USER MOD reduce.3.24.130724 H: found=0, std=0, add=288, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 288 hydrogens (17 hets) HEADER DNA 23-SEP-08 2K8U TITLE SOLUTION NMR STRUCTURE OF TRANS-4-HYDROXYNONENAL DERIVED DG TITLE 2 ADDUCT OF (6S,8R,11S)-CONFIGURATION MATCHED WITH DC COMPND MOL_ID: 1; COMPND 2 MOLECULE: 5'- COMPND 3 D(*DGP*DCP*DTP*DAP*DGP*DCP*DGP*DAP*DGP*DTP*DCP*DC)-3'; COMPND 4 CHAIN: A; COMPND 5 ENGINEERED: YES; COMPND 6 MOL_ID: 2; COMPND 7 MOLECULE: 5'- COMPND 8 D(*DGP*DGP*DAP*DCP*DTP*DCP*DGP*DCP*DTP*DAP*DGP*DC)-3'; COMPND 9 CHAIN: B; COMPND 0 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 OTHER_DETAILS: DNA STRAND A; SOURCE 4 MOL_ID: 2; SOURCE 5 SYNTHETIC: YES; SOURCE 6 OTHER_DETAILS: DNA STRAND B KEYWDS HNE-DG (6S,8R,11S), HNE DERIVED DG ADDUCT, TRANS-4- KEYWDS 2 HYDROXYNONENAL, DNA EXPDTA SOLUTION NMR AUTHOR H.HUANG,H.WANG,N.QI,R.S.LLOYD,C.J.RIZZO,M.P.STONE REVDAT 3 24-FEB-09 2K8U 1 VERSN REVDAT 2 11-NOV-08 2K8U 1 JRNL REVDAT 1 04-NOV-08 2K8U 0 JRNL AUTH H.HUANG,H.WANG,N.QI,R.S.LLOYD,C.J.RIZZO,M.P.STONE JRNL TITL THE STEREOCHEMISTRY OF JRNL TITL 2 TRANS-4-HYDROXYNONENAL-DERIVED EXOCYCLIC JRNL TITL 3 1,N2-2'-DEOXYGUANOSINE ADDUCTS MODULATES FORMATION JRNL TITL 4 OF INTERSTRAND CROSS-LINKS IN THE 5'-CPG-3' JRNL TITL 5 SEQUENCE. JRNL REF BIOCHEMISTRY V. 47 11457 2008 JRNL REFN ISSN 0006-2960 JRNL PMID 18847226 JRNL DOI 10.1021/BI8011143 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : AMBER 7.0 REMARK 3 AUTHORS : CASE, DARDEN, CHEATHAM, III, SIMMERLING, WANG, REMARK 3 DUKE, LUO, ... AND KOLLM REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 2K8U COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 08-OCT-08. REMARK 100 THE RCSB ID CODE IS RCSB100821. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298 REMARK 210 PH : 7.0 REMARK 210 IONIC STRENGTH : 100 REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 1 MM DNA (5'-D(*DGP*DCP*DTP* REMARK 210 DAP*DGP*DCP*DGP*DAP*DGP*DTP*DCP*DC)-3'), 1 MM DNA (5'-D(*DGP* REMARK 210 DGP*DAP*DCP*DTP*DCP*DGP*DCP*DTP*DAP*DGP*DC)-3'), 100% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D 1H-1H NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 800 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NULL REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 10 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : BACK CALCULATED DATA AGREE REMARK 210 WITH EXPERIMENTAL NOESY REMARK 210 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 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 2 N3 - C2 - O2 ANGL. DEV. = -5.0 DEGREES REMARK 500 DA A 4 C4 - C5 - C6 ANGL. DEV. = -3.3 DEGREES REMARK 500 DA A 4 C5 - C6 - N1 ANGL. DEV. = 3.4 DEGREES REMARK 500 DA A 4 N1 - C6 - N6 ANGL. DEV. = -4.6 DEGREES REMARK 500 DC A 6 N3 - C2 - O2 ANGL. DEV. = -5.0 DEGREES REMARK 500 DA A 8 C4 - C5 - C6 ANGL. DEV. = -3.6 DEGREES REMARK 500 DA A 8 C5 - C6 - N1 ANGL. DEV. = 3.6 DEGREES REMARK 500 DA A 8 N1 - C6 - N6 ANGL. DEV. = -5.6 DEGREES REMARK 500 DG A 9 O4' - C1' - N9 ANGL. DEV. = 2.7 DEGREES REMARK 500 DC A 11 N3 - C2 - O2 ANGL. DEV. = -5.1 DEGREES REMARK 500 DC A 12 N3 - C2 - O2 ANGL. DEV. = -5.0 DEGREES REMARK 500 DA B 15 C4 - C5 - C6 ANGL. DEV. = -3.2 DEGREES REMARK 500 DA B 15 C5 - C6 - N1 ANGL. DEV. = 3.5 DEGREES REMARK 500 DA B 15 N1 - C6 - N6 ANGL. DEV. = -4.8 DEGREES REMARK 500 DC B 16 O4' - C1' - N1 ANGL. DEV. = 2.2 DEGREES REMARK 500 DC B 16 N3 - C2 - O2 ANGL. DEV. = -5.0 DEGREES REMARK 500 DC B 18 N3 - C2 - O2 ANGL. DEV. = -5.3 DEGREES REMARK 500 DG B 19 O4' - C1' - N9 ANGL. DEV. = 2.3 DEGREES REMARK 500 DC B 20 N1 - C2 - O2 ANGL. DEV. = 3.7 DEGREES REMARK 500 DC B 20 N3 - C2 - O2 ANGL. DEV. = -5.2 DEGREES REMARK 500 DA B 22 C4 - C5 - C6 ANGL. DEV. = -3.3 DEGREES REMARK 500 DA B 22 C5 - C6 - N1 ANGL. DEV. = 3.6 DEGREES REMARK 500 DA B 22 N1 - C6 - N6 ANGL. DEV. = -4.6 DEGREES REMARK 500 DC B 24 N3 - C2 - O2 ANGL. DEV. = -5.1 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 7 0.06 SIDE_CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE HNB A 125 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 2K8T RELATED DB: PDB REMARK 900 TRANS-4-HYDROXYNONENAL DERIVED DG ADDUCT OF (6R,8S,11R)- REMARK 900 CONFIGURATION OPPOSITE DC DBREF 2K8U A 1 12 PDB 2K8U 2K8U 1 12 DBREF 2K8U B 13 24 PDB 2K8U 2K8U 13 24 SEQRES 1 A 12 DG DC DT DA DG DC DG DA DG DT DC DC SEQRES 1 B 12 DG DG DA DC DT DC DG DC DT DA DG DC HET HNB A 125 28 HETNAM HNB (2S,5R)-5-PENTYLTETRAHYDROFURAN-2-OL FORMUL 3 HNB C9 H18 O2 LINK N2 DG A 7 C3 HNB A 125 1555 1555 1.47 SITE *** AC1 7 DG A 7 DA A 8 DG A 9 DT A 10 SITE *** AC1 7 DC B 18 DG B 19 DC B 20 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 7 DG H21 : A 7 DG N2 : A 125 HNB C3 :(H bumps) USER MOD NoAdj-H: A 125 HNB H3A : A 125 HNB C3 : A 7 DG N2 :(H bumps) USER MOD Single : A 1 DG O5' : rot 180:sc= 0 USER MOD Single : A 3 DT C7 :methyl 150:sc= -0.259 (180deg=-0.259) USER MOD Single : A 10 DT C7 :methyl -30:sc= -0.317 (180deg=-0.496) USER MOD Single : A 12 DC O3' : rot 180:sc= 0 USER MOD Single : A 125 HNB O1 : rot 180:sc= 0 USER MOD Single : B 13 DG O5' : rot 180:sc= 0 USER MOD Single : B 17 DT C7 :methyl 150:sc= -0.0526 (180deg=-0.0526) USER MOD Single : B 21 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 24 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 9.708 1.072 -2.889 1.00 0.00 O ATOM 2 C5' DG A 1 10.538 2.165 -3.288 1.00 0.00 C ATOM 3 C4' DG A 1 10.239 3.488 -2.551 1.00 0.00 C ATOM 4 O4' DG A 1 8.957 3.985 -2.930 1.00 0.00 O ATOM 5 C3' DG A 1 10.269 3.367 -1.018 1.00 0.00 C ATOM 6 O3' DG A 1 10.870 4.532 -0.454 1.00 0.00 O ATOM 7 C2' DG A 1 8.785 3.232 -0.689 1.00 0.00 C ATOM 8 C1' DG A 1 8.121 4.069 -1.783 1.00 0.00 C ATOM 9 N9 DG A 1 6.760 3.589 -2.125 1.00 0.00 N ATOM 10 C8 DG A 1 6.365 2.321 -2.481 1.00 0.00 C ATOM 11 N7 DG A 1 5.090 2.209 -2.755 1.00 0.00 N ATOM 12 C5 DG A 1 4.599 3.509 -2.560 1.00 0.00 C ATOM 13 C6 DG A 1 3.277 4.066 -2.715 1.00 0.00 C ATOM 14 O6 DG A 1 2.237 3.516 -3.084 1.00 0.00 O ATOM 15 N1 DG A 1 3.207 5.411 -2.415 1.00 0.00 N ATOM 16 C2 DG A 1 4.273 6.155 -2.033 1.00 0.00 C ATOM 17 N2 DG A 1 4.066 7.422 -1.801 1.00 0.00 N ATOM 18 N3 DG A 1 5.514 5.695 -1.894 1.00 0.00 N ATOM 19 C4 DG A 1 5.616 4.357 -2.169 1.00 0.00 C ATOM 0 H5' DG A 1 10.420 2.324 -4.360 1.00 0.00 H new ATOM 0 H5'' DG A 1 11.581 1.896 -3.119 1.00 0.00 H new ATOM 0 H4' DG A 1 11.036 4.171 -2.846 1.00 0.00 H new ATOM 0 H3' DG A 1 10.856 2.538 -0.621 1.00 0.00 H new ATOM 0 H2' DG A 1 8.457 2.193 -0.718 1.00 0.00 H new ATOM 0 H2'' DG A 1 8.555 3.611 0.307 1.00 0.00 H new ATOM 0 HO5' DG A 1 9.954 0.272 -3.398 1.00 0.00 H new ATOM 0 H1' DG A 1 8.006 5.093 -1.429 1.00 0.00 H new ATOM 0 H8 DG A 1 7.050 1.487 -2.530 1.00 0.00 H new ATOM 0 H1 DG A 1 2.300 5.872 -2.485 1.00 0.00 H new ATOM 0 H21 DG A 1 4.839 8.020 -1.511 1.00 0.00 H new ATOM 0 H22 DG A 1 3.131 7.814 -1.910 1.00 0.00 H new ATOM 32 P DC A 2 11.122 4.717 1.132 1.00 0.00 P ATOM 33 OP1 DC A 2 12.375 5.494 1.303 1.00 0.00 O ATOM 34 OP2 DC A 2 11.005 3.397 1.800 1.00 0.00 O ATOM 35 O5' DC A 2 9.880 5.632 1.605 1.00 0.00 O ATOM 36 C5' DC A 2 9.794 7.002 1.221 1.00 0.00 C ATOM 37 C4' DC A 2 8.507 7.687 1.702 1.00 0.00 C ATOM 38 O4' DC A 2 7.377 7.100 1.067 1.00 0.00 O ATOM 39 C3' DC A 2 8.309 7.635 3.228 1.00 0.00 C ATOM 40 O3' DC A 2 8.232 8.960 3.749 1.00 0.00 O ATOM 41 C2' DC A 2 7.006 6.848 3.374 1.00 0.00 C ATOM 42 C1' DC A 2 6.327 6.983 2.009 1.00 0.00 C ATOM 43 N1 DC A 2 5.502 5.792 1.661 1.00 0.00 N ATOM 44 C2 DC A 2 4.127 5.937 1.430 1.00 0.00 C ATOM 45 O2 DC A 2 3.545 7.013 1.566 1.00 0.00 O ATOM 46 N3 DC A 2 3.374 4.875 1.052 1.00 0.00 N ATOM 47 C4 DC A 2 3.957 3.701 0.932 1.00 0.00 C ATOM 48 N4 DC A 2 3.196 2.727 0.527 1.00 0.00 N ATOM 49 C5 DC A 2 5.339 3.480 1.175 1.00 0.00 C ATOM 50 C6 DC A 2 6.083 4.554 1.539 1.00 0.00 C ATOM 0 H5' DC A 2 9.851 7.072 0.135 1.00 0.00 H new ATOM 0 H5'' DC A 2 10.654 7.539 1.620 1.00 0.00 H new ATOM 0 H4' DC A 2 8.606 8.738 1.429 1.00 0.00 H new ATOM 0 H3' DC A 2 9.122 7.166 3.782 1.00 0.00 H new ATOM 0 H2' DC A 2 7.198 5.804 3.621 1.00 0.00 H new ATOM 0 H2'' DC A 2 6.383 7.255 4.170 1.00 0.00 H new ATOM 0 H1' DC A 2 5.654 7.840 2.017 1.00 0.00 H new ATOM 0 H41 DC A 2 3.584 1.791 0.412 1.00 0.00 H new ATOM 0 H42 DC A 2 2.211 2.900 0.324 1.00 0.00 H new ATOM 0 H5 DC A 2 5.779 2.499 1.074 1.00 0.00 H new ATOM 0 H6 DC A 2 7.139 4.435 1.734 1.00 0.00 H new ATOM 62 P DT A 3 8.116 9.278 5.331 1.00 0.00 P ATOM 63 OP1 DT A 3 8.722 10.611 5.571 1.00 0.00 O ATOM 64 OP2 DT A 3 8.620 8.114 6.102 1.00 0.00 O ATOM 65 O5' DT A 3 6.526 9.392 5.567 1.00 0.00 O ATOM 66 C5' DT A 3 5.770 10.415 4.927 1.00 0.00 C ATOM 67 C4' DT A 3 4.256 10.264 5.132 1.00 0.00 C ATOM 68 O4' DT A 3 3.794 9.074 4.502 1.00 0.00 O ATOM 69 C3' DT A 3 3.826 10.232 6.610 1.00 0.00 C ATOM 70 O3' DT A 3 2.821 11.220 6.824 1.00 0.00 O ATOM 71 C2' DT A 3 3.306 8.804 6.769 1.00 0.00 C ATOM 72 C1' DT A 3 2.840 8.465 5.352 1.00 0.00 C ATOM 73 N1 DT A 3 2.781 7.004 5.062 1.00 0.00 N ATOM 74 C2 DT A 3 1.580 6.469 4.573 1.00 0.00 C ATOM 75 O2 DT A 3 0.534 7.107 4.461 1.00 0.00 O ATOM 76 N3 DT A 3 1.593 5.141 4.217 1.00 0.00 N ATOM 77 C4 DT A 3 2.661 4.285 4.340 1.00 0.00 C ATOM 78 O4 DT A 3 2.526 3.118 3.980 1.00 0.00 O ATOM 79 C5 DT A 3 3.869 4.885 4.903 1.00 0.00 C ATOM 80 C7 DT A 3 5.113 4.038 5.118 1.00 0.00 C ATOM 81 C6 DT A 3 3.893 6.202 5.237 1.00 0.00 C ATOM 0 H5' DT A 3 5.989 10.406 3.859 1.00 0.00 H new ATOM 0 H5'' DT A 3 6.087 11.385 5.309 1.00 0.00 H new ATOM 0 H4' DT A 3 3.809 11.151 4.683 1.00 0.00 H new ATOM 0 H3' DT A 3 4.610 10.458 7.333 1.00 0.00 H new ATOM 0 H2' DT A 3 4.085 8.124 7.114 1.00 0.00 H new ATOM 0 H2'' DT A 3 2.490 8.746 7.490 1.00 0.00 H new ATOM 0 H1' DT A 3 1.820 8.822 5.209 1.00 0.00 H new ATOM 0 H3 DT A 3 0.733 4.757 3.827 1.00 0.00 H new ATOM 0 H71 DT A 3 6.000 4.663 5.020 1.00 0.00 H new ATOM 0 H72 DT A 3 5.087 3.600 6.116 1.00 0.00 H new ATOM 0 H73 DT A 3 5.145 3.243 4.373 1.00 0.00 H new ATOM 0 H6 DT A 3 4.796 6.629 5.646 1.00 0.00 H new ATOM 94 P DA A 4 2.207 11.547 8.281 1.00 0.00 P ATOM 95 OP1 DA A 4 1.798 12.974 8.292 1.00 0.00 O ATOM 96 OP2 DA A 4 3.146 11.065 9.325 1.00 0.00 O ATOM 97 O5' DA A 4 0.882 10.633 8.336 1.00 0.00 O ATOM 98 C5' DA A 4 -0.236 10.916 7.500 1.00 0.00 C ATOM 99 C4' DA A 4 -1.380 9.904 7.662 1.00 0.00 C ATOM 100 O4' DA A 4 -1.004 8.648 7.107 1.00 0.00 O ATOM 101 C3' DA A 4 -1.810 9.677 9.124 1.00 0.00 C ATOM 102 O3' DA A 4 -3.223 9.839 9.217 1.00 0.00 O ATOM 103 C2' DA A 4 -1.339 8.243 9.375 1.00 0.00 C ATOM 104 C1' DA A 4 -1.446 7.628 7.983 1.00 0.00 C ATOM 105 N9 DA A 4 -0.600 6.425 7.807 1.00 0.00 N ATOM 106 C8 DA A 4 0.745 6.276 8.053 1.00 0.00 C ATOM 107 N7 DA A 4 1.229 5.101 7.738 1.00 0.00 N ATOM 108 C5 DA A 4 0.092 4.413 7.281 1.00 0.00 C ATOM 109 C6 DA A 4 -0.158 3.108 6.789 1.00 0.00 C ATOM 110 N6 DA A 4 0.762 2.178 6.615 1.00 0.00 N ATOM 111 N1 DA A 4 -1.389 2.724 6.447 1.00 0.00 N ATOM 112 C2 DA A 4 -2.375 3.605 6.557 1.00 0.00 C ATOM 113 N3 DA A 4 -2.297 4.864 6.972 1.00 0.00 N ATOM 114 C4 DA A 4 -1.025 5.207 7.328 1.00 0.00 C ATOM 0 H5' DA A 4 0.089 10.925 6.460 1.00 0.00 H new ATOM 0 H5'' DA A 4 -0.608 11.915 7.726 1.00 0.00 H new ATOM 0 H4' DA A 4 -2.230 10.336 7.134 1.00 0.00 H new ATOM 0 H3' DA A 4 -1.397 10.368 9.859 1.00 0.00 H new ATOM 0 H2' DA A 4 -0.319 8.209 9.759 1.00 0.00 H new ATOM 0 H2'' DA A 4 -1.969 7.727 10.099 1.00 0.00 H new ATOM 0 H1' DA A 4 -2.467 7.294 7.796 1.00 0.00 H new ATOM 0 H8 DA A 4 1.353 7.064 8.472 1.00 0.00 H new ATOM 0 H61 DA A 4 0.498 1.261 6.255 1.00 0.00 H new ATOM 0 H62 DA A 4 1.737 2.376 6.840 1.00 0.00 H new ATOM 0 H2 DA A 4 -3.358 3.257 6.276 1.00 0.00 H new ATOM 126 P DG A 5 -4.038 9.710 10.605 1.00 0.00 P ATOM 127 OP1 DG A 5 -5.138 10.706 10.581 1.00 0.00 O ATOM 128 OP2 DG A 5 -3.084 9.722 11.742 1.00 0.00 O ATOM 129 O5' DG A 5 -4.677 8.235 10.495 1.00 0.00 O ATOM 130 C5' DG A 5 -5.669 7.944 9.514 1.00 0.00 C ATOM 131 C4' DG A 5 -6.200 6.504 9.591 1.00 0.00 C ATOM 132 O4' DG A 5 -5.202 5.584 9.156 1.00 0.00 O ATOM 133 C3' DG A 5 -6.657 6.094 11.003 1.00 0.00 C ATOM 134 O3' DG A 5 -7.946 5.493 10.914 1.00 0.00 O ATOM 135 C2' DG A 5 -5.549 5.125 11.417 1.00 0.00 C ATOM 136 C1' DG A 5 -5.154 4.509 10.077 1.00 0.00 C ATOM 137 N9 DG A 5 -3.799 3.911 10.088 1.00 0.00 N ATOM 138 C8 DG A 5 -2.609 4.487 10.466 1.00 0.00 C ATOM 139 N7 DG A 5 -1.567 3.707 10.340 1.00 0.00 N ATOM 140 C5 DG A 5 -2.113 2.510 9.851 1.00 0.00 C ATOM 141 C6 DG A 5 -1.504 1.253 9.493 1.00 0.00 C ATOM 142 O6 DG A 5 -0.316 0.931 9.507 1.00 0.00 O ATOM 143 N1 DG A 5 -2.410 0.299 9.078 1.00 0.00 N ATOM 144 C2 DG A 5 -3.744 0.514 8.989 1.00 0.00 C ATOM 145 N2 DG A 5 -4.493 -0.504 8.664 1.00 0.00 N ATOM 146 N3 DG A 5 -4.349 1.663 9.276 1.00 0.00 N ATOM 147 C4 DG A 5 -3.480 2.627 9.707 1.00 0.00 C ATOM 0 H5' DG A 5 -5.250 8.116 8.522 1.00 0.00 H new ATOM 0 H5'' DG A 5 -6.502 8.637 9.633 1.00 0.00 H new ATOM 0 H4' DG A 5 -7.072 6.475 8.937 1.00 0.00 H new ATOM 0 H3' DG A 5 -6.776 6.900 11.727 1.00 0.00 H new ATOM 0 H2' DG A 5 -4.714 5.639 11.893 1.00 0.00 H new ATOM 0 H2'' DG A 5 -5.905 4.374 12.123 1.00 0.00 H new ATOM 0 H1' DG A 5 -5.826 3.689 9.823 1.00 0.00 H new ATOM 0 H8 DG A 5 -2.541 5.499 10.836 1.00 0.00 H new ATOM 0 H1 DG A 5 -2.054 -0.622 8.823 1.00 0.00 H new ATOM 0 H21 DG A 5 -5.503 -0.389 8.585 1.00 0.00 H new ATOM 0 H22 DG A 5 -4.068 -1.415 8.489 1.00 0.00 H new ATOM 159 P DC A 6 -8.757 4.944 12.198 1.00 0.00 P ATOM 160 OP1 DC A 6 -10.207 5.081 11.913 1.00 0.00 O ATOM 161 OP2 DC A 6 -8.208 5.566 13.428 1.00 0.00 O ATOM 162 O5' DC A 6 -8.382 3.376 12.207 1.00 0.00 O ATOM 163 C5' DC A 6 -8.781 2.530 11.133 1.00 0.00 C ATOM 164 C4' DC A 6 -8.275 1.089 11.279 1.00 0.00 C ATOM 165 O4' DC A 6 -6.858 1.045 11.195 1.00 0.00 O ATOM 166 C3' DC A 6 -8.702 0.403 12.587 1.00 0.00 C ATOM 167 O3' DC A 6 -9.518 -0.720 12.273 1.00 0.00 O ATOM 168 C2' DC A 6 -7.364 0.025 13.229 1.00 0.00 C ATOM 169 C1' DC A 6 -6.395 0.016 12.047 1.00 0.00 C ATOM 170 N1 DC A 6 -4.986 0.301 12.438 1.00 0.00 N ATOM 171 C2 DC A 6 -3.995 -0.665 12.210 1.00 0.00 C ATOM 172 O2 DC A 6 -4.255 -1.792 11.788 1.00 0.00 O ATOM 173 N3 DC A 6 -2.690 -0.382 12.440 1.00 0.00 N ATOM 174 C4 DC A 6 -2.379 0.799 12.930 1.00 0.00 C ATOM 175 N4 DC A 6 -1.110 1.030 13.088 1.00 0.00 N ATOM 176 C5 DC A 6 -3.336 1.812 13.211 1.00 0.00 C ATOM 177 C6 DC A 6 -4.637 1.527 12.951 1.00 0.00 C ATOM 0 H5' DC A 6 -8.411 2.945 10.195 1.00 0.00 H new ATOM 0 H5'' DC A 6 -9.869 2.522 11.071 1.00 0.00 H new ATOM 0 H4' DC A 6 -8.736 0.543 10.456 1.00 0.00 H new ATOM 0 H3' DC A 6 -9.301 1.014 13.263 1.00 0.00 H new ATOM 0 H2' DC A 6 -7.065 0.747 13.989 1.00 0.00 H new ATOM 0 H2'' DC A 6 -7.413 -0.949 13.716 1.00 0.00 H new ATOM 0 H1' DC A 6 -6.378 -0.971 11.585 1.00 0.00 H new ATOM 0 H41 DC A 6 -0.797 1.925 13.463 1.00 0.00 H new ATOM 0 H42 DC A 6 -0.426 0.316 12.837 1.00 0.00 H new ATOM 0 H5 DC A 6 -3.040 2.769 13.615 1.00 0.00 H new ATOM 0 H6 DC A 6 -5.400 2.266 13.148 1.00 0.00 H new ATOM 189 P DG A 7 -10.271 -1.597 13.398 1.00 0.00 P ATOM 190 OP1 DG A 7 -11.502 -2.160 12.787 1.00 0.00 O ATOM 191 OP2 DG A 7 -10.395 -0.795 14.641 1.00 0.00 O ATOM 192 O5' DG A 7 -9.239 -2.802 13.676 1.00 0.00 O ATOM 193 C5' DG A 7 -8.975 -3.784 12.678 1.00 0.00 C ATOM 194 C4' DG A 7 -7.998 -4.872 13.146 1.00 0.00 C ATOM 195 O4' DG A 7 -6.673 -4.361 13.216 1.00 0.00 O ATOM 196 C3' DG A 7 -8.365 -5.472 14.515 1.00 0.00 C ATOM 197 O3' DG A 7 -8.484 -6.885 14.377 1.00 0.00 O ATOM 198 C2' DG A 7 -7.195 -5.021 15.395 1.00 0.00 C ATOM 199 C1' DG A 7 -6.054 -4.860 14.389 1.00 0.00 C ATOM 200 N9 DG A 7 -5.010 -3.894 14.807 1.00 0.00 N ATOM 201 C8 DG A 7 -5.171 -2.585 15.193 1.00 0.00 C ATOM 202 N7 DG A 7 -4.054 -1.923 15.340 1.00 0.00 N ATOM 203 C5 DG A 7 -3.070 -2.880 15.050 1.00 0.00 C ATOM 204 C6 DG A 7 -1.635 -2.787 15.010 1.00 0.00 C ATOM 205 O6 DG A 7 -0.918 -1.804 15.200 1.00 0.00 O ATOM 206 N1 DG A 7 -1.009 -3.982 14.718 1.00 0.00 N ATOM 207 C2 DG A 7 -1.659 -5.153 14.470 1.00 0.00 C ATOM 208 N2 DG A 7 -0.878 -6.185 14.184 1.00 0.00 N ATOM 209 N3 DG A 7 -2.997 -5.266 14.467 1.00 0.00 N ATOM 210 C4 DG A 7 -3.646 -4.100 14.764 1.00 0.00 C ATOM 0 H5' DG A 7 -8.567 -3.294 11.794 1.00 0.00 H new ATOM 0 H5'' DG A 7 -9.913 -4.251 12.379 1.00 0.00 H new ATOM 0 H4' DG A 7 -8.065 -5.667 12.403 1.00 0.00 H new ATOM 0 H3' DG A 7 -9.316 -5.154 14.941 1.00 0.00 H new ATOM 0 H2' DG A 7 -7.414 -4.086 15.911 1.00 0.00 H new ATOM 0 H2'' DG A 7 -6.957 -5.759 16.161 1.00 0.00 H new ATOM 0 H1' DG A 7 -5.545 -5.816 14.270 1.00 0.00 H new ATOM 0 H8 DG A 7 -6.141 -2.140 15.361 1.00 0.00 H new ATOM 0 H1 DG A 7 0.010 -3.989 14.686 1.00 0.00 H new ATOM 0 H22 DG A 7 0.135 -6.067 14.162 1.00 0.00 H new ATOM 221 P DA A 8 -9.060 -7.834 15.549 1.00 0.00 P ATOM 222 OP1 DA A 8 -9.584 -9.071 14.917 1.00 0.00 O ATOM 223 OP2 DA A 8 -9.957 -7.041 16.426 1.00 0.00 O ATOM 224 O5' DA A 8 -7.737 -8.208 16.382 1.00 0.00 O ATOM 225 C5' DA A 8 -6.705 -8.987 15.789 1.00 0.00 C ATOM 226 C4' DA A 8 -5.407 -8.939 16.601 1.00 0.00 C ATOM 227 O4' DA A 8 -4.858 -7.626 16.578 1.00 0.00 O ATOM 228 C3' DA A 8 -5.567 -9.380 18.068 1.00 0.00 C ATOM 229 O3' DA A 8 -4.770 -10.544 18.264 1.00 0.00 O ATOM 230 C2' DA A 8 -5.101 -8.136 18.833 1.00 0.00 C ATOM 231 C1' DA A 8 -4.222 -7.409 17.819 1.00 0.00 C ATOM 232 N9 DA A 8 -4.098 -5.953 18.076 1.00 0.00 N ATOM 233 C8 DA A 8 -5.076 -5.027 18.365 1.00 0.00 C ATOM 234 N7 DA A 8 -4.633 -3.804 18.532 1.00 0.00 N ATOM 235 C5 DA A 8 -3.245 -3.948 18.358 1.00 0.00 C ATOM 236 C6 DA A 8 -2.122 -3.082 18.394 1.00 0.00 C ATOM 237 N6 DA A 8 -2.161 -1.781 18.605 1.00 0.00 N ATOM 238 N1 DA A 8 -0.885 -3.540 18.186 1.00 0.00 N ATOM 239 C2 DA A 8 -0.730 -4.830 17.934 1.00 0.00 C ATOM 240 N3 DA A 8 -1.675 -5.753 17.862 1.00 0.00 N ATOM 241 C4 DA A 8 -2.919 -5.249 18.083 1.00 0.00 C ATOM 0 H5' DA A 8 -6.514 -8.625 14.779 1.00 0.00 H new ATOM 0 H5'' DA A 8 -7.038 -10.021 15.700 1.00 0.00 H new ATOM 0 H4' DA A 8 -4.739 -9.654 16.121 1.00 0.00 H new ATOM 0 H3' DA A 8 -6.566 -9.670 18.394 1.00 0.00 H new ATOM 0 H2' DA A 8 -5.943 -7.520 19.150 1.00 0.00 H new ATOM 0 H2'' DA A 8 -4.544 -8.401 19.731 1.00 0.00 H new ATOM 0 H1' DA A 8 -3.201 -7.789 17.864 1.00 0.00 H new ATOM 0 H8 DA A 8 -6.121 -5.287 18.447 1.00 0.00 H new ATOM 0 H61 DA A 8 -1.297 -1.239 18.613 1.00 0.00 H new ATOM 0 H62 DA A 8 -3.056 -1.316 18.760 1.00 0.00 H new ATOM 0 H2 DA A 8 0.283 -5.167 17.768 1.00 0.00 H new ATOM 253 P DG A 9 -4.546 -11.263 19.692 1.00 0.00 P ATOM 254 OP1 DG A 9 -4.476 -12.728 19.464 1.00 0.00 O ATOM 255 OP2 DG A 9 -5.518 -10.734 20.682 1.00 0.00 O ATOM 256 O5' DG A 9 -3.073 -10.731 20.072 1.00 0.00 O ATOM 257 C5' DG A 9 -1.964 -11.056 19.239 1.00 0.00 C ATOM 258 C4' DG A 9 -0.678 -10.308 19.605 1.00 0.00 C ATOM 259 O4' DG A 9 -0.864 -8.901 19.476 1.00 0.00 O ATOM 260 C3' DG A 9 -0.161 -10.604 21.022 1.00 0.00 C ATOM 261 O3' DG A 9 1.201 -11.014 20.936 1.00 0.00 O ATOM 262 C2' DG A 9 -0.340 -9.255 21.713 1.00 0.00 C ATOM 263 C1' DG A 9 -0.193 -8.275 20.554 1.00 0.00 C ATOM 264 N9 DG A 9 -0.803 -6.964 20.868 1.00 0.00 N ATOM 265 C8 DG A 9 -2.125 -6.671 21.098 1.00 0.00 C ATOM 266 N7 DG A 9 -2.359 -5.416 21.383 1.00 0.00 N ATOM 267 C5 DG A 9 -1.084 -4.832 21.353 1.00 0.00 C ATOM 268 C6 DG A 9 -0.644 -3.477 21.580 1.00 0.00 C ATOM 269 O6 DG A 9 -1.309 -2.475 21.845 1.00 0.00 O ATOM 270 N1 DG A 9 0.724 -3.319 21.480 1.00 0.00 N ATOM 271 C2 DG A 9 1.580 -4.325 21.183 1.00 0.00 C ATOM 272 N2 DG A 9 2.855 -4.050 21.200 1.00 0.00 N ATOM 273 N3 DG A 9 1.223 -5.585 20.952 1.00 0.00 N ATOM 274 C4 DG A 9 -0.127 -5.778 21.049 1.00 0.00 C ATOM 0 H5' DG A 9 -2.221 -10.833 18.204 1.00 0.00 H new ATOM 0 H5'' DG A 9 -1.779 -12.129 19.298 1.00 0.00 H new ATOM 0 H4' DG A 9 0.073 -10.671 18.903 1.00 0.00 H new ATOM 0 H3' DG A 9 -0.670 -11.404 21.559 1.00 0.00 H new ATOM 0 H2' DG A 9 -1.314 -9.171 22.196 1.00 0.00 H new ATOM 0 H2'' DG A 9 0.413 -9.090 22.484 1.00 0.00 H new ATOM 0 H1' DG A 9 0.852 -8.063 20.330 1.00 0.00 H new ATOM 0 H8 DG A 9 -2.906 -7.415 21.048 1.00 0.00 H new ATOM 0 H1 DG A 9 1.113 -2.389 21.639 1.00 0.00 H new ATOM 0 H21 DG A 9 3.536 -4.777 20.983 1.00 0.00 H new ATOM 0 H22 DG A 9 3.170 -3.108 21.431 1.00 0.00 H new ATOM 286 P DT A 10 2.069 -11.461 22.222 1.00 0.00 P ATOM 287 OP1 DT A 10 3.036 -12.496 21.779 1.00 0.00 O ATOM 288 OP2 DT A 10 1.151 -11.777 23.345 1.00 0.00 O ATOM 289 O5' DT A 10 2.888 -10.125 22.603 1.00 0.00 O ATOM 290 C5' DT A 10 3.858 -9.581 21.711 1.00 0.00 C ATOM 291 C4' DT A 10 4.691 -8.450 22.335 1.00 0.00 C ATOM 292 O4' DT A 10 3.899 -7.274 22.468 1.00 0.00 O ATOM 293 C3' DT A 10 5.274 -8.815 23.712 1.00 0.00 C ATOM 294 O3' DT A 10 6.659 -8.481 23.750 1.00 0.00 O ATOM 295 C2' DT A 10 4.414 -7.975 24.656 1.00 0.00 C ATOM 296 C1' DT A 10 4.029 -6.775 23.789 1.00 0.00 C ATOM 297 N1 DT A 10 2.746 -6.126 24.185 1.00 0.00 N ATOM 298 C2 DT A 10 2.746 -4.744 24.425 1.00 0.00 C ATOM 299 O2 DT A 10 3.754 -4.040 24.432 1.00 0.00 O ATOM 300 N3 DT A 10 1.526 -4.160 24.674 1.00 0.00 N ATOM 301 C4 DT A 10 0.317 -4.809 24.742 1.00 0.00 C ATOM 302 O4 DT A 10 -0.697 -4.144 24.947 1.00 0.00 O ATOM 303 C5 DT A 10 0.387 -6.256 24.548 1.00 0.00 C ATOM 304 C7 DT A 10 -0.872 -7.099 24.658 1.00 0.00 C ATOM 305 C6 DT A 10 1.576 -6.858 24.271 1.00 0.00 C ATOM 0 H5' DT A 10 3.353 -9.203 20.822 1.00 0.00 H new ATOM 0 H5'' DT A 10 4.527 -10.377 21.383 1.00 0.00 H new ATOM 0 H4' DT A 10 5.528 -8.279 21.658 1.00 0.00 H new ATOM 0 H3' DT A 10 5.243 -9.873 23.971 1.00 0.00 H new ATOM 0 H2' DT A 10 3.537 -8.523 24.999 1.00 0.00 H new ATOM 0 H2'' DT A 10 4.968 -7.671 25.544 1.00 0.00 H new ATOM 0 H1' DT A 10 4.795 -6.008 23.898 1.00 0.00 H new ATOM 0 H3 DT A 10 1.518 -3.151 24.822 1.00 0.00 H new ATOM 0 H71 DT A 10 -1.562 -6.632 25.360 1.00 0.00 H new ATOM 0 H72 DT A 10 -1.346 -7.175 23.679 1.00 0.00 H new ATOM 0 H73 DT A 10 -0.612 -8.096 25.013 1.00 0.00 H new ATOM 0 H6 DT A 10 1.606 -7.926 24.116 1.00 0.00 H new ATOM 318 P DC A 11 7.607 -8.817 25.015 1.00 0.00 P ATOM 319 OP1 DC A 11 8.993 -8.994 24.515 1.00 0.00 O ATOM 320 OP2 DC A 11 6.990 -9.905 25.815 1.00 0.00 O ATOM 321 O5' DC A 11 7.545 -7.459 25.878 1.00 0.00 O ATOM 322 C5' DC A 11 8.092 -6.247 25.369 1.00 0.00 C ATOM 323 C4' DC A 11 7.752 -5.034 26.246 1.00 0.00 C ATOM 324 O4' DC A 11 6.351 -4.795 26.232 1.00 0.00 O ATOM 325 C3' DC A 11 8.200 -5.177 27.711 1.00 0.00 C ATOM 326 O3' DC A 11 9.175 -4.181 28.016 1.00 0.00 O ATOM 327 C2' DC A 11 6.892 -4.990 28.486 1.00 0.00 C ATOM 328 C1' DC A 11 5.994 -4.256 27.489 1.00 0.00 C ATOM 329 N1 DC A 11 4.535 -4.458 27.722 1.00 0.00 N ATOM 330 C2 DC A 11 3.715 -3.346 27.959 1.00 0.00 C ATOM 331 O2 DC A 11 4.167 -2.208 28.091 1.00 0.00 O ATOM 332 N3 DC A 11 2.373 -3.487 28.068 1.00 0.00 N ATOM 333 C4 DC A 11 1.857 -4.693 27.969 1.00 0.00 C ATOM 334 N4 DC A 11 0.561 -4.764 28.052 1.00 0.00 N ATOM 335 C5 DC A 11 2.631 -5.867 27.767 1.00 0.00 C ATOM 336 C6 DC A 11 3.976 -5.712 27.652 1.00 0.00 C ATOM 0 H5' DC A 11 7.716 -6.078 24.360 1.00 0.00 H new ATOM 0 H5'' DC A 11 9.175 -6.345 25.294 1.00 0.00 H new ATOM 0 H4' DC A 11 8.304 -4.200 25.813 1.00 0.00 H new ATOM 0 H3' DC A 11 8.680 -6.126 27.952 1.00 0.00 H new ATOM 0 H2' DC A 11 6.462 -5.946 28.786 1.00 0.00 H new ATOM 0 H2'' DC A 11 7.043 -4.408 29.395 1.00 0.00 H new ATOM 0 H1' DC A 11 6.144 -3.180 27.577 1.00 0.00 H new ATOM 0 H41 DC A 11 0.094 -5.668 27.983 1.00 0.00 H new ATOM 0 H42 DC A 11 0.011 -3.915 28.186 1.00 0.00 H new ATOM 0 H5 DC A 11 2.170 -6.842 27.707 1.00 0.00 H new ATOM 0 H6 DC A 11 4.607 -6.576 27.505 1.00 0.00 H new ATOM 348 P DC A 12 10.039 -4.199 29.382 1.00 0.00 P ATOM 349 OP1 DC A 12 11.302 -3.462 29.130 1.00 0.00 O ATOM 350 OP2 DC A 12 10.116 -5.592 29.889 1.00 0.00 O ATOM 351 O5' DC A 12 9.147 -3.343 30.416 1.00 0.00 O ATOM 352 C5' DC A 12 9.062 -1.924 30.324 1.00 0.00 C ATOM 353 C4' DC A 12 7.994 -1.334 31.259 1.00 0.00 C ATOM 354 O4' DC A 12 6.696 -1.684 30.809 1.00 0.00 O ATOM 355 C3' DC A 12 8.092 -1.796 32.725 1.00 0.00 C ATOM 356 O3' DC A 12 8.805 -0.873 33.548 1.00 0.00 O ATOM 357 C2' DC A 12 6.626 -1.872 33.164 1.00 0.00 C ATOM 358 C1' DC A 12 5.811 -1.541 31.903 1.00 0.00 C ATOM 359 N1 DC A 12 4.650 -2.457 31.716 1.00 0.00 N ATOM 360 C2 DC A 12 3.346 -1.964 31.865 1.00 0.00 C ATOM 361 O2 DC A 12 3.114 -0.791 32.164 1.00 0.00 O ATOM 362 N3 DC A 12 2.276 -2.780 31.707 1.00 0.00 N ATOM 363 C4 DC A 12 2.492 -4.047 31.421 1.00 0.00 C ATOM 364 N4 DC A 12 1.430 -4.789 31.311 1.00 0.00 N ATOM 365 C5 DC A 12 3.787 -4.614 31.270 1.00 0.00 C ATOM 366 C6 DC A 12 4.849 -3.786 31.432 1.00 0.00 C ATOM 0 H5' DC A 12 8.834 -1.643 29.296 1.00 0.00 H new ATOM 0 H5'' DC A 12 10.032 -1.489 30.566 1.00 0.00 H new ATOM 0 H4' DC A 12 8.175 -0.260 31.229 1.00 0.00 H new ATOM 0 H3' DC A 12 8.637 -2.735 32.818 1.00 0.00 H new ATOM 0 H2' DC A 12 6.379 -2.864 33.543 1.00 0.00 H new ATOM 0 H2'' DC A 12 6.417 -1.163 33.965 1.00 0.00 H new ATOM 0 HO3' DC A 12 8.837 -1.212 34.467 1.00 0.00 H new ATOM 0 H1' DC A 12 5.403 -0.534 31.988 1.00 0.00 H new ATOM 0 H41 DC A 12 1.521 -5.781 31.091 1.00 0.00 H new ATOM 0 H42 DC A 12 0.506 -4.379 31.445 1.00 0.00 H new ATOM 0 H5 DC A 12 3.920 -5.660 31.036 1.00 0.00 H new ATOM 0 H6 DC A 12 5.853 -4.172 31.337 1.00 0.00 H new TER 379 DC A 12 ATOM 380 O5' DG B 13 -8.088 1.009 35.194 1.00 0.00 O ATOM 381 C5' DG B 13 -7.863 1.574 33.905 1.00 0.00 C ATOM 382 C4' DG B 13 -6.481 2.245 33.814 1.00 0.00 C ATOM 383 O4' DG B 13 -5.460 1.252 33.906 1.00 0.00 O ATOM 384 C3' DG B 13 -6.307 2.980 32.473 1.00 0.00 C ATOM 385 O3' DG B 13 -5.796 4.289 32.706 1.00 0.00 O ATOM 386 C2' DG B 13 -5.332 2.078 31.717 1.00 0.00 C ATOM 387 C1' DG B 13 -4.535 1.425 32.844 1.00 0.00 C ATOM 388 N9 DG B 13 -3.981 0.106 32.449 1.00 0.00 N ATOM 389 C8 DG B 13 -4.671 -1.040 32.130 1.00 0.00 C ATOM 390 N7 DG B 13 -3.913 -2.071 31.862 1.00 0.00 N ATOM 391 C5 DG B 13 -2.612 -1.563 31.998 1.00 0.00 C ATOM 392 C6 DG B 13 -1.323 -2.192 31.855 1.00 0.00 C ATOM 393 O6 DG B 13 -1.052 -3.364 31.589 1.00 0.00 O ATOM 394 N1 DG B 13 -0.264 -1.331 32.066 1.00 0.00 N ATOM 395 C2 DG B 13 -0.407 -0.028 32.404 1.00 0.00 C ATOM 396 N2 DG B 13 0.686 0.663 32.576 1.00 0.00 N ATOM 397 N3 DG B 13 -1.572 0.594 32.571 1.00 0.00 N ATOM 398 C4 DG B 13 -2.646 -0.227 32.349 1.00 0.00 C ATOM 0 H5' DG B 13 -8.639 2.308 33.688 1.00 0.00 H new ATOM 0 H5'' DG B 13 -7.940 0.795 33.147 1.00 0.00 H new ATOM 0 H4' DG B 13 -6.405 2.961 34.632 1.00 0.00 H new ATOM 0 H3' DG B 13 -7.228 3.135 31.910 1.00 0.00 H new ATOM 0 H2' DG B 13 -5.853 1.339 31.109 1.00 0.00 H new ATOM 0 H2'' DG B 13 -4.690 2.648 31.045 1.00 0.00 H new ATOM 0 HO5' DG B 13 -8.975 0.592 35.218 1.00 0.00 H new ATOM 0 H1' DG B 13 -3.682 2.046 33.117 1.00 0.00 H new ATOM 0 H8 DG B 13 -5.750 -1.085 32.103 1.00 0.00 H new ATOM 0 H1 DG B 13 0.682 -1.699 31.961 1.00 0.00 H new ATOM 0 H21 DG B 13 0.631 1.649 32.831 1.00 0.00 H new ATOM 0 H22 DG B 13 1.595 0.217 32.455 1.00 0.00 H new ATOM 411 P DG B 14 -5.713 5.408 31.545 1.00 0.00 P ATOM 412 OP1 DG B 14 -5.825 6.739 32.192 1.00 0.00 O ATOM 413 OP2 DG B 14 -6.669 5.057 30.465 1.00 0.00 O ATOM 414 O5' DG B 14 -4.220 5.240 30.968 1.00 0.00 O ATOM 415 C5' DG B 14 -3.088 5.605 31.750 1.00 0.00 C ATOM 416 C4' DG B 14 -1.753 5.337 31.039 1.00 0.00 C ATOM 417 O4' DG B 14 -1.505 3.936 30.969 1.00 0.00 O ATOM 418 C3' DG B 14 -1.683 5.915 29.612 1.00 0.00 C ATOM 419 O3' DG B 14 -0.499 6.695 29.483 1.00 0.00 O ATOM 420 C2' DG B 14 -1.675 4.647 28.757 1.00 0.00 C ATOM 421 C1' DG B 14 -0.994 3.641 29.681 1.00 0.00 C ATOM 422 N9 DG B 14 -1.293 2.232 29.329 1.00 0.00 N ATOM 423 C8 DG B 14 -2.518 1.641 29.130 1.00 0.00 C ATOM 424 N7 DG B 14 -2.465 0.361 28.870 1.00 0.00 N ATOM 425 C5 DG B 14 -1.091 0.086 28.873 1.00 0.00 C ATOM 426 C6 DG B 14 -0.362 -1.137 28.652 1.00 0.00 C ATOM 427 O6 DG B 14 -0.793 -2.266 28.415 1.00 0.00 O ATOM 428 N1 DG B 14 1.006 -0.984 28.726 1.00 0.00 N ATOM 429 C2 DG B 14 1.623 0.192 28.991 1.00 0.00 C ATOM 430 N2 DG B 14 2.926 0.197 28.983 1.00 0.00 N ATOM 431 N3 DG B 14 0.996 1.346 29.212 1.00 0.00 N ATOM 432 C4 DG B 14 -0.366 1.230 29.141 1.00 0.00 C ATOM 0 H5' DG B 14 -3.110 5.053 32.690 1.00 0.00 H new ATOM 0 H5'' DG B 14 -3.153 6.664 32.001 1.00 0.00 H new ATOM 0 H4' DG B 14 -0.995 5.843 31.637 1.00 0.00 H new ATOM 0 H3' DG B 14 -2.493 6.587 29.329 1.00 0.00 H new ATOM 0 H2' DG B 14 -2.683 4.333 28.485 1.00 0.00 H new ATOM 0 H2'' DG B 14 -1.122 4.786 27.828 1.00 0.00 H new ATOM 0 H1' DG B 14 0.090 3.730 29.610 1.00 0.00 H new ATOM 0 H8 DG B 14 -3.447 2.189 29.184 1.00 0.00 H new ATOM 0 H1 DG B 14 1.589 -1.807 28.572 1.00 0.00 H new ATOM 0 H21 DG B 14 3.434 1.060 29.177 1.00 0.00 H new ATOM 0 H22 DG B 14 3.438 -0.662 28.783 1.00 0.00 H new ATOM 444 P DA B 15 -0.112 7.500 28.137 1.00 0.00 P ATOM 445 OP1 DA B 15 0.524 8.780 28.537 1.00 0.00 O ATOM 446 OP2 DA B 15 -1.285 7.537 27.228 1.00 0.00 O ATOM 447 O5' DA B 15 1.011 6.554 27.473 1.00 0.00 O ATOM 448 C5' DA B 15 2.269 6.365 28.114 1.00 0.00 C ATOM 449 C4' DA B 15 3.218 5.437 27.341 1.00 0.00 C ATOM 450 O4' DA B 15 2.713 4.104 27.353 1.00 0.00 O ATOM 451 C3' DA B 15 3.447 5.865 25.880 1.00 0.00 C ATOM 452 O3' DA B 15 4.844 5.815 25.602 1.00 0.00 O ATOM 453 C2' DA B 15 2.618 4.828 25.125 1.00 0.00 C ATOM 454 C1' DA B 15 2.721 3.600 26.029 1.00 0.00 C ATOM 455 N9 DA B 15 1.594 2.655 25.853 1.00 0.00 N ATOM 456 C8 DA B 15 0.245 2.923 25.797 1.00 0.00 C ATOM 457 N7 DA B 15 -0.512 1.870 25.613 1.00 0.00 N ATOM 458 C5 DA B 15 0.425 0.825 25.539 1.00 0.00 C ATOM 459 C6 DA B 15 0.348 -0.577 25.349 1.00 0.00 C ATOM 460 N6 DA B 15 -0.770 -1.258 25.188 1.00 0.00 N ATOM 461 N1 DA B 15 1.445 -1.333 25.338 1.00 0.00 N ATOM 462 C2 DA B 15 2.619 -0.738 25.502 1.00 0.00 C ATOM 463 N3 DA B 15 2.853 0.557 25.678 1.00 0.00 N ATOM 464 C4 DA B 15 1.704 1.292 25.691 1.00 0.00 C ATOM 0 H5' DA B 15 2.102 5.953 29.109 1.00 0.00 H new ATOM 0 H5'' DA B 15 2.750 7.334 28.246 1.00 0.00 H new ATOM 0 H4' DA B 15 4.179 5.499 27.851 1.00 0.00 H new ATOM 0 H3' DA B 15 3.152 6.880 25.614 1.00 0.00 H new ATOM 0 H2' DA B 15 1.585 5.151 24.995 1.00 0.00 H new ATOM 0 H2'' DA B 15 3.019 4.634 24.130 1.00 0.00 H new ATOM 0 H1' DA B 15 3.622 3.037 25.787 1.00 0.00 H new ATOM 0 H8 DA B 15 -0.157 3.921 25.897 1.00 0.00 H new ATOM 0 H61 DA B 15 -0.737 -2.269 25.057 1.00 0.00 H new ATOM 0 H62 DA B 15 -1.668 -0.774 25.195 1.00 0.00 H new ATOM 0 H2 DA B 15 3.486 -1.382 25.491 1.00 0.00 H new ATOM 476 P DC B 16 5.478 6.131 24.150 1.00 0.00 P ATOM 477 OP1 DC B 16 6.834 6.698 24.357 1.00 0.00 O ATOM 478 OP2 DC B 16 4.498 6.896 23.339 1.00 0.00 O ATOM 479 O5' DC B 16 5.630 4.656 23.519 1.00 0.00 O ATOM 480 C5' DC B 16 6.498 3.702 24.124 1.00 0.00 C ATOM 481 C4' DC B 16 6.416 2.310 23.485 1.00 0.00 C ATOM 482 O4' DC B 16 5.113 1.762 23.638 1.00 0.00 O ATOM 483 C3' DC B 16 6.776 2.286 21.989 1.00 0.00 C ATOM 484 O3' DC B 16 7.847 1.366 21.795 1.00 0.00 O ATOM 485 C2' DC B 16 5.465 1.833 21.344 1.00 0.00 C ATOM 486 C1' DC B 16 4.813 1.027 22.466 1.00 0.00 C ATOM 487 N1 DC B 16 3.339 0.894 22.298 1.00 0.00 N ATOM 488 C2 DC B 16 2.784 -0.369 22.051 1.00 0.00 C ATOM 489 O2 DC B 16 3.474 -1.381 21.936 1.00 0.00 O ATOM 490 N3 DC B 16 1.445 -0.523 21.919 1.00 0.00 N ATOM 491 C4 DC B 16 0.678 0.540 22.021 1.00 0.00 C ATOM 492 N4 DC B 16 -0.600 0.319 21.926 1.00 0.00 N ATOM 493 C5 DC B 16 1.174 1.851 22.258 1.00 0.00 C ATOM 494 C6 DC B 16 2.519 1.992 22.388 1.00 0.00 C ATOM 0 H5' DC B 16 6.255 3.622 25.184 1.00 0.00 H new ATOM 0 H5'' DC B 16 7.524 4.063 24.059 1.00 0.00 H new ATOM 0 H4' DC B 16 7.158 1.712 24.014 1.00 0.00 H new ATOM 0 H3' DC B 16 7.122 3.230 21.567 1.00 0.00 H new ATOM 0 H2' DC B 16 4.848 2.678 21.039 1.00 0.00 H new ATOM 0 H2'' DC B 16 5.637 1.227 20.455 1.00 0.00 H new ATOM 0 H1' DC B 16 5.188 0.004 22.487 1.00 0.00 H new ATOM 0 H41 DC B 16 -1.258 1.095 21.995 1.00 0.00 H new ATOM 0 H42 DC B 16 -0.944 -0.630 21.782 1.00 0.00 H new ATOM 0 H5 DC B 16 0.510 2.699 22.332 1.00 0.00 H new ATOM 0 H6 DC B 16 2.944 2.969 22.562 1.00 0.00 H new ATOM 506 P DT B 17 8.559 1.136 20.367 1.00 0.00 P ATOM 507 OP1 DT B 17 9.981 0.793 20.620 1.00 0.00 O ATOM 508 OP2 DT B 17 8.250 2.282 19.476 1.00 0.00 O ATOM 509 O5' DT B 17 7.811 -0.170 19.788 1.00 0.00 O ATOM 510 C5' DT B 17 7.971 -1.444 20.409 1.00 0.00 C ATOM 511 C4' DT B 17 7.331 -2.588 19.607 1.00 0.00 C ATOM 512 O4' DT B 17 5.914 -2.525 19.704 1.00 0.00 O ATOM 513 C3' DT B 17 7.726 -2.567 18.119 1.00 0.00 C ATOM 514 O3' DT B 17 8.266 -3.826 17.730 1.00 0.00 O ATOM 515 C2' DT B 17 6.401 -2.250 17.430 1.00 0.00 C ATOM 516 C1' DT B 17 5.357 -2.765 18.424 1.00 0.00 C ATOM 517 N1 DT B 17 4.042 -2.069 18.336 1.00 0.00 N ATOM 518 C2 DT B 17 2.887 -2.835 18.118 1.00 0.00 C ATOM 519 O2 DT B 17 2.896 -4.041 17.871 1.00 0.00 O ATOM 520 N3 DT B 17 1.684 -2.169 18.180 1.00 0.00 N ATOM 521 C4 DT B 17 1.515 -0.818 18.369 1.00 0.00 C ATOM 522 O4 DT B 17 0.372 -0.362 18.397 1.00 0.00 O ATOM 523 C5 DT B 17 2.759 -0.063 18.517 1.00 0.00 C ATOM 524 C7 DT B 17 2.717 1.446 18.688 1.00 0.00 C ATOM 525 C6 DT B 17 3.959 -0.700 18.510 1.00 0.00 C ATOM 0 H5' DT B 17 7.529 -1.415 21.405 1.00 0.00 H new ATOM 0 H5'' DT B 17 9.034 -1.648 20.538 1.00 0.00 H new ATOM 0 H4' DT B 17 7.705 -3.515 20.042 1.00 0.00 H new ATOM 0 H3' DT B 17 8.504 -1.847 17.866 1.00 0.00 H new ATOM 0 H2' DT B 17 6.289 -1.182 17.246 1.00 0.00 H new ATOM 0 H2'' DT B 17 6.319 -2.750 16.465 1.00 0.00 H new ATOM 0 H1' DT B 17 5.149 -3.814 18.213 1.00 0.00 H new ATOM 0 H3 DT B 17 0.839 -2.731 18.076 1.00 0.00 H new ATOM 0 H71 DT B 17 3.570 1.768 19.285 1.00 0.00 H new ATOM 0 H72 DT B 17 2.757 1.924 17.709 1.00 0.00 H new ATOM 0 H73 DT B 17 1.793 1.729 19.193 1.00 0.00 H new ATOM 0 H6 DT B 17 4.864 -0.127 18.643 1.00 0.00 H new ATOM 538 P DC B 18 9.019 -4.047 16.314 1.00 0.00 P ATOM 539 OP1 DC B 18 10.188 -4.929 16.555 1.00 0.00 O ATOM 540 OP2 DC B 18 9.240 -2.731 15.664 1.00 0.00 O ATOM 541 O5' DC B 18 7.939 -4.853 15.434 1.00 0.00 O ATOM 542 C5' DC B 18 7.625 -6.210 15.730 1.00 0.00 C ATOM 543 C4' DC B 18 6.495 -6.762 14.851 1.00 0.00 C ATOM 544 O4' DC B 18 5.294 -6.062 15.148 1.00 0.00 O ATOM 545 C3' DC B 18 6.776 -6.670 13.340 1.00 0.00 C ATOM 546 O3' DC B 18 6.642 -7.966 12.761 1.00 0.00 O ATOM 547 C2' DC B 18 5.730 -5.658 12.865 1.00 0.00 C ATOM 548 C1' DC B 18 4.643 -5.710 13.945 1.00 0.00 C ATOM 549 N1 DC B 18 3.933 -4.419 14.180 1.00 0.00 N ATOM 550 C2 DC B 18 2.535 -4.417 14.283 1.00 0.00 C ATOM 551 O2 DC B 18 1.861 -5.431 14.108 1.00 0.00 O ATOM 552 N3 DC B 18 1.857 -3.282 14.570 1.00 0.00 N ATOM 553 C4 DC B 18 2.543 -2.172 14.742 1.00 0.00 C ATOM 554 N4 DC B 18 1.843 -1.118 15.038 1.00 0.00 N ATOM 555 C5 DC B 18 3.960 -2.100 14.670 1.00 0.00 C ATOM 556 C6 DC B 18 4.625 -3.248 14.386 1.00 0.00 C ATOM 0 H5' DC B 18 7.337 -6.292 16.778 1.00 0.00 H new ATOM 0 H5'' DC B 18 8.517 -6.823 15.596 1.00 0.00 H new ATOM 0 H4' DC B 18 6.409 -7.823 15.083 1.00 0.00 H new ATOM 0 H3' DC B 18 7.780 -6.348 13.063 1.00 0.00 H new ATOM 0 H2' DC B 18 6.155 -4.658 12.775 1.00 0.00 H new ATOM 0 H2'' DC B 18 5.332 -5.925 11.886 1.00 0.00 H new ATOM 0 H1' DC B 18 3.885 -6.420 13.612 1.00 0.00 H new ATOM 0 H41 DC B 18 2.308 -0.222 15.186 1.00 0.00 H new ATOM 0 H42 DC B 18 0.829 -1.187 15.123 1.00 0.00 H new ATOM 0 H5 DC B 18 4.486 -1.171 14.834 1.00 0.00 H new ATOM 0 H6 DC B 18 5.703 -3.242 14.321 1.00 0.00 H new ATOM 568 P DG B 19 6.873 -8.259 11.189 1.00 0.00 P ATOM 569 OP1 DG B 19 7.315 -9.669 11.046 1.00 0.00 O ATOM 570 OP2 DG B 19 7.710 -7.182 10.602 1.00 0.00 O ATOM 571 O5' DG B 19 5.382 -8.128 10.594 1.00 0.00 O ATOM 572 C5' DG B 19 4.354 -9.015 11.022 1.00 0.00 C ATOM 573 C4' DG B 19 2.960 -8.588 10.546 1.00 0.00 C ATOM 574 O4' DG B 19 2.569 -7.380 11.193 1.00 0.00 O ATOM 575 C3' DG B 19 2.855 -8.374 9.025 1.00 0.00 C ATOM 576 O3' DG B 19 1.729 -9.105 8.546 1.00 0.00 O ATOM 577 C2' DG B 19 2.679 -6.857 8.939 1.00 0.00 C ATOM 578 C1' DG B 19 1.923 -6.568 10.231 1.00 0.00 C ATOM 579 N9 DG B 19 1.967 -5.145 10.636 1.00 0.00 N ATOM 580 C8 DG B 19 3.055 -4.311 10.724 1.00 0.00 C ATOM 581 N7 DG B 19 2.775 -3.098 11.121 1.00 0.00 N ATOM 582 C5 DG B 19 1.382 -3.123 11.286 1.00 0.00 C ATOM 583 C6 DG B 19 0.449 -2.099 11.683 1.00 0.00 C ATOM 584 O6 DG B 19 0.666 -0.935 12.019 1.00 0.00 O ATOM 585 N1 DG B 19 -0.866 -2.515 11.661 1.00 0.00 N ATOM 586 C2 DG B 19 -1.256 -3.764 11.317 1.00 0.00 C ATOM 587 N2 DG B 19 -2.538 -4.002 11.301 1.00 0.00 N ATOM 588 N3 DG B 19 -0.435 -4.751 10.972 1.00 0.00 N ATOM 589 C4 DG B 19 0.880 -4.369 10.973 1.00 0.00 C ATOM 0 H5' DG B 19 4.359 -9.071 12.111 1.00 0.00 H new ATOM 0 H5'' DG B 19 4.568 -10.017 10.650 1.00 0.00 H new ATOM 0 H4' DG B 19 2.299 -9.415 10.807 1.00 0.00 H new ATOM 0 H3' DG B 19 3.698 -8.716 8.425 1.00 0.00 H new ATOM 0 H2' DG B 19 3.635 -6.334 8.897 1.00 0.00 H new ATOM 0 H2'' DG B 19 2.113 -6.559 8.056 1.00 0.00 H new ATOM 0 H1' DG B 19 0.860 -6.782 10.116 1.00 0.00 H new ATOM 0 H8 DG B 19 4.058 -4.631 10.485 1.00 0.00 H new ATOM 0 H1 DG B 19 -1.587 -1.841 11.919 1.00 0.00 H new ATOM 0 H21 DG B 19 -2.882 -4.928 11.048 1.00 0.00 H new ATOM 0 H22 DG B 19 -3.197 -3.262 11.541 1.00 0.00 H new ATOM 601 P DC B 20 1.297 -9.167 6.991 1.00 0.00 P ATOM 602 OP1 DC B 20 0.948 -10.574 6.672 1.00 0.00 O ATOM 603 OP2 DC B 20 2.316 -8.477 6.161 1.00 0.00 O ATOM 604 O5' DC B 20 -0.054 -8.285 6.974 1.00 0.00 O ATOM 605 C5' DC B 20 -1.216 -8.728 7.671 1.00 0.00 C ATOM 606 C4' DC B 20 -2.426 -7.788 7.540 1.00 0.00 C ATOM 607 O4' DC B 20 -2.158 -6.554 8.198 1.00 0.00 O ATOM 608 C3' DC B 20 -2.825 -7.491 6.084 1.00 0.00 C ATOM 609 O3' DC B 20 -4.244 -7.566 5.955 1.00 0.00 O ATOM 610 C2' DC B 20 -2.274 -6.080 5.891 1.00 0.00 C ATOM 611 C1' DC B 20 -2.398 -5.486 7.297 1.00 0.00 C ATOM 612 N1 DC B 20 -1.423 -4.392 7.565 1.00 0.00 N ATOM 613 C2 DC B 20 -1.893 -3.138 7.979 1.00 0.00 C ATOM 614 O2 DC B 20 -3.090 -2.891 8.113 1.00 0.00 O ATOM 615 N3 DC B 20 -1.030 -2.129 8.245 1.00 0.00 N ATOM 616 C4 DC B 20 0.259 -2.351 8.110 1.00 0.00 C ATOM 617 N4 DC B 20 1.034 -1.360 8.434 1.00 0.00 N ATOM 618 C5 DC B 20 0.804 -3.599 7.702 1.00 0.00 C ATOM 619 C6 DC B 20 -0.071 -4.602 7.440 1.00 0.00 C ATOM 0 H5' DC B 20 -0.971 -8.842 8.727 1.00 0.00 H new ATOM 0 H5'' DC B 20 -1.495 -9.714 7.300 1.00 0.00 H new ATOM 0 H4' DC B 20 -3.261 -8.311 8.006 1.00 0.00 H new ATOM 0 H3' DC B 20 -2.442 -8.186 5.337 1.00 0.00 H new ATOM 0 H2' DC B 20 -1.241 -6.091 5.544 1.00 0.00 H new ATOM 0 H2'' DC B 20 -2.850 -5.515 5.159 1.00 0.00 H new ATOM 0 H1' DC B 20 -3.387 -5.041 7.409 1.00 0.00 H new ATOM 0 H41 DC B 20 2.046 -1.458 8.356 1.00 0.00 H new ATOM 0 H42 DC B 20 0.630 -0.484 8.767 1.00 0.00 H new ATOM 0 H5 DC B 20 1.870 -3.743 7.605 1.00 0.00 H new ATOM 0 H6 DC B 20 0.297 -5.570 7.132 1.00 0.00 H new ATOM 631 P DT B 21 -5.009 -7.411 4.540 1.00 0.00 P ATOM 632 OP1 DT B 21 -6.279 -8.174 4.624 1.00 0.00 O ATOM 633 OP2 DT B 21 -4.062 -7.721 3.440 1.00 0.00 O ATOM 634 O5' DT B 21 -5.362 -5.839 4.472 1.00 0.00 O ATOM 635 C5' DT B 21 -6.330 -5.269 5.347 1.00 0.00 C ATOM 636 C4' DT B 21 -6.406 -3.741 5.237 1.00 0.00 C ATOM 637 O4' DT B 21 -5.194 -3.152 5.686 1.00 0.00 O ATOM 638 C3' DT B 21 -6.698 -3.219 3.817 1.00 0.00 C ATOM 639 O3' DT B 21 -7.962 -2.561 3.803 1.00 0.00 O ATOM 640 C2' DT B 21 -5.523 -2.271 3.559 1.00 0.00 C ATOM 641 C1' DT B 21 -5.016 -1.951 4.964 1.00 0.00 C ATOM 642 N1 DT B 21 -3.583 -1.548 4.988 1.00 0.00 N ATOM 643 C2 DT B 21 -3.264 -0.255 5.421 1.00 0.00 C ATOM 644 O2 DT B 21 -4.094 0.604 5.709 1.00 0.00 O ATOM 645 N3 DT B 21 -1.928 0.054 5.502 1.00 0.00 N ATOM 646 C4 DT B 21 -0.887 -0.754 5.117 1.00 0.00 C ATOM 647 O4 DT B 21 0.259 -0.319 5.219 1.00 0.00 O ATOM 648 C5 DT B 21 -1.284 -2.068 4.613 1.00 0.00 C ATOM 649 C7 DT B 21 -0.231 -3.051 4.129 1.00 0.00 C ATOM 650 C6 DT B 21 -2.596 -2.422 4.574 1.00 0.00 C ATOM 0 H5' DT B 21 -6.090 -5.543 6.374 1.00 0.00 H new ATOM 0 H5'' DT B 21 -7.309 -5.694 5.124 1.00 0.00 H new ATOM 0 H4' DT B 21 -7.248 -3.454 5.867 1.00 0.00 H new ATOM 0 H3' DT B 21 -6.770 -3.987 3.047 1.00 0.00 H new ATOM 0 H2' DT B 21 -4.751 -2.743 2.950 1.00 0.00 H new ATOM 0 H2'' DT B 21 -5.840 -1.372 3.031 1.00 0.00 H new ATOM 0 H1' DT B 21 -5.558 -1.104 5.385 1.00 0.00 H new ATOM 0 H3 DT B 21 -1.687 0.969 5.884 1.00 0.00 H new ATOM 0 H71 DT B 21 -0.580 -4.070 4.298 1.00 0.00 H new ATOM 0 H72 DT B 21 -0.054 -2.900 3.064 1.00 0.00 H new ATOM 0 H73 DT B 21 0.697 -2.890 4.678 1.00 0.00 H new ATOM 0 H6 DT B 21 -2.871 -3.402 4.214 1.00 0.00 H new ATOM 663 P DA B 22 -8.622 -1.955 2.458 1.00 0.00 P ATOM 664 OP1 DA B 22 -10.097 -1.985 2.622 1.00 0.00 O ATOM 665 OP2 DA B 22 -8.021 -2.622 1.276 1.00 0.00 O ATOM 666 O5' DA B 22 -8.137 -0.418 2.470 1.00 0.00 O ATOM 667 C5' DA B 22 -8.563 0.474 3.495 1.00 0.00 C ATOM 668 C4' DA B 22 -7.948 1.876 3.363 1.00 0.00 C ATOM 669 O4' DA B 22 -6.555 1.835 3.655 1.00 0.00 O ATOM 670 C3' DA B 22 -8.132 2.502 1.969 1.00 0.00 C ATOM 671 O3' DA B 22 -8.733 3.786 2.113 1.00 0.00 O ATOM 672 C2' DA B 22 -6.695 2.556 1.444 1.00 0.00 C ATOM 673 C1' DA B 22 -5.883 2.671 2.731 1.00 0.00 C ATOM 674 N9 DA B 22 -4.484 2.206 2.584 1.00 0.00 N ATOM 675 C8 DA B 22 -4.032 0.972 2.179 1.00 0.00 C ATOM 676 N7 DA B 22 -2.733 0.823 2.232 1.00 0.00 N ATOM 677 C5 DA B 22 -2.297 2.083 2.677 1.00 0.00 C ATOM 678 C6 DA B 22 -1.036 2.662 2.964 1.00 0.00 C ATOM 679 N6 DA B 22 0.116 2.025 2.891 1.00 0.00 N ATOM 680 N1 DA B 22 -0.929 3.936 3.350 1.00 0.00 N ATOM 681 C2 DA B 22 -2.045 4.641 3.488 1.00 0.00 C ATOM 682 N3 DA B 22 -3.294 4.234 3.290 1.00 0.00 N ATOM 683 C4 DA B 22 -3.353 2.935 2.876 1.00 0.00 C ATOM 0 H5' DA B 22 -8.297 0.056 4.466 1.00 0.00 H new ATOM 0 H5'' DA B 22 -9.650 0.556 3.470 1.00 0.00 H new ATOM 0 H4' DA B 22 -8.483 2.499 4.080 1.00 0.00 H new ATOM 0 H3' DA B 22 -8.786 1.958 1.287 1.00 0.00 H new ATOM 0 H2' DA B 22 -6.435 1.662 0.878 1.00 0.00 H new ATOM 0 H2'' DA B 22 -6.535 3.409 0.784 1.00 0.00 H new ATOM 0 H1' DA B 22 -5.816 3.714 3.040 1.00 0.00 H new ATOM 0 H8 DA B 22 -4.696 0.189 1.844 1.00 0.00 H new ATOM 0 H61 DA B 22 0.984 2.513 3.114 1.00 0.00 H new ATOM 0 H62 DA B 22 0.140 1.044 2.611 1.00 0.00 H new ATOM 0 H2 DA B 22 -1.923 5.668 3.798 1.00 0.00 H new ATOM 695 P DG B 23 -9.194 4.683 0.854 1.00 0.00 P ATOM 696 OP1 DG B 23 -10.362 5.495 1.276 1.00 0.00 O ATOM 697 OP2 DG B 23 -9.320 3.817 -0.345 1.00 0.00 O ATOM 698 O5' DG B 23 -7.938 5.666 0.635 1.00 0.00 O ATOM 699 C5' DG B 23 -7.627 6.678 1.587 1.00 0.00 C ATOM 700 C4' DG B 23 -6.382 7.490 1.208 1.00 0.00 C ATOM 701 O4' DG B 23 -5.207 6.703 1.370 1.00 0.00 O ATOM 702 C3' DG B 23 -6.414 8.027 -0.237 1.00 0.00 C ATOM 703 O3' DG B 23 -6.233 9.440 -0.213 1.00 0.00 O ATOM 704 C2' DG B 23 -5.254 7.266 -0.883 1.00 0.00 C ATOM 705 C1' DG B 23 -4.329 7.008 0.304 1.00 0.00 C ATOM 706 N9 DG B 23 -3.385 5.885 0.085 1.00 0.00 N ATOM 707 C8 DG B 23 -3.651 4.614 -0.368 1.00 0.00 C ATOM 708 N7 DG B 23 -2.600 3.841 -0.453 1.00 0.00 N ATOM 709 C5 DG B 23 -1.550 4.668 -0.027 1.00 0.00 C ATOM 710 C6 DG B 23 -0.136 4.425 0.111 1.00 0.00 C ATOM 711 O6 DG B 23 0.503 3.398 -0.120 1.00 0.00 O ATOM 712 N1 DG B 23 0.569 5.517 0.573 1.00 0.00 N ATOM 713 C2 DG B 23 0.002 6.710 0.869 1.00 0.00 C ATOM 714 N2 DG B 23 0.797 7.665 1.266 1.00 0.00 N ATOM 715 N3 DG B 23 -1.294 6.987 0.754 1.00 0.00 N ATOM 716 C4 DG B 23 -2.025 5.921 0.303 1.00 0.00 C ATOM 0 H5' DG B 23 -7.471 6.217 2.562 1.00 0.00 H new ATOM 0 H5'' DG B 23 -8.478 7.352 1.685 1.00 0.00 H new ATOM 0 H4' DG B 23 -6.374 8.347 1.881 1.00 0.00 H new ATOM 0 H3' DG B 23 -7.345 7.877 -0.784 1.00 0.00 H new ATOM 0 H2' DG B 23 -5.586 6.338 -1.348 1.00 0.00 H new ATOM 0 H2'' DG B 23 -4.764 7.854 -1.659 1.00 0.00 H new ATOM 0 H1' DG B 23 -3.693 7.874 0.489 1.00 0.00 H new ATOM 0 H8 DG B 23 -4.644 4.282 -0.631 1.00 0.00 H new ATOM 0 H1 DG B 23 1.577 5.420 0.699 1.00 0.00 H new ATOM 0 H21 DG B 23 0.416 8.582 1.500 1.00 0.00 H new ATOM 0 H22 DG B 23 1.800 7.495 1.342 1.00 0.00 H new ATOM 728 P DC B 24 -6.253 10.360 -1.542 1.00 0.00 P ATOM 729 OP1 DC B 24 -6.886 11.656 -1.192 1.00 0.00 O ATOM 730 OP2 DC B 24 -6.800 9.578 -2.678 1.00 0.00 O ATOM 731 O5' DC B 24 -4.685 10.611 -1.808 1.00 0.00 O ATOM 732 C5' DC B 24 -3.902 11.347 -0.872 1.00 0.00 C ATOM 733 C4' DC B 24 -2.403 11.325 -1.199 1.00 0.00 C ATOM 734 O4' DC B 24 -1.921 9.988 -1.127 1.00 0.00 O ATOM 735 C3' DC B 24 -2.060 11.888 -2.594 1.00 0.00 C ATOM 736 O3' DC B 24 -1.067 12.911 -2.531 1.00 0.00 O ATOM 737 C2' DC B 24 -1.489 10.676 -3.324 1.00 0.00 C ATOM 738 C1' DC B 24 -0.984 9.803 -2.171 1.00 0.00 C ATOM 739 N1 DC B 24 -0.897 8.359 -2.523 1.00 0.00 N ATOM 740 C2 DC B 24 0.342 7.707 -2.452 1.00 0.00 C ATOM 741 O2 DC B 24 1.375 8.287 -2.113 1.00 0.00 O ATOM 742 N3 DC B 24 0.454 6.395 -2.773 1.00 0.00 N ATOM 743 C4 DC B 24 -0.624 5.750 -3.164 1.00 0.00 C ATOM 744 N4 DC B 24 -0.451 4.495 -3.458 1.00 0.00 N ATOM 745 C5 DC B 24 -1.909 6.350 -3.261 1.00 0.00 C ATOM 746 C6 DC B 24 -2.009 7.662 -2.931 1.00 0.00 C ATOM 0 H5' DC B 24 -4.057 10.937 0.126 1.00 0.00 H new ATOM 0 H5'' DC B 24 -4.249 12.380 -0.849 1.00 0.00 H new ATOM 0 H4' DC B 24 -1.924 11.970 -0.462 1.00 0.00 H new ATOM 0 H3' DC B 24 -2.927 12.341 -3.075 1.00 0.00 H new ATOM 0 H2' DC B 24 -2.247 10.165 -3.918 1.00 0.00 H new ATOM 0 H2'' DC B 24 -0.685 10.954 -4.005 1.00 0.00 H new ATOM 0 HO3' DC B 24 -0.878 13.239 -3.435 1.00 0.00 H new ATOM 0 H1' DC B 24 0.030 10.095 -1.898 1.00 0.00 H new ATOM 0 H41 DC B 24 -1.242 3.930 -3.769 1.00 0.00 H new ATOM 0 H42 DC B 24 0.475 4.075 -3.378 1.00 0.00 H new ATOM 0 H5 DC B 24 -2.770 5.784 -3.584 1.00 0.00 H new ATOM 0 H6 DC B 24 -2.965 8.160 -2.989 1.00 0.00 H new TER 759 DC B 24 HETATM 760 C1 HNB A 125 -0.674 -9.583 12.843 1.00 0.00 C HETATM 761 C2 HNB A 125 -0.385 -8.100 12.720 1.00 0.00 C HETATM 762 C3 HNB A 125 -1.317 -7.520 13.762 1.00 0.00 C HETATM 763 C4 HNB A 125 -1.325 -8.621 14.847 1.00 0.00 C HETATM 764 C5 HNB A 125 -0.361 -8.496 16.047 1.00 0.00 C HETATM 765 C6 HNB A 125 1.148 -8.647 15.788 1.00 0.00 C HETATM 766 C7 HNB A 125 1.909 -8.571 17.128 1.00 0.00 C HETATM 767 C8 HNB A 125 3.437 -8.663 17.004 1.00 0.00 C HETATM 768 C9 HNB A 125 3.917 -10.009 16.448 1.00 0.00 C HETATM 769 O4 HNB A 125 -1.070 -9.853 14.171 1.00 0.00 O HETATM 770 O1 HNB A 125 -1.852 -9.923 12.164 1.00 0.00 O HETATM 0 HO1 HNB A 125 -2.017 -10.885 12.257 1.00 0.00 H new HETATM 0 H4 HNB A 125 -2.300 -8.537 15.327 1.00 0.00 H new HETATM 0 H39 HNB A 125 3.591 -10.813 17.109 1.00 0.00 H new HETATM 0 H3 HNB A 125 -2.314 -7.338 13.360 1.00 0.00 H new HETATM 0 H29 HNB A 125 3.496 -10.163 15.454 1.00 0.00 H new HETATM 0 H28 HNB A 125 3.791 -7.862 16.355 1.00 0.00 H new HETATM 0 H27 HNB A 125 1.654 -7.634 17.622 1.00 0.00 H new HETATM 0 H26 HNB A 125 1.350 -9.598 15.296 1.00 0.00 H new HETATM 0 H25 HNB A 125 -0.524 -7.520 16.504 1.00 0.00 H new HETATM 0 H22 HNB A 125 0.659 -7.867 12.929 1.00 0.00 H new HETATM 0 H19 HNB A 125 5.005 -10.009 16.385 1.00 0.00 H new HETATM 0 H18 HNB A 125 3.885 -8.501 17.984 1.00 0.00 H new HETATM 0 H17 HNB A 125 1.561 -9.377 17.774 1.00 0.00 H new HETATM 0 H16 HNB A 125 1.493 -7.861 15.116 1.00 0.00 H new HETATM 0 H15 HNB A 125 -0.649 -9.246 16.784 1.00 0.00 H new HETATM 0 H12 HNB A 125 -0.602 -7.722 11.721 1.00 0.00 H new HETATM 0 H1 HNB A 125 0.215 -10.103 12.485 1.00 0.00 H new CONECT 208 762 CONECT 760 761 769 770 773 CONECT 761 760 762 775 776 CONECT 762 208 761 763 771 CONECT 763 762 764 769 772 CONECT 764 763 765 777 778 CONECT 765 764 766 779 780 CONECT 766 765 767 781 782 CONECT 767 766 768 783 784 CONECT 768 767 785 786 787 CONECT 769 760 763 CONECT 770 760 774 CONECT 771 762 CONECT 772 763 CONECT 773 760 CONECT 774 770 CONECT 775 761 CONECT 776 761 CONECT 777 764 CONECT 778 764 CONECT 779 765 CONECT 780 765 CONECT 781 766 CONECT 782 766 CONECT 783 767 CONECT 784 767 CONECT 785 768 CONECT 786 768 CONECT 787 768 END