USER MOD reduce.3.24.130724 H: found=0, std=0, add=248, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 248 hydrogens (25 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 DG O5' : rot 180:sc= 0 USER MOD Single : A 20 DT C7 :methyl -30:sc= -4.67! (180deg=-8.9!) USER MOD Single : A 20 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -8.818 -3.701 -8.739 1.00 0.00 O ATOM 2 C5' DG A 1 -8.448 -3.668 -7.359 1.00 0.00 C ATOM 3 C4' DG A 1 -7.459 -4.781 -7.021 1.00 0.00 C ATOM 4 O4' DG A 1 -6.222 -4.581 -7.712 1.00 0.00 O ATOM 5 C3' DG A 1 -7.131 -4.888 -5.536 1.00 0.00 C ATOM 6 O3' DG A 1 -7.960 -5.906 -4.932 1.00 0.00 O ATOM 7 C2' DG A 1 -5.656 -5.260 -5.475 1.00 0.00 C ATOM 8 C1' DG A 1 -5.160 -5.104 -6.908 1.00 0.00 C ATOM 9 N9 DG A 1 -3.991 -4.215 -7.055 1.00 0.00 N ATOM 10 C8 DG A 1 -2.707 -4.539 -7.397 1.00 0.00 C ATOM 11 N7 DG A 1 -1.847 -3.570 -7.301 1.00 0.00 N ATOM 12 C5 DG A 1 -2.621 -2.499 -6.863 1.00 0.00 C ATOM 13 C6 DG A 1 -2.245 -1.158 -6.583 1.00 0.00 C ATOM 14 O6 DG A 1 -1.131 -0.646 -6.666 1.00 0.00 O ATOM 15 N1 DG A 1 -3.334 -0.399 -6.173 1.00 0.00 N ATOM 16 C2 DG A 1 -4.625 -0.872 -6.045 1.00 0.00 C ATOM 17 N2 DG A 1 -5.542 0.000 -5.634 1.00 0.00 N ATOM 18 N3 DG A 1 -4.980 -2.132 -6.308 1.00 0.00 N ATOM 19 C4 DG A 1 -3.934 -2.886 -6.709 1.00 0.00 C ATOM 0 H5' DG A 1 -9.339 -3.770 -6.739 1.00 0.00 H new ATOM 0 H5'' DG A 1 -8.004 -2.701 -7.123 1.00 0.00 H new ATOM 0 H4' DG A 1 -7.956 -5.700 -7.331 1.00 0.00 H new ATOM 0 H3' DG A 1 -7.321 -3.962 -4.992 1.00 0.00 H new ATOM 0 H2' DG A 1 -5.110 -4.607 -4.794 1.00 0.00 H new ATOM 0 H2'' DG A 1 -5.519 -6.280 -5.117 1.00 0.00 H new ATOM 0 HO5' DG A 1 -9.453 -2.978 -8.925 1.00 0.00 H new ATOM 0 H1' DG A 1 -4.844 -6.097 -7.228 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.428 -5.530 -7.724 1.00 0.00 H new ATOM 0 H1 DG A 1 -3.167 0.582 -5.950 1.00 0.00 H new ATOM 0 H21 DG A 1 -6.512 -0.295 -5.522 1.00 0.00 H new ATOM 0 H22 DG A 1 -5.275 0.963 -5.431 1.00 0.00 H new ATOM 32 P DG A 2 -8.047 -6.062 -3.323 1.00 0.00 P ATOM 33 OP1 DG A 2 -9.131 -7.018 -3.004 1.00 0.00 O ATOM 34 OP2 DG A 2 -8.049 -4.710 -2.723 1.00 0.00 O ATOM 35 O5' DG A 2 -6.633 -6.765 -2.993 1.00 0.00 O ATOM 36 C5' DG A 2 -6.356 -8.081 -3.503 1.00 0.00 C ATOM 37 C4' DG A 2 -4.889 -8.473 -3.313 1.00 0.00 C ATOM 38 O4' DG A 2 -4.059 -7.551 -4.004 1.00 0.00 O ATOM 39 C3' DG A 2 -4.366 -8.540 -1.888 1.00 0.00 C ATOM 40 O3' DG A 2 -4.604 -9.871 -1.378 1.00 0.00 O ATOM 41 C2' DG A 2 -2.887 -8.217 -2.035 1.00 0.00 C ATOM 42 C1' DG A 2 -2.840 -7.336 -3.281 1.00 0.00 C ATOM 43 N9 DG A 2 -2.780 -5.900 -2.972 1.00 0.00 N ATOM 44 C8 DG A 2 -3.805 -5.070 -2.635 1.00 0.00 C ATOM 45 N7 DG A 2 -3.465 -3.857 -2.347 1.00 0.00 N ATOM 46 C5 DG A 2 -2.089 -3.866 -2.501 1.00 0.00 C ATOM 47 C6 DG A 2 -1.163 -2.814 -2.327 1.00 0.00 C ATOM 48 O6 DG A 2 -1.391 -1.650 -1.992 1.00 0.00 O ATOM 49 N1 DG A 2 0.134 -3.233 -2.587 1.00 0.00 N ATOM 50 C2 DG A 2 0.499 -4.510 -2.965 1.00 0.00 C ATOM 51 N2 DG A 2 1.804 -4.717 -3.168 1.00 0.00 N ATOM 52 N3 DG A 2 -0.377 -5.511 -3.128 1.00 0.00 N ATOM 53 C4 DG A 2 -1.650 -5.117 -2.880 1.00 0.00 C ATOM 0 H5' DG A 2 -6.607 -8.119 -4.563 1.00 0.00 H new ATOM 0 H5'' DG A 2 -6.993 -8.807 -2.998 1.00 0.00 H new ATOM 0 H4' DG A 2 -4.854 -9.491 -3.700 1.00 0.00 H new ATOM 0 H3' DG A 2 -4.843 -7.856 -1.186 1.00 0.00 H new ATOM 0 H2' DG A 2 -2.501 -7.696 -1.159 1.00 0.00 H new ATOM 0 H2'' DG A 2 -2.289 -9.120 -2.158 1.00 0.00 H new ATOM 0 H1' DG A 2 -1.942 -7.603 -3.839 1.00 0.00 H new ATOM 0 H8 DG A 2 -4.832 -5.403 -2.610 1.00 0.00 H new ATOM 0 H1 DG A 2 0.878 -2.542 -2.491 1.00 0.00 H new ATOM 0 H21 DG A 2 2.136 -5.640 -3.449 1.00 0.00 H new ATOM 0 H22 DG A 2 2.467 -3.952 -3.042 1.00 0.00 H new ATOM 65 P DG A 3 -4.450 -10.278 0.184 1.00 0.00 P ATOM 66 OP1 DG A 3 -5.052 -11.615 0.389 1.00 0.00 O ATOM 67 OP2 DG A 3 -4.876 -9.128 1.013 1.00 0.00 O ATOM 68 O5' DG A 3 -2.847 -10.414 0.276 1.00 0.00 O ATOM 69 C5' DG A 3 -2.220 -11.341 -0.615 1.00 0.00 C ATOM 70 C4' DG A 3 -0.692 -11.255 -0.620 1.00 0.00 C ATOM 71 O4' DG A 3 -0.328 -9.883 -0.851 1.00 0.00 O ATOM 72 C3' DG A 3 0.070 -11.676 0.639 1.00 0.00 C ATOM 73 O3' DG A 3 1.264 -12.268 0.135 1.00 0.00 O ATOM 74 C2' DG A 3 0.406 -10.389 1.363 1.00 0.00 C ATOM 75 C1' DG A 3 0.476 -9.378 0.239 1.00 0.00 C ATOM 76 N9 DG A 3 -0.029 -8.047 0.617 1.00 0.00 N ATOM 77 C8 DG A 3 -1.295 -7.661 0.952 1.00 0.00 C ATOM 78 N7 DG A 3 -1.420 -6.414 1.296 1.00 0.00 N ATOM 79 C5 DG A 3 -0.121 -5.924 1.184 1.00 0.00 C ATOM 80 C6 DG A 3 0.380 -4.622 1.429 1.00 0.00 C ATOM 81 O6 DG A 3 -0.232 -3.624 1.797 1.00 0.00 O ATOM 82 N1 DG A 3 1.743 -4.550 1.199 1.00 0.00 N ATOM 83 C2 DG A 3 2.540 -5.589 0.786 1.00 0.00 C ATOM 84 N2 DG A 3 3.839 -5.309 0.627 1.00 0.00 N ATOM 85 N3 DG A 3 2.076 -6.824 0.550 1.00 0.00 N ATOM 86 C4 DG A 3 0.738 -6.916 0.771 1.00 0.00 C ATOM 0 H5' DG A 3 -2.588 -11.165 -1.626 1.00 0.00 H new ATOM 0 H5'' DG A 3 -2.517 -12.353 -0.340 1.00 0.00 H new ATOM 0 H4' DG A 3 -0.406 -11.974 -1.388 1.00 0.00 H new ATOM 0 H3' DG A 3 -0.466 -12.352 1.305 1.00 0.00 H new ATOM 0 H2' DG A 3 -0.357 -10.126 2.096 1.00 0.00 H new ATOM 0 H2'' DG A 3 1.352 -10.462 1.900 1.00 0.00 H new ATOM 0 H1' DG A 3 1.524 -9.252 -0.033 1.00 0.00 H new ATOM 0 H8 DG A 3 -2.132 -8.343 0.933 1.00 0.00 H new ATOM 0 H1 DG A 3 2.194 -3.648 1.349 1.00 0.00 H new ATOM 0 H21 DG A 3 4.484 -6.038 0.322 1.00 0.00 H new ATOM 0 H22 DG A 3 4.184 -4.367 0.811 1.00 0.00 H new ATOM 98 P DG A 4 1.489 -13.854 0.009 1.00 0.00 P ATOM 99 OP1 DG A 4 0.241 -14.473 -0.489 1.00 0.00 O ATOM 100 OP2 DG A 4 2.121 -14.344 1.255 1.00 0.00 O ATOM 101 O5' DG A 4 2.582 -13.876 -1.174 1.00 0.00 O ATOM 102 C5' DG A 4 2.142 -13.434 -2.469 1.00 0.00 C ATOM 103 C4' DG A 4 3.255 -13.237 -3.489 1.00 0.00 C ATOM 104 O4' DG A 4 4.041 -12.117 -3.109 1.00 0.00 O ATOM 105 C3' DG A 4 4.188 -14.418 -3.674 1.00 0.00 C ATOM 106 O3' DG A 4 4.530 -14.507 -5.063 1.00 0.00 O ATOM 107 C2' DG A 4 5.429 -14.054 -2.850 1.00 0.00 C ATOM 108 C1' DG A 4 5.254 -12.563 -2.516 1.00 0.00 C ATOM 109 N9 DG A 4 5.173 -12.233 -1.070 1.00 0.00 N ATOM 110 C8 DG A 4 4.733 -12.992 -0.017 1.00 0.00 C ATOM 111 N7 DG A 4 4.782 -12.412 1.142 1.00 0.00 N ATOM 112 C5 DG A 4 5.293 -11.153 0.849 1.00 0.00 C ATOM 113 C6 DG A 4 5.566 -10.063 1.717 1.00 0.00 C ATOM 114 O6 DG A 4 5.409 -10.002 2.934 1.00 0.00 O ATOM 115 N1 DG A 4 6.068 -8.972 1.022 1.00 0.00 N ATOM 116 C2 DG A 4 6.281 -8.930 -0.340 1.00 0.00 C ATOM 117 N2 DG A 4 6.763 -7.784 -0.824 1.00 0.00 N ATOM 118 N3 DG A 4 6.029 -9.955 -1.162 1.00 0.00 N ATOM 119 C4 DG A 4 5.537 -11.031 -0.501 1.00 0.00 C ATOM 0 H5' DG A 4 1.604 -12.493 -2.353 1.00 0.00 H new ATOM 0 H5'' DG A 4 1.432 -14.161 -2.863 1.00 0.00 H new ATOM 0 H4' DG A 4 2.744 -13.097 -4.441 1.00 0.00 H new ATOM 0 H3' DG A 4 3.756 -15.370 -3.365 1.00 0.00 H new ATOM 0 H2' DG A 4 5.494 -14.657 -1.945 1.00 0.00 H new ATOM 0 H2'' DG A 4 6.345 -14.228 -3.415 1.00 0.00 H new ATOM 0 H1' DG A 4 6.150 -12.074 -2.899 1.00 0.00 H new ATOM 0 H8 DG A 4 4.371 -14.002 -0.143 1.00 0.00 H new ATOM 0 H1 DG A 4 6.297 -8.136 1.560 1.00 0.00 H new ATOM 0 H21 DG A 4 6.943 -7.688 -1.823 1.00 0.00 H new ATOM 0 H22 DG A 4 6.952 -7.004 -0.195 1.00 0.00 H new ATOM 131 P DC A 5 3.686 -15.487 -6.034 1.00 0.00 P ATOM 132 OP1 DC A 5 3.333 -16.701 -5.265 1.00 0.00 O ATOM 133 OP2 DC A 5 4.422 -15.613 -7.311 1.00 0.00 O ATOM 134 O5' DC A 5 2.328 -14.662 -6.316 1.00 0.00 O ATOM 135 C5' DC A 5 2.290 -13.526 -7.188 1.00 0.00 C ATOM 136 C4' DC A 5 0.974 -12.775 -7.048 1.00 0.00 C ATOM 137 O4' DC A 5 0.863 -12.242 -5.735 1.00 0.00 O ATOM 138 C3' DC A 5 0.829 -11.618 -8.022 1.00 0.00 C ATOM 139 O3' DC A 5 0.048 -11.999 -9.159 1.00 0.00 O ATOM 140 C2' DC A 5 0.084 -10.541 -7.240 1.00 0.00 C ATOM 141 C1' DC A 5 0.151 -11.006 -5.787 1.00 0.00 C ATOM 142 N1 DC A 5 0.834 -10.061 -4.879 1.00 0.00 N ATOM 143 C2 DC A 5 2.106 -9.636 -5.225 1.00 0.00 C ATOM 144 O2 DC A 5 2.643 -10.071 -6.241 1.00 0.00 O ATOM 145 N3 DC A 5 2.736 -8.748 -4.404 1.00 0.00 N ATOM 146 C4 DC A 5 2.140 -8.296 -3.290 1.00 0.00 C ATOM 147 N4 DC A 5 2.784 -7.434 -2.498 1.00 0.00 N ATOM 148 C5 DC A 5 0.825 -8.731 -2.938 1.00 0.00 C ATOM 149 C6 DC A 5 0.217 -9.612 -3.754 1.00 0.00 C ATOM 0 H5' DC A 5 2.419 -13.851 -8.220 1.00 0.00 H new ATOM 0 H5'' DC A 5 3.120 -12.858 -6.958 1.00 0.00 H new ATOM 0 H4' DC A 5 0.192 -13.503 -7.264 1.00 0.00 H new ATOM 0 H3' DC A 5 1.799 -11.286 -8.393 1.00 0.00 H new ATOM 0 H2' DC A 5 0.552 -9.564 -7.366 1.00 0.00 H new ATOM 0 H2'' DC A 5 -0.948 -10.447 -7.579 1.00 0.00 H new ATOM 0 H1' DC A 5 -0.881 -11.094 -5.449 1.00 0.00 H new ATOM 0 H41 DC A 5 2.335 -7.087 -1.650 1.00 0.00 H new ATOM 0 H42 DC A 5 3.724 -7.123 -2.741 1.00 0.00 H new ATOM 0 H5 DC A 5 0.336 -8.365 -2.047 1.00 0.00 H new ATOM 0 H6 DC A 5 -0.774 -9.967 -3.512 1.00 0.00 H new ATOM 161 P DG A 6 0.669 -11.938 -10.641 1.00 0.00 P ATOM 162 OP1 DG A 6 -0.415 -12.203 -11.612 1.00 0.00 O ATOM 163 OP2 DG A 6 1.906 -12.749 -10.667 1.00 0.00 O ATOM 164 O5' DG A 6 1.070 -10.386 -10.741 1.00 0.00 O ATOM 165 C5' DG A 6 0.099 -9.353 -10.583 1.00 0.00 C ATOM 166 C4' DG A 6 0.781 -7.983 -10.608 1.00 0.00 C ATOM 167 O4' DG A 6 0.508 -7.338 -11.859 1.00 0.00 O ATOM 168 C3' DG A 6 0.351 -7.013 -9.508 1.00 0.00 C ATOM 169 O3' DG A 6 1.518 -6.340 -9.061 1.00 0.00 O ATOM 170 C2' DG A 6 -0.591 -6.025 -10.166 1.00 0.00 C ATOM 171 C1' DG A 6 -0.307 -6.168 -11.651 1.00 0.00 C ATOM 172 N9 DG A 6 -1.528 -6.330 -12.452 1.00 0.00 N ATOM 173 C8 DG A 6 -2.460 -7.320 -12.388 1.00 0.00 C ATOM 174 N7 DG A 6 -3.443 -7.208 -13.234 1.00 0.00 N ATOM 175 C5 DG A 6 -3.139 -6.031 -13.921 1.00 0.00 C ATOM 176 C6 DG A 6 -3.842 -5.374 -14.969 1.00 0.00 C ATOM 177 O6 DG A 6 -4.891 -5.714 -15.516 1.00 0.00 O ATOM 178 N1 DG A 6 -3.192 -4.213 -15.371 1.00 0.00 N ATOM 179 C2 DG A 6 -2.013 -3.738 -14.833 1.00 0.00 C ATOM 180 N2 DG A 6 -1.545 -2.599 -15.346 1.00 0.00 N ATOM 181 N3 DG A 6 -1.349 -4.353 -13.850 1.00 0.00 N ATOM 182 C4 DG A 6 -1.966 -5.488 -13.445 1.00 0.00 C ATOM 0 H5' DG A 6 -0.434 -9.485 -9.642 1.00 0.00 H new ATOM 0 H5'' DG A 6 -0.642 -9.414 -11.380 1.00 0.00 H new ATOM 0 H4' DG A 6 1.837 -8.201 -10.451 1.00 0.00 H new ATOM 0 H3' DG A 6 -0.133 -7.507 -8.665 1.00 0.00 H new ATOM 0 H2' DG A 6 -1.632 -6.254 -9.936 1.00 0.00 H new ATOM 0 H2'' DG A 6 -0.405 -5.008 -9.821 1.00 0.00 H new ATOM 0 H1' DG A 6 0.193 -5.253 -11.970 1.00 0.00 H new ATOM 0 H8 DG A 6 -2.389 -8.138 -11.687 1.00 0.00 H new ATOM 0 H1 DG A 6 -3.619 -3.670 -16.121 1.00 0.00 H new ATOM 0 H21 DG A 6 -0.678 -2.198 -14.990 1.00 0.00 H new ATOM 0 H22 DG A 6 -2.055 -2.129 -16.094 1.00 0.00 H new ATOM 194 P DG A 7 2.163 -6.734 -7.646 1.00 0.00 P ATOM 195 OP1 DG A 7 2.408 -8.191 -7.645 1.00 0.00 O ATOM 196 OP2 DG A 7 1.347 -6.121 -6.574 1.00 0.00 O ATOM 197 O5' DG A 7 3.581 -5.997 -7.689 1.00 0.00 O ATOM 198 C5' DG A 7 4.583 -6.435 -8.612 1.00 0.00 C ATOM 199 C4' DG A 7 5.784 -5.523 -8.570 1.00 0.00 C ATOM 200 O4' DG A 7 5.448 -4.223 -9.020 1.00 0.00 O ATOM 201 C3' DG A 7 6.327 -5.382 -7.171 1.00 0.00 C ATOM 202 O3' DG A 7 7.258 -6.431 -6.867 1.00 0.00 O ATOM 203 C2' DG A 7 7.024 -4.032 -7.220 1.00 0.00 C ATOM 204 C1' DG A 7 6.302 -3.293 -8.354 1.00 0.00 C ATOM 205 N9 DG A 7 5.457 -2.173 -7.914 1.00 0.00 N ATOM 206 C8 DG A 7 5.823 -0.902 -7.597 1.00 0.00 C ATOM 207 N7 DG A 7 4.849 -0.117 -7.241 1.00 0.00 N ATOM 208 C5 DG A 7 3.730 -0.945 -7.326 1.00 0.00 C ATOM 209 C6 DG A 7 2.363 -0.662 -7.060 1.00 0.00 C ATOM 210 O6 DG A 7 1.862 0.392 -6.680 1.00 0.00 O ATOM 211 N1 DG A 7 1.561 -1.771 -7.276 1.00 0.00 N ATOM 212 C2 DG A 7 2.008 -3.003 -7.698 1.00 0.00 C ATOM 213 N2 DG A 7 1.077 -3.938 -7.871 1.00 0.00 N ATOM 214 N3 DG A 7 3.294 -3.278 -7.944 1.00 0.00 N ATOM 215 C4 DG A 7 4.095 -2.206 -7.740 1.00 0.00 C ATOM 0 H5' DG A 7 4.171 -6.455 -9.621 1.00 0.00 H new ATOM 0 H5'' DG A 7 4.886 -7.454 -8.371 1.00 0.00 H new ATOM 0 H4' DG A 7 6.534 -5.976 -9.219 1.00 0.00 H new ATOM 0 H3' DG A 7 5.558 -5.447 -6.401 1.00 0.00 H new ATOM 0 H2' DG A 7 6.933 -3.500 -6.273 1.00 0.00 H new ATOM 0 H2'' DG A 7 8.089 -4.138 -7.425 1.00 0.00 H new ATOM 0 H1' DG A 7 7.084 -2.879 -8.991 1.00 0.00 H new ATOM 0 H8 DG A 7 6.849 -0.568 -7.638 1.00 0.00 H new ATOM 0 H1 DG A 7 0.560 -1.666 -7.109 1.00 0.00 H new ATOM 0 H21 DG A 7 1.344 -4.872 -8.183 1.00 0.00 H new ATOM 0 H22 DG A 7 0.097 -3.721 -7.692 1.00 0.00 H new ATOM 227 P DG A 8 7.250 -7.063 -5.382 1.00 0.00 P ATOM 228 OP1 DG A 8 8.304 -8.100 -5.311 1.00 0.00 O ATOM 229 OP2 DG A 8 5.853 -7.399 -5.023 1.00 0.00 O ATOM 230 O5' DG A 8 7.714 -5.811 -4.496 1.00 0.00 O ATOM 231 C5' DG A 8 9.010 -5.247 -4.653 1.00 0.00 C ATOM 232 C4' DG A 8 9.125 -3.941 -3.889 1.00 0.00 C ATOM 233 O4' DG A 8 8.147 -3.034 -4.385 1.00 0.00 O ATOM 234 C3' DG A 8 8.876 -4.022 -2.399 1.00 0.00 C ATOM 235 O3' DG A 8 10.083 -4.399 -1.709 1.00 0.00 O ATOM 236 C2' DG A 8 8.462 -2.596 -2.066 1.00 0.00 C ATOM 237 C1' DG A 8 7.769 -2.120 -3.346 1.00 0.00 C ATOM 238 N9 DG A 8 6.289 -2.114 -3.256 1.00 0.00 N ATOM 239 C8 DG A 8 5.412 -3.155 -3.400 1.00 0.00 C ATOM 240 N7 DG A 8 4.163 -2.867 -3.185 1.00 0.00 N ATOM 241 C5 DG A 8 4.203 -1.513 -2.866 1.00 0.00 C ATOM 242 C6 DG A 8 3.142 -0.628 -2.539 1.00 0.00 C ATOM 243 O6 DG A 8 1.943 -0.866 -2.470 1.00 0.00 O ATOM 244 N1 DG A 8 3.599 0.651 -2.293 1.00 0.00 N ATOM 245 C2 DG A 8 4.918 1.047 -2.344 1.00 0.00 C ATOM 246 N2 DG A 8 5.160 2.327 -2.063 1.00 0.00 N ATOM 247 N3 DG A 8 5.928 0.220 -2.651 1.00 0.00 N ATOM 248 C4 DG A 8 5.498 -1.041 -2.901 1.00 0.00 C ATOM 0 H5' DG A 8 9.211 -5.074 -5.710 1.00 0.00 H new ATOM 0 H5'' DG A 8 9.763 -5.950 -4.296 1.00 0.00 H new ATOM 0 H4' DG A 8 10.160 -3.632 -4.037 1.00 0.00 H new ATOM 0 H3' DG A 8 8.133 -4.764 -2.107 1.00 0.00 H new ATOM 0 H2' DG A 8 7.790 -2.563 -1.209 1.00 0.00 H new ATOM 0 H2'' DG A 8 9.323 -1.975 -1.820 1.00 0.00 H new ATOM 0 H1' DG A 8 8.076 -1.091 -3.534 1.00 0.00 H new ATOM 0 H8 DG A 8 5.736 -4.148 -3.674 1.00 0.00 H new ATOM 0 H1 DG A 8 2.905 1.360 -2.054 1.00 0.00 H new ATOM 0 H21 DG A 8 6.116 2.682 -2.084 1.00 0.00 H new ATOM 0 H22 DG A 8 4.389 2.952 -1.827 1.00 0.00 H new ATOM 260 P DG A 9 10.018 -4.995 -0.205 1.00 0.00 P ATOM 261 OP1 DG A 9 11.341 -5.555 0.134 1.00 0.00 O ATOM 262 OP2 DG A 9 8.800 -5.826 -0.079 1.00 0.00 O ATOM 263 O5' DG A 9 9.803 -3.642 0.636 1.00 0.00 O ATOM 264 C5' DG A 9 10.841 -2.662 0.589 1.00 0.00 C ATOM 265 C4' DG A 9 10.282 -1.252 0.444 1.00 0.00 C ATOM 266 O4' DG A 9 8.877 -1.308 0.195 1.00 0.00 O ATOM 267 C3' DG A 9 10.457 -0.317 1.639 1.00 0.00 C ATOM 268 O3' DG A 9 10.510 1.037 1.150 1.00 0.00 O ATOM 269 C2' DG A 9 9.143 -0.501 2.382 1.00 0.00 C ATOM 270 C1' DG A 9 8.196 -0.574 1.204 1.00 0.00 C ATOM 271 N9 DG A 9 6.900 -1.226 1.435 1.00 0.00 N ATOM 272 C8 DG A 9 6.519 -2.518 1.198 1.00 0.00 C ATOM 273 N7 DG A 9 5.248 -2.756 1.362 1.00 0.00 N ATOM 274 C5 DG A 9 4.742 -1.509 1.745 1.00 0.00 C ATOM 275 C6 DG A 9 3.411 -1.112 2.062 1.00 0.00 C ATOM 276 O6 DG A 9 2.395 -1.794 2.085 1.00 0.00 O ATOM 277 N1 DG A 9 3.342 0.235 2.384 1.00 0.00 N ATOM 278 C2 DG A 9 4.419 1.096 2.408 1.00 0.00 C ATOM 279 N2 DG A 9 4.167 2.358 2.741 1.00 0.00 N ATOM 280 N3 DG A 9 5.664 0.729 2.117 1.00 0.00 N ATOM 281 C4 DG A 9 5.752 -0.577 1.793 1.00 0.00 C ATOM 0 H5' DG A 9 11.506 -2.877 -0.247 1.00 0.00 H new ATOM 0 H5'' DG A 9 11.441 -2.724 1.497 1.00 0.00 H new ATOM 0 H4' DG A 9 10.869 -0.840 -0.377 1.00 0.00 H new ATOM 0 H3' DG A 9 11.347 -0.512 2.237 1.00 0.00 H new ATOM 0 H2' DG A 9 9.128 -1.407 2.988 1.00 0.00 H new ATOM 0 H2'' DG A 9 8.919 0.332 3.048 1.00 0.00 H new ATOM 0 H1' DG A 9 7.945 0.455 0.949 1.00 0.00 H new ATOM 0 H8 DG A 9 7.219 -3.284 0.897 1.00 0.00 H new ATOM 0 H1 DG A 9 2.427 0.617 2.621 1.00 0.00 H new ATOM 0 H21 DG A 9 4.927 3.038 2.775 1.00 0.00 H new ATOM 0 H22 DG A 9 3.214 2.646 2.963 1.00 0.00 H new ATOM 293 P DC A 10 11.557 1.540 0.023 1.00 0.00 P ATOM 294 OP1 DC A 10 12.275 0.358 -0.511 1.00 0.00 O ATOM 295 OP2 DC A 10 12.315 2.688 0.564 1.00 0.00 O ATOM 296 O5' DC A 10 10.538 2.078 -1.126 1.00 0.00 O ATOM 297 C5' DC A 10 9.626 1.176 -1.785 1.00 0.00 C ATOM 298 C4' DC A 10 8.485 1.895 -2.501 1.00 0.00 C ATOM 299 O4' DC A 10 7.674 2.535 -1.516 1.00 0.00 O ATOM 300 C3' DC A 10 8.883 2.957 -3.517 1.00 0.00 C ATOM 301 O3' DC A 10 7.967 2.906 -4.625 1.00 0.00 O ATOM 302 C2' DC A 10 8.741 4.278 -2.784 1.00 0.00 C ATOM 303 C1' DC A 10 7.822 3.956 -1.609 1.00 0.00 C ATOM 304 N1 DC A 10 8.305 4.455 -0.301 1.00 0.00 N ATOM 305 C2 DC A 10 7.385 5.119 0.493 1.00 0.00 C ATOM 306 O2 DC A 10 6.226 5.252 0.111 1.00 0.00 O ATOM 307 N3 DC A 10 7.801 5.609 1.692 1.00 0.00 N ATOM 308 C4 DC A 10 9.068 5.456 2.098 1.00 0.00 C ATOM 309 N4 DC A 10 9.443 5.955 3.274 1.00 0.00 N ATOM 310 C5 DC A 10 10.021 4.767 1.286 1.00 0.00 C ATOM 311 C6 DC A 10 9.602 4.283 0.102 1.00 0.00 C ATOM 0 H5' DC A 10 9.209 0.488 -1.049 1.00 0.00 H new ATOM 0 H5'' DC A 10 10.178 0.574 -2.507 1.00 0.00 H new ATOM 0 H4' DC A 10 7.976 1.116 -3.069 1.00 0.00 H new ATOM 0 H3' DC A 10 9.892 2.817 -3.904 1.00 0.00 H new ATOM 0 H2' DC A 10 9.707 4.651 -2.444 1.00 0.00 H new ATOM 0 H2'' DC A 10 8.311 5.046 -3.427 1.00 0.00 H new ATOM 0 H1' DC A 10 6.879 4.464 -1.813 1.00 0.00 H new ATOM 0 H41 DC A 10 10.406 5.843 3.592 1.00 0.00 H new ATOM 0 H42 DC A 10 8.767 6.449 3.857 1.00 0.00 H new ATOM 0 H5 DC A 10 11.043 4.639 1.611 1.00 0.00 H new ATOM 0 H6 DC A 10 10.295 3.754 -0.536 1.00 0.00 H new ATOM 323 P DG A 11 8.186 3.851 -5.910 1.00 0.00 P ATOM 324 OP1 DG A 11 7.503 3.234 -7.070 1.00 0.00 O ATOM 325 OP2 DG A 11 9.622 4.200 -5.991 1.00 0.00 O ATOM 326 O5' DG A 11 7.359 5.170 -5.480 1.00 0.00 O ATOM 327 C5' DG A 11 7.785 6.485 -5.843 1.00 0.00 C ATOM 328 C4' DG A 11 6.750 7.535 -5.430 1.00 0.00 C ATOM 329 O4' DG A 11 5.521 7.324 -6.117 1.00 0.00 O ATOM 330 C3' DG A 11 6.399 7.539 -3.945 1.00 0.00 C ATOM 331 O3' DG A 11 7.301 8.372 -3.187 1.00 0.00 O ATOM 332 C2' DG A 11 5.001 8.147 -3.923 1.00 0.00 C ATOM 333 C1' DG A 11 4.482 7.937 -5.348 1.00 0.00 C ATOM 334 N9 DG A 11 3.282 7.083 -5.425 1.00 0.00 N ATOM 335 C8 DG A 11 1.983 7.417 -5.176 1.00 0.00 C ATOM 336 N7 DG A 11 1.132 6.441 -5.275 1.00 0.00 N ATOM 337 C5 DG A 11 1.932 5.357 -5.625 1.00 0.00 C ATOM 338 C6 DG A 11 1.569 4.008 -5.877 1.00 0.00 C ATOM 339 O6 DG A 11 0.449 3.502 -5.835 1.00 0.00 O ATOM 340 N1 DG A 11 2.676 3.235 -6.201 1.00 0.00 N ATOM 341 C2 DG A 11 3.974 3.699 -6.276 1.00 0.00 C ATOM 342 N2 DG A 11 4.908 2.803 -6.606 1.00 0.00 N ATOM 343 N3 DG A 11 4.320 4.970 -6.038 1.00 0.00 N ATOM 344 C4 DG A 11 3.252 5.740 -5.719 1.00 0.00 C ATOM 0 H5' DG A 11 7.947 6.534 -6.920 1.00 0.00 H new ATOM 0 H5'' DG A 11 8.740 6.705 -5.367 1.00 0.00 H new ATOM 0 H4' DG A 11 7.226 8.483 -5.682 1.00 0.00 H new ATOM 0 H3' DG A 11 6.462 6.545 -3.502 1.00 0.00 H new ATOM 0 H2' DG A 11 4.363 7.654 -3.189 1.00 0.00 H new ATOM 0 H2'' DG A 11 5.030 9.205 -3.661 1.00 0.00 H new ATOM 0 H1' DG A 11 4.199 8.917 -5.732 1.00 0.00 H new ATOM 0 H8 DG A 11 1.684 8.421 -4.915 1.00 0.00 H new ATOM 0 H1 DG A 11 2.518 2.247 -6.399 1.00 0.00 H new ATOM 0 H21 DG A 11 5.885 3.087 -6.677 1.00 0.00 H new ATOM 0 H22 DG A 11 4.644 1.834 -6.787 1.00 0.00 H new ATOM 356 P DG A 12 7.687 7.956 -1.672 1.00 0.00 P ATOM 357 OP1 DG A 12 8.637 8.962 -1.145 1.00 0.00 O ATOM 358 OP2 DG A 12 8.051 6.529 -1.654 1.00 0.00 O ATOM 359 O5' DG A 12 6.285 8.134 -0.895 1.00 0.00 O ATOM 360 C5' DG A 12 5.680 9.420 -0.742 1.00 0.00 C ATOM 361 C4' DG A 12 4.258 9.312 -0.191 1.00 0.00 C ATOM 362 O4' DG A 12 3.458 8.551 -1.088 1.00 0.00 O ATOM 363 C3' DG A 12 4.118 8.636 1.163 1.00 0.00 C ATOM 364 O3' DG A 12 4.328 9.607 2.203 1.00 0.00 O ATOM 365 C2' DG A 12 2.674 8.140 1.139 1.00 0.00 C ATOM 366 C1' DG A 12 2.406 7.905 -0.355 1.00 0.00 C ATOM 367 N9 DG A 12 2.403 6.481 -0.748 1.00 0.00 N ATOM 368 C8 DG A 12 3.456 5.685 -1.101 1.00 0.00 C ATOM 369 N7 DG A 12 3.157 4.443 -1.342 1.00 0.00 N ATOM 370 C5 DG A 12 1.779 4.403 -1.135 1.00 0.00 C ATOM 371 C6 DG A 12 0.874 3.311 -1.253 1.00 0.00 C ATOM 372 O6 DG A 12 1.120 2.148 -1.565 1.00 0.00 O ATOM 373 N1 DG A 12 -0.427 3.694 -0.961 1.00 0.00 N ATOM 374 C2 DG A 12 -0.817 4.967 -0.599 1.00 0.00 C ATOM 375 N2 DG A 12 -2.117 5.141 -0.357 1.00 0.00 N ATOM 376 N3 DG A 12 0.031 5.997 -0.488 1.00 0.00 N ATOM 377 C4 DG A 12 1.308 5.644 -0.769 1.00 0.00 C ATOM 0 H5' DG A 12 5.660 9.930 -1.705 1.00 0.00 H new ATOM 0 H5'' DG A 12 6.285 10.030 -0.071 1.00 0.00 H new ATOM 0 H4' DG A 12 3.943 10.349 -0.077 1.00 0.00 H new ATOM 0 H3' DG A 12 4.832 7.834 1.348 1.00 0.00 H new ATOM 0 H2' DG A 12 2.553 7.225 1.718 1.00 0.00 H new ATOM 0 H2'' DG A 12 1.989 8.876 1.560 1.00 0.00 H new ATOM 0 H1' DG A 12 1.413 8.301 -0.570 1.00 0.00 H new ATOM 0 H8 DG A 12 4.466 6.061 -1.175 1.00 0.00 H new ATOM 0 H1 DG A 12 -1.152 2.979 -1.018 1.00 0.00 H new ATOM 0 H21 DG A 12 -2.467 6.060 -0.085 1.00 0.00 H new ATOM 0 H22 DG A 12 -2.762 4.355 -0.444 1.00 0.00 H new ATOM 389 P DG A 13 4.798 9.163 3.685 1.00 0.00 P ATOM 390 OP1 DG A 13 5.174 10.380 4.439 1.00 0.00 O ATOM 391 OP2 DG A 13 5.762 8.047 3.552 1.00 0.00 O ATOM 392 O5' DG A 13 3.435 8.578 4.311 1.00 0.00 O ATOM 393 C5' DG A 13 2.312 9.450 4.459 1.00 0.00 C ATOM 394 C4' DG A 13 1.063 8.728 4.952 1.00 0.00 C ATOM 395 O4' DG A 13 0.715 7.698 4.048 1.00 0.00 O ATOM 396 C3' DG A 13 1.165 8.068 6.317 1.00 0.00 C ATOM 397 O3' DG A 13 0.851 9.087 7.285 1.00 0.00 O ATOM 398 C2' DG A 13 0.102 6.970 6.250 1.00 0.00 C ATOM 399 C1' DG A 13 -0.101 6.745 4.734 1.00 0.00 C ATOM 400 N9 DG A 13 0.324 5.422 4.250 1.00 0.00 N ATOM 401 C8 DG A 13 1.564 5.031 3.863 1.00 0.00 C ATOM 402 N7 DG A 13 1.671 3.794 3.500 1.00 0.00 N ATOM 403 C5 DG A 13 0.387 3.304 3.661 1.00 0.00 C ATOM 404 C6 DG A 13 -0.113 2.001 3.421 1.00 0.00 C ATOM 405 O6 DG A 13 0.501 1.010 3.017 1.00 0.00 O ATOM 406 N1 DG A 13 -1.466 1.919 3.716 1.00 0.00 N ATOM 407 C2 DG A 13 -2.238 2.964 4.190 1.00 0.00 C ATOM 408 N2 DG A 13 -3.508 2.685 4.451 1.00 0.00 N ATOM 409 N3 DG A 13 -1.770 4.196 4.407 1.00 0.00 N ATOM 410 C4 DG A 13 -0.454 4.293 4.126 1.00 0.00 C ATOM 0 H5' DG A 13 2.098 9.924 3.501 1.00 0.00 H new ATOM 0 H5'' DG A 13 2.566 10.246 5.159 1.00 0.00 H new ATOM 0 H4' DG A 13 0.323 9.525 5.027 1.00 0.00 H new ATOM 0 H3' DG A 13 2.135 7.648 6.584 1.00 0.00 H new ATOM 0 H2' DG A 13 0.435 6.060 6.748 1.00 0.00 H new ATOM 0 H2'' DG A 13 -0.823 7.279 6.736 1.00 0.00 H new ATOM 0 H1' DG A 13 -1.171 6.839 4.548 1.00 0.00 H new ATOM 0 H8 DG A 13 2.406 5.707 3.858 1.00 0.00 H new ATOM 0 H1 DG A 13 -1.926 1.020 3.572 1.00 0.00 H new ATOM 0 H21 DG A 13 -4.128 3.414 4.803 1.00 0.00 H new ATOM 0 H22 DG A 13 -3.864 1.741 4.300 1.00 0.00 H new ATOM 422 P DG A 14 1.262 9.045 8.853 1.00 0.00 P ATOM 423 OP1 DG A 14 1.132 10.413 9.402 1.00 0.00 O ATOM 424 OP2 DG A 14 2.550 8.325 8.972 1.00 0.00 O ATOM 425 O5' DG A 14 0.109 8.129 9.511 1.00 0.00 O ATOM 426 C5' DG A 14 -1.237 8.390 9.121 1.00 0.00 C ATOM 427 C4' DG A 14 -2.159 8.895 10.230 1.00 0.00 C ATOM 428 O4' DG A 14 -2.368 7.847 11.184 1.00 0.00 O ATOM 429 C3' DG A 14 -1.674 10.131 11.002 1.00 0.00 C ATOM 430 O3' DG A 14 -2.822 10.965 11.247 1.00 0.00 O ATOM 431 C2' DG A 14 -1.153 9.568 12.318 1.00 0.00 C ATOM 432 C1' DG A 14 -1.911 8.257 12.476 1.00 0.00 C ATOM 433 N9 DG A 14 -1.098 7.155 13.018 1.00 0.00 N ATOM 434 C8 DG A 14 -0.419 6.179 12.346 1.00 0.00 C ATOM 435 N7 DG A 14 0.184 5.310 13.099 1.00 0.00 N ATOM 436 C5 DG A 14 -0.116 5.743 14.389 1.00 0.00 C ATOM 437 C6 DG A 14 0.266 5.197 15.645 1.00 0.00 C ATOM 438 O6 DG A 14 0.951 4.201 15.866 1.00 0.00 O ATOM 439 N1 DG A 14 -0.247 5.940 16.700 1.00 0.00 N ATOM 440 C2 DG A 14 -1.029 7.071 16.567 1.00 0.00 C ATOM 441 N2 DG A 14 -1.424 7.655 17.697 1.00 0.00 N ATOM 442 N3 DG A 14 -1.391 7.586 15.388 1.00 0.00 N ATOM 443 C4 DG A 14 -0.901 6.874 14.348 1.00 0.00 C ATOM 0 H5' DG A 14 -1.661 7.474 8.709 1.00 0.00 H new ATOM 0 H5'' DG A 14 -1.227 9.126 8.317 1.00 0.00 H new ATOM 0 H4' DG A 14 -3.068 9.197 9.710 1.00 0.00 H new ATOM 0 H3' DG A 14 -0.917 10.716 10.480 1.00 0.00 H new ATOM 0 H2' DG A 14 -0.076 9.406 12.285 1.00 0.00 H new ATOM 0 H2'' DG A 14 -1.348 10.246 13.149 1.00 0.00 H new ATOM 0 H1' DG A 14 -2.719 8.449 13.182 1.00 0.00 H new ATOM 0 H8 DG A 14 -0.386 6.133 11.267 1.00 0.00 H new ATOM 0 H1 DG A 14 -0.030 5.627 17.646 1.00 0.00 H new ATOM 0 H21 DG A 14 -2.003 8.494 17.662 1.00 0.00 H new ATOM 0 H22 DG A 14 -1.147 7.263 18.597 1.00 0.00 H new ATOM 455 P DC A 15 -3.226 12.275 10.345 1.00 0.00 P ATOM 456 OP1 DC A 15 -2.087 13.219 10.396 1.00 0.00 O ATOM 457 OP2 DC A 15 -4.567 12.729 10.786 1.00 0.00 O ATOM 458 O5' DC A 15 -3.355 11.741 8.817 1.00 0.00 O ATOM 459 C5' DC A 15 -2.165 11.664 8.006 1.00 0.00 C ATOM 460 C4' DC A 15 -2.310 10.775 6.776 1.00 0.00 C ATOM 461 O4' DC A 15 -2.617 9.465 7.194 1.00 0.00 O ATOM 462 C3' DC A 15 -3.350 11.143 5.746 1.00 0.00 C ATOM 463 O3' DC A 15 -2.751 12.055 4.809 1.00 0.00 O ATOM 464 C2' DC A 15 -3.740 9.817 5.109 1.00 0.00 C ATOM 465 C1' DC A 15 -3.298 8.773 6.148 1.00 0.00 C ATOM 466 N1 DC A 15 -4.400 8.049 6.803 1.00 0.00 N ATOM 467 C2 DC A 15 -4.773 6.827 6.279 1.00 0.00 C ATOM 468 O2 DC A 15 -4.138 6.343 5.347 1.00 0.00 O ATOM 469 N3 DC A 15 -5.810 6.162 6.864 1.00 0.00 N ATOM 470 C4 DC A 15 -6.447 6.682 7.925 1.00 0.00 C ATOM 471 N4 DC A 15 -7.457 6.011 8.481 1.00 0.00 N ATOM 472 C5 DC A 15 -6.058 7.948 8.466 1.00 0.00 C ATOM 473 C6 DC A 15 -5.035 8.591 7.873 1.00 0.00 C ATOM 0 H5' DC A 15 -1.344 11.289 8.618 1.00 0.00 H new ATOM 0 H5'' DC A 15 -1.891 12.669 7.685 1.00 0.00 H new ATOM 0 H4' DC A 15 -1.348 10.897 6.277 1.00 0.00 H new ATOM 0 H3' DC A 15 -4.231 11.642 6.148 1.00 0.00 H new ATOM 0 H2' DC A 15 -4.812 9.764 4.918 1.00 0.00 H new ATOM 0 H2'' DC A 15 -3.238 9.669 4.153 1.00 0.00 H new ATOM 0 H1' DC A 15 -2.694 8.046 5.605 1.00 0.00 H new ATOM 0 H41 DC A 15 -7.945 6.400 9.287 1.00 0.00 H new ATOM 0 H42 DC A 15 -7.741 5.109 8.100 1.00 0.00 H new ATOM 0 H5 DC A 15 -6.567 8.372 9.319 1.00 0.00 H new ATOM 0 H6 DC A 15 -4.716 9.550 8.253 1.00 0.00 H new ATOM 485 P DG A 16 -3.620 12.766 3.659 1.00 0.00 P ATOM 486 OP1 DG A 16 -2.891 13.965 3.186 1.00 0.00 O ATOM 487 OP2 DG A 16 -5.016 12.880 4.134 1.00 0.00 O ATOM 488 O5' DG A 16 -3.562 11.640 2.503 1.00 0.00 O ATOM 489 C5' DG A 16 -2.273 11.279 1.968 1.00 0.00 C ATOM 490 C4' DG A 16 -2.330 10.124 0.965 1.00 0.00 C ATOM 491 O4' DG A 16 -2.746 8.935 1.651 1.00 0.00 O ATOM 492 C3' DG A 16 -3.292 10.350 -0.196 1.00 0.00 C ATOM 493 O3' DG A 16 -2.743 9.825 -1.415 1.00 0.00 O ATOM 494 C2' DG A 16 -4.508 9.535 0.188 1.00 0.00 C ATOM 495 C1' DG A 16 -3.915 8.409 1.027 1.00 0.00 C ATOM 496 N9 DG A 16 -4.804 7.897 2.094 1.00 0.00 N ATOM 497 C8 DG A 16 -5.665 8.580 2.911 1.00 0.00 C ATOM 498 N7 DG A 16 -6.326 7.848 3.753 1.00 0.00 N ATOM 499 C5 DG A 16 -5.873 6.562 3.482 1.00 0.00 C ATOM 500 C6 DG A 16 -6.226 5.332 4.097 1.00 0.00 C ATOM 501 O6 DG A 16 -7.030 5.140 5.006 1.00 0.00 O ATOM 502 N1 DG A 16 -5.530 4.266 3.545 1.00 0.00 N ATOM 503 C2 DG A 16 -4.611 4.368 2.516 1.00 0.00 C ATOM 504 N2 DG A 16 -4.050 3.231 2.105 1.00 0.00 N ATOM 505 N3 DG A 16 -4.275 5.526 1.935 1.00 0.00 N ATOM 506 C4 DG A 16 -4.941 6.579 2.469 1.00 0.00 C ATOM 0 H5' DG A 16 -1.612 11.004 2.790 1.00 0.00 H new ATOM 0 H5'' DG A 16 -1.833 12.150 1.482 1.00 0.00 H new ATOM 0 H4' DG A 16 -1.328 10.040 0.543 1.00 0.00 H new ATOM 0 H3' DG A 16 -3.503 11.406 -0.363 1.00 0.00 H new ATOM 0 H2' DG A 16 -5.227 10.126 0.756 1.00 0.00 H new ATOM 0 H2'' DG A 16 -5.031 9.153 -0.689 1.00 0.00 H new ATOM 0 H1' DG A 16 -3.728 7.570 0.357 1.00 0.00 H new ATOM 0 H8 DG A 16 -5.785 9.652 2.858 1.00 0.00 H new ATOM 0 H1 DG A 16 -5.709 3.337 3.927 1.00 0.00 H new ATOM 0 H21 DG A 16 -3.365 3.244 1.349 1.00 0.00 H new ATOM 0 H22 DG A 16 -4.306 2.348 2.546 1.00 0.00 H new ATOM 518 P DG A 17 -3.447 10.198 -2.820 1.00 0.00 P ATOM 519 OP1 DG A 17 -2.481 9.917 -3.904 1.00 0.00 O ATOM 520 OP2 DG A 17 -4.050 11.544 -2.697 1.00 0.00 O ATOM 521 O5' DG A 17 -4.639 9.115 -2.912 1.00 0.00 O ATOM 522 C5' DG A 17 -5.920 9.486 -3.426 1.00 0.00 C ATOM 523 C4' DG A 17 -6.859 8.289 -3.547 1.00 0.00 C ATOM 524 O4' DG A 17 -6.364 7.348 -4.487 1.00 0.00 O ATOM 525 C3' DG A 17 -7.082 7.510 -2.257 1.00 0.00 C ATOM 526 O3' DG A 17 -8.155 8.075 -1.474 1.00 0.00 O ATOM 527 C2' DG A 17 -7.457 6.118 -2.755 1.00 0.00 C ATOM 528 C1' DG A 17 -7.036 6.118 -4.225 1.00 0.00 C ATOM 529 N9 DG A 17 -6.142 5.009 -4.598 1.00 0.00 N ATOM 530 C8 DG A 17 -6.473 3.714 -4.858 1.00 0.00 C ATOM 531 N7 DG A 17 -5.478 2.937 -5.151 1.00 0.00 N ATOM 532 C5 DG A 17 -4.379 3.786 -5.085 1.00 0.00 C ATOM 533 C6 DG A 17 -3.006 3.505 -5.312 1.00 0.00 C ATOM 534 O6 DG A 17 -2.487 2.429 -5.613 1.00 0.00 O ATOM 535 N1 DG A 17 -2.220 4.636 -5.146 1.00 0.00 N ATOM 536 C2 DG A 17 -2.695 5.887 -4.801 1.00 0.00 C ATOM 537 N2 DG A 17 -1.784 6.856 -4.685 1.00 0.00 N ATOM 538 N3 DG A 17 -3.991 6.156 -4.587 1.00 0.00 N ATOM 539 C4 DG A 17 -4.773 5.061 -4.745 1.00 0.00 C ATOM 0 H5' DG A 17 -5.797 9.950 -4.405 1.00 0.00 H new ATOM 0 H5'' DG A 17 -6.369 10.234 -2.773 1.00 0.00 H new ATOM 0 H4' DG A 17 -7.804 8.740 -3.852 1.00 0.00 H new ATOM 0 H3' DG A 17 -6.209 7.520 -1.604 1.00 0.00 H new ATOM 0 H2' DG A 17 -6.939 5.341 -2.193 1.00 0.00 H new ATOM 0 H2'' DG A 17 -8.525 5.931 -2.647 1.00 0.00 H new ATOM 0 H1' DG A 17 -7.943 5.994 -4.817 1.00 0.00 H new ATOM 0 H8 DG A 17 -7.493 3.359 -4.823 1.00 0.00 H new ATOM 0 H1 DG A 17 -1.215 4.537 -5.290 1.00 0.00 H new ATOM 0 H21 DG A 17 -2.074 7.801 -4.433 1.00 0.00 H new ATOM 0 H22 DG A 17 -0.798 6.651 -4.849 1.00 0.00 H new ATOM 551 P DG A 18 -8.098 7.964 0.141 1.00 0.00 P ATOM 552 OP1 DG A 18 -9.234 8.728 0.704 1.00 0.00 O ATOM 553 OP2 DG A 18 -6.724 8.261 0.572 1.00 0.00 O ATOM 554 O5' DG A 18 -8.367 6.398 0.391 1.00 0.00 O ATOM 555 C5' DG A 18 -9.628 5.812 0.066 1.00 0.00 C ATOM 556 C4' DG A 18 -9.562 4.287 0.121 1.00 0.00 C ATOM 557 O4' DG A 18 -8.590 3.838 -0.808 1.00 0.00 O ATOM 558 C3' DG A 18 -9.172 3.663 1.453 1.00 0.00 C ATOM 559 O3' DG A 18 -10.341 3.497 2.278 1.00 0.00 O ATOM 560 C2' DG A 18 -8.583 2.317 1.044 1.00 0.00 C ATOM 561 C1' DG A 18 -8.093 2.562 -0.389 1.00 0.00 C ATOM 562 N9 DG A 18 -6.625 2.594 -0.528 1.00 0.00 N ATOM 563 C8 DG A 18 -5.762 3.648 -0.410 1.00 0.00 C ATOM 564 N7 DG A 18 -4.504 3.355 -0.582 1.00 0.00 N ATOM 565 C5 DG A 18 -4.531 1.986 -0.839 1.00 0.00 C ATOM 566 C6 DG A 18 -3.464 1.086 -1.119 1.00 0.00 C ATOM 567 O6 DG A 18 -2.261 1.330 -1.189 1.00 0.00 O ATOM 568 N1 DG A 18 -3.929 -0.208 -1.323 1.00 0.00 N ATOM 569 C2 DG A 18 -5.258 -0.588 -1.263 1.00 0.00 C ATOM 570 N2 DG A 18 -5.523 -1.872 -1.478 1.00 0.00 N ATOM 571 N3 DG A 18 -6.257 0.254 -1.003 1.00 0.00 N ATOM 572 C4 DG A 18 -5.826 1.515 -0.803 1.00 0.00 C ATOM 0 H5' DG A 18 -9.933 6.129 -0.931 1.00 0.00 H new ATOM 0 H5'' DG A 18 -10.388 6.171 0.760 1.00 0.00 H new ATOM 0 H4' DG A 18 -10.586 3.978 -0.089 1.00 0.00 H new ATOM 0 H3' DG A 18 -8.475 4.264 2.037 1.00 0.00 H new ATOM 0 H2' DG A 18 -7.767 2.019 1.702 1.00 0.00 H new ATOM 0 H2'' DG A 18 -9.329 1.524 1.083 1.00 0.00 H new ATOM 0 H1' DG A 18 -8.456 1.731 -0.993 1.00 0.00 H new ATOM 0 H8 DG A 18 -6.099 4.650 -0.190 1.00 0.00 H new ATOM 0 H1 DG A 18 -3.240 -0.930 -1.532 1.00 0.00 H new ATOM 0 H21 DG A 18 -6.486 -2.206 -1.446 1.00 0.00 H new ATOM 0 H22 DG A 18 -4.763 -2.523 -1.675 1.00 0.00 H new ATOM 584 P DG A 19 -10.201 3.314 3.875 1.00 0.00 P ATOM 585 OP1 DG A 19 -11.545 3.448 4.481 1.00 0.00 O ATOM 586 OP2 DG A 19 -9.091 4.171 4.343 1.00 0.00 O ATOM 587 O5' DG A 19 -9.736 1.772 3.993 1.00 0.00 O ATOM 588 C5' DG A 19 -10.619 0.730 3.547 1.00 0.00 C ATOM 589 C4' DG A 19 -9.960 -0.651 3.581 1.00 0.00 C ATOM 590 O4' DG A 19 -8.794 -0.638 2.772 1.00 0.00 O ATOM 591 C3' DG A 19 -9.491 -1.124 4.940 1.00 0.00 C ATOM 592 O3' DG A 19 -10.562 -1.763 5.656 1.00 0.00 O ATOM 593 C2' DG A 19 -8.426 -2.160 4.570 1.00 0.00 C ATOM 594 C1' DG A 19 -7.936 -1.704 3.193 1.00 0.00 C ATOM 595 N9 DG A 19 -6.552 -1.202 3.201 1.00 0.00 N ATOM 596 C8 DG A 19 -6.094 0.053 3.477 1.00 0.00 C ATOM 597 N7 DG A 19 -4.805 0.189 3.447 1.00 0.00 N ATOM 598 C5 DG A 19 -4.355 -1.086 3.119 1.00 0.00 C ATOM 599 C6 DG A 19 -3.032 -1.560 2.930 1.00 0.00 C ATOM 600 O6 DG A 19 -1.978 -0.933 3.028 1.00 0.00 O ATOM 601 N1 DG A 19 -3.016 -2.908 2.596 1.00 0.00 N ATOM 602 C2 DG A 19 -4.132 -3.707 2.467 1.00 0.00 C ATOM 603 N2 DG A 19 -3.912 -4.985 2.142 1.00 0.00 N ATOM 604 N3 DG A 19 -5.382 -3.265 2.649 1.00 0.00 N ATOM 605 C4 DG A 19 -5.418 -1.949 2.970 1.00 0.00 C ATOM 0 H5' DG A 19 -10.948 0.947 2.531 1.00 0.00 H new ATOM 0 H5'' DG A 19 -11.510 0.720 4.175 1.00 0.00 H new ATOM 0 H4' DG A 19 -10.747 -1.323 3.238 1.00 0.00 H new ATOM 0 H3' DG A 19 -9.133 -0.318 5.580 1.00 0.00 H new ATOM 0 H2' DG A 19 -7.615 -2.177 5.298 1.00 0.00 H new ATOM 0 H2'' DG A 19 -8.843 -3.167 4.533 1.00 0.00 H new ATOM 0 H1' DG A 19 -7.959 -2.565 2.525 1.00 0.00 H new ATOM 0 H8 DG A 19 -6.758 0.874 3.704 1.00 0.00 H new ATOM 0 H1 DG A 19 -2.107 -3.341 2.433 1.00 0.00 H new ATOM 0 H21 DG A 19 -4.698 -5.626 2.032 1.00 0.00 H new ATOM 0 H22 DG A 19 -2.958 -5.319 2.004 1.00 0.00 H new ATOM 617 P DT A 20 -10.618 -1.694 7.272 1.00 0.00 P ATOM 618 OP1 DT A 20 -11.845 -2.391 7.719 1.00 0.00 O ATOM 619 OP2 DT A 20 -10.376 -0.295 7.688 1.00 0.00 O ATOM 620 O5' DT A 20 -9.349 -2.588 7.712 1.00 0.00 O ATOM 621 C5' DT A 20 -9.283 -3.981 7.395 1.00 0.00 C ATOM 622 C4' DT A 20 -7.927 -4.585 7.764 1.00 0.00 C ATOM 623 O4' DT A 20 -6.919 -3.938 6.985 1.00 0.00 O ATOM 624 C3' DT A 20 -7.537 -4.434 9.236 1.00 0.00 C ATOM 625 O3' DT A 20 -6.894 -5.619 9.717 1.00 0.00 O ATOM 626 C2' DT A 20 -6.571 -3.252 9.267 1.00 0.00 C ATOM 627 C1' DT A 20 -6.110 -3.099 7.815 1.00 0.00 C ATOM 628 N1 DT A 20 -6.159 -1.719 7.261 1.00 0.00 N ATOM 629 C2 DT A 20 -5.100 -1.335 6.460 1.00 0.00 C ATOM 630 O2 DT A 20 -4.183 -2.100 6.182 1.00 0.00 O ATOM 631 N3 DT A 20 -5.135 -0.040 5.977 1.00 0.00 N ATOM 632 C4 DT A 20 -6.123 0.895 6.219 1.00 0.00 C ATOM 633 O4 DT A 20 -6.057 2.020 5.725 1.00 0.00 O ATOM 634 C5 DT A 20 -7.190 0.408 7.061 1.00 0.00 C ATOM 635 C7 DT A 20 -8.346 1.339 7.418 1.00 0.00 C ATOM 636 C6 DT A 20 -7.183 -0.853 7.543 1.00 0.00 C ATOM 0 H5' DT A 20 -9.465 -4.120 6.329 1.00 0.00 H new ATOM 0 H5'' DT A 20 -10.074 -4.512 7.925 1.00 0.00 H new ATOM 0 H4' DT A 20 -8.010 -5.654 7.566 1.00 0.00 H new ATOM 0 H3' DT A 20 -8.407 -4.274 9.873 1.00 0.00 H new ATOM 0 H2' DT A 20 -7.062 -2.347 9.626 1.00 0.00 H new ATOM 0 H2'' DT A 20 -5.730 -3.444 9.933 1.00 0.00 H new ATOM 0 HO3' DT A 20 -6.652 -5.500 10.659 1.00 0.00 H new ATOM 0 H1' DT A 20 -5.057 -3.381 7.820 1.00 0.00 H new ATOM 0 H3 DT A 20 -4.357 0.253 5.386 1.00 0.00 H new ATOM 0 H71 DT A 20 -7.990 2.369 7.441 1.00 0.00 H new ATOM 0 H72 DT A 20 -9.134 1.244 6.671 1.00 0.00 H new ATOM 0 H73 DT A 20 -8.741 1.070 8.398 1.00 0.00 H new ATOM 0 H6 DT A 20 -8.001 -1.186 8.164 1.00 0.00 H new TER 650 DT A 20 HETATM 651 O4 LOC A 101 6.593 4.887 7.410 1.00 0.00 O HETATM 652 C12 LOC A 101 5.422 4.591 7.181 1.00 0.00 C HETATM 653 C13 LOC A 101 4.280 5.507 7.621 1.00 0.00 C HETATM 654 N1 LOC A 101 5.047 3.492 6.513 1.00 0.00 N HETATM 655 C11 LOC A 101 3.820 2.748 6.840 1.00 0.00 C HETATM 656 C14 LOC A 101 4.061 1.389 6.677 1.00 0.00 C HETATM 657 C15 LOC A 101 5.430 1.311 6.898 1.00 0.00 C HETATM 658 C10 LOC A 101 2.724 3.183 5.882 1.00 0.00 C HETATM 659 C9 LOC A 101 1.353 2.891 6.468 1.00 0.00 C HETATM 660 C8 LOC A 101 0.992 1.577 6.201 1.00 0.00 C HETATM 661 C7 LOC A 101 -0.392 1.439 6.229 1.00 0.00 C HETATM 662 C5 LOC A 101 -0.959 0.171 6.240 1.00 0.00 C HETATM 663 C3 LOC A 101 -0.149 -0.955 6.250 1.00 0.00 C HETATM 664 C1 LOC A 101 1.232 -0.808 6.185 1.00 0.00 C HETATM 665 O1 LOC A 101 1.984 -1.856 6.617 1.00 0.00 O HETATM 666 C2 LOC A 101 1.880 -1.971 8.038 1.00 0.00 C HETATM 667 O2 LOC A 101 -0.677 -2.120 5.788 1.00 0.00 O HETATM 668 C4 LOC A 101 -1.620 -2.640 6.728 1.00 0.00 C HETATM 669 O3 LOC A 101 -2.305 -0.026 6.281 1.00 0.00 O HETATM 670 C6 LOC A 101 -2.841 0.639 7.427 1.00 0.00 C HETATM 671 C22 LOC A 101 1.813 0.455 6.148 1.00 0.00 C HETATM 672 C21 LOC A 101 3.204 0.427 6.155 1.00 0.00 C HETATM 673 C20 LOC A 101 3.541 -0.641 5.329 1.00 0.00 C HETATM 674 C19 LOC A 101 4.780 -1.262 5.247 1.00 0.00 C HETATM 675 C17 LOC A 101 6.011 -0.793 5.694 1.00 0.00 C HETATM 676 C16 LOC A 101 6.316 0.355 6.416 1.00 0.00 C HETATM 677 O5 LOC A 101 7.500 0.556 6.679 1.00 0.00 O HETATM 678 O6 LOC A 101 7.099 -1.574 5.463 1.00 0.00 O HETATM 679 C18 LOC A 101 7.346 -2.374 6.623 1.00 0.00 C HETATM 0 H18B LOC A 101 7.532 -1.726 7.479 1.00 0.00 H new HETATM 0 H18A LOC A 101 6.477 -3.001 6.824 1.00 0.00 H new HETATM 0 H13B LOC A 101 4.305 5.625 8.704 1.00 0.00 H new HETATM 0 H13A LOC A 101 4.393 6.482 7.147 1.00 0.00 H new HETATM 0 H10A LOC A 101 2.817 4.249 5.675 1.00 0.00 H new HETATM 0 HN1 LOC A 101 5.634 3.158 5.749 1.00 0.00 H new HETATM 0 H9A LOC A 101 1.365 3.062 7.544 1.00 0.00 H new HETATM 0 H9 LOC A 101 0.615 3.573 6.045 1.00 0.00 H new HETATM 0 H7 LOC A 101 -1.029 2.323 6.242 1.00 0.00 H new HETATM 0 H6B LOC A 101 -2.384 0.234 8.330 1.00 0.00 H new HETATM 0 H6A LOC A 101 -2.629 1.706 7.361 1.00 0.00 H new HETATM 0 H6 LOC A 101 -3.919 0.485 7.466 1.00 0.00 H new HETATM 0 H4B LOC A 101 -1.121 -2.827 7.679 1.00 0.00 H new HETATM 0 H4A LOC A 101 -2.423 -1.918 6.875 1.00 0.00 H new HETATM 0 H4 LOC A 101 -2.036 -3.573 6.348 1.00 0.00 H new HETATM 0 H2B LOC A 101 2.238 -1.053 8.504 1.00 0.00 H new HETATM 0 H2A LOC A 101 0.839 -2.136 8.314 1.00 0.00 H new HETATM 0 H20 LOC A 101 2.754 -1.029 4.682 1.00 0.00 H new HETATM 0 H2 LOC A 101 2.484 -2.812 8.380 1.00 0.00 H new HETATM 0 H19 LOC A 101 4.789 -2.243 4.771 1.00 0.00 H new HETATM 0 H18 LOC A 101 8.217 -3.006 6.450 1.00 0.00 H new HETATM 0 H15 LOC A 101 5.861 2.093 7.524 1.00 0.00 H new HETATM 0 H13 LOC A 101 3.327 5.068 7.326 1.00 0.00 H new HETATM 0 H11 LOC A 101 3.517 2.945 7.868 1.00 0.00 H new HETATM 0 H10 LOC A 101 2.837 2.662 4.931 1.00 0.00 H new