 134 C4' DG A 5 2.973 -5.604 -3.895 1.00 0.00 C ATOM 135 O4' DG A 5 4.105 -5.963 -3.084 1.00 0.00 O ATOM 136 C3' DG A 5 3.010 -4.082 -4.108 1.00 0.00 C ATOM 137 O3' DG A 5 2.039 -3.376 -3.307 1.00 0.00 O ATOM 138 C2' DG A 5 4.429 -3.706 -3.733 1.00 0.00 C ATOM 139 C1' DG A 5 4.899 -4.805 -2.794 1.00 0.00 C ATOM 140 N9 DG A 5 6.338 -5.120 -2.835 1.00 0.00 N ATOM 141 C8 DG A 5 7.151 -5.339 -1.756 1.00 0.00 C ATOM 142 N7 DG A 5 8.378 -5.616 -2.066 1.00 0.00 N ATOM 143 C5 DG A 5 8.394 -5.582 -3.455 1.00 0.00 C ATOM 144 C6 DG A 5 9.491 -5.703 -4.344 1.00 0.00 C ATOM 145 O6 DG A 5 10.658 -5.970 -4.076 1.00 0.00 O ATOM 146 N1 DG A 5 9.114 -5.483 -5.653 1.00 0.00 N ATOM 147 C2 DG A 5 7.836 -5.181 -6.070 1.00 0.00 C ATOM 148 N2 DG A 5 7.683 -5.008 -7.380 1.00 0.00 N ATOM 149 N3 DG A 5 6.792 -5.062 -5.234 1.00 0.00 N ATOM 150 C4 DG A 5 7.147 -5.277 -3.942 1.00 0.00 C ATOM 0 H5' DG A 5 3.075 -7.454 -4.987 1.00 0.00 H new ATOM 0 H5'' DG A 5 2.037 -6.248 -5.721 1.00 0.00 H new ATOM 0 H4' DG A 5 2.036 -5.862 -3.401 1.00 0.00 H new ATOM 0 H3' DG A 5 2.750 -3.807 -5.130 1.00 0.00 H new ATOM 0 H2' DG A 5 5.066 -3.643 -4.615 1.00 0.00 H new ATOM 0 H2'' DG A 5 4.462 -2.731 -3.246 1.00 0.00 H new ATOM 0 H1' DG A 5 4.762 -4.446 -1.774 1.00 0.00 H new ATOM 0 H8 DG A 5 6.800 -5.286 -0.736 1.00 0.00 H new ATOM 0 H1 DG A 5 9.838 -5.549 -6.368 1.00 0.00 H new ATOM 0 H21 DG A 5 6.764 -4.782 -7.761 1.00 0.00 H new ATOM 0 H22 DG A 5 8.485 -5.101 -8.004 1.00 0.00 H new ATOM 162 P DG A 6 1.829 -3.492 -1.698 1.00 0.00 P ATOM 163 OP1 DG A 6 1.662 -4.922 -1.348 1.00 0.00 O ATOM 164 OP2 DG A 6 0.780 -2.524 -1.303 1.00 0.00 O ATOM 165 O5' DG A 6 3.229 -2.990 -1.073 1.00 0.00 O ATOM 166 C5' DG A 6 3.562 -1.604 -0.913 1.00 0.00 C ATOM 167 C4' DG A 6 4.957 -1.435 -0.308 1.00 0.00 C ATOM 168 O4' DG A 6 5.895 -2.317 -0.945 1.00 0.00 O ATOM 169 C3' DG A 6 5.506 -0.007 -0.404 1.00 0.00 C ATOM 170 O3' DG A 6 5.447 0.637 0.876 1.00 0.00 O ATOM 171 C2' DG A 6 6.943 -0.188 -0.854 1.00 0.00 C ATOM 172 C1' DG A 6 7.173 -1.680 -1.019 1.00 0.00 C ATOM 173 N9 DG A 6 7.917 -2.006 -2.253 1.00 0.00 N ATOM 174 C8 DG A 6 7.507 -2.000 -3.568 1.00 0.00 C ATOM 175 N7 DG A 6 8.443 -2.353 -4.402 1.00 0.00 N ATOM 176 C5 DG A 6 9.545 -2.609 -3.596 1.00 0.00 C ATOM 177 C6 DG A 6 10.892 -2.869 -3.961 1.00 0.00 C ATOM 178 O6 DG A 6 11.355 -3.082 -5.075 1.00 0.00 O ATOM 179 N1 DG A 6 11.728 -2.866 -2.861 1.00 0.00 N ATOM 180 C2 DG A 6 11.329 -2.643 -1.565 1.00 0.00 C ATOM 181 N2 DG A 6 12.293 -2.671 -0.654 1.00 0.00 N ATOM 182 N3 DG A 6 10.065 -2.400 -1.210 1.00 0.00 N ATOM 183 C4 DG A 6 9.230 -2.399 -2.281 1.00 0.00 C ATOM 0 H5' DG A 6 2.824 -1.122 -0.272 1.00 0.00 H new ATOM 0 H5'' DG A 6 3.519 -1.103 -1.880 1.00 0.00 H new ATOM 0 H4' DG A 6 4.841 -1.678 0.748 1.00 0.00 H new ATOM 0 H3' DG A 6 4.935 0.620 -1.089 1.00 0.00 H new ATOM 0 H2' DG A 6 7.122 0.336 -1.793 1.00 0.00 H new ATOM 0 H2'' DG A 6 7.632 0.229 -0.120 1.00 0.00 H new ATOM 0 H1' DG A 6 7.814 -2.054 -0.221 1.00 0.00 H new ATOM 0 H8 DG A 6 6.508 -1.729 -3.877 1.00 0.00 H new ATOM 0 H1 DG A 6 12.719 -3.043 -3.024 1.00 0.00 H new ATOM 0 H21 DG A 6 12.071 -2.514 0.329 1.00 0.00 H new ATOM 0 H22 DG A 6 13.257 -2.850 -0.937 1.00 0.00 H new ATOM 195 P DT A 7 5.856 2.184 1.140 1.00 0.00 P ATOM 196 OP1 DT A 7 4.710 2.848 1.806 1.00 0.00 O ATOM 197 OP2 DT A 7 6.402 2.754 -0.111 1.00 0.00 O ATOM 198 O5' DT A 7 7.063 2.101 2.215 1.00 0.00 O ATOM 199 C5' DT A 7 7.470 0.900 2.889 1.00 0.00 C ATOM 200 C4' DT A 7 8.981 0.881 3.137 1.00 0.00 C ATOM 201 O4' DT A 7 9.390 -0.381 3.693 1.00 0.00 O ATOM 202 C3' DT A 7 9.775 1.111 1.847 1.00 0.00 C ATOM 203 O3' DT A 7 10.608 2.278 1.941 1.00 0.00 O ATOM 204 C2' DT A 7 10.533 -0.181 1.614 1.00 0.00 C ATOM 205 C1' DT A 7 10.461 -0.955 2.922 1.00 0.00 C ATOM 206 N1 DT A 7 10.336 -2.417 2.694 1.00 0.00 N ATOM 207 C2 DT A 7 11.473 -3.106 2.282 1.00 0.00 C ATOM 208 O2 DT A 7 12.565 -2.565 2.107 1.00 0.00 O ATOM 209 N3 DT A 7 11.316 -4.463 2.081 1.00 0.00 N ATOM 210 C4 DT A 7 10.148 -5.186 2.252 1.00 0.00 C ATOM 211 O4 DT A 7 10.134 -6.397 2.043 1.00 0.00 O ATOM 212 C5 DT A 7 9.018 -4.390 2.682 1.00 0.00 C ATOM 213 C7 DT A 7 7.661 -5.062 2.921 1.00 0.00 C ATOM 214 C6 DT A 7 9.144 -3.064 2.884 1.00 0.00 C ATOM 0 H5' DT A 7 7.187 0.033 2.292 1.00 0.00 H new ATOM 0 H5'' DT A 7 6.943 0.818 3.840 1.00 0.00 H new ATOM 0 H4' DT A 7 9.190 1.691 3.836 1.00 0.00 H new ATOM 0 H3' DT A 7 9.137 1.327 0.990 1.00 0.00 H new ATOM 0 H2' DT A 7 10.089 -0.752 0.799 1.00 0.00 H new ATOM 0 H2'' DT A 7 11.568 0.019 1.336 1.00 0.00 H new ATOM 0 H1' DT A 7 11.388 -0.864 3.488 1.00 0.00 H new ATOM 0 H3 DT A 7 12.140 -4.983 1.777 1.00 0.00 H new ATOM 0 H71 DT A 7 7.117 -4.518 3.693 1.00 0.00 H new ATOM 0 H72 DT A 7 7.083 -5.054 1.997 1.00 0.00 H new ATOM 0 H73 DT A 7 7.817 -6.092 3.243 1.00 0.00 H new ATOM 0 H6 DT A 7 8.283 -2.497 3.204 1.00 0.00 H new ATOM 227 P DG A 8 11.992 2.459 2.779 1.00 0.00 P ATOM 228 OP1 DG A 8 12.602 1.133 3.034 1.00 0.00 O ATOM 229 OP2 DG A 8 11.722 3.371 3.911 1.00 0.00 O ATOM 230 O5' DG A 8 12.938 3.238 1.727 1.00 0.00 O ATOM 231 C5' DG A 8 12.501 3.555 0.400 1.00 0.00 C ATOM 232 C4' DG A 8 12.801 2.420 -0.585 1.00 0.00 C ATOM 233 O4' DG A 8 11.578 1.782 -0.991 1.00 0.00 O ATOM 234 C3' DG A 8 13.538 2.874 -1.851 1.00 0.00 C ATOM 235 O3' DG A 8 14.073 4.202 -1.761 1.00 0.00 O ATOM 236 C2' DG A 8 12.534 2.714 -2.974 1.00 0.00 C ATOM 237 C1' DG A 8 11.338 1.962 -2.398 1.00 0.00 C ATOM 238 N9 DG A 8 10.079 2.695 -2.653 1.00 0.00 N ATOM 239 C8 DG A 8 9.632 3.846 -2.060 1.00 0.00 C ATOM 240 N7 DG A 8 8.480 4.258 -2.501 1.00 0.00 N ATOM 241 C5 DG A 8 8.131 3.314 -3.458 1.00 0.00 C ATOM 242 C6 DG A 8 6.965 3.229 -4.260 1.00 0.00 C ATOM 243 O6 DG A 8 6.004 3.994 -4.291 1.00 0.00 O ATOM 244 N1 DG A 8 6.987 2.114 -5.077 1.00 0.00 N ATOM 245 C2 DG A 8 8.004 1.187 -5.123 1.00 0.00 C ATOM 246 N2 DG A 8 7.826 0.180 -5.973 1.00 0.00 N ATOM 247 N3 DG A 8 9.109 1.259 -4.368 1.00 0.00 N ATOM 248 C4 DG A 8 9.103 2.350 -3.561 1.00 0.00 C ATOM 0 H5' DG A 8 12.993 4.468 0.064 1.00 0.00 H new ATOM 0 H5'' DG A 8 11.430 3.755 0.408 1.00 0.00 H new ATOM 0 H4' DG A 8 13.455 1.734 -0.047 1.00 0.00 H new ATOM 0 H3' DG A 8 14.428 2.268 -2.021 1.00 0.00 H new ATOM 0 H2' DG A 8 12.229 3.687 -3.360 1.00 0.00 H new ATOM 0 H2'' DG A 8 12.971 2.163 -3.807 1.00 0.00 H new ATOM 0 H1' DG A 8 11.226 0.991 -2.880 1.00 0.00 H new ATOM 0 H8 DG A 8 10.188 4.366 -1.293 1.00 0.00 H new ATOM 0 H1 DG A 8 6.188 1.967 -5.694 1.00 0.00 H new ATOM 0 H21 DG A 8 8.538 -0.545 -6.061 1.00 0.00 H new ATOM 0 H22 DG A 8 6.977 0.133 -6.537 1.00 0.00 H new ATOM 260 P DT A 9 15.578 4.537 -2.236 1.00 0.00 P ATOM 261 OP1 DT A 9 16.119 5.590 -1.347 1.00 0.00 O ATOM 262 OP2 DT A 9 15.549 4.757 -3.701 1.00 0.00 O ATOM 263 O5' DT A 9 16.384 3.163 -1.950 1.00 0.00 O ATOM 264 C5' DT A 9 16.951 2.848 -0.666 1.00 0.00 C ATOM 265 C4' DT A 9 18.262 2.047 -0.754 1.00 0.00 C ATOM 266 O4' DT A 9 18.012 0.637 -0.744 1.00 0.00 O ATOM 267 C3' DT A 9 19.050 2.316 -2.029 1.00 0.00 C ATOM 268 O3' DT A 9 20.454 2.478 -1.751 1.00 0.00 O ATOM 269 C2' DT A 9 18.687 1.145 -2.935 1.00 0.00 C ATOM 270 C1' DT A 9 17.880 0.147 -2.089 1.00 0.00 C ATOM 271 N1 DT A 9 16.455 -0.039 -2.522 1.00 0.00 N ATOM 272 C2 DT A 9 15.431 -0.046 -1.561 1.00 0.00 C ATOM 273 O2 DT A 9 15.607 0.080 -0.350 1.00 0.00 O ATOM 274 N3 DT A 9 14.147 -0.213 -2.043 1.00 0.00 N ATOM 275 C4 DT A 9 13.784 -0.372 -3.362 1.00 0.00 C ATOM 276 O4 DT A 9 12.602 -0.492 -3.673 1.00 0.00 O ATOM 277 C5 DT A 9 14.888 -0.358 -4.287 1.00 0.00 C ATOM 278 C7 DT A 9 14.583 -0.547 -5.776 1.00 0.00 C ATOM 279 C6 DT A 9 16.157 -0.197 -3.857 1.00 0.00 C ATOM 0 H5' DT A 9 16.224 2.278 -0.087 1.00 0.00 H new ATOM 0 H5'' DT A 9 17.136 3.774 -0.122 1.00 0.00 H new ATOM 0 H4' DT A 9 18.834 2.370 0.115 1.00 0.00 H new ATOM 0 H3' DT A 9 18.802 3.256 -2.522 1.00 0.00 H new ATOM 0 H2' DT A 9 18.102 1.487 -3.789 1.00 0.00 H new ATOM 0 H2'' DT A 9 19.586 0.673 -3.333 1.00 0.00 H new ATOM 0 H1' DT A 9 18.269 -0.865 -2.202 1.00 0.00 H new ATOM 0 H3 DT A 9 13.394 -0.219 -1.355 1.00 0.00 H new ATOM 0 H71 DT A 9 15.326 -0.015 -6.370 1.00 0.00 H new ATOM 0 H72 DT A 9 14.614 -1.608 -6.022 1.00 0.00 H new ATOM 0 H73 DT A 9 13.592 -0.152 -5.997 1.00 0.00 H new ATOM 0 H6 DT A 9 16.960 -0.192 -4.579 1.00 0.00 H new ATOM 292 P DG A 10 21.494 1.358 -1.207 1.00 0.00 P ATOM 293 OP1 DG A 10 22.606 2.078 -0.543 1.00 0.00 O ATOM 294 OP2 DG A 10 21.793 0.443 -2.332 1.00 0.00 O ATOM 295 O5' DG A 10 20.705 0.521 -0.069 1.00 0.00 O ATOM 296 C5' DG A 10 20.652 -0.913 -0.098 1.00 0.00 C ATOM 297 C4' DG A 10 20.140 -1.519 1.214 1.00 0.00 C ATOM 298 O4' DG A 10 18.699 -1.514 1.200 1.00 0.00 O ATOM 299 C3' DG A 10 20.573 -2.984 1.382 1.00 0.00 C ATOM 300 O3' DG A 10 20.650 -3.292 2.790 1.00 0.00 O ATOM 301 C2' DG A 10 19.424 -3.700 0.700 1.00 0.00 C ATOM 302 C1' DG A 10 18.215 -2.861 1.072 1.00 0.00 C ATOM 303 N9 DG A 10 17.065 -2.990 0.155 1.00 0.00 N ATOM 304 C8 DG A 10 15.745 -3.079 0.496 1.00 0.00 C ATOM 305 N7 DG A 10 14.943 -3.192 -0.519 1.00 0.00 N ATOM 306 C5 DG A 10 15.786 -3.176 -1.619 1.00 0.00 C ATOM 307 C6 DG A 10 15.484 -3.301 -2.998 1.00 0.00 C ATOM 308 O6 DG A 10 14.380 -3.417 -3.527 1.00 0.00 O ATOM 309 N1 DG A 10 16.628 -3.276 -3.773 1.00 0.00 N ATOM 310 C2 DG A 10 17.912 -3.147 -3.286 1.00 0.00 C ATOM 311 N2 DG A 10 18.888 -3.141 -4.189 1.00 0.00 N ATOM 312 N3 DG A 10 18.204 -3.029 -1.987 1.00 0.00 N ATOM 313 C4 DG A 10 17.093 -3.052 -1.216 1.00 0.00 C ATOM 0 H5' DG A 10 21.647 -1.304 -0.308 1.00 0.00 H new ATOM 0 H5'' DG A 10 20.005 -1.231 -0.916 1.00 0.00 H new ATOM 0 H4' DG A 10 20.553 -0.923 2.027 1.00 0.00 H new ATOM 0 H3' DG A 10 21.547 -3.248 0.971 1.00 0.00 H new ATOM 0 H2' DG A 10 19.564 -3.746 -0.380 1.00 0.00 H new ATOM 0 H2'' DG A 10 19.324 -4.727 1.053 1.00 0.00 H new ATOM 0 H1' DG A 10 17.788 -3.219 2.009 1.00 0.00 H new ATOM 0 H8 DG A 10 15.399 -3.057 1.519 1.00 0.00 H new ATOM 0 H1 DG A 10 16.514 -3.359 -4.783 1.00 0.00 H new ATOM 0 H21 DG A 10 19.859 -3.048 -3.890 1.00 0.00 H new ATOM 0 H22 DG A 10 18.666 -3.229 -5.181 1.00 0.00 H new ATOM 325 P DG A 11 20.485 -4.768 3.443 1.00 0.00 P ATOM 326 OP1 DG A 11 20.793 -4.674 4.886 1.00 0.00 O ATOM 327 OP2 DG A 11 21.223 -5.731 2.602 1.00 0.00 O ATOM 328 O5' DG A 11 18.910 -5.079 3.265 1.00 0.00 O ATOM 329 C5' DG A 11 17.925 -4.714 4.239 1.00 0.00 C ATOM 330 C4' DG A 11 16.626 -5.502 4.067 1.00 0.00 C ATOM 331 O4' DG A 11 15.905 -5.091 2.894 1.00 0.00 O ATOM 332 C3' DG A 11 16.848 -7.007 3.969 1.00 0.00 C ATOM 333 O3' DG A 11 16.656 -7.628 5.244 1.00 0.00 O ATOM 334 C2' DG A 11 15.816 -7.471 2.958 1.00 0.00 C ATOM 335 C1' DG A 11 15.227 -6.219 2.315 1.00 0.00 C ATOM 336 N9 DG A 11 15.343 -6.246 0.841 1.00 0.00 N ATOM 337 C8 DG A 11 16.477 -6.315 0.065 1.00 0.00 C ATOM 338 N7 DG A 11 16.237 -6.331 -1.213 1.00 0.00 N ATOM 339 C5 DG A 11 14.851 -6.267 -1.300 1.00 0.00 C ATOM 340 C6 DG A 11 14.016 -6.252 -2.447 1.00 0.00 C ATOM 341 O6 DG A 11 14.343 -6.295 -3.627 1.00 0.00 O ATOM 342 N1 DG A 11 12.681 -6.184 -2.110 1.00 0.00 N ATOM 343 C2 DG A 11 12.189 -6.134 -0.823 1.00 0.00 C ATOM 344 N2 DG A 11 10.865 -6.074 -0.725 1.00 0.00 N ATOM 345 N3 DG A 11 12.971 -6.147 0.265 1.00 0.00 N ATOM 346 C4 DG A 11 14.292 -6.215 -0.051 1.00 0.00 C ATOM 0 H5' DG A 11 17.715 -3.647 4.159 1.00 0.00 H new ATOM 0 H5'' DG A 11 18.323 -4.886 5.239 1.00 0.00 H new ATOM 0 H4' DG A 11 16.049 -5.285 4.966 1.00 0.00 H new ATOM 0 H3' DG A 11 17.861 -7.268 3.664 1.00 0.00 H new ATOM 0 H2' DG A 11 16.275 -8.112 2.205 1.00 0.00 H new ATOM 0 H2'' DG A 11 15.037 -8.058 3.444 1.00 0.00 H new ATOM 0 H1' DG A 11 14.157 -6.157 2.512 1.00 0.00 H new ATOM 0 H8 DG A 11 17.474 -6.352 0.479 1.00 0.00 H new ATOM 0 H1 DG A 11 12.004 -6.170 -2.873 1.00 0.00 H new ATOM 0 H21 DG A 11 10.423 -6.034 0.193 1.00 0.00 H new ATOM 0 H22 DG A 11 10.291 -6.068 -1.568 1.00 0.00 H new ATOM 358 P DT A 12 17.198 -9.113 5.565 1.00 0.00 P ATOM 359 OP1 DT A 12 16.241 -10.085 4.987 1.00 0.00 O ATOM 360 OP2 DT A 12 17.538 -9.181 7.003 1.00 0.00 O ATOM 361 O5' DT A 12 18.575 -9.175 4.728 1.00 0.00 O ATOM 362 C5' DT A 12 18.906 -10.283 3.886 1.00 0.00 C ATOM 363 C4' DT A 12 20.361 -10.231 3.422 1.00 0.00 C ATOM 364 O4' DT A 12 21.273 -10.256 4.534 1.00 0.00 O ATOM 365 C3' DT A 12 20.670 -8.988 2.591 1.00 0.00 C ATOM 366 O3' DT A 12 20.612 -9.268 1.188 1.00 0.00 O ATOM 367 C2' DT A 12 22.066 -8.608 3.032 1.00 0.00 C ATOM 368 C1' DT A 12 22.278 -9.233 4.401 1.00 0.00 C ATOM 369 N1 DT A 12 22.179 -8.196 5.466 1.00 0.00 N ATOM 370 C2 DT A 12 23.334 -7.520 5.844 1.00 0.00 C ATOM 371 O2 DT A 12 24.436 -7.741 5.344 1.00 0.00 O ATOM 372 N3 DT A 12 23.179 -6.565 6.834 1.00 0.00 N ATOM 373 C4 DT A 12 21.996 -6.228 7.470 1.00 0.00 C ATOM 374 O4 DT A 12 21.981 -5.357 8.336 1.00 0.00 O ATOM 375 C5 DT A 12 20.848 -6.983 7.013 1.00 0.00 C ATOM 376 C7 DT A 12 19.470 -6.725 7.627 1.00 0.00 C ATOM 377 C6 DT A 12 20.975 -7.916 6.052 1.00 0.00 C ATOM 0 H5' DT A 12 18.248 -10.288 3.017 1.00 0.00 H new ATOM 0 H5'' DT A 12 18.730 -11.214 4.425 1.00 0.00 H new ATOM 0 H4' DT A 12 20.496 -11.118 2.803 1.00 0.00 H new ATOM 0 H3' DT A 12 19.949 -8.184 2.744 1.00 0.00 H new ATOM 0 H2' DT A 12 22.808 -8.972 2.322 1.00 0.00 H new ATOM 0 H2'' DT A 12 22.175 -7.525 3.080 1.00 0.00 H new ATOM 0 H1' DT A 12 23.271 -9.669 4.504 1.00 0.00 H new ATOM 0 H3 DT A 12 24.017 -6.061 7.123 1.00 0.00 H new ATOM 0 H71 DT A 12 18.697 -6.929 6.886 1.00 0.00 H new ATOM 0 H72 DT A 12 19.327 -7.378 8.488 1.00 0.00 H new ATOM 0 H73 DT A 12 19.402 -5.685 7.945 1.00 0.00 H new ATOM 0 H6 DT A 12 20.099 -8.461 5.733 1.00 0.00 H new ATOM 390 P DT A 13 19.377 -8.765 0.279 1.00 0.00 P ATOM 391 OP1 DT A 13 19.469 -7.294 0.146 1.00 0.00 O ATOM 392 OP2 DT A 13 18.134 -9.378 0.804 1.00 0.00 O ATOM 393 O5' DT A 13 19.702 -9.419 -1.157 1.00 0.00 O ATOM 394 C5' DT A 13 19.320 -10.754 -1.531 1.00 0.00 C ATOM 395 C4' DT A 13 19.013 -10.907 -3.031 1.00 0.00 C ATOM 396 O4' DT A 13 17.658 -11.318 -3.273 1.00 0.00 O ATOM 397 C3' DT A 13 19.243 -9.643 -3.854 1.00 0.00 C ATOM 398 O3' DT A 13 20.553 -9.628 -4.421 1.00 0.00 O ATOM 399 C2' DT A 13 18.178 -9.679 -4.921 1.00 0.00 C ATOM 400 C1' DT A 13 17.151 -10.715 -4.483 1.00 0.00 C ATOM 401 N1 DT A 13 15.789 -10.122 -4.339 1.00 0.00 N ATOM 402 C2 DT A 13 15.164 -9.616 -5.480 1.00 0.00 C ATOM 403 O2 DT A 13 15.679 -9.624 -6.598 1.00 0.00 O ATOM 404 N3 DT A 13 13.901 -9.086 -5.293 1.00 0.00 N ATOM 405 C4 DT A 13 13.211 -9.012 -4.098 1.00 0.00 C ATOM 406 O4 DT A 13 12.088 -8.513 -4.061 1.00 0.00 O ATOM 407 C5 DT A 13 13.930 -9.558 -2.969 1.00 0.00 C ATOM 408 C7 DT A 13 13.278 -9.544 -1.583 1.00 0.00 C ATOM 409 C6 DT A 13 15.165 -10.081 -3.118 1.00 0.00 C ATOM 0 H5' DT A 13 18.441 -11.046 -0.957 1.00 0.00 H new ATOM 0 H5'' DT A 13 20.121 -11.442 -1.260 1.00 0.00 H new ATOM 0 H4' DT A 13 19.720 -11.673 -3.349 1.00 0.00 H new ATOM 0 H3' DT A 13 19.178 -8.740 -3.247 1.00 0.00 H new ATOM 0 H2' DT A 13 17.714 -8.700 -5.037 1.00 0.00 H new ATOM 0 H2'' DT A 13 18.607 -9.945 -5.887 1.00 0.00 H new ATOM 0 H1' DT A 13 17.019 -11.488 -5.240 1.00 0.00 H new ATOM 0 H3 DT A 13 13.432 -8.713 -6.118 1.00 0.00 H new ATOM 0 H71 DT A 13 12.607 -8.689 -1.505 1.00 0.00 H new ATOM 0 H72 DT A 13 12.712 -10.464 -1.438 1.00 0.00 H new ATOM 0 H73 DT A 13 14.051 -9.469 -0.818 1.00 0.00 H new ATOM 0 H6 DT A 13 15.676 -10.478 -2.253 1.00 0.00 H new ATOM 422 P DG A 14 21.778 -9.018 -3.576 1.00 0.00 P ATOM 423 OP1 DG A 14 22.156 -10.010 -2.541 1.00 0.00 O ATOM 424 OP2 DG A 14 21.392 -7.647 -3.180 1.00 0.00 O ATOM 425 O5' DG A 14 22.998 -8.920 -4.626 1.00 0.00 O ATOM 426 C5' DG A 14 22.849 -9.219 -6.021 1.00 0.00 C ATOM 427 C4' DG A 14 22.906 -7.974 -6.923 1.00 0.00 C ATOM 428 O4' DG A 14 21.665 -7.836 -7.638 1.00 0.00 O ATOM 429 C3' DG A 14 23.167 -6.644 -6.182 1.00 0.00 C ATOM 430 O3' DG A 14 24.264 -5.867 -6.696 1.00 0.00 O ATOM 431 C2' DG A 14 21.875 -5.879 -6.324 1.00 0.00 C ATOM 432 C1' DG A 14 21.168 -6.495 -7.516 1.00 0.00 C ATOM 433 N9 DG A 14 19.693 -6.440 -7.479 1.00 0.00 N ATOM 434 C8 DG A 14 18.848 -6.392 -8.554 1.00 0.00 C ATOM 435 N7 DG A 14 17.590 -6.346 -8.240 1.00 0.00 N ATOM 436 C5 DG A 14 17.588 -6.366 -6.851 1.00 0.00 C ATOM 437 C6 DG A 14 16.506 -6.239 -5.952 1.00 0.00 C ATOM 438 O6 DG A 14 15.307 -6.174 -6.213 1.00 0.00 O ATOM 439 N1 DG A 14 16.939 -6.190 -4.637 1.00 0.00 N ATOM 440 C2 DG A 14 18.254 -6.255 -4.233 1.00 0.00 C ATOM 441 N2 DG A 14 18.476 -6.196 -2.923 1.00 0.00 N ATOM 442 N3 DG A 14 19.281 -6.373 -5.081 1.00 0.00 N ATOM 443 C4 DG A 14 18.873 -6.423 -6.372 1.00 0.00 C ATOM 0 H5' DG A 14 21.897 -9.728 -6.176 1.00 0.00 H new ATOM 0 H5'' DG A 14 23.634 -9.913 -6.322 1.00 0.00 H new ATOM 0 H4' DG A 14 23.755 -8.146 -7.584 1.00 0.00 H new ATOM 0 H3' DG A 14 23.458 -6.850 -5.152 1.00 0.00 H new ATOM 0 H2' DG A 14 21.269 -5.962 -5.422 1.00 0.00 H new ATOM 0 H2'' DG A 14 22.063 -4.817 -6.485 1.00 0.00 H new ATOM 0 H1' DG A 14 21.395 -5.898 -8.399 1.00 0.00 H new ATOM 0 H8 DG A 14 19.198 -6.392 -9.576 1.00 0.00 H new ATOM 0 H1 DG A 14 16.228 -6.099 -3.911 1.00 0.00 H new ATOM 0 H21 DG A 14 19.430 -6.240 -2.565 1.00 0.00 H new ATOM 0 H22 DG A 14 17.692 -6.107 -2.276 1.00 0.00 H new ATOM 455 P DG A 15 24.671 -5.630 -8.247 1.00 0.00 P ATOM 456 OP1 DG A 15 24.975 -6.947 -8.852 1.00 0.00 O ATOM 457 OP2 DG A 15 25.697 -4.562 -8.281 1.00 0.00 O ATOM 458 O5' DG A 15 23.341 -5.042 -8.960 1.00 0.00 O ATOM 459 C5' DG A 15 23.112 -5.252 -10.364 1.00 0.00 C ATOM 460 C4' DG A 15 22.414 -4.077 -11.055 1.00 0.00 C ATOM 461 O4' DG A 15 20.994 -4.122 -10.808 1.00 0.00 O ATOM 462 C3' DG A 15 22.932 -2.690 -10.671 1.00 0.00 C ATOM 463 O3' DG A 15 23.594 -2.114 -11.802 1.00 0.00 O ATOM 464 C2' DG A 15 21.696 -1.911 -10.238 1.00 0.00 C ATOM 465 C1' DG A 15 20.497 -2.842 -10.419 1.00 0.00 C ATOM 466 N9 DG A 15 19.652 -2.974 -9.213 1.00 0.00 N ATOM 467 C8 DG A 15 20.028 -3.142 -7.900 1.00 0.00 C ATOM 468 N7 DG A 15 19.026 -3.225 -7.073 1.00 0.00 N ATOM 469 C5 DG A 15 17.901 -3.103 -7.883 1.00 0.00 C ATOM 470 C6 DG A 15 16.529 -3.028 -7.532 1.00 0.00 C ATOM 471 O6 DG A 15 16.020 -3.151 -6.424 1.00 0.00 O ATOM 472 N1 DG A 15 15.732 -2.795 -8.637 1.00 0.00 N ATOM 473 C2 DG A 15 16.191 -2.653 -9.929 1.00 0.00 C ATOM 474 N2 DG A 15 15.265 -2.440 -10.855 1.00 0.00 N ATOM 475 N3 DG A 15 17.482 -2.723 -10.268 1.00 0.00 N ATOM 476 C4 DG A 15 18.274 -2.950 -9.194 1.00 0.00 C ATOM 0 H5' DG A 15 22.508 -6.150 -10.495 1.00 0.00 H new ATOM 0 H5'' DG A 15 24.067 -5.436 -10.856 1.00 0.00 H new ATOM 0 H4' DG A 15 22.644 -4.208 -12.112 1.00 0.00 H new ATOM 0 H3' DG A 15 23.665 -2.697 -9.864 1.00 0.00 H new ATOM 0 H2' DG A 15 21.784 -1.593 -9.199 1.00 0.00 H new ATOM 0 H2'' DG A 15 21.578 -1.009 -10.838 1.00 0.00 H new ATOM 0 HO3' DG A 15 23.928 -1.223 -11.567 1.00 0.00 H new ATOM 0 H1' DG A 15 19.850 -2.407 -11.181 1.00 0.00 H new ATOM 0 H8 DG A 15 21.059 -3.200 -7.585 1.00 0.00 H new ATOM 0 H1 DG A 15 14.726 -2.723 -8.485 1.00 0.00 H new ATOM 0 H21 DG A 15 15.537 -2.326 -11.831 1.00 0.00 H new ATOM 0 H22 DG A 15 14.281 -2.390 -10.590 1.00 0.00 H new TER 489 DG A 15 END