USER MOD reduce.3.24.130724 H: found=0, std=0, add=245, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 245 hydrogens (50 hets) HEADER DNA 11-DEC-06 2E4I TITLE HUMAN TELOMERIC DNA MIXED-PARALLEL/ANTIPARALLEL QUADRUPLEX TITLE 2 UNDER PHYSIOLOGICAL IONIC CONDITIONS STABILIZED BY PROPER TITLE 3 INCORPORATION OF 8-BROMOGUANOSINES COMPND MOL_ID: 1; COMPND 2 MOLECULE: DNA (5'-D(*DAP*(BGM)P*DGP*DGP*DTP*DTP*DAP*(BGM) COMPND 3 P*DGP*DGP*DTP*DTP*DAP*(BGM)P*(BGM)P*DGP*DTP*DTP*DAP*(BGM) COMPND 4 P*DGP*DG)-3'); COMPND 5 CHAIN: A; COMPND 6 ENGINEERED: YES; COMPND 7 OTHER_DETAILS: HUMAN TELOMERIC DNA SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES KEYWDS TELOMERE, QUADRUPLEX, MIXED-PARALLEL/ANTIPARALLEL, NMR, DNA, KEYWDS 2 STRUCTURE EXPDTA SOLUTION NMR AUTHOR A.MATSUGAMI,Y.XU,Y.NOGUCHI,H.SUGIYAMA,M.KATAHIRA REVDAT 2 24-FEB-09 2E4I 1 VERSN REVDAT 1 11-DEC-07 2E4I 0 JRNL AUTH A.MATSUGAMI,Y.XU,Y.NOGUCHI,H.SUGIYAMA,M.KATAHIRA JRNL TITL STRUCTURE OF A HUMAN TELOMERIC DNA SEQUENCE JRNL TITL 2 STABILIZED BY 8-BROMOGUANOSINE SUBSTITUTIONS, AS JRNL TITL 3 DETERMINED BY NMR IN A K+ SOLUTION JRNL REF FEBS J. V. 274 3545 2007 JRNL REFN ISSN 1742-464X JRNL PMID 17561958 JRNL DOI 10.1111/J.1742-4658.2007.05881.X REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.851 REMARK 3 AUTHORS : A.T. BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: THE STRUCTURES ARE BASED ON A TOTAL REMARK 3 OF 752 RESTRAINTS, 582 ARE NOE-DERIVED DISTANCE CONSTRAINTS, REMARK 3 110 DIHEDRAL ANGLE RESTRAINTS,48 DISTANCE RESTRAINTS FROM REMARK 3 HYDROGEN BONDS, 12 PLANARITY RESTRAINTS FOR TETRAD PLANES. REMARK 4 REMARK 4 2E4I COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 14-DEC-06. REMARK 100 THE RCSB ID CODE IS RCSB026214. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298 REMARK 210 PH : 6.3 REMARK 210 IONIC STRENGTH : 110MM POTASSIUM ION REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 0.6MM DNA; 100MM KCL; 10MM K- REMARK 210 PHOSPHATE (PH 6.3); 0.01MM REMARK 210 DSS, 100% D2O; 0.6MM DNA; REMARK 210 100MM KCL; 10MM K-PHOSPHATE REMARK 210 (PH 6.3); 0.01MM DSS, 95% H2O, REMARK 210 5% D2O; 1.3MM DNA; 100MM KCL; REMARK 210 10MM K-PHOSPHATE (PH 6.3); REMARK 210 0.01MM DSS, 95% H2O, 5% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D NOESY, 2D TOCSY, DQF-COSY, REMARK 210 JR-HMBC, 13C-HSQC, H, P HSQC REMARK 210 SPECTROMETER FIELD STRENGTH : 800 MHZ, 600 MHZ, 500 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NMRPIPE 2.4, XWINNMR 3.5, REMARK 210 PIPP 4.3.2, SPAKY 3.112, X- REMARK 210 PLOR 3.851 REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 100 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LOWEST REMARK 210 ENERGY 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: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 O3' DT A 11 O4' DT A 12 2.18 REMARK 500 REMARK 500 REMARK: NULL DBREF 2E4I A 1 22 PDB 2E4I 2E4I 1 22 SEQRES 1 A 22 DA BGM DG DG DT DT DA BGM DG DG DT DT DA SEQRES 2 A 22 BGM BGM DG DT DT DA BGM DG DG MODRES 2E4I BGM A 2 DG MODRES 2E4I BGM A 8 DG MODRES 2E4I BGM A 14 DG MODRES 2E4I BGM A 15 DG MODRES 2E4I BGM A 20 DG HET BGM A 2 33 HET BGM A 8 33 HET BGM A 14 33 HET BGM A 15 33 HET BGM A 20 33 HETNAM BGM 8-BROMO-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE FORMUL 1 BGM 5(C10 H13 BR N5 O7 P) LINK O3' DA A 1 P BGM A 2 1555 1555 1.61 LINK O3' BGM A 2 P DG A 3 1555 1555 1.61 LINK O3' DA A 7 P BGM A 8 1555 1555 1.61 LINK O3' BGM A 8 P DG A 9 1555 1555 1.61 LINK O3' DA A 13 P BGM A 14 1555 1555 1.61 LINK O3' BGM A 14 P BGM A 15 1555 1555 1.61 LINK O3' BGM A 15 P DG A 16 1555 1555 1.61 LINK O3' DA A 19 P BGM A 20 1555 1555 1.61 LINK O3' BGM A 20 P DG A 21 1555 1555 1.61 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 -69:sc= 0.00362 USER MOD Single : A 5 DT C7 :methyl 150:sc= -5.45! (180deg=-5.45!) USER MOD Single : A 6 DT C7 :methyl 150:sc= -0.0361 (180deg=-0.0361) USER MOD Single : A 11 DT C7 :methyl -30:sc= 0 (180deg=-0.815) USER MOD Single : A 12 DT C7 :methyl 150:sc= -4.28! (180deg=-4.28!) USER MOD Single : A 17 DT C7 :methyl 150:sc= -0.0939 (180deg=-0.0939) USER MOD Single : A 18 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 22 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 6.680 3.444 4.413 1.00 0.00 O ATOM 2 C5' DA A 1 6.726 2.031 4.628 1.00 0.00 C ATOM 3 C4' DA A 1 5.750 1.617 5.704 1.00 0.00 C ATOM 4 O4' DA A 1 5.600 0.184 5.685 1.00 0.00 O ATOM 5 C3' DA A 1 6.185 1.938 7.129 1.00 0.00 C ATOM 6 O3' DA A 1 5.719 3.235 7.512 1.00 0.00 O ATOM 7 C2' DA A 1 5.506 0.860 7.960 1.00 0.00 C ATOM 8 C1' DA A 1 5.151 -0.244 6.961 1.00 0.00 C ATOM 9 N9 DA A 1 5.783 -1.530 7.250 1.00 0.00 N ATOM 10 C8 DA A 1 7.069 -1.918 6.967 1.00 0.00 C ATOM 11 N7 DA A 1 7.350 -3.138 7.355 1.00 0.00 N ATOM 12 C5 DA A 1 6.169 -3.584 7.932 1.00 0.00 C ATOM 13 C6 DA A 1 5.812 -4.802 8.537 1.00 0.00 C ATOM 14 N6 DA A 1 6.646 -5.836 8.668 1.00 0.00 N ATOM 15 N1 DA A 1 4.553 -4.923 9.010 1.00 0.00 N ATOM 16 C2 DA A 1 3.717 -3.885 8.880 1.00 0.00 C ATOM 17 N3 DA A 1 3.935 -2.691 8.333 1.00 0.00 N ATOM 18 C4 DA A 1 5.195 -2.604 7.873 1.00 0.00 C ATOM 0 H5' DA A 1 7.735 1.735 4.914 1.00 0.00 H new ATOM 0 H5'' DA A 1 6.492 1.510 3.699 1.00 0.00 H new ATOM 0 H4' DA A 1 4.843 2.176 5.474 1.00 0.00 H new ATOM 0 H3' DA A 1 7.268 1.951 7.253 1.00 0.00 H new ATOM 0 H2' DA A 1 6.169 0.488 8.741 1.00 0.00 H new ATOM 0 H2'' DA A 1 4.615 1.246 8.455 1.00 0.00 H new ATOM 0 HO5' DA A 1 5.826 3.684 3.995 1.00 0.00 H new ATOM 0 H1' DA A 1 4.074 -0.401 7.015 1.00 0.00 H new ATOM 0 H8 DA A 1 7.783 -1.277 6.471 1.00 0.00 H new ATOM 0 H61 DA A 1 6.327 -6.695 9.117 1.00 0.00 H new ATOM 0 H62 DA A 1 7.602 -5.767 8.319 1.00 0.00 H new ATOM 0 H2 DA A 1 2.724 -4.038 9.275 1.00 0.00 H new HETATM 31 P BGM A 2 6.061 3.803 8.976 1.00 0.00 P HETATM 32 OP1 BGM A 2 7.251 4.681 8.844 1.00 0.00 O HETATM 33 OP2 BGM A 2 6.094 2.661 9.924 1.00 0.00 O HETATM 34 O5' BGM A 2 4.808 4.718 9.338 1.00 0.00 O HETATM 35 C5' BGM A 2 3.494 4.377 8.894 1.00 0.00 C HETATM 36 C4' BGM A 2 2.897 5.522 8.110 1.00 0.00 C HETATM 37 O4' BGM A 2 3.368 5.449 6.742 1.00 0.00 O HETATM 38 C1' BGM A 2 2.269 5.319 5.855 1.00 0.00 C HETATM 39 N9 BGM A 2 2.668 4.420 4.775 1.00 0.00 N HETATM 40 C8 BGM A 2 3.369 4.754 3.642 1.00 0.00 C HETATM 41 N7 BGM A 2 3.583 3.738 2.851 1.00 0.00 N HETATM 42 C5 BGM A 2 2.987 2.666 3.503 1.00 0.00 C HETATM 43 C4 BGM A 2 2.417 3.072 4.692 1.00 0.00 C HETATM 44 N3 BGM A 2 1.751 2.332 5.603 1.00 0.00 N HETATM 45 C2 BGM A 2 1.670 1.061 5.244 1.00 0.00 C HETATM 46 N2 BGM A 2 1.038 0.182 6.036 1.00 0.00 N HETATM 47 N1 BGM A 2 2.202 0.557 4.083 1.00 0.00 N HETATM 48 C6 BGM A 2 2.893 1.300 3.131 1.00 0.00 C HETATM 49 O6 BGM A 2 3.333 0.744 2.117 1.00 0.00 O HETATM 50 C2' BGM A 2 1.104 4.831 6.697 1.00 0.00 C HETATM 51 C3' BGM A 2 1.370 5.521 8.021 1.00 0.00 C HETATM 52 O3' BGM A 2 0.876 6.864 8.000 1.00 0.00 O HETATM 53 BR BGM A 2 3.977 6.529 3.272 1.00 0.00 BR HETATM 0 H5'' BGM A 2 3.532 3.482 8.273 1.00 0.00 H new HETATM 0 H2'' BGM A 2 0.143 5.119 6.271 1.00 0.00 H new HETATM 0 H5' BGM A 2 2.861 4.144 9.751 1.00 0.00 H new HETATM 0 H4' BGM A 2 3.205 6.419 8.646 1.00 0.00 H new HETATM 0 H3' BGM A 2 0.885 5.029 8.864 1.00 0.00 H new HETATM 0 H22 BGM A 2 0.974 -0.798 5.761 1.00 0.00 H new HETATM 0 H21 BGM A 2 0.621 0.494 6.913 1.00 0.00 H new HETATM 0 H2' BGM A 2 1.097 3.745 6.795 1.00 0.00 H new HETATM 0 H1' BGM A 2 1.961 6.246 5.372 1.00 0.00 H new HETATM 0 H1 BGM A 2 2.081 -0.440 3.904 1.00 0.00 H new ATOM 64 P DG A 3 -0.558 7.198 8.645 1.00 0.00 P ATOM 65 OP1 DG A 3 -0.653 8.675 8.770 1.00 0.00 O ATOM 66 OP2 DG A 3 -0.740 6.347 9.849 1.00 0.00 O ATOM 67 O5' DG A 3 -1.599 6.724 7.536 1.00 0.00 O ATOM 68 C5' DG A 3 -2.292 7.673 6.726 1.00 0.00 C ATOM 69 C4' DG A 3 -1.454 8.043 5.524 1.00 0.00 C ATOM 70 O4' DG A 3 -0.862 6.835 4.988 1.00 0.00 O ATOM 71 C3' DG A 3 -2.229 8.689 4.373 1.00 0.00 C ATOM 72 O3' DG A 3 -1.473 9.764 3.806 1.00 0.00 O ATOM 73 C2' DG A 3 -2.390 7.562 3.369 1.00 0.00 C ATOM 74 C1' DG A 3 -1.153 6.721 3.609 1.00 0.00 C ATOM 75 N9 DG A 3 -1.320 5.303 3.304 1.00 0.00 N ATOM 76 C8 DG A 3 -2.060 4.391 4.014 1.00 0.00 C ATOM 77 N7 DG A 3 -2.035 3.193 3.499 1.00 0.00 N ATOM 78 C5 DG A 3 -1.223 3.319 2.380 1.00 0.00 C ATOM 79 C6 DG A 3 -0.826 2.352 1.422 1.00 0.00 C ATOM 80 O6 DG A 3 -1.120 1.152 1.369 1.00 0.00 O ATOM 81 N1 DG A 3 0.001 2.905 0.451 1.00 0.00 N ATOM 82 C2 DG A 3 0.399 4.217 0.408 1.00 0.00 C ATOM 83 N2 DG A 3 1.206 4.550 -0.609 1.00 0.00 N ATOM 84 N3 DG A 3 0.035 5.131 1.293 1.00 0.00 N ATOM 85 C4 DG A 3 -0.771 4.615 2.246 1.00 0.00 C ATOM 0 H5' DG A 3 -2.517 8.565 7.310 1.00 0.00 H new ATOM 0 H5'' DG A 3 -3.245 7.257 6.400 1.00 0.00 H new ATOM 0 H4' DG A 3 -0.730 8.773 5.887 1.00 0.00 H new ATOM 0 H3' DG A 3 -3.183 9.114 4.687 1.00 0.00 H new ATOM 0 H2' DG A 3 -3.305 6.995 3.541 1.00 0.00 H new ATOM 0 H2'' DG A 3 -2.434 7.935 2.346 1.00 0.00 H new ATOM 0 H1' DG A 3 -0.366 7.085 2.949 1.00 0.00 H new ATOM 0 H8 DG A 3 -2.609 4.641 4.910 1.00 0.00 H new ATOM 0 H1 DG A 3 0.338 2.287 -0.287 1.00 0.00 H new ATOM 0 H21 DG A 3 1.540 5.509 -0.702 1.00 0.00 H new ATOM 0 H22 DG A 3 1.486 3.844 -1.290 1.00 0.00 H new ATOM 97 P DG A 4 -2.235 11.036 3.182 1.00 0.00 P ATOM 98 OP1 DG A 4 -1.306 12.191 3.266 1.00 0.00 O ATOM 99 OP2 DG A 4 -3.583 11.134 3.798 1.00 0.00 O ATOM 100 O5' DG A 4 -2.416 10.661 1.644 1.00 0.00 O ATOM 101 C5' DG A 4 -1.302 10.243 0.857 1.00 0.00 C ATOM 102 C4' DG A 4 -1.731 10.004 -0.572 1.00 0.00 C ATOM 103 O4' DG A 4 -1.722 8.577 -0.829 1.00 0.00 O ATOM 104 C3' DG A 4 -3.147 10.477 -0.910 1.00 0.00 C ATOM 105 O3' DG A 4 -3.198 10.989 -2.246 1.00 0.00 O ATOM 106 C2' DG A 4 -3.970 9.208 -0.796 1.00 0.00 C ATOM 107 C1' DG A 4 -2.991 8.176 -1.315 1.00 0.00 C ATOM 108 N9 DG A 4 -3.237 6.807 -0.869 1.00 0.00 N ATOM 109 C8 DG A 4 -3.802 6.407 0.317 1.00 0.00 C ATOM 110 N7 DG A 4 -3.896 5.110 0.431 1.00 0.00 N ATOM 111 C5 DG A 4 -3.360 4.623 -0.754 1.00 0.00 C ATOM 112 C6 DG A 4 -3.192 3.289 -1.207 1.00 0.00 C ATOM 113 O6 DG A 4 -3.496 2.236 -0.633 1.00 0.00 O ATOM 114 N1 DG A 4 -2.604 3.246 -2.467 1.00 0.00 N ATOM 115 C2 DG A 4 -2.228 4.347 -3.199 1.00 0.00 C ATOM 116 N2 DG A 4 -1.678 4.104 -4.398 1.00 0.00 N ATOM 117 N3 DG A 4 -2.380 5.595 -2.788 1.00 0.00 N ATOM 118 C4 DG A 4 -2.948 5.659 -1.566 1.00 0.00 C ATOM 0 H5' DG A 4 -0.876 9.330 1.274 1.00 0.00 H new ATOM 0 H5'' DG A 4 -0.521 11.003 0.887 1.00 0.00 H new ATOM 0 H4' DG A 4 -1.028 10.576 -1.178 1.00 0.00 H new ATOM 0 H3' DG A 4 -3.500 11.279 -0.262 1.00 0.00 H new ATOM 0 H2' DG A 4 -4.275 9.006 0.231 1.00 0.00 H new ATOM 0 H2'' DG A 4 -4.879 9.252 -1.396 1.00 0.00 H new ATOM 0 H1' DG A 4 -3.079 8.146 -2.401 1.00 0.00 H new ATOM 0 H8 DG A 4 -4.135 7.096 1.079 1.00 0.00 H new ATOM 0 H1 DG A 4 -2.439 2.328 -2.879 1.00 0.00 H new ATOM 0 H21 DG A 4 -1.378 4.880 -4.988 1.00 0.00 H new ATOM 0 H22 DG A 4 -1.559 3.143 -4.719 1.00 0.00 H new ATOM 130 P DT A 5 -2.469 12.378 -2.597 1.00 0.00 P ATOM 131 OP1 DT A 5 -2.758 13.324 -1.489 1.00 0.00 O ATOM 132 OP2 DT A 5 -2.826 12.748 -3.990 1.00 0.00 O ATOM 133 O5' DT A 5 -0.917 12.020 -2.551 1.00 0.00 O ATOM 134 C5' DT A 5 -0.001 12.585 -3.491 1.00 0.00 C ATOM 135 C4' DT A 5 1.023 13.435 -2.772 1.00 0.00 C ATOM 136 O4' DT A 5 1.058 13.034 -1.380 1.00 0.00 O ATOM 137 C3' DT A 5 2.459 13.295 -3.279 1.00 0.00 C ATOM 138 O3' DT A 5 3.149 14.545 -3.178 1.00 0.00 O ATOM 139 C2' DT A 5 3.062 12.278 -2.329 1.00 0.00 C ATOM 140 C1' DT A 5 2.374 12.642 -1.026 1.00 0.00 C ATOM 141 N1 DT A 5 2.274 11.544 -0.043 1.00 0.00 N ATOM 142 C2 DT A 5 2.753 11.767 1.229 1.00 0.00 C ATOM 143 O2 DT A 5 3.254 12.824 1.575 1.00 0.00 O ATOM 144 N3 DT A 5 2.624 10.704 2.085 1.00 0.00 N ATOM 145 C4 DT A 5 2.078 9.470 1.803 1.00 0.00 C ATOM 146 O4 DT A 5 2.010 8.616 2.683 1.00 0.00 O ATOM 147 C5 DT A 5 1.599 9.301 0.450 1.00 0.00 C ATOM 148 C7 DT A 5 1.019 7.982 0.049 1.00 0.00 C ATOM 149 C6 DT A 5 1.713 10.333 -0.398 1.00 0.00 C ATOM 0 H5' DT A 5 -0.542 13.191 -4.218 1.00 0.00 H new ATOM 0 H5'' DT A 5 0.499 11.791 -4.046 1.00 0.00 H new ATOM 0 H4' DT A 5 0.706 14.464 -2.942 1.00 0.00 H new ATOM 0 H3' DT A 5 2.519 12.996 -4.325 1.00 0.00 H new ATOM 0 H2' DT A 5 2.848 11.254 -2.634 1.00 0.00 H new ATOM 0 H2'' DT A 5 4.146 12.371 -2.261 1.00 0.00 H new ATOM 0 H1' DT A 5 2.968 13.416 -0.541 1.00 0.00 H new ATOM 0 H3 DT A 5 2.970 10.841 3.035 1.00 0.00 H new ATOM 0 H71 DT A 5 0.265 8.136 -0.723 1.00 0.00 H new ATOM 0 H72 DT A 5 1.810 7.339 -0.338 1.00 0.00 H new ATOM 0 H73 DT A 5 0.559 7.508 0.916 1.00 0.00 H new ATOM 0 H6 DT A 5 1.349 10.212 -1.407 1.00 0.00 H new ATOM 162 P DT A 6 4.702 14.634 -3.585 1.00 0.00 P ATOM 163 OP1 DT A 6 5.100 16.062 -3.505 1.00 0.00 O ATOM 164 OP2 DT A 6 4.894 13.889 -4.854 1.00 0.00 O ATOM 165 O5' DT A 6 5.456 13.845 -2.423 1.00 0.00 O ATOM 166 C5' DT A 6 6.799 13.394 -2.597 1.00 0.00 C ATOM 167 C4' DT A 6 7.443 13.134 -1.256 1.00 0.00 C ATOM 168 O4' DT A 6 7.119 14.239 -0.381 1.00 0.00 O ATOM 169 C3' DT A 6 6.950 11.878 -0.536 1.00 0.00 C ATOM 170 O3' DT A 6 8.013 11.302 0.231 1.00 0.00 O ATOM 171 C2' DT A 6 5.858 12.412 0.371 1.00 0.00 C ATOM 172 C1' DT A 6 6.416 13.767 0.757 1.00 0.00 C ATOM 173 N1 DT A 6 5.387 14.763 1.086 1.00 0.00 N ATOM 174 C2 DT A 6 5.165 15.092 2.404 1.00 0.00 C ATOM 175 O2 DT A 6 5.789 14.598 3.329 1.00 0.00 O ATOM 176 N3 DT A 6 4.179 16.025 2.600 1.00 0.00 N ATOM 177 C4 DT A 6 3.414 16.645 1.632 1.00 0.00 C ATOM 178 O4 DT A 6 2.559 17.464 1.959 1.00 0.00 O ATOM 179 C5 DT A 6 3.704 16.251 0.271 1.00 0.00 C ATOM 180 C7 DT A 6 2.912 16.857 -0.842 1.00 0.00 C ATOM 181 C6 DT A 6 4.667 15.343 0.065 1.00 0.00 C ATOM 0 H5' DT A 6 7.373 14.142 -3.145 1.00 0.00 H new ATOM 0 H5'' DT A 6 6.809 12.483 -3.196 1.00 0.00 H new ATOM 0 H4' DT A 6 8.506 13.008 -1.461 1.00 0.00 H new ATOM 0 H3' DT A 6 6.600 11.095 -1.209 1.00 0.00 H new ATOM 0 H2' DT A 6 4.901 12.495 -0.145 1.00 0.00 H new ATOM 0 H2'' DT A 6 5.698 11.773 1.239 1.00 0.00 H new ATOM 0 H1' DT A 6 7.030 13.642 1.649 1.00 0.00 H new ATOM 0 H3 DT A 6 3.990 16.290 3.567 1.00 0.00 H new ATOM 0 H71 DT A 6 3.527 16.908 -1.740 1.00 0.00 H new ATOM 0 H72 DT A 6 2.033 16.244 -1.039 1.00 0.00 H new ATOM 0 H73 DT A 6 2.598 17.862 -0.560 1.00 0.00 H new ATOM 0 H6 DT A 6 4.890 15.052 -0.951 1.00 0.00 H new ATOM 194 P DA A 7 7.706 10.079 1.228 1.00 0.00 P ATOM 195 OP1 DA A 7 7.315 10.660 2.538 1.00 0.00 O ATOM 196 OP2 DA A 7 8.844 9.128 1.159 1.00 0.00 O ATOM 197 O5' DA A 7 6.423 9.381 0.591 1.00 0.00 O ATOM 198 C5' DA A 7 5.705 8.372 1.302 1.00 0.00 C ATOM 199 C4' DA A 7 5.793 7.055 0.566 1.00 0.00 C ATOM 200 O4' DA A 7 4.558 6.837 -0.161 1.00 0.00 O ATOM 201 C3' DA A 7 6.904 6.978 -0.480 1.00 0.00 C ATOM 202 O3' DA A 7 7.415 5.644 -0.567 1.00 0.00 O ATOM 203 C2' DA A 7 6.191 7.368 -1.760 1.00 0.00 C ATOM 204 C1' DA A 7 4.821 6.754 -1.554 1.00 0.00 C ATOM 205 N9 DA A 7 3.728 7.422 -2.261 1.00 0.00 N ATOM 206 C8 DA A 7 3.597 8.750 -2.589 1.00 0.00 C ATOM 207 N7 DA A 7 2.487 9.029 -3.227 1.00 0.00 N ATOM 208 C5 DA A 7 1.841 7.804 -3.325 1.00 0.00 C ATOM 209 C6 DA A 7 0.613 7.423 -3.893 1.00 0.00 C ATOM 210 N6 DA A 7 -0.220 8.275 -4.497 1.00 0.00 N ATOM 211 N1 DA A 7 0.263 6.120 -3.818 1.00 0.00 N ATOM 212 C2 DA A 7 1.099 5.266 -3.212 1.00 0.00 C ATOM 213 N3 DA A 7 2.279 5.504 -2.645 1.00 0.00 N ATOM 214 C4 DA A 7 2.595 6.806 -2.735 1.00 0.00 C ATOM 0 H5' DA A 7 4.661 8.667 1.412 1.00 0.00 H new ATOM 0 H5'' DA A 7 6.113 8.264 2.307 1.00 0.00 H new ATOM 0 H4' DA A 7 5.995 6.314 1.339 1.00 0.00 H new ATOM 0 H3' DA A 7 7.760 7.614 -0.255 1.00 0.00 H new ATOM 0 H2' DA A 7 6.139 8.450 -1.885 1.00 0.00 H new ATOM 0 H2'' DA A 7 6.689 6.968 -2.643 1.00 0.00 H new ATOM 0 H1' DA A 7 4.852 5.740 -1.953 1.00 0.00 H new ATOM 0 H8 DA A 7 4.340 9.495 -2.344 1.00 0.00 H new ATOM 0 H61 DA A 7 -1.098 7.937 -4.890 1.00 0.00 H new ATOM 0 H62 DA A 7 0.022 9.263 -4.565 1.00 0.00 H new ATOM 0 H2 DA A 7 0.768 4.238 -3.179 1.00 0.00 H new HETATM 226 P BGM A 8 8.853 5.385 -1.235 1.00 0.00 P HETATM 227 OP1 BGM A 8 9.265 4.003 -0.879 1.00 0.00 O HETATM 228 OP2 BGM A 8 9.739 6.526 -0.892 1.00 0.00 O HETATM 229 O5' BGM A 8 8.562 5.431 -2.801 1.00 0.00 O HETATM 230 C5' BGM A 8 9.321 4.637 -3.713 1.00 0.00 C HETATM 231 C4' BGM A 8 8.420 4.084 -4.794 1.00 0.00 C HETATM 232 O4' BGM A 8 7.858 2.836 -4.326 1.00 0.00 O HETATM 233 C1' BGM A 8 6.519 2.748 -4.755 1.00 0.00 C HETATM 234 N9 BGM A 8 5.808 1.858 -3.842 1.00 0.00 N HETATM 235 C8 BGM A 8 5.429 0.557 -4.077 1.00 0.00 C HETATM 236 N7 BGM A 8 4.787 0.022 -3.076 1.00 0.00 N HETATM 237 C5 BGM A 8 4.745 1.025 -2.118 1.00 0.00 C HETATM 238 C4 BGM A 8 5.375 2.164 -2.574 1.00 0.00 C HETATM 239 N3 BGM A 8 5.546 3.343 -1.938 1.00 0.00 N HETATM 240 C2 BGM A 8 5.011 3.332 -0.728 1.00 0.00 C HETATM 241 N2 BGM A 8 5.098 4.411 0.059 1.00 0.00 N HETATM 242 N1 BGM A 8 4.355 2.259 -0.190 1.00 0.00 N HETATM 243 C6 BGM A 8 4.176 1.031 -0.820 1.00 0.00 C HETATM 244 O6 BGM A 8 3.583 0.115 -0.233 1.00 0.00 O HETATM 245 C2' BGM A 8 6.007 4.172 -4.776 1.00 0.00 C HETATM 246 C3' BGM A 8 7.234 4.981 -5.168 1.00 0.00 C HETATM 247 O3' BGM A 8 7.240 5.255 -6.577 1.00 0.00 O HETATM 248 BR BGM A 8 5.819 -0.391 -5.695 1.00 0.00 BR HETATM 0 H5'' BGM A 8 10.112 5.239 -4.161 1.00 0.00 H new HETATM 0 H2'' BGM A 8 5.197 4.297 -5.494 1.00 0.00 H new HETATM 0 H5' BGM A 8 9.806 3.820 -3.179 1.00 0.00 H new HETATM 0 H4' BGM A 8 9.050 3.986 -5.678 1.00 0.00 H new HETATM 0 H3' BGM A 8 7.264 5.948 -4.667 1.00 0.00 H new HETATM 0 H22 BGM A 8 4.684 4.397 0.991 1.00 0.00 H new HETATM 0 H21 BGM A 8 5.579 5.247 -0.273 1.00 0.00 H new HETATM 0 H2' BGM A 8 5.620 4.474 -3.803 1.00 0.00 H new HETATM 0 H1' BGM A 8 6.383 2.321 -5.749 1.00 0.00 H new HETATM 0 H1 BGM A 8 3.966 2.367 0.747 1.00 0.00 H new ATOM 259 P DG A 9 6.964 4.072 -7.633 1.00 0.00 P ATOM 260 OP1 DG A 9 8.017 3.040 -7.454 1.00 0.00 O ATOM 261 OP2 DG A 9 6.767 4.692 -8.968 1.00 0.00 O ATOM 262 O5' DG A 9 5.578 3.441 -7.166 1.00 0.00 O ATOM 263 C5' DG A 9 4.389 3.621 -7.935 1.00 0.00 C ATOM 264 C4' DG A 9 3.459 2.447 -7.735 1.00 0.00 C ATOM 265 O4' DG A 9 3.560 2.000 -6.368 1.00 0.00 O ATOM 266 C3' DG A 9 1.972 2.743 -7.953 1.00 0.00 C ATOM 267 O3' DG A 9 1.542 2.286 -9.245 1.00 0.00 O ATOM 268 C2' DG A 9 1.266 1.970 -6.844 1.00 0.00 C ATOM 269 C1' DG A 9 2.381 1.287 -6.067 1.00 0.00 C ATOM 270 N9 DG A 9 2.195 1.310 -4.621 1.00 0.00 N ATOM 271 C8 DG A 9 2.459 2.354 -3.773 1.00 0.00 C ATOM 272 N7 DG A 9 2.171 2.093 -2.526 1.00 0.00 N ATOM 273 C5 DG A 9 1.694 0.789 -2.553 1.00 0.00 C ATOM 274 C6 DG A 9 1.226 -0.045 -1.502 1.00 0.00 C ATOM 275 O6 DG A 9 1.139 0.210 -0.295 1.00 0.00 O ATOM 276 N1 DG A 9 0.836 -1.294 -1.974 1.00 0.00 N ATOM 277 C2 DG A 9 0.892 -1.695 -3.286 1.00 0.00 C ATOM 278 N2 DG A 9 0.477 -2.944 -3.540 1.00 0.00 N ATOM 279 N3 DG A 9 1.324 -0.929 -4.275 1.00 0.00 N ATOM 280 C4 DG A 9 1.706 0.290 -3.840 1.00 0.00 C ATOM 0 H5' DG A 9 4.641 3.720 -8.991 1.00 0.00 H new ATOM 0 H5'' DG A 9 3.891 4.544 -7.638 1.00 0.00 H new ATOM 0 H4' DG A 9 3.775 1.717 -8.480 1.00 0.00 H new ATOM 0 H3' DG A 9 1.753 3.810 -7.922 1.00 0.00 H new ATOM 0 H2' DG A 9 0.690 2.637 -6.203 1.00 0.00 H new ATOM 0 H2'' DG A 9 0.567 1.241 -7.254 1.00 0.00 H new ATOM 0 H1' DG A 9 2.408 0.236 -6.357 1.00 0.00 H new ATOM 0 H8 DG A 9 2.865 3.299 -4.103 1.00 0.00 H new ATOM 0 H1 DG A 9 0.481 -1.964 -1.292 1.00 0.00 H new ATOM 0 H21 DG A 9 0.493 -3.303 -4.495 1.00 0.00 H new ATOM 0 H22 DG A 9 0.145 -3.536 -2.779 1.00 0.00 H new ATOM 292 P DG A 10 1.932 0.810 -9.751 1.00 0.00 P ATOM 293 OP1 DG A 10 1.967 -0.090 -8.572 1.00 0.00 O ATOM 294 OP2 DG A 10 3.129 0.922 -10.623 1.00 0.00 O ATOM 295 O5' DG A 10 0.698 0.376 -10.660 1.00 0.00 O ATOM 296 C5' DG A 10 -0.606 0.912 -10.434 1.00 0.00 C ATOM 297 C4' DG A 10 -1.570 -0.196 -10.079 1.00 0.00 C ATOM 298 O4' DG A 10 -1.356 -0.574 -8.694 1.00 0.00 O ATOM 299 C3' DG A 10 -3.050 0.178 -10.189 1.00 0.00 C ATOM 300 O3' DG A 10 -3.816 -0.935 -10.661 1.00 0.00 O ATOM 301 C2' DG A 10 -3.426 0.510 -8.759 1.00 0.00 C ATOM 302 C1' DG A 10 -2.579 -0.476 -7.985 1.00 0.00 C ATOM 303 N9 DG A 10 -2.293 -0.049 -6.621 1.00 0.00 N ATOM 304 C8 DG A 10 -1.843 1.184 -6.230 1.00 0.00 C ATOM 305 N7 DG A 10 -1.726 1.304 -4.936 1.00 0.00 N ATOM 306 C5 DG A 10 -2.113 0.065 -4.443 1.00 0.00 C ATOM 307 C6 DG A 10 -2.199 -0.405 -3.109 1.00 0.00 C ATOM 308 O6 DG A 10 -1.947 0.202 -2.062 1.00 0.00 O ATOM 309 N1 DG A 10 -2.636 -1.727 -3.059 1.00 0.00 N ATOM 310 C2 DG A 10 -2.942 -2.497 -4.154 1.00 0.00 C ATOM 311 N2 DG A 10 -3.335 -3.755 -3.901 1.00 0.00 N ATOM 312 N3 DG A 10 -2.869 -2.068 -5.403 1.00 0.00 N ATOM 313 C4 DG A 10 -2.452 -0.787 -5.473 1.00 0.00 C ATOM 0 H5' DG A 10 -0.953 1.434 -11.326 1.00 0.00 H new ATOM 0 H5'' DG A 10 -0.571 1.646 -9.629 1.00 0.00 H new ATOM 0 H4' DG A 10 -1.369 -0.991 -10.797 1.00 0.00 H new ATOM 0 H3' DG A 10 -3.237 0.995 -10.886 1.00 0.00 H new ATOM 0 H2' DG A 10 -3.190 1.543 -8.502 1.00 0.00 H new ATOM 0 H2'' DG A 10 -4.491 0.371 -8.572 1.00 0.00 H new ATOM 0 H1' DG A 10 -3.118 -1.420 -7.903 1.00 0.00 H new ATOM 0 H8 DG A 10 -1.608 1.978 -6.924 1.00 0.00 H new ATOM 0 H1 DG A 10 -2.736 -2.156 -2.139 1.00 0.00 H new ATOM 0 H21 DG A 10 -3.577 -4.378 -4.671 1.00 0.00 H new ATOM 0 H22 DG A 10 -3.392 -4.088 -2.938 1.00 0.00 H new ATOM 325 P DT A 11 -5.347 -0.718 -11.106 1.00 0.00 P ATOM 326 OP1 DT A 11 -5.841 -2.013 -11.640 1.00 0.00 O ATOM 327 OP2 DT A 11 -5.418 0.500 -11.953 1.00 0.00 O ATOM 328 O5' DT A 11 -6.113 -0.422 -9.741 1.00 0.00 O ATOM 329 C5' DT A 11 -6.445 -1.478 -8.839 1.00 0.00 C ATOM 330 C4' DT A 11 -7.807 -1.239 -8.231 1.00 0.00 C ATOM 331 O4' DT A 11 -7.767 -0.004 -7.478 1.00 0.00 O ATOM 332 C3' DT A 11 -8.956 -1.094 -9.232 1.00 0.00 C ATOM 333 O3' DT A 11 -10.105 -1.791 -8.743 1.00 0.00 O ATOM 334 C2' DT A 11 -9.203 0.404 -9.282 1.00 0.00 C ATOM 335 C1' DT A 11 -8.812 0.857 -7.891 1.00 0.00 C ATOM 336 N1 DT A 11 -8.306 2.239 -7.819 1.00 0.00 N ATOM 337 C2 DT A 11 -9.168 3.244 -7.441 1.00 0.00 C ATOM 338 O2 DT A 11 -10.339 3.046 -7.160 1.00 0.00 O ATOM 339 N3 DT A 11 -8.606 4.494 -7.403 1.00 0.00 N ATOM 340 C4 DT A 11 -7.300 4.831 -7.699 1.00 0.00 C ATOM 341 O4 DT A 11 -6.937 6.001 -7.622 1.00 0.00 O ATOM 342 C5 DT A 11 -6.452 3.727 -8.089 1.00 0.00 C ATOM 343 C7 DT A 11 -5.020 3.995 -8.429 1.00 0.00 C ATOM 344 C6 DT A 11 -6.988 2.500 -8.130 1.00 0.00 C ATOM 0 H5' DT A 11 -5.694 -1.543 -8.052 1.00 0.00 H new ATOM 0 H5'' DT A 11 -6.437 -2.432 -9.366 1.00 0.00 H new ATOM 0 H4' DT A 11 -8.008 -2.126 -7.629 1.00 0.00 H new ATOM 0 H3' DT A 11 -8.736 -1.507 -10.216 1.00 0.00 H new ATOM 0 H2' DT A 11 -8.599 0.888 -10.049 1.00 0.00 H new ATOM 0 H2'' DT A 11 -10.245 0.635 -9.504 1.00 0.00 H new ATOM 0 H1' DT A 11 -9.704 0.824 -7.265 1.00 0.00 H new ATOM 0 H3 DT A 11 -9.220 5.259 -7.125 1.00 0.00 H new ATOM 0 H71 DT A 11 -4.926 5.000 -8.841 1.00 0.00 H new ATOM 0 H72 DT A 11 -4.411 3.913 -7.529 1.00 0.00 H new ATOM 0 H73 DT A 11 -4.679 3.268 -9.165 1.00 0.00 H new ATOM 0 H6 DT A 11 -6.356 1.674 -8.421 1.00 0.00 H new ATOM 357 P DT A 12 -11.406 -1.949 -9.673 1.00 0.00 P ATOM 358 OP1 DT A 12 -11.474 -3.373 -10.091 1.00 0.00 O ATOM 359 OP2 DT A 12 -11.394 -0.883 -10.706 1.00 0.00 O ATOM 360 O5' DT A 12 -12.617 -1.673 -8.675 1.00 0.00 O ATOM 361 C5' DT A 12 -12.387 -1.142 -7.368 1.00 0.00 C ATOM 362 C4' DT A 12 -11.567 -2.110 -6.546 1.00 0.00 C ATOM 363 O4' DT A 12 -10.190 -1.692 -6.568 1.00 0.00 O ATOM 364 C3' DT A 12 -11.935 -2.195 -5.062 1.00 0.00 C ATOM 365 O3' DT A 12 -12.747 -3.353 -4.817 1.00 0.00 O ATOM 366 C2' DT A 12 -10.592 -2.294 -4.343 1.00 0.00 C ATOM 367 C1' DT A 12 -9.552 -2.273 -5.456 1.00 0.00 C ATOM 368 N1 DT A 12 -8.350 -1.478 -5.165 1.00 0.00 N ATOM 369 C2 DT A 12 -7.115 -2.077 -5.258 1.00 0.00 C ATOM 370 O2 DT A 12 -6.963 -3.248 -5.565 1.00 0.00 O ATOM 371 N3 DT A 12 -6.059 -1.252 -4.977 1.00 0.00 N ATOM 372 C4 DT A 12 -6.115 0.077 -4.611 1.00 0.00 C ATOM 373 O4 DT A 12 -5.077 0.695 -4.391 1.00 0.00 O ATOM 374 C5 DT A 12 -7.444 0.635 -4.524 1.00 0.00 C ATOM 375 C7 DT A 12 -7.610 2.049 -4.067 1.00 0.00 C ATOM 376 C6 DT A 12 -8.484 -0.158 -4.809 1.00 0.00 C ATOM 0 H5' DT A 12 -13.339 -0.950 -6.873 1.00 0.00 H new ATOM 0 H5'' DT A 12 -11.868 -0.187 -7.442 1.00 0.00 H new ATOM 0 H4' DT A 12 -11.760 -3.081 -7.001 1.00 0.00 H new ATOM 0 H3' DT A 12 -12.516 -1.339 -4.719 1.00 0.00 H new ATOM 0 H2' DT A 12 -10.450 -1.462 -3.653 1.00 0.00 H new ATOM 0 H2'' DT A 12 -10.524 -3.210 -3.756 1.00 0.00 H new ATOM 0 H1' DT A 12 -9.206 -3.295 -5.607 1.00 0.00 H new ATOM 0 H3 DT A 12 -5.129 -1.665 -5.046 1.00 0.00 H new ATOM 0 H71 DT A 12 -8.497 2.480 -4.532 1.00 0.00 H new ATOM 0 H72 DT A 12 -7.722 2.070 -2.983 1.00 0.00 H new ATOM 0 H73 DT A 12 -6.732 2.629 -4.352 1.00 0.00 H new ATOM 0 H6 DT A 12 -9.478 0.261 -4.756 1.00 0.00 H new ATOM 389 P DA A 13 -12.086 -4.821 -4.825 1.00 0.00 P ATOM 390 OP1 DA A 13 -10.932 -4.809 -5.757 1.00 0.00 O ATOM 391 OP2 DA A 13 -13.175 -5.812 -5.022 1.00 0.00 O ATOM 392 O5' DA A 13 -11.519 -4.996 -3.347 1.00 0.00 O ATOM 393 C5' DA A 13 -10.310 -5.717 -3.106 1.00 0.00 C ATOM 394 C4' DA A 13 -9.919 -5.609 -1.649 1.00 0.00 C ATOM 395 O4' DA A 13 -8.660 -4.899 -1.562 1.00 0.00 O ATOM 396 C3' DA A 13 -10.902 -4.832 -0.771 1.00 0.00 C ATOM 397 O3' DA A 13 -10.988 -5.429 0.527 1.00 0.00 O ATOM 398 C2' DA A 13 -10.279 -3.450 -0.683 1.00 0.00 C ATOM 399 C1' DA A 13 -8.798 -3.767 -0.719 1.00 0.00 C ATOM 400 N9 DA A 13 -7.952 -2.703 -1.260 1.00 0.00 N ATOM 401 C8 DA A 13 -7.044 -2.801 -2.285 1.00 0.00 C ATOM 402 N7 DA A 13 -6.412 -1.682 -2.540 1.00 0.00 N ATOM 403 C5 DA A 13 -6.947 -0.782 -1.629 1.00 0.00 C ATOM 404 C6 DA A 13 -6.697 0.580 -1.388 1.00 0.00 C ATOM 405 N6 DA A 13 -5.803 1.301 -2.068 1.00 0.00 N ATOM 406 N1 DA A 13 -7.405 1.184 -0.410 1.00 0.00 N ATOM 407 C2 DA A 13 -8.299 0.460 0.275 1.00 0.00 C ATOM 408 N3 DA A 13 -8.619 -0.826 0.145 1.00 0.00 N ATOM 409 C4 DA A 13 -7.900 -1.397 -0.837 1.00 0.00 C ATOM 0 H5' DA A 13 -9.511 -5.323 -3.735 1.00 0.00 H new ATOM 0 H5'' DA A 13 -10.442 -6.764 -3.378 1.00 0.00 H new ATOM 0 H4' DA A 13 -9.884 -6.636 -1.284 1.00 0.00 H new ATOM 0 H3' DA A 13 -11.916 -4.817 -1.170 1.00 0.00 H new ATOM 0 H2' DA A 13 -10.580 -2.813 -1.515 1.00 0.00 H new ATOM 0 H2'' DA A 13 -10.563 -2.932 0.233 1.00 0.00 H new ATOM 0 H1' DA A 13 -8.468 -3.918 0.309 1.00 0.00 H new ATOM 0 H8 DA A 13 -6.867 -3.716 -2.831 1.00 0.00 H new ATOM 0 H61 DA A 13 -5.667 2.287 -1.845 1.00 0.00 H new ATOM 0 H62 DA A 13 -5.255 0.866 -2.810 1.00 0.00 H new ATOM 0 H2 DA A 13 -8.838 0.996 1.043 1.00 0.00 H new HETATM 421 P BGM A 14 -11.641 -6.888 0.692 1.00 0.00 P HETATM 422 OP1 BGM A 14 -12.726 -7.004 -0.316 1.00 0.00 O HETATM 423 OP2 BGM A 14 -11.949 -7.102 2.128 1.00 0.00 O HETATM 424 O5' BGM A 14 -10.470 -7.884 0.276 1.00 0.00 O HETATM 425 C5' BGM A 14 -9.316 -8.044 1.100 1.00 0.00 C HETATM 426 C4' BGM A 14 -8.293 -8.912 0.405 1.00 0.00 C HETATM 427 O4' BGM A 14 -7.610 -8.119 -0.598 1.00 0.00 O HETATM 428 C1' BGM A 14 -6.214 -8.121 -0.343 1.00 0.00 C HETATM 429 N9 BGM A 14 -5.686 -6.811 -0.712 1.00 0.00 N HETATM 430 C8 BGM A 14 -5.048 -6.468 -1.881 1.00 0.00 C HETATM 431 N7 BGM A 14 -4.689 -5.214 -1.921 1.00 0.00 N HETATM 432 C5 BGM A 14 -5.114 -4.697 -0.705 1.00 0.00 C HETATM 433 C4 BGM A 14 -5.731 -5.670 0.053 1.00 0.00 C HETATM 434 N3 BGM A 14 -6.274 -5.562 1.283 1.00 0.00 N HETATM 435 C2 BGM A 14 -6.165 -4.336 1.766 1.00 0.00 C HETATM 436 N2 BGM A 14 -6.653 -4.052 2.982 1.00 0.00 N HETATM 437 N1 BGM A 14 -5.570 -3.296 1.093 1.00 0.00 N HETATM 438 C6 BGM A 14 -5.003 -3.385 -0.175 1.00 0.00 C HETATM 439 O6 BGM A 14 -4.490 -2.385 -0.693 1.00 0.00 O HETATM 440 C2' BGM A 14 -6.064 -8.472 1.123 1.00 0.00 C HETATM 441 C3' BGM A 14 -7.194 -9.468 1.312 1.00 0.00 C HETATM 442 O3' BGM A 14 -6.817 -10.779 0.874 1.00 0.00 O HETATM 443 BR BGM A 14 -4.719 -7.696 -3.314 1.00 0.00 BR HETATM 0 H5'' BGM A 14 -8.883 -7.069 1.325 1.00 0.00 H new HETATM 0 H2'' BGM A 14 -5.090 -8.910 1.343 1.00 0.00 H new HETATM 0 H5' BGM A 14 -9.599 -8.494 2.051 1.00 0.00 H new HETATM 0 H4' BGM A 14 -8.861 -9.752 0.005 1.00 0.00 H new HETATM 0 H3' BGM A 14 -7.489 -9.575 2.356 1.00 0.00 H new HETATM 0 H22 BGM A 14 -6.570 -3.107 3.357 1.00 0.00 H new HETATM 0 H21 BGM A 14 -7.107 -4.781 3.532 1.00 0.00 H new HETATM 0 H2' BGM A 14 -6.174 -7.600 1.767 1.00 0.00 H new HETATM 0 H1' BGM A 14 -5.645 -8.846 -0.925 1.00 0.00 H new HETATM 0 H1 BGM A 14 -5.542 -2.389 1.559 1.00 0.00 H new HETATM 454 P BGM A 15 -5.374 -11.371 1.266 1.00 0.00 P HETATM 455 OP1 BGM A 15 -5.290 -12.745 0.711 1.00 0.00 O HETATM 456 OP2 BGM A 15 -5.159 -11.152 2.719 1.00 0.00 O HETATM 457 O5' BGM A 15 -4.354 -10.448 0.463 1.00 0.00 O HETATM 458 C5' BGM A 15 -2.945 -10.667 0.541 1.00 0.00 C HETATM 459 C4' BGM A 15 -2.335 -10.632 -0.841 1.00 0.00 C HETATM 460 O4' BGM A 15 -2.416 -9.278 -1.353 1.00 0.00 O HETATM 461 C1' BGM A 15 -1.159 -8.905 -1.881 1.00 0.00 C HETATM 462 N9 BGM A 15 -1.032 -7.455 -1.771 1.00 0.00 N HETATM 463 C8 BGM A 15 -0.465 -6.598 -2.684 1.00 0.00 C HETATM 464 N7 BGM A 15 -0.488 -5.351 -2.301 1.00 0.00 N HETATM 465 C5 BGM A 15 -1.112 -5.385 -1.061 1.00 0.00 C HETATM 466 C4 BGM A 15 -1.455 -6.676 -0.721 1.00 0.00 C HETATM 467 N3 BGM A 15 -2.073 -7.118 0.394 1.00 0.00 N HETATM 468 C2 BGM A 15 -2.357 -6.130 1.226 1.00 0.00 C HETATM 469 N2 BGM A 15 -2.977 -6.394 2.385 1.00 0.00 N HETATM 470 N1 BGM A 15 -2.057 -4.811 0.983 1.00 0.00 N HETATM 471 C6 BGM A 15 -1.420 -4.334 -0.159 1.00 0.00 C HETATM 472 O6 BGM A 15 -1.194 -3.123 -0.279 1.00 0.00 O HETATM 473 C2' BGM A 15 -0.142 -9.693 -1.085 1.00 0.00 C HETATM 474 C3' BGM A 15 -0.854 -11.020 -0.902 1.00 0.00 C HETATM 475 O3' BGM A 15 -0.612 -11.878 -2.021 1.00 0.00 O HETATM 476 BR BGM A 15 0.273 -7.165 -4.357 1.00 0.00 BR HETATM 0 H5'' BGM A 15 -2.485 -9.904 1.169 1.00 0.00 H new HETATM 0 H2'' BGM A 15 0.800 -9.805 -1.622 1.00 0.00 H new HETATM 0 H5' BGM A 15 -2.745 -11.630 1.011 1.00 0.00 H new HETATM 0 H4' BGM A 15 -2.899 -11.363 -1.421 1.00 0.00 H new HETATM 0 H3' BGM A 15 -0.518 -11.561 -0.018 1.00 0.00 H new HETATM 0 H22 BGM A 15 -3.198 -5.635 3.030 1.00 0.00 H new HETATM 0 H21 BGM A 15 -3.228 -7.354 2.622 1.00 0.00 H new HETATM 0 H2' BGM A 15 0.089 -9.218 -0.132 1.00 0.00 H new HETATM 0 H1' BGM A 15 -1.018 -9.131 -2.938 1.00 0.00 H new HETATM 0 H1 BGM A 15 -2.321 -4.129 1.694 1.00 0.00 H new ATOM 487 P DG A 16 0.881 -12.394 -2.320 1.00 0.00 P ATOM 488 OP1 DG A 16 0.841 -13.154 -3.595 1.00 0.00 O ATOM 489 OP2 DG A 16 1.401 -13.047 -1.092 1.00 0.00 O ATOM 490 O5' DG A 16 1.711 -11.056 -2.564 1.00 0.00 O ATOM 491 C5' DG A 16 1.910 -10.545 -3.881 1.00 0.00 C ATOM 492 C4' DG A 16 3.123 -9.644 -3.913 1.00 0.00 C ATOM 493 O4' DG A 16 2.766 -8.363 -3.342 1.00 0.00 O ATOM 494 C3' DG A 16 4.327 -10.152 -3.110 1.00 0.00 C ATOM 495 O3' DG A 16 5.500 -10.160 -3.931 1.00 0.00 O ATOM 496 C2' DG A 16 4.481 -9.145 -1.981 1.00 0.00 C ATOM 497 C1' DG A 16 3.838 -7.900 -2.551 1.00 0.00 C ATOM 498 N9 DG A 16 3.302 -6.974 -1.556 1.00 0.00 N ATOM 499 C8 DG A 16 2.514 -7.283 -0.475 1.00 0.00 C ATOM 500 N7 DG A 16 2.196 -6.242 0.245 1.00 0.00 N ATOM 501 C5 DG A 16 2.812 -5.178 -0.401 1.00 0.00 C ATOM 502 C6 DG A 16 2.827 -3.793 -0.085 1.00 0.00 C ATOM 503 O6 DG A 16 2.282 -3.213 0.861 1.00 0.00 O ATOM 504 N1 DG A 16 3.573 -3.066 -1.008 1.00 0.00 N ATOM 505 C2 DG A 16 4.220 -3.602 -2.095 1.00 0.00 C ATOM 506 N2 DG A 16 4.888 -2.738 -2.871 1.00 0.00 N ATOM 507 N3 DG A 16 4.214 -4.889 -2.400 1.00 0.00 N ATOM 508 C4 DG A 16 3.496 -5.613 -1.517 1.00 0.00 C ATOM 0 H5' DG A 16 1.028 -9.991 -4.201 1.00 0.00 H new ATOM 0 H5'' DG A 16 2.041 -11.369 -4.583 1.00 0.00 H new ATOM 0 H4' DG A 16 3.418 -9.597 -4.961 1.00 0.00 H new ATOM 0 H3' DG A 16 4.187 -11.169 -2.745 1.00 0.00 H new ATOM 0 H2' DG A 16 3.981 -9.478 -1.071 1.00 0.00 H new ATOM 0 H2'' DG A 16 5.528 -8.979 -1.727 1.00 0.00 H new ATOM 0 H1' DG A 16 4.600 -7.338 -3.091 1.00 0.00 H new ATOM 0 H8 DG A 16 2.190 -8.287 -0.244 1.00 0.00 H new ATOM 0 H1 DG A 16 3.645 -2.058 -0.867 1.00 0.00 H new ATOM 0 H21 DG A 16 5.389 -3.074 -3.694 1.00 0.00 H new ATOM 0 H22 DG A 16 4.895 -1.745 -2.639 1.00 0.00 H new ATOM 520 P DT A 17 6.622 -11.289 -3.705 1.00 0.00 P ATOM 521 OP1 DT A 17 6.596 -12.185 -4.889 1.00 0.00 O ATOM 522 OP2 DT A 17 6.440 -11.863 -2.347 1.00 0.00 O ATOM 523 O5' DT A 17 7.995 -10.481 -3.725 1.00 0.00 O ATOM 524 C5' DT A 17 8.500 -9.926 -4.939 1.00 0.00 C ATOM 525 C4' DT A 17 9.287 -8.671 -4.651 1.00 0.00 C ATOM 526 O4' DT A 17 8.772 -7.608 -5.490 1.00 0.00 O ATOM 527 C3' DT A 17 9.175 -8.159 -3.215 1.00 0.00 C ATOM 528 O3' DT A 17 10.403 -7.549 -2.805 1.00 0.00 O ATOM 529 C2' DT A 17 8.068 -7.127 -3.310 1.00 0.00 C ATOM 530 C1' DT A 17 8.319 -6.535 -4.682 1.00 0.00 C ATOM 531 N1 DT A 17 7.125 -5.954 -5.327 1.00 0.00 N ATOM 532 C2 DT A 17 7.137 -4.615 -5.647 1.00 0.00 C ATOM 533 O2 DT A 17 8.090 -3.886 -5.425 1.00 0.00 O ATOM 534 N3 DT A 17 5.989 -4.158 -6.240 1.00 0.00 N ATOM 535 C4 DT A 17 4.856 -4.888 -6.535 1.00 0.00 C ATOM 536 O4 DT A 17 3.896 -4.339 -7.068 1.00 0.00 O ATOM 537 C5 DT A 17 4.911 -6.286 -6.172 1.00 0.00 C ATOM 538 C7 DT A 17 3.723 -7.153 -6.447 1.00 0.00 C ATOM 539 C6 DT A 17 6.029 -6.748 -5.594 1.00 0.00 C ATOM 0 H5' DT A 17 7.675 -9.700 -5.615 1.00 0.00 H new ATOM 0 H5'' DT A 17 9.135 -10.654 -5.444 1.00 0.00 H new ATOM 0 H4' DT A 17 10.329 -8.931 -4.837 1.00 0.00 H new ATOM 0 H3' DT A 17 8.970 -8.944 -2.487 1.00 0.00 H new ATOM 0 H2' DT A 17 7.079 -7.579 -3.234 1.00 0.00 H new ATOM 0 H2'' DT A 17 8.138 -6.378 -2.522 1.00 0.00 H new ATOM 0 H1' DT A 17 9.030 -5.716 -4.572 1.00 0.00 H new ATOM 0 H3 DT A 17 5.970 -3.169 -6.491 1.00 0.00 H new ATOM 0 H71 DT A 17 4.053 -8.175 -6.632 1.00 0.00 H new ATOM 0 H72 DT A 17 3.054 -7.138 -5.586 1.00 0.00 H new ATOM 0 H73 DT A 17 3.194 -6.779 -7.324 1.00 0.00 H new ATOM 0 H6 DT A 17 6.074 -7.793 -5.324 1.00 0.00 H new ATOM 552 P DT A 18 11.520 -8.430 -2.059 1.00 0.00 P ATOM 553 OP1 DT A 18 12.731 -7.583 -1.913 1.00 0.00 O ATOM 554 OP2 DT A 18 11.620 -9.740 -2.751 1.00 0.00 O ATOM 555 O5' DT A 18 10.914 -8.678 -0.607 1.00 0.00 O ATOM 556 C5' DT A 18 9.890 -7.832 -0.083 1.00 0.00 C ATOM 557 C4' DT A 18 10.151 -7.541 1.377 1.00 0.00 C ATOM 558 O4' DT A 18 10.847 -6.274 1.479 1.00 0.00 O ATOM 559 C3' DT A 18 8.905 -7.401 2.252 1.00 0.00 C ATOM 560 O3' DT A 18 9.163 -7.905 3.568 1.00 0.00 O ATOM 561 C2' DT A 18 8.676 -5.902 2.291 1.00 0.00 C ATOM 562 C1' DT A 18 10.096 -5.370 2.275 1.00 0.00 C ATOM 563 N1 DT A 18 10.241 -4.021 1.691 1.00 0.00 N ATOM 564 C2 DT A 18 10.744 -3.015 2.486 1.00 0.00 C ATOM 565 O2 DT A 18 11.076 -3.188 3.647 1.00 0.00 O ATOM 566 N3 DT A 18 10.844 -1.795 1.870 1.00 0.00 N ATOM 567 C4 DT A 18 10.501 -1.487 0.570 1.00 0.00 C ATOM 568 O4 DT A 18 10.648 -0.341 0.153 1.00 0.00 O ATOM 569 C5 DT A 18 9.981 -2.589 -0.208 1.00 0.00 C ATOM 570 C7 DT A 18 9.584 -2.346 -1.630 1.00 0.00 C ATOM 571 C6 DT A 18 9.876 -3.789 0.381 1.00 0.00 C ATOM 0 H5' DT A 18 8.918 -8.311 -0.198 1.00 0.00 H new ATOM 0 H5'' DT A 18 9.854 -6.900 -0.647 1.00 0.00 H new ATOM 0 H4' DT A 18 10.715 -8.401 1.737 1.00 0.00 H new ATOM 0 H3' DT A 18 8.046 -7.955 1.873 1.00 0.00 H new ATOM 0 H2' DT A 18 8.100 -5.554 1.434 1.00 0.00 H new ATOM 0 H2'' DT A 18 8.134 -5.594 3.185 1.00 0.00 H new ATOM 0 H1' DT A 18 10.434 -5.289 3.308 1.00 0.00 H new ATOM 0 H3 DT A 18 11.213 -1.030 2.435 1.00 0.00 H new ATOM 0 H71 DT A 18 9.729 -3.258 -2.209 1.00 0.00 H new ATOM 0 H72 DT A 18 8.535 -2.053 -1.670 1.00 0.00 H new ATOM 0 H73 DT A 18 10.199 -1.549 -2.048 1.00 0.00 H new ATOM 0 H6 DT A 18 9.487 -4.614 -0.198 1.00 0.00 H new ATOM 584 P DA A 19 8.594 -9.345 3.997 1.00 0.00 P ATOM 585 OP1 DA A 19 9.522 -9.906 5.011 1.00 0.00 O ATOM 586 OP2 DA A 19 8.299 -10.119 2.764 1.00 0.00 O ATOM 587 O5' DA A 19 7.214 -9.013 4.720 1.00 0.00 O ATOM 588 C5' DA A 19 7.190 -8.410 6.013 1.00 0.00 C ATOM 589 C4' DA A 19 5.858 -7.738 6.248 1.00 0.00 C ATOM 590 O4' DA A 19 5.839 -6.476 5.535 1.00 0.00 O ATOM 591 C3' DA A 19 4.646 -8.519 5.739 1.00 0.00 C ATOM 592 O3' DA A 19 3.519 -8.304 6.594 1.00 0.00 O ATOM 593 C2' DA A 19 4.403 -7.918 4.368 1.00 0.00 C ATOM 594 C1' DA A 19 4.770 -6.464 4.602 1.00 0.00 C ATOM 595 N9 DA A 19 5.217 -5.731 3.416 1.00 0.00 N ATOM 596 C8 DA A 19 5.502 -6.220 2.163 1.00 0.00 C ATOM 597 N7 DA A 19 5.876 -5.299 1.309 1.00 0.00 N ATOM 598 C5 DA A 19 5.836 -4.124 2.047 1.00 0.00 C ATOM 599 C6 DA A 19 6.121 -2.789 1.714 1.00 0.00 C ATOM 600 N6 DA A 19 6.518 -2.396 0.501 1.00 0.00 N ATOM 601 N1 DA A 19 5.981 -1.857 2.682 1.00 0.00 N ATOM 602 C2 DA A 19 5.581 -2.251 3.897 1.00 0.00 C ATOM 603 N3 DA A 19 5.283 -3.474 4.331 1.00 0.00 N ATOM 604 C4 DA A 19 5.433 -4.376 3.346 1.00 0.00 C ATOM 0 H5' DA A 19 7.994 -7.679 6.097 1.00 0.00 H new ATOM 0 H5'' DA A 19 7.365 -9.166 6.779 1.00 0.00 H new ATOM 0 H4' DA A 19 5.774 -7.644 7.331 1.00 0.00 H new ATOM 0 H3' DA A 19 4.804 -9.597 5.712 1.00 0.00 H new ATOM 0 H2' DA A 19 5.026 -8.380 3.602 1.00 0.00 H new ATOM 0 H2'' DA A 19 3.367 -8.033 4.048 1.00 0.00 H new ATOM 0 H1' DA A 19 3.870 -5.951 4.940 1.00 0.00 H new ATOM 0 H8 DA A 19 5.425 -7.266 1.906 1.00 0.00 H new ATOM 0 H61 DA A 19 6.710 -1.410 0.322 1.00 0.00 H new ATOM 0 H62 DA A 19 6.629 -3.082 -0.246 1.00 0.00 H new ATOM 0 H2 DA A 19 5.486 -1.464 4.631 1.00 0.00 H new HETATM 616 P BGM A 20 2.391 -9.441 6.725 1.00 0.00 P HETATM 617 OP1 BGM A 20 2.907 -10.475 7.658 1.00 0.00 O HETATM 618 OP2 BGM A 20 1.962 -9.833 5.359 1.00 0.00 O HETATM 619 O5' BGM A 20 1.174 -8.696 7.434 1.00 0.00 O HETATM 620 C5' BGM A 20 -0.073 -8.525 6.760 1.00 0.00 C HETATM 621 C4' BGM A 20 -1.079 -7.878 7.683 1.00 0.00 C HETATM 622 O4' BGM A 20 -0.628 -6.538 7.991 1.00 0.00 O HETATM 623 C1' BGM A 20 -1.501 -5.564 7.440 1.00 0.00 C HETATM 624 N9 BGM A 20 -0.687 -4.608 6.695 1.00 0.00 N HETATM 625 C8 BGM A 20 -0.399 -3.307 7.037 1.00 0.00 C HETATM 626 N7 BGM A 20 0.354 -2.701 6.160 1.00 0.00 N HETATM 627 C5 BGM A 20 0.580 -3.658 5.181 1.00 0.00 C HETATM 628 C4 BGM A 20 -0.054 -4.841 5.497 1.00 0.00 C HETATM 629 N3 BGM A 20 -0.073 -5.999 4.803 1.00 0.00 N HETATM 630 C2 BGM A 20 0.629 -5.916 3.684 1.00 0.00 C HETATM 631 N2 BGM A 20 0.720 -6.980 2.873 1.00 0.00 N HETATM 632 N1 BGM A 20 1.295 -4.786 3.278 1.00 0.00 N HETATM 633 C6 BGM A 20 1.328 -3.584 3.977 1.00 0.00 C HETATM 634 O6 BGM A 20 1.961 -2.624 3.521 1.00 0.00 O HETATM 635 C2' BGM A 20 -2.519 -6.304 6.585 1.00 0.00 C HETATM 636 C3' BGM A 20 -2.484 -7.732 7.099 1.00 0.00 C HETATM 637 O3' BGM A 20 -3.478 -7.941 8.110 1.00 0.00 O HETATM 638 BR BGM A 20 -1.018 -2.464 8.642 1.00 0.00 BR HETATM 0 H5'' BGM A 20 0.066 -7.908 5.872 1.00 0.00 H new HETATM 0 H2'' BGM A 20 -3.514 -5.870 6.688 1.00 0.00 H new HETATM 0 H5' BGM A 20 -0.447 -9.491 6.421 1.00 0.00 H new HETATM 0 H4' BGM A 20 -1.144 -8.537 8.549 1.00 0.00 H new HETATM 0 H3' BGM A 20 -2.695 -8.462 6.317 1.00 0.00 H new HETATM 0 H22 BGM A 20 1.260 -6.919 2.010 1.00 0.00 H new HETATM 0 H21 BGM A 20 0.249 -7.851 3.119 1.00 0.00 H new HETATM 0 H2' BGM A 20 -2.258 -6.257 5.528 1.00 0.00 H new HETATM 0 H1' BGM A 20 -2.053 -4.997 8.189 1.00 0.00 H new HETATM 0 H1 BGM A 20 1.805 -4.832 2.396 1.00 0.00 H new ATOM 649 P DG A 21 -3.527 -6.987 9.403 1.00 0.00 P ATOM 650 OP1 DG A 21 -2.131 -6.696 9.814 1.00 0.00 O ATOM 651 OP2 DG A 21 -4.464 -7.598 10.380 1.00 0.00 O ATOM 652 O5' DG A 21 -4.189 -5.638 8.870 1.00 0.00 O ATOM 653 C5' DG A 21 -4.940 -4.801 9.751 1.00 0.00 C ATOM 654 C4' DG A 21 -5.565 -3.655 8.989 1.00 0.00 C ATOM 655 O4' DG A 21 -4.656 -3.219 7.948 1.00 0.00 O ATOM 656 C3' DG A 21 -6.888 -3.975 8.281 1.00 0.00 C ATOM 657 O3' DG A 21 -7.832 -2.926 8.516 1.00 0.00 O ATOM 658 C2' DG A 21 -6.508 -4.026 6.813 1.00 0.00 C ATOM 659 C1' DG A 21 -5.403 -2.997 6.770 1.00 0.00 C ATOM 660 N9 DG A 21 -4.500 -3.086 5.627 1.00 0.00 N ATOM 661 C8 DG A 21 -4.268 -4.181 4.833 1.00 0.00 C ATOM 662 N7 DG A 21 -3.411 -3.950 3.876 1.00 0.00 N ATOM 663 C5 DG A 21 -3.057 -2.619 4.050 1.00 0.00 C ATOM 664 C6 DG A 21 -2.162 -1.803 3.311 1.00 0.00 C ATOM 665 O6 DG A 21 -1.483 -2.103 2.323 1.00 0.00 O ATOM 666 N1 DG A 21 -2.100 -0.514 3.830 1.00 0.00 N ATOM 667 C2 DG A 21 -2.808 -0.067 4.919 1.00 0.00 C ATOM 668 N2 DG A 21 -2.613 1.213 5.267 1.00 0.00 N ATOM 669 N3 DG A 21 -3.644 -0.817 5.616 1.00 0.00 N ATOM 670 C4 DG A 21 -3.719 -2.073 5.128 1.00 0.00 C ATOM 0 H5' DG A 21 -4.290 -4.412 10.535 1.00 0.00 H new ATOM 0 H5'' DG A 21 -5.718 -5.386 10.242 1.00 0.00 H new ATOM 0 H4' DG A 21 -5.767 -2.903 9.752 1.00 0.00 H new ATOM 0 H3' DG A 21 -7.349 -4.899 8.629 1.00 0.00 H new ATOM 0 H2' DG A 21 -6.164 -5.015 6.509 1.00 0.00 H new ATOM 0 H2'' DG A 21 -7.342 -3.765 6.161 1.00 0.00 H new ATOM 0 H1' DG A 21 -5.859 -2.011 6.683 1.00 0.00 H new ATOM 0 H8 DG A 21 -4.746 -5.137 4.985 1.00 0.00 H new ATOM 0 H1 DG A 21 -1.481 0.151 3.366 1.00 0.00 H new ATOM 0 H21 DG A 21 -3.109 1.605 6.067 1.00 0.00 H new ATOM 0 H22 DG A 21 -1.968 1.794 4.732 1.00 0.00 H new ATOM 682 P DG A 22 -9.401 -3.197 8.291 1.00 0.00 P ATOM 683 OP1 DG A 22 -9.880 -4.010 9.438 1.00 0.00 O ATOM 684 OP2 DG A 22 -9.601 -3.692 6.906 1.00 0.00 O ATOM 685 O5' DG A 22 -10.055 -1.748 8.405 1.00 0.00 O ATOM 686 C5' DG A 22 -9.333 -0.663 8.987 1.00 0.00 C ATOM 687 C4' DG A 22 -9.243 0.486 8.014 1.00 0.00 C ATOM 688 O4' DG A 22 -8.042 0.338 7.230 1.00 0.00 O ATOM 689 C3' DG A 22 -10.392 0.543 7.009 1.00 0.00 C ATOM 690 O3' DG A 22 -11.296 1.596 7.343 1.00 0.00 O ATOM 691 C2' DG A 22 -9.722 0.821 5.670 1.00 0.00 C ATOM 692 C1' DG A 22 -8.245 0.976 5.990 1.00 0.00 C ATOM 693 N9 DG A 22 -7.363 0.350 5.011 1.00 0.00 N ATOM 694 C8 DG A 22 -7.157 -0.994 4.825 1.00 0.00 C ATOM 695 N7 DG A 22 -6.326 -1.258 3.855 1.00 0.00 N ATOM 696 C5 DG A 22 -5.956 -0.009 3.374 1.00 0.00 C ATOM 697 C6 DG A 22 -5.075 0.346 2.320 1.00 0.00 C ATOM 698 O6 DG A 22 -4.427 -0.398 1.574 1.00 0.00 O ATOM 699 N1 DG A 22 -4.985 1.726 2.171 1.00 0.00 N ATOM 700 C2 DG A 22 -5.658 2.647 2.936 1.00 0.00 C ATOM 701 N2 DG A 22 -5.438 3.936 2.641 1.00 0.00 N ATOM 702 N3 DG A 22 -6.483 2.330 3.919 1.00 0.00 N ATOM 703 C4 DG A 22 -6.584 0.994 4.081 1.00 0.00 C ATOM 0 H5' DG A 22 -8.332 -0.991 9.266 1.00 0.00 H new ATOM 0 H5'' DG A 22 -9.828 -0.336 9.901 1.00 0.00 H new ATOM 0 H4' DG A 22 -9.266 1.390 8.622 1.00 0.00 H new ATOM 0 H3' DG A 22 -10.975 -0.378 6.996 1.00 0.00 H new ATOM 0 H2' DG A 22 -9.890 0.004 4.968 1.00 0.00 H new ATOM 0 H2'' DG A 22 -10.122 1.724 5.209 1.00 0.00 H new ATOM 0 HO3' DG A 22 -12.025 1.621 6.689 1.00 0.00 H new ATOM 0 H1' DG A 22 -8.003 2.039 5.992 1.00 0.00 H new ATOM 0 H8 DG A 22 -7.635 -1.757 5.422 1.00 0.00 H new ATOM 0 H1 DG A 22 -4.372 2.081 1.437 1.00 0.00 H new ATOM 0 H21 DG A 22 -5.908 4.668 3.173 1.00 0.00 H new ATOM 0 H22 DG A 22 -4.800 4.184 1.885 1.00 0.00 H new TER 716 DG A 22 CONECT 6 31 CONECT 31 6 32 33 34 CONECT 32 31 CONECT 33 31 CONECT 34 31 35 CONECT 35 34 36 54 55 CONECT 36 35 37 51 56 CONECT 37 36 38 CONECT 38 37 39 50 57 CONECT 39 38 40 43 CONECT 40 39 41 53 CONECT 41 40 42 CONECT 42 41 43 48 CONECT 43 39 42 44 CONECT 44 43 45 CONECT 45 44 46 47 CONECT 46 45 58 59 CONECT 47 45 48 60 CONECT 48 42 47 49 CONECT 49 48 CONECT 50 38 51 61 62 CONECT 51 36 50 52 63 CONECT 52 51 64 CONECT 53 40 CONECT 54 35 CONECT 55 35 CONECT 56 36 CONECT 57 38 CONECT 58 46 CONECT 59 46 CONECT 60 47 CONECT 61 50 CONECT 62 50 CONECT 63 51 CONECT 64 52 CONECT 202 226 CONECT 226 202 227 228 229 CONECT 227 226 CONECT 228 226 CONECT 229 226 230 CONECT 230 229 231 249 250 CONECT 231 230 232 246 251 CONECT 232 231 233 CONECT 233 232 234 245 252 CONECT 234 233 235 238 CONECT 235 234 236 248 CONECT 236 235 237 CONECT 237 236 238 243 CONECT 238 234 237 239 CONECT 239 238 240 CONECT 240 239 241 242 CONECT 241 240 253 254 CONECT 242 240 243 255 CONECT 243 237 242 244 CONECT 244 243 CONECT 245 233 246 256 257 CONECT 246 231 245 247 258 CONECT 247 246 259 CONECT 248 235 CONECT 249 230 CONECT 250 230 CONECT 251 231 CONECT 252 233 CONECT 253 241 CONECT 254 241 CONECT 255 242 CONECT 256 245 CONECT 257 245 CONECT 258 246 CONECT 259 247 CONECT 397 421 CONECT 421 397 422 423 424 CONECT 422 421 CONECT 423 421 CONECT 424 421 425 CONECT 425 424 426 444 445 CONECT 426 425 427 441 446 CONECT 427 426 428 CONECT 428 427 429 440 447 CONECT 429 428 430 433 CONECT 430 429 431 443 CONECT 431 430 432 CONECT 432 431 433 438 CONECT 433 429 432 434 CONECT 434 433 435 CONECT 435 434 436 437 CONECT 436 435 448 449 CONECT 437 435 438 450 CONECT 438 432 437 439 CONECT 439 438 CONECT 440 428 441 451 452 CONECT 441 426 440 442 453 CONECT 442 441 454 CONECT 443 430 CONECT 444 425 CONECT 445 425 CONECT 446 426 CONECT 447 428 CONECT 448 436 CONECT 449 436 CONECT 450 437 CONECT 451 440 CONECT 452 440 CONECT 453 441 CONECT 454 442 455 456 457 CONECT 455 454 CONECT 456 454 CONECT 457 454 458 CONECT 458 457 459 477 478 CONECT 459 458 460 474 479 CONECT 460 459 461 CONECT 461 460 462 473 480 CONECT 462 461 463 466 CONECT 463 462 464 476 CONECT 464 463 465 CONECT 465 464 466 471 CONECT 466 462 465 467 CONECT 467 466 468 CONECT 468 467 469 470 CONECT 469 468 481 482 CONECT 470 468 471 483 CONECT 471 465 470 472 CONECT 472 471 CONECT 473 461 474 484 485 CONECT 474 459 473 475 486 CONECT 475 474 487 CONECT 476 463 CONECT 477 458 CONECT 478 458 CONECT 479 459 CONECT 480 461 CONECT 481 469 CONECT 482 469 CONECT 483 470 CONECT 484 473 CONECT 485 473 CONECT 486 474 CONECT 487 475 CONECT 592 616 CONECT 616 592 617 618 619 CONECT 617 616 CONECT 618 616 CONECT 619 616 620 CONECT 620 619 621 639 640 CONECT 621 620 622 636 641 CONECT 622 621 623 CONECT 623 622 624 635 642 CONECT 624 623 625 628 CONECT 625 624 626 638 CONECT 626 625 627 CONECT 627 626 628 633 CONECT 628 624 627 629 CONECT 629 628 630 CONECT 630 629 631 632 CONECT 631 630 643 644 CONECT 632 630 633 645 CONECT 633 627 632 634 CONECT 634 633 CONECT 635 623 636 646 647 CONECT 636 621 635 637 648 CONECT 637 636 649 CONECT 638 625 CONECT 639 620 CONECT 640 620 CONECT 641 621 CONECT 642 623 CONECT 643 631 CONECT 644 631 CONECT 645 632 CONECT 646 635 CONECT 647 635 CONECT 648 636 CONECT 649 637 END