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= -3.83! (180deg=-7.88!) USER MOD Single : A 20 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -9.053 -3.687 -8.210 1.00 0.00 O ATOM 2 C5' DG A 1 -8.622 -3.643 -6.850 1.00 0.00 C ATOM 3 C4' DG A 1 -7.633 -4.765 -6.544 1.00 0.00 C ATOM 4 O4' DG A 1 -6.430 -4.597 -7.300 1.00 0.00 O ATOM 5 C3' DG A 1 -7.236 -4.855 -5.074 1.00 0.00 C ATOM 6 O3' DG A 1 -8.057 -5.846 -4.417 1.00 0.00 O ATOM 7 C2' DG A 1 -5.766 -5.252 -5.081 1.00 0.00 C ATOM 8 C1' DG A 1 -5.335 -5.115 -6.539 1.00 0.00 C ATOM 9 N9 DG A 1 -4.166 -4.236 -6.756 1.00 0.00 N ATOM 10 C8 DG A 1 -2.890 -4.585 -7.105 1.00 0.00 C ATOM 11 N7 DG A 1 -2.015 -3.623 -7.049 1.00 0.00 N ATOM 12 C5 DG A 1 -2.773 -2.530 -6.629 1.00 0.00 C ATOM 13 C6 DG A 1 -2.377 -1.184 -6.388 1.00 0.00 C ATOM 14 O6 DG A 1 -1.257 -0.688 -6.493 1.00 0.00 O ATOM 15 N1 DG A 1 -3.450 -0.400 -5.985 1.00 0.00 N ATOM 16 C2 DG A 1 -4.746 -0.853 -5.832 1.00 0.00 C ATOM 17 N2 DG A 1 -5.647 0.047 -5.438 1.00 0.00 N ATOM 18 N3 DG A 1 -5.121 -2.116 -6.055 1.00 0.00 N ATOM 19 C4 DG A 1 -4.088 -2.896 -6.448 1.00 0.00 C ATOM 0 H5' DG A 1 -9.485 -3.727 -6.190 1.00 0.00 H new ATOM 0 H5'' DG A 1 -8.156 -2.679 -6.645 1.00 0.00 H new ATOM 0 H4' DG A 1 -8.157 -5.682 -6.815 1.00 0.00 H new ATOM 0 H3' DG A 1 -7.380 -3.920 -4.533 1.00 0.00 H new ATOM 0 H2' DG A 1 -5.178 -4.604 -4.431 1.00 0.00 H new ATOM 0 H2'' DG A 1 -5.629 -6.272 -4.722 1.00 0.00 H new ATOM 0 HO5' DG A 1 -9.686 -2.958 -8.376 1.00 0.00 H new ATOM 0 H1' DG A 1 -5.039 -6.114 -6.858 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.627 -5.588 -7.406 1.00 0.00 H new ATOM 0 H1 DG A 1 -3.268 0.584 -5.787 1.00 0.00 H new ATOM 0 H21 DG A 1 -6.620 -0.229 -5.308 1.00 0.00 H new ATOM 0 H22 DG A 1 -5.363 1.012 -5.267 1.00 0.00 H new ATOM 32 P DG A 2 -8.089 -5.965 -2.805 1.00 0.00 P ATOM 33 OP1 DG A 2 -9.172 -6.901 -2.427 1.00 0.00 O ATOM 34 OP2 DG A 2 -8.052 -4.601 -2.233 1.00 0.00 O ATOM 35 O5' DG A 2 -6.677 -6.682 -2.512 1.00 0.00 O ATOM 36 C5' DG A 2 -6.451 -8.010 -3.009 1.00 0.00 C ATOM 37 C4' DG A 2 -4.993 -8.436 -2.868 1.00 0.00 C ATOM 38 O4' DG A 2 -4.164 -7.558 -3.618 1.00 0.00 O ATOM 39 C3' DG A 2 -4.416 -8.491 -1.463 1.00 0.00 C ATOM 40 O3' DG A 2 -4.664 -9.811 -0.931 1.00 0.00 O ATOM 41 C2' DG A 2 -2.937 -8.202 -1.675 1.00 0.00 C ATOM 42 C1' DG A 2 -2.918 -7.357 -2.945 1.00 0.00 C ATOM 43 N9 DG A 2 -2.814 -5.921 -2.670 1.00 0.00 N ATOM 44 C8 DG A 2 -3.804 -5.057 -2.319 1.00 0.00 C ATOM 45 N7 DG A 2 -3.419 -3.857 -2.056 1.00 0.00 N ATOM 46 C5 DG A 2 -2.053 -3.911 -2.236 1.00 0.00 C ATOM 47 C6 DG A 2 -1.096 -2.890 -2.091 1.00 0.00 C ATOM 48 O6 DG A 2 -1.276 -1.719 -1.750 1.00 0.00 O ATOM 49 N1 DG A 2 0.177 -3.352 -2.376 1.00 0.00 N ATOM 50 C2 DG A 2 0.494 -4.640 -2.753 1.00 0.00 C ATOM 51 N2 DG A 2 1.785 -4.884 -2.990 1.00 0.00 N ATOM 52 N3 DG A 2 -0.412 -5.613 -2.887 1.00 0.00 N ATOM 53 C4 DG A 2 -1.663 -5.175 -2.614 1.00 0.00 C ATOM 0 H5' DG A 2 -6.742 -8.058 -4.058 1.00 0.00 H new ATOM 0 H5'' DG A 2 -7.087 -8.712 -2.469 1.00 0.00 H new ATOM 0 H4' DG A 2 -5.001 -9.464 -3.231 1.00 0.00 H new ATOM 0 H3' DG A 2 -4.847 -7.787 -0.751 1.00 0.00 H new ATOM 0 H2' DG A 2 -2.508 -7.665 -0.829 1.00 0.00 H new ATOM 0 H2'' DG A 2 -2.362 -9.120 -1.795 1.00 0.00 H new ATOM 0 H1' DG A 2 -2.051 -7.661 -3.531 1.00 0.00 H new ATOM 0 H8 DG A 2 -4.840 -5.357 -2.265 1.00 0.00 H new ATOM 0 H1 DG A 2 0.944 -2.684 -2.301 1.00 0.00 H new ATOM 0 H21 DG A 2 2.084 -5.817 -3.273 1.00 0.00 H new ATOM 0 H22 DG A 2 2.472 -4.137 -2.889 1.00 0.00 H new ATOM 65 P DG A 3 -4.481 -10.212 0.630 1.00 0.00 P ATOM 66 OP1 DG A 3 -5.092 -11.543 0.844 1.00 0.00 O ATOM 67 OP2 DG A 3 -4.884 -9.058 1.464 1.00 0.00 O ATOM 68 O5' DG A 3 -2.877 -10.365 0.686 1.00 0.00 O ATOM 69 C5' DG A 3 -2.291 -11.302 -0.220 1.00 0.00 C ATOM 70 C4' DG A 3 -0.760 -11.231 -0.298 1.00 0.00 C ATOM 71 O4' DG A 3 -0.399 -9.862 -0.552 1.00 0.00 O ATOM 72 C3' DG A 3 0.068 -11.647 0.922 1.00 0.00 C ATOM 73 O3' DG A 3 1.234 -12.248 0.363 1.00 0.00 O ATOM 74 C2' DG A 3 0.459 -10.360 1.616 1.00 0.00 C ATOM 75 C1' DG A 3 0.483 -9.365 0.478 1.00 0.00 C ATOM 76 N9 DG A 3 0.027 -8.020 0.860 1.00 0.00 N ATOM 77 C8 DG A 3 -1.222 -7.607 1.219 1.00 0.00 C ATOM 78 N7 DG A 3 -1.319 -6.354 1.546 1.00 0.00 N ATOM 79 C5 DG A 3 -0.014 -5.889 1.401 1.00 0.00 C ATOM 80 C6 DG A 3 0.511 -4.590 1.618 1.00 0.00 C ATOM 81 O6 DG A 3 -0.080 -3.581 1.987 1.00 0.00 O ATOM 82 N1 DG A 3 1.867 -4.537 1.361 1.00 0.00 N ATOM 83 C2 DG A 3 2.645 -5.592 0.948 1.00 0.00 C ATOM 84 N2 DG A 3 3.947 -5.327 0.766 1.00 0.00 N ATOM 85 N3 DG A 3 2.159 -6.827 0.736 1.00 0.00 N ATOM 86 C4 DG A 3 0.822 -6.900 0.985 1.00 0.00 C ATOM 0 H5' DG A 3 -2.702 -11.133 -1.215 1.00 0.00 H new ATOM 0 H5'' DG A 3 -2.582 -12.309 0.079 1.00 0.00 H new ATOM 0 H4' DG A 3 -0.522 -11.962 -1.071 1.00 0.00 H new ATOM 0 H3' DG A 3 -0.442 -12.314 1.617 1.00 0.00 H new ATOM 0 H2' DG A 3 -0.261 -10.079 2.385 1.00 0.00 H new ATOM 0 H2'' DG A 3 1.430 -10.441 2.104 1.00 0.00 H new ATOM 0 H1' DG A 3 1.517 -9.268 0.148 1.00 0.00 H new ATOM 0 H8 DG A 3 -2.071 -8.275 1.231 1.00 0.00 H new ATOM 0 H1 DG A 3 2.331 -3.638 1.489 1.00 0.00 H new ATOM 0 H21 DG A 3 4.580 -6.066 0.460 1.00 0.00 H new ATOM 0 H22 DG A 3 4.304 -4.386 0.934 1.00 0.00 H new ATOM 98 P DG A 4 1.457 -13.832 0.236 1.00 0.00 P ATOM 99 OP1 DG A 4 0.195 -14.453 -0.221 1.00 0.00 O ATOM 100 OP2 DG A 4 2.129 -14.317 1.464 1.00 0.00 O ATOM 101 O5' DG A 4 2.514 -13.855 -0.980 1.00 0.00 O ATOM 102 C5' DG A 4 2.031 -13.410 -2.257 1.00 0.00 C ATOM 103 C4' DG A 4 3.102 -13.232 -3.329 1.00 0.00 C ATOM 104 O4' DG A 4 3.921 -12.121 -2.997 1.00 0.00 O ATOM 105 C3' DG A 4 4.011 -14.426 -3.554 1.00 0.00 C ATOM 106 O3' DG A 4 4.284 -14.527 -4.960 1.00 0.00 O ATOM 107 C2' DG A 4 5.295 -14.075 -2.794 1.00 0.00 C ATOM 108 C1' DG A 4 5.158 -12.578 -2.463 1.00 0.00 C ATOM 109 N9 DG A 4 5.147 -12.237 -1.018 1.00 0.00 N ATOM 110 C8 DG A 4 4.750 -12.984 0.060 1.00 0.00 C ATOM 111 N7 DG A 4 4.853 -12.394 1.210 1.00 0.00 N ATOM 112 C5 DG A 4 5.355 -11.140 0.884 1.00 0.00 C ATOM 113 C6 DG A 4 5.668 -10.046 1.730 1.00 0.00 C ATOM 114 O6 DG A 4 5.561 -9.972 2.951 1.00 0.00 O ATOM 115 N1 DG A 4 6.144 -8.961 1.004 1.00 0.00 N ATOM 116 C2 DG A 4 6.300 -8.932 -0.367 1.00 0.00 C ATOM 117 N2 DG A 4 6.766 -7.794 -0.883 1.00 0.00 N ATOM 118 N3 DG A 4 6.009 -9.964 -1.167 1.00 0.00 N ATOM 119 C4 DG A 4 5.541 -11.031 -0.477 1.00 0.00 C ATOM 0 H5' DG A 4 1.514 -12.460 -2.121 1.00 0.00 H new ATOM 0 H5'' DG A 4 1.293 -14.126 -2.618 1.00 0.00 H new ATOM 0 H4' DG A 4 2.545 -13.090 -4.255 1.00 0.00 H new ATOM 0 H3' DG A 4 3.583 -15.371 -3.219 1.00 0.00 H new ATOM 0 H2' DG A 4 5.395 -14.673 -1.888 1.00 0.00 H new ATOM 0 H2'' DG A 4 6.179 -14.267 -3.402 1.00 0.00 H new ATOM 0 H1' DG A 4 6.041 -12.105 -2.892 1.00 0.00 H new ATOM 0 H8 DG A 4 4.378 -13.993 -0.041 1.00 0.00 H new ATOM 0 H1 DG A 4 6.398 -8.121 1.524 1.00 0.00 H new ATOM 0 H21 DG A 4 6.904 -7.709 -1.890 1.00 0.00 H new ATOM 0 H22 DG A 4 6.985 -7.008 -0.270 1.00 0.00 H new ATOM 131 P DC A 5 3.382 -15.498 -5.890 1.00 0.00 P ATOM 132 OP1 DC A 5 3.054 -16.711 -5.108 1.00 0.00 O ATOM 133 OP2 DC A 5 4.046 -15.629 -7.205 1.00 0.00 O ATOM 134 O5' DC A 5 2.022 -14.655 -6.100 1.00 0.00 O ATOM 135 C5' DC A 5 1.944 -13.524 -6.978 1.00 0.00 C ATOM 136 C4' DC A 5 0.653 -12.758 -6.743 1.00 0.00 C ATOM 137 O4' DC A 5 0.656 -12.226 -5.424 1.00 0.00 O ATOM 138 C3' DC A 5 0.442 -11.595 -7.697 1.00 0.00 C ATOM 139 O3' DC A 5 -0.420 -11.956 -8.776 1.00 0.00 O ATOM 140 C2' DC A 5 -0.254 -10.531 -6.857 1.00 0.00 C ATOM 141 C1' DC A 5 -0.064 -10.994 -5.417 1.00 0.00 C ATOM 142 N1 DC A 5 0.682 -10.041 -4.570 1.00 0.00 N ATOM 143 C2 DC A 5 1.921 -9.607 -5.015 1.00 0.00 C ATOM 144 O2 DC A 5 2.383 -10.041 -6.068 1.00 0.00 O ATOM 145 N3 DC A 5 2.604 -8.706 -4.248 1.00 0.00 N ATOM 146 C4 DC A 5 2.085 -8.251 -3.096 1.00 0.00 C ATOM 147 N4 DC A 5 2.776 -7.379 -2.353 1.00 0.00 N ATOM 148 C5 DC A 5 0.807 -8.694 -2.647 1.00 0.00 C ATOM 149 C6 DC A 5 0.148 -9.588 -3.406 1.00 0.00 C ATOM 0 H5' DC A 5 1.993 -13.857 -8.015 1.00 0.00 H new ATOM 0 H5'' DC A 5 2.799 -12.868 -6.813 1.00 0.00 H new ATOM 0 H4' DC A 5 -0.151 -13.475 -6.906 1.00 0.00 H new ATOM 0 H3' DC A 5 1.387 -11.267 -8.131 1.00 0.00 H new ATOM 0 H2' DC A 5 0.187 -9.547 -7.019 1.00 0.00 H new ATOM 0 H2'' DC A 5 -1.311 -10.453 -7.112 1.00 0.00 H new ATOM 0 H1' DC A 5 -1.063 -11.091 -4.992 1.00 0.00 H new ATOM 0 H41 DC A 5 2.384 -7.032 -1.478 1.00 0.00 H new ATOM 0 H42 DC A 5 3.695 -7.061 -2.662 1.00 0.00 H new ATOM 0 H5 DC A 5 0.381 -8.324 -1.726 1.00 0.00 H new ATOM 0 H6 DC A 5 -0.818 -9.950 -3.086 1.00 0.00 H new ATOM 161 P DG A 6 0.101 -11.897 -10.292 1.00 0.00 P ATOM 162 OP1 DG A 6 -1.054 -12.100 -11.197 1.00 0.00 O ATOM 163 OP2 DG A 6 1.295 -12.763 -10.409 1.00 0.00 O ATOM 164 O5' DG A 6 0.570 -10.365 -10.399 1.00 0.00 O ATOM 165 C5' DG A 6 -0.321 -9.284 -10.127 1.00 0.00 C ATOM 166 C4' DG A 6 0.422 -7.953 -10.264 1.00 0.00 C ATOM 167 O4' DG A 6 0.227 -7.438 -11.588 1.00 0.00 O ATOM 168 C3' DG A 6 -0.005 -6.857 -9.296 1.00 0.00 C ATOM 169 O3' DG A 6 1.186 -6.234 -8.842 1.00 0.00 O ATOM 170 C2' DG A 6 -0.818 -5.864 -10.112 1.00 0.00 C ATOM 171 C1' DG A 6 -0.430 -6.154 -11.553 1.00 0.00 C ATOM 172 N9 DG A 6 -1.591 -6.234 -12.457 1.00 0.00 N ATOM 173 C8 DG A 6 -2.436 -7.280 -12.634 1.00 0.00 C ATOM 174 N7 DG A 6 -3.416 -7.075 -13.459 1.00 0.00 N ATOM 175 C5 DG A 6 -3.214 -5.762 -13.870 1.00 0.00 C ATOM 176 C6 DG A 6 -3.969 -4.970 -14.777 1.00 0.00 C ATOM 177 O6 DG A 6 -4.980 -5.284 -15.404 1.00 0.00 O ATOM 178 N1 DG A 6 -3.430 -3.701 -14.917 1.00 0.00 N ATOM 179 C2 DG A 6 -2.303 -3.242 -14.269 1.00 0.00 C ATOM 180 N2 DG A 6 -1.944 -1.985 -14.539 1.00 0.00 N ATOM 181 N3 DG A 6 -1.584 -3.983 -13.411 1.00 0.00 N ATOM 182 C4 DG A 6 -2.097 -5.230 -13.260 1.00 0.00 C ATOM 0 H5' DG A 6 -0.729 -9.381 -9.121 1.00 0.00 H new ATOM 0 H5'' DG A 6 -1.164 -9.313 -10.817 1.00 0.00 H new ATOM 0 H4' DG A 6 1.460 -8.194 -10.036 1.00 0.00 H new ATOM 0 H3' DG A 6 -0.586 -7.227 -8.451 1.00 0.00 H new ATOM 0 H2' DG A 6 -1.888 -6.000 -9.953 1.00 0.00 H new ATOM 0 H2'' DG A 6 -0.583 -4.836 -9.836 1.00 0.00 H new ATOM 0 H1' DG A 6 0.208 -5.337 -11.890 1.00 0.00 H new ATOM 0 H8 DG A 6 -2.302 -8.221 -12.122 1.00 0.00 H new ATOM 0 H1 DG A 6 -3.904 -3.056 -15.549 1.00 0.00 H new ATOM 0 H21 DG A 6 -1.119 -1.583 -14.093 1.00 0.00 H new ATOM 0 H22 DG A 6 -2.494 -1.426 -15.191 1.00 0.00 H new ATOM 194 P DG A 7 1.798 -6.649 -7.418 1.00 0.00 P ATOM 195 OP1 DG A 7 1.952 -8.118 -7.395 1.00 0.00 O ATOM 196 OP2 DG A 7 1.024 -5.968 -6.358 1.00 0.00 O ATOM 197 O5' DG A 7 3.260 -6.004 -7.469 1.00 0.00 O ATOM 198 C5' DG A 7 4.236 -6.531 -8.374 1.00 0.00 C ATOM 199 C4' DG A 7 5.496 -5.705 -8.335 1.00 0.00 C ATOM 200 O4' DG A 7 5.269 -4.397 -8.828 1.00 0.00 O ATOM 201 C3' DG A 7 6.014 -5.571 -6.928 1.00 0.00 C ATOM 202 O3' DG A 7 6.844 -6.688 -6.588 1.00 0.00 O ATOM 203 C2' DG A 7 6.805 -4.271 -6.986 1.00 0.00 C ATOM 204 C1' DG A 7 6.141 -3.501 -8.138 1.00 0.00 C ATOM 205 N9 DG A 7 5.327 -2.351 -7.710 1.00 0.00 N ATOM 206 C8 DG A 7 5.731 -1.094 -7.372 1.00 0.00 C ATOM 207 N7 DG A 7 4.776 -0.276 -7.049 1.00 0.00 N ATOM 208 C5 DG A 7 3.630 -1.053 -7.174 1.00 0.00 C ATOM 209 C6 DG A 7 2.271 -0.708 -6.947 1.00 0.00 C ATOM 210 O6 DG A 7 1.811 0.377 -6.582 1.00 0.00 O ATOM 211 N1 DG A 7 1.426 -1.787 -7.197 1.00 0.00 N ATOM 212 C2 DG A 7 1.835 -3.033 -7.609 1.00 0.00 C ATOM 213 N2 DG A 7 0.864 -3.920 -7.824 1.00 0.00 N ATOM 214 N3 DG A 7 3.116 -3.365 -7.812 1.00 0.00 N ATOM 215 C4 DG A 7 3.956 -2.329 -7.578 1.00 0.00 C ATOM 0 H5' DG A 7 3.833 -6.541 -9.387 1.00 0.00 H new ATOM 0 H5'' DG A 7 4.464 -7.564 -8.111 1.00 0.00 H new ATOM 0 H4' DG A 7 6.223 -6.223 -8.960 1.00 0.00 H new ATOM 0 H3' DG A 7 5.233 -5.555 -6.167 1.00 0.00 H new ATOM 0 H2' DG A 7 6.743 -3.721 -6.047 1.00 0.00 H new ATOM 0 H2'' DG A 7 7.862 -4.452 -7.181 1.00 0.00 H new ATOM 0 H1' DG A 7 6.952 -3.116 -8.756 1.00 0.00 H new ATOM 0 H8 DG A 7 6.770 -0.800 -7.373 1.00 0.00 H new ATOM 0 H1 DG A 7 0.425 -1.641 -7.064 1.00 0.00 H new ATOM 0 H21 DG A 7 1.095 -4.865 -8.131 1.00 0.00 H new ATOM 0 H22 DG A 7 -0.110 -3.654 -7.681 1.00 0.00 H new ATOM 227 P DG A 8 6.751 -7.286 -5.092 1.00 0.00 P ATOM 228 OP1 DG A 8 7.681 -8.434 -4.986 1.00 0.00 O ATOM 229 OP2 DG A 8 5.322 -7.450 -4.741 1.00 0.00 O ATOM 230 O5' DG A 8 7.347 -6.072 -4.246 1.00 0.00 O ATOM 231 C5' DG A 8 8.697 -5.677 -4.429 1.00 0.00 C ATOM 232 C4' DG A 8 8.968 -4.353 -3.744 1.00 0.00 C ATOM 233 O4' DG A 8 8.121 -3.356 -4.314 1.00 0.00 O ATOM 234 C3' DG A 8 8.708 -4.304 -2.253 1.00 0.00 C ATOM 235 O3' DG A 8 9.868 -4.767 -1.539 1.00 0.00 O ATOM 236 C2' DG A 8 8.455 -2.819 -2.025 1.00 0.00 C ATOM 237 C1' DG A 8 7.766 -2.389 -3.312 1.00 0.00 C ATOM 238 N9 DG A 8 6.294 -2.354 -3.201 1.00 0.00 N ATOM 239 C8 DG A 8 5.403 -3.380 -3.315 1.00 0.00 C ATOM 240 N7 DG A 8 4.163 -3.068 -3.094 1.00 0.00 N ATOM 241 C5 DG A 8 4.226 -1.709 -2.802 1.00 0.00 C ATOM 242 C6 DG A 8 3.183 -0.799 -2.482 1.00 0.00 C ATOM 243 O6 DG A 8 1.986 -1.007 -2.402 1.00 0.00 O ATOM 244 N1 DG A 8 3.659 0.470 -2.265 1.00 0.00 N ATOM 245 C2 DG A 8 4.977 0.845 -2.337 1.00 0.00 C ATOM 246 N2 DG A 8 5.228 2.123 -2.085 1.00 0.00 N ATOM 247 N3 DG A 8 5.975 0.000 -2.639 1.00 0.00 N ATOM 248 C4 DG A 8 5.526 -1.260 -2.860 1.00 0.00 C ATOM 0 H5' DG A 8 8.915 -5.592 -5.494 1.00 0.00 H new ATOM 0 H5'' DG A 8 9.362 -6.442 -4.028 1.00 0.00 H new ATOM 0 H4' DG A 8 10.035 -4.192 -3.894 1.00 0.00 H new ATOM 0 H3' DG A 8 7.886 -4.932 -1.910 1.00 0.00 H new ATOM 0 H2' DG A 8 7.825 -2.646 -1.152 1.00 0.00 H new ATOM 0 H2'' DG A 8 9.383 -2.272 -1.862 1.00 0.00 H new ATOM 0 H1' DG A 8 8.089 -1.377 -3.555 1.00 0.00 H new ATOM 0 H8 DG A 8 5.708 -4.384 -3.572 1.00 0.00 H new ATOM 0 H1 DG A 8 2.978 1.193 -2.031 1.00 0.00 H new ATOM 0 H21 DG A 8 6.186 2.471 -2.121 1.00 0.00 H new ATOM 0 H22 DG A 8 4.463 2.757 -1.856 1.00 0.00 H new ATOM 260 P DG A 9 9.798 -5.153 0.030 1.00 0.00 P ATOM 261 OP1 DG A 9 11.057 -5.826 0.419 1.00 0.00 O ATOM 262 OP2 DG A 9 8.488 -5.784 0.311 1.00 0.00 O ATOM 263 O5' DG A 9 9.798 -3.666 0.625 1.00 0.00 O ATOM 264 C5' DG A 9 10.829 -2.808 0.145 1.00 0.00 C ATOM 265 C4' DG A 9 10.444 -1.334 0.208 1.00 0.00 C ATOM 266 O4' DG A 9 9.018 -1.188 0.028 1.00 0.00 O ATOM 267 C3' DG A 9 10.748 -0.618 1.514 1.00 0.00 C ATOM 268 O3' DG A 9 10.804 0.801 1.248 1.00 0.00 O ATOM 269 C2' DG A 9 9.486 -0.898 2.315 1.00 0.00 C ATOM 270 C1' DG A 9 8.449 -0.657 1.236 1.00 0.00 C ATOM 271 N9 DG A 9 7.111 -1.269 1.444 1.00 0.00 N ATOM 272 C8 DG A 9 6.693 -2.558 1.232 1.00 0.00 C ATOM 273 N7 DG A 9 5.410 -2.761 1.384 1.00 0.00 N ATOM 274 C5 DG A 9 4.930 -1.493 1.738 1.00 0.00 C ATOM 275 C6 DG A 9 3.601 -1.065 2.037 1.00 0.00 C ATOM 276 O6 DG A 9 2.570 -1.727 2.049 1.00 0.00 O ATOM 277 N1 DG A 9 3.551 0.287 2.342 1.00 0.00 N ATOM 278 C2 DG A 9 4.638 1.134 2.364 1.00 0.00 C ATOM 279 N2 DG A 9 4.390 2.407 2.685 1.00 0.00 N ATOM 280 N3 DG A 9 5.888 0.740 2.086 1.00 0.00 N ATOM 281 C4 DG A 9 5.962 -0.580 1.781 1.00 0.00 C ATOM 0 H5' DG A 9 11.067 -3.074 -0.885 1.00 0.00 H new ATOM 0 H5'' DG A 9 11.733 -2.969 0.733 1.00 0.00 H new ATOM 0 H4' DG A 9 11.051 -0.886 -0.579 1.00 0.00 H new ATOM 0 H3' DG A 9 11.676 -0.924 1.998 1.00 0.00 H new ATOM 0 H2' DG A 9 9.455 -1.915 2.707 1.00 0.00 H new ATOM 0 H2'' DG A 9 9.371 -0.225 3.165 1.00 0.00 H new ATOM 0 H1' DG A 9 8.244 0.414 1.223 1.00 0.00 H new ATOM 0 H8 DG A 9 7.375 -3.349 0.959 1.00 0.00 H new ATOM 0 H1 DG A 9 2.639 0.685 2.567 1.00 0.00 H new ATOM 0 H21 DG A 9 5.153 3.083 2.718 1.00 0.00 H new ATOM 0 H22 DG A 9 3.437 2.703 2.897 1.00 0.00 H new ATOM 293 P DC A 10 11.679 1.451 0.042 1.00 0.00 P ATOM 294 OP1 DC A 10 12.281 0.345 -0.732 1.00 0.00 O ATOM 295 OP2 DC A 10 12.534 2.527 0.592 1.00 0.00 O ATOM 296 O5' DC A 10 10.500 2.127 -0.855 1.00 0.00 O ATOM 297 C5' DC A 10 9.525 1.321 -1.549 1.00 0.00 C ATOM 298 C4' DC A 10 8.276 2.116 -1.897 1.00 0.00 C ATOM 299 O4' DC A 10 7.666 2.562 -0.688 1.00 0.00 O ATOM 300 C3' DC A 10 8.442 3.340 -2.779 1.00 0.00 C ATOM 301 O3' DC A 10 8.332 3.002 -4.172 1.00 0.00 O ATOM 302 C2' DC A 10 7.305 4.234 -2.350 1.00 0.00 C ATOM 303 C1' DC A 10 7.107 3.862 -0.885 1.00 0.00 C ATOM 304 N1 DC A 10 7.783 4.783 0.051 1.00 0.00 N ATOM 305 C2 DC A 10 7.070 5.886 0.486 1.00 0.00 C ATOM 306 O2 DC A 10 5.914 6.054 0.114 1.00 0.00 O ATOM 307 N3 DC A 10 7.680 6.762 1.329 1.00 0.00 N ATOM 308 C4 DC A 10 8.943 6.564 1.728 1.00 0.00 C ATOM 309 N4 DC A 10 9.511 7.443 2.552 1.00 0.00 N ATOM 310 C5 DC A 10 9.685 5.426 1.282 1.00 0.00 C ATOM 311 C6 DC A 10 9.071 4.564 0.450 1.00 0.00 C ATOM 0 H5' DC A 10 9.251 0.468 -0.928 1.00 0.00 H new ATOM 0 H5'' DC A 10 9.967 0.922 -2.462 1.00 0.00 H new ATOM 0 H4' DC A 10 7.683 1.413 -2.482 1.00 0.00 H new ATOM 0 H3' DC A 10 9.421 3.808 -2.671 1.00 0.00 H new ATOM 0 H2' DC A 10 7.555 5.288 -2.468 1.00 0.00 H new ATOM 0 H2'' DC A 10 6.405 4.052 -2.937 1.00 0.00 H new ATOM 0 H1' DC A 10 6.038 3.908 -0.678 1.00 0.00 H new ATOM 0 H41 DC A 10 10.472 7.303 2.863 1.00 0.00 H new ATOM 0 H42 DC A 10 8.985 8.256 2.872 1.00 0.00 H new ATOM 0 H5 DC A 10 10.704 5.263 1.602 1.00 0.00 H new ATOM 0 H6 DC A 10 9.601 3.692 0.095 1.00 0.00 H new ATOM 323 P DG A 11 8.927 3.989 -5.302 1.00 0.00 P ATOM 324 OP1 DG A 11 8.767 3.335 -6.620 1.00 0.00 O ATOM 325 OP2 DG A 11 10.261 4.457 -4.863 1.00 0.00 O ATOM 326 O5' DG A 11 7.891 5.235 -5.225 1.00 0.00 O ATOM 327 C5' DG A 11 8.257 6.542 -5.692 1.00 0.00 C ATOM 328 C4' DG A 11 7.131 7.568 -5.473 1.00 0.00 C ATOM 329 O4' DG A 11 5.940 7.190 -6.165 1.00 0.00 O ATOM 330 C3' DG A 11 6.722 7.729 -4.015 1.00 0.00 C ATOM 331 O3' DG A 11 7.539 8.703 -3.340 1.00 0.00 O ATOM 332 C2' DG A 11 5.289 8.231 -4.099 1.00 0.00 C ATOM 333 C1' DG A 11 4.845 7.845 -5.512 1.00 0.00 C ATOM 334 N9 DG A 11 3.652 6.970 -5.550 1.00 0.00 N ATOM 335 C8 DG A 11 2.354 7.311 -5.298 1.00 0.00 C ATOM 336 N7 DG A 11 1.506 6.332 -5.326 1.00 0.00 N ATOM 337 C5 DG A 11 2.297 5.230 -5.622 1.00 0.00 C ATOM 338 C6 DG A 11 1.924 3.871 -5.791 1.00 0.00 C ATOM 339 O6 DG A 11 0.800 3.375 -5.691 1.00 0.00 O ATOM 340 N1 DG A 11 3.022 3.075 -6.092 1.00 0.00 N ATOM 341 C2 DG A 11 4.323 3.536 -6.213 1.00 0.00 C ATOM 342 N2 DG A 11 5.250 2.628 -6.503 1.00 0.00 N ATOM 343 N3 DG A 11 4.676 4.819 -6.054 1.00 0.00 N ATOM 344 C4 DG A 11 3.619 5.607 -5.761 1.00 0.00 C ATOM 0 H5' DG A 11 8.501 6.493 -6.753 1.00 0.00 H new ATOM 0 H5'' DG A 11 9.156 6.874 -5.173 1.00 0.00 H new ATOM 0 H4' DG A 11 7.550 8.502 -5.847 1.00 0.00 H new ATOM 0 H3' DG A 11 6.831 6.800 -3.455 1.00 0.00 H new ATOM 0 H2' DG A 11 4.658 7.766 -3.341 1.00 0.00 H new ATOM 0 H2'' DG A 11 5.233 9.308 -3.943 1.00 0.00 H new ATOM 0 H1' DG A 11 4.559 8.765 -6.022 1.00 0.00 H new ATOM 0 H8 DG A 11 2.055 8.328 -5.090 1.00 0.00 H new ATOM 0 H1 DG A 11 2.858 2.078 -6.234 1.00 0.00 H new ATOM 0 H21 DG A 11 6.225 2.909 -6.604 1.00 0.00 H new ATOM 0 H22 DG A 11 4.986 1.650 -6.624 1.00 0.00 H new ATOM 356 P DG A 12 8.000 8.430 -1.814 1.00 0.00 P ATOM 357 OP1 DG A 12 8.773 9.606 -1.356 1.00 0.00 O ATOM 358 OP2 DG A 12 8.610 7.091 -1.730 1.00 0.00 O ATOM 359 O5' DG A 12 6.599 8.420 -1.016 1.00 0.00 O ATOM 360 C5' DG A 12 5.817 9.607 -0.893 1.00 0.00 C ATOM 361 C4' DG A 12 4.451 9.334 -0.277 1.00 0.00 C ATOM 362 O4' DG A 12 3.714 8.468 -1.124 1.00 0.00 O ATOM 363 C3' DG A 12 4.447 8.670 1.088 1.00 0.00 C ATOM 364 O3' DG A 12 4.609 9.658 2.119 1.00 0.00 O ATOM 365 C2' DG A 12 3.055 8.036 1.138 1.00 0.00 C ATOM 366 C1' DG A 12 2.699 7.824 -0.346 1.00 0.00 C ATOM 367 N9 DG A 12 2.654 6.405 -0.756 1.00 0.00 N ATOM 368 C8 DG A 12 3.680 5.587 -1.137 1.00 0.00 C ATOM 369 N7 DG A 12 3.352 4.348 -1.355 1.00 0.00 N ATOM 370 C5 DG A 12 1.982 4.334 -1.101 1.00 0.00 C ATOM 371 C6 DG A 12 1.055 3.258 -1.178 1.00 0.00 C ATOM 372 O6 DG A 12 1.269 2.088 -1.485 1.00 0.00 O ATOM 373 N1 DG A 12 -0.231 3.667 -0.850 1.00 0.00 N ATOM 374 C2 DG A 12 -0.585 4.954 -0.491 1.00 0.00 C ATOM 375 N2 DG A 12 -1.872 5.161 -0.211 1.00 0.00 N ATOM 376 N3 DG A 12 0.286 5.968 -0.416 1.00 0.00 N ATOM 377 C4 DG A 12 1.546 5.588 -0.734 1.00 0.00 C ATOM 0 H5' DG A 12 5.687 10.058 -1.877 1.00 0.00 H new ATOM 0 H5'' DG A 12 6.353 10.331 -0.279 1.00 0.00 H new ATOM 0 H4' DG A 12 4.022 10.329 -0.160 1.00 0.00 H new ATOM 0 H3' DG A 12 5.251 7.950 1.239 1.00 0.00 H new ATOM 0 H2' DG A 12 3.063 7.094 1.687 1.00 0.00 H new ATOM 0 H2'' DG A 12 2.335 8.688 1.634 1.00 0.00 H new ATOM 0 H1' DG A 12 1.701 8.233 -0.502 1.00 0.00 H new ATOM 0 H8 DG A 12 4.693 5.945 -1.249 1.00 0.00 H new ATOM 0 H1 DG A 12 -0.970 2.965 -0.876 1.00 0.00 H new ATOM 0 H21 DG A 12 -2.192 6.091 0.060 1.00 0.00 H new ATOM 0 H22 DG A 12 -2.537 4.389 -0.268 1.00 0.00 H new ATOM 389 P DG A 13 5.136 9.239 3.590 1.00 0.00 P ATOM 390 OP1 DG A 13 5.499 10.473 4.321 1.00 0.00 O ATOM 391 OP2 DG A 13 6.123 8.147 3.440 1.00 0.00 O ATOM 392 O5' DG A 13 3.800 8.635 4.250 1.00 0.00 O ATOM 393 C5' DG A 13 2.692 9.522 4.398 1.00 0.00 C ATOM 394 C4' DG A 13 1.408 8.852 4.884 1.00 0.00 C ATOM 395 O4' DG A 13 0.999 7.864 3.957 1.00 0.00 O ATOM 396 C3' DG A 13 1.434 8.180 6.249 1.00 0.00 C ATOM 397 O3' DG A 13 1.144 9.225 7.200 1.00 0.00 O ATOM 398 C2' DG A 13 0.326 7.121 6.140 1.00 0.00 C ATOM 399 C1' DG A 13 0.160 6.914 4.622 1.00 0.00 C ATOM 400 N9 DG A 13 0.584 5.590 4.138 1.00 0.00 N ATOM 401 C8 DG A 13 1.817 5.204 3.739 1.00 0.00 C ATOM 402 N7 DG A 13 1.929 3.965 3.364 1.00 0.00 N ATOM 403 C5 DG A 13 0.640 3.474 3.533 1.00 0.00 C ATOM 404 C6 DG A 13 0.126 2.173 3.293 1.00 0.00 C ATOM 405 O6 DG A 13 0.723 1.178 2.873 1.00 0.00 O ATOM 406 N1 DG A 13 -1.224 2.101 3.609 1.00 0.00 N ATOM 407 C2 DG A 13 -1.980 3.150 4.095 1.00 0.00 C ATOM 408 N2 DG A 13 -3.245 2.886 4.377 1.00 0.00 N ATOM 409 N3 DG A 13 -1.502 4.376 4.307 1.00 0.00 N ATOM 410 C4 DG A 13 -0.193 4.466 4.012 1.00 0.00 C ATOM 0 H5' DG A 13 2.496 10.003 3.439 1.00 0.00 H new ATOM 0 H5'' DG A 13 2.964 10.310 5.100 1.00 0.00 H new ATOM 0 H4' DG A 13 0.724 9.696 4.976 1.00 0.00 H new ATOM 0 H3' DG A 13 2.367 7.706 6.556 1.00 0.00 H new ATOM 0 H2' DG A 13 0.608 6.195 6.641 1.00 0.00 H new ATOM 0 H2'' DG A 13 -0.601 7.463 6.600 1.00 0.00 H new ATOM 0 H1' DG A 13 -0.904 7.024 4.414 1.00 0.00 H new ATOM 0 H8 DG A 13 2.657 5.883 3.732 1.00 0.00 H new ATOM 0 H1 DG A 13 -1.693 1.206 3.472 1.00 0.00 H new ATOM 0 H21 DG A 13 -3.851 3.622 4.739 1.00 0.00 H new ATOM 0 H22 DG A 13 -3.614 1.946 4.232 1.00 0.00 H new ATOM 422 P DG A 14 1.328 9.139 8.808 1.00 0.00 P ATOM 423 OP1 DG A 14 1.361 10.521 9.342 1.00 0.00 O ATOM 424 OP2 DG A 14 2.426 8.193 9.110 1.00 0.00 O ATOM 425 O5' DG A 14 -0.068 8.467 9.228 1.00 0.00 O ATOM 426 C5' DG A 14 -1.211 9.180 8.774 1.00 0.00 C ATOM 427 C4' DG A 14 -2.577 8.577 9.131 1.00 0.00 C ATOM 428 O4' DG A 14 -2.625 7.236 8.634 1.00 0.00 O ATOM 429 C3' DG A 14 -2.978 8.511 10.599 1.00 0.00 C ATOM 430 O3' DG A 14 -4.403 8.716 10.621 1.00 0.00 O ATOM 431 C2' DG A 14 -2.675 7.087 11.026 1.00 0.00 C ATOM 432 C1' DG A 14 -2.741 6.303 9.722 1.00 0.00 C ATOM 433 N9 DG A 14 -1.659 5.322 9.583 1.00 0.00 N ATOM 434 C8 DG A 14 -0.411 5.505 9.072 1.00 0.00 C ATOM 435 N7 DG A 14 0.359 4.462 9.111 1.00 0.00 N ATOM 436 C5 DG A 14 -0.447 3.494 9.705 1.00 0.00 C ATOM 437 C6 DG A 14 -0.156 2.141 10.019 1.00 0.00 C ATOM 438 O6 DG A 14 0.890 1.523 9.835 1.00 0.00 O ATOM 439 N1 DG A 14 -1.243 1.511 10.612 1.00 0.00 N ATOM 440 C2 DG A 14 -2.459 2.107 10.870 1.00 0.00 C ATOM 441 N2 DG A 14 -3.380 1.333 11.447 1.00 0.00 N ATOM 442 N3 DG A 14 -2.737 3.382 10.577 1.00 0.00 N ATOM 443 C4 DG A 14 -1.688 4.012 9.997 1.00 0.00 C ATOM 0 H5' DG A 14 -1.150 9.269 7.689 1.00 0.00 H new ATOM 0 H5'' DG A 14 -1.167 10.191 9.180 1.00 0.00 H new ATOM 0 H4' DG A 14 -3.280 9.274 8.676 1.00 0.00 H new ATOM 0 H3' DG A 14 -2.472 9.234 11.239 1.00 0.00 H new ATOM 0 H2' DG A 14 -1.693 7.008 11.492 1.00 0.00 H new ATOM 0 H2'' DG A 14 -3.402 6.722 11.751 1.00 0.00 H new ATOM 0 H1' DG A 14 -3.686 5.760 9.717 1.00 0.00 H new ATOM 0 H8 DG A 14 -0.085 6.450 8.664 1.00 0.00 H new ATOM 0 H1 DG A 14 -1.133 0.532 10.877 1.00 0.00 H new ATOM 0 H21 DG A 14 -4.301 1.713 11.665 1.00 0.00 H new ATOM 0 H22 DG A 14 -3.163 0.362 11.670 1.00 0.00 H new ATOM 455 P DC A 15 -5.134 10.159 10.764 1.00 0.00 P ATOM 456 OP1 DC A 15 -4.357 10.975 11.725 1.00 0.00 O ATOM 457 OP2 DC A 15 -6.577 9.926 10.992 1.00 0.00 O ATOM 458 O5' DC A 15 -4.954 10.809 9.292 1.00 0.00 O ATOM 459 C5' DC A 15 -3.768 11.561 9.020 1.00 0.00 C ATOM 460 C4' DC A 15 -3.333 11.567 7.543 1.00 0.00 C ATOM 461 O4' DC A 15 -2.898 10.246 7.184 1.00 0.00 O ATOM 462 C3' DC A 15 -4.395 11.980 6.525 1.00 0.00 C ATOM 463 O3' DC A 15 -3.804 12.862 5.560 1.00 0.00 O ATOM 464 C2' DC A 15 -4.798 10.691 5.824 1.00 0.00 C ATOM 465 C1' DC A 15 -3.596 9.782 6.027 1.00 0.00 C ATOM 466 N1 DC A 15 -3.915 8.336 6.219 1.00 0.00 N ATOM 467 C2 DC A 15 -3.193 7.419 5.467 1.00 0.00 C ATOM 468 O2 DC A 15 -2.347 7.809 4.667 1.00 0.00 O ATOM 469 N3 DC A 15 -3.450 6.092 5.644 1.00 0.00 N ATOM 470 C4 DC A 15 -4.375 5.678 6.519 1.00 0.00 C ATOM 471 N4 DC A 15 -4.598 4.371 6.670 1.00 0.00 N ATOM 472 C5 DC A 15 -5.122 6.616 7.294 1.00 0.00 C ATOM 473 C6 DC A 15 -4.860 7.924 7.114 1.00 0.00 C ATOM 0 H5' DC A 15 -2.953 11.159 9.623 1.00 0.00 H new ATOM 0 H5'' DC A 15 -3.925 12.590 9.342 1.00 0.00 H new ATOM 0 H4' DC A 15 -2.551 12.324 7.493 1.00 0.00 H new ATOM 0 H3' DC A 15 -5.240 12.484 6.994 1.00 0.00 H new ATOM 0 H2' DC A 15 -5.702 10.264 6.259 1.00 0.00 H new ATOM 0 H2'' DC A 15 -5.001 10.857 4.766 1.00 0.00 H new ATOM 0 H1' DC A 15 -3.009 9.834 5.110 1.00 0.00 H new ATOM 0 H41 DC A 15 -5.301 4.047 7.334 1.00 0.00 H new ATOM 0 H42 DC A 15 -4.066 3.696 6.121 1.00 0.00 H new ATOM 0 H5 DC A 15 -5.871 6.288 8.000 1.00 0.00 H new ATOM 0 H6 DC A 15 -5.406 8.659 7.687 1.00 0.00 H new ATOM 485 P DG A 16 -4.706 13.525 4.402 1.00 0.00 P ATOM 486 OP1 DG A 16 -4.117 14.837 4.056 1.00 0.00 O ATOM 487 OP2 DG A 16 -6.125 13.435 4.810 1.00 0.00 O ATOM 488 O5' DG A 16 -4.476 12.519 3.159 1.00 0.00 O ATOM 489 C5' DG A 16 -3.153 12.381 2.611 1.00 0.00 C ATOM 490 C4' DG A 16 -3.062 11.329 1.504 1.00 0.00 C ATOM 491 O4' DG A 16 -3.269 10.043 2.083 1.00 0.00 O ATOM 492 C3' DG A 16 -4.075 11.524 0.369 1.00 0.00 C ATOM 493 O3' DG A 16 -3.483 11.245 -0.907 1.00 0.00 O ATOM 494 C2' DG A 16 -5.113 10.450 0.634 1.00 0.00 C ATOM 495 C1' DG A 16 -4.341 9.388 1.426 1.00 0.00 C ATOM 496 N9 DG A 16 -5.132 8.679 2.460 1.00 0.00 N ATOM 497 C8 DG A 16 -6.116 9.158 3.282 1.00 0.00 C ATOM 498 N7 DG A 16 -6.665 8.278 4.061 1.00 0.00 N ATOM 499 C5 DG A 16 -5.997 7.103 3.736 1.00 0.00 C ATOM 500 C6 DG A 16 -6.163 5.793 4.262 1.00 0.00 C ATOM 501 O6 DG A 16 -6.940 5.418 5.136 1.00 0.00 O ATOM 502 N1 DG A 16 -5.295 4.888 3.664 1.00 0.00 N ATOM 503 C2 DG A 16 -4.378 5.206 2.676 1.00 0.00 C ATOM 504 N2 DG A 16 -3.632 4.207 2.207 1.00 0.00 N ATOM 505 N3 DG A 16 -4.219 6.441 2.184 1.00 0.00 N ATOM 506 C4 DG A 16 -5.057 7.335 2.755 1.00 0.00 C ATOM 0 H5' DG A 16 -2.462 12.117 3.411 1.00 0.00 H new ATOM 0 H5'' DG A 16 -2.829 13.344 2.215 1.00 0.00 H new ATOM 0 H4' DG A 16 -2.072 11.429 1.058 1.00 0.00 H new ATOM 0 H3' DG A 16 -4.460 12.543 0.344 1.00 0.00 H new ATOM 0 H2' DG A 16 -5.957 10.840 1.204 1.00 0.00 H new ATOM 0 H2'' DG A 16 -5.515 10.044 -0.294 1.00 0.00 H new ATOM 0 H1' DG A 16 -4.027 8.632 0.706 1.00 0.00 H new ATOM 0 H8 DG A 16 -6.414 10.196 3.282 1.00 0.00 H new ATOM 0 H1 DG A 16 -5.336 3.918 3.976 1.00 0.00 H new ATOM 0 H21 DG A 16 -2.941 4.385 1.478 1.00 0.00 H new ATOM 0 H22 DG A 16 -3.752 3.264 2.576 1.00 0.00 H new ATOM 518 P DG A 17 -4.222 11.723 -2.271 1.00 0.00 P ATOM 519 OP1 DG A 17 -3.222 11.681 -3.362 1.00 0.00 O ATOM 520 OP2 DG A 17 -4.931 12.991 -1.986 1.00 0.00 O ATOM 521 O5' DG A 17 -5.341 10.589 -2.579 1.00 0.00 O ATOM 522 C5' DG A 17 -4.963 9.234 -2.839 1.00 0.00 C ATOM 523 C4' DG A 17 -6.168 8.327 -3.175 1.00 0.00 C ATOM 524 O4' DG A 17 -5.842 7.431 -4.240 1.00 0.00 O ATOM 525 C3' DG A 17 -6.681 7.472 -2.012 1.00 0.00 C ATOM 526 O3' DG A 17 -7.800 8.120 -1.366 1.00 0.00 O ATOM 527 C2' DG A 17 -7.114 6.155 -2.645 1.00 0.00 C ATOM 528 C1' DG A 17 -6.620 6.243 -4.086 1.00 0.00 C ATOM 529 N9 DG A 17 -5.800 5.097 -4.534 1.00 0.00 N ATOM 530 C8 DG A 17 -6.200 3.819 -4.805 1.00 0.00 C ATOM 531 N7 DG A 17 -5.243 2.988 -5.089 1.00 0.00 N ATOM 532 C5 DG A 17 -4.100 3.774 -5.007 1.00 0.00 C ATOM 533 C6 DG A 17 -2.739 3.422 -5.224 1.00 0.00 C ATOM 534 O6 DG A 17 -2.278 2.321 -5.531 1.00 0.00 O ATOM 535 N1 DG A 17 -1.896 4.513 -5.047 1.00 0.00 N ATOM 536 C2 DG A 17 -2.314 5.787 -4.700 1.00 0.00 C ATOM 537 N2 DG A 17 -1.364 6.712 -4.572 1.00 0.00 N ATOM 538 N3 DG A 17 -3.595 6.118 -4.496 1.00 0.00 N ATOM 539 C4 DG A 17 -4.428 5.068 -4.664 1.00 0.00 C ATOM 0 H5' DG A 17 -4.445 8.833 -1.968 1.00 0.00 H new ATOM 0 H5'' DG A 17 -4.256 9.212 -3.668 1.00 0.00 H new ATOM 0 H4' DG A 17 -6.957 9.028 -3.447 1.00 0.00 H new ATOM 0 H3' DG A 17 -5.920 7.322 -1.246 1.00 0.00 H new ATOM 0 H2' DG A 17 -6.676 5.302 -2.126 1.00 0.00 H new ATOM 0 H2'' DG A 17 -8.196 6.031 -2.603 1.00 0.00 H new ATOM 0 H1' DG A 17 -7.518 6.244 -4.704 1.00 0.00 H new ATOM 0 H8 DG A 17 -7.238 3.521 -4.785 1.00 0.00 H new ATOM 0 H1 DG A 17 -0.896 4.364 -5.183 1.00 0.00 H new ATOM 0 H21 DG A 17 -1.614 7.668 -4.318 1.00 0.00 H new ATOM 0 H22 DG A 17 -0.387 6.464 -4.728 1.00 0.00 H new ATOM 551 P DG A 18 -7.951 8.045 0.235 1.00 0.00 P ATOM 552 OP1 DG A 18 -9.144 8.827 0.628 1.00 0.00 O ATOM 553 OP2 DG A 18 -6.649 8.355 0.815 1.00 0.00 O ATOM 554 O5' DG A 18 -8.256 6.491 0.502 1.00 0.00 O ATOM 555 C5' DG A 18 -9.473 5.878 0.078 1.00 0.00 C ATOM 556 C4' DG A 18 -9.368 4.366 0.192 1.00 0.00 C ATOM 557 O4' DG A 18 -8.321 3.918 -0.641 1.00 0.00 O ATOM 558 C3' DG A 18 -9.056 3.812 1.572 1.00 0.00 C ATOM 559 O3' DG A 18 -10.270 3.621 2.318 1.00 0.00 O ATOM 560 C2' DG A 18 -8.354 2.488 1.279 1.00 0.00 C ATOM 561 C1' DG A 18 -7.858 2.655 -0.167 1.00 0.00 C ATOM 562 N9 DG A 18 -6.393 2.656 -0.309 1.00 0.00 N ATOM 563 C8 DG A 18 -5.510 3.696 -0.221 1.00 0.00 C ATOM 564 N7 DG A 18 -4.263 3.375 -0.400 1.00 0.00 N ATOM 565 C5 DG A 18 -4.319 2.002 -0.624 1.00 0.00 C ATOM 566 C6 DG A 18 -3.275 1.076 -0.896 1.00 0.00 C ATOM 567 O6 DG A 18 -2.067 1.293 -0.989 1.00 0.00 O ATOM 568 N1 DG A 18 -3.773 -0.212 -1.068 1.00 0.00 N ATOM 569 C2 DG A 18 -5.111 -0.559 -0.984 1.00 0.00 C ATOM 570 N2 DG A 18 -5.416 -1.835 -1.169 1.00 0.00 N ATOM 571 N3 DG A 18 -6.084 0.310 -0.729 1.00 0.00 N ATOM 572 C4 DG A 18 -5.621 1.560 -0.563 1.00 0.00 C ATOM 0 H5' DG A 18 -9.689 6.158 -0.953 1.00 0.00 H new ATOM 0 H5'' DG A 18 -10.302 6.239 0.687 1.00 0.00 H new ATOM 0 H4' DG A 18 -10.362 4.012 -0.083 1.00 0.00 H new ATOM 0 H3' DG A 18 -8.440 4.475 2.179 1.00 0.00 H new ATOM 0 H2' DG A 18 -7.528 2.311 1.968 1.00 0.00 H new ATOM 0 H2'' DG A 18 -9.036 1.643 1.374 1.00 0.00 H new ATOM 0 H1' DG A 18 -8.240 1.802 -0.728 1.00 0.00 H new ATOM 0 H8 DG A 18 -5.825 4.709 -0.018 1.00 0.00 H new ATOM 0 H1 DG A 18 -3.104 -0.955 -1.271 1.00 0.00 H new ATOM 0 H21 DG A 18 -6.388 -2.140 -1.117 1.00 0.00 H new ATOM 0 H22 DG A 18 -4.679 -2.513 -1.363 1.00 0.00 H new ATOM 584 P DG A 19 -10.215 3.500 3.924 1.00 0.00 P ATOM 585 OP1 DG A 19 -11.599 3.571 4.443 1.00 0.00 O ATOM 586 OP2 DG A 19 -9.182 4.430 4.429 1.00 0.00 O ATOM 587 O5' DG A 19 -9.680 1.990 4.108 1.00 0.00 O ATOM 588 C5' DG A 19 -10.499 0.900 3.663 1.00 0.00 C ATOM 589 C4' DG A 19 -9.784 -0.451 3.738 1.00 0.00 C ATOM 590 O4' DG A 19 -8.618 -0.422 2.927 1.00 0.00 O ATOM 591 C3' DG A 19 -9.294 -0.861 5.111 1.00 0.00 C ATOM 592 O3' DG A 19 -10.336 -1.505 5.859 1.00 0.00 O ATOM 593 C2' DG A 19 -8.205 -1.883 4.765 1.00 0.00 C ATOM 594 C1' DG A 19 -7.753 -1.478 3.360 1.00 0.00 C ATOM 595 N9 DG A 19 -6.364 -0.992 3.316 1.00 0.00 N ATOM 596 C8 DG A 19 -5.890 0.264 3.544 1.00 0.00 C ATOM 597 N7 DG A 19 -4.601 0.383 3.492 1.00 0.00 N ATOM 598 C5 DG A 19 -4.168 -0.904 3.200 1.00 0.00 C ATOM 599 C6 DG A 19 -2.850 -1.395 3.009 1.00 0.00 C ATOM 600 O6 DG A 19 -1.789 -0.778 3.074 1.00 0.00 O ATOM 601 N1 DG A 19 -2.852 -2.752 2.721 1.00 0.00 N ATOM 602 C2 DG A 19 -3.976 -3.544 2.631 1.00 0.00 C ATOM 603 N2 DG A 19 -3.769 -4.834 2.344 1.00 0.00 N ATOM 604 N3 DG A 19 -5.221 -3.084 2.813 1.00 0.00 N ATOM 605 C4 DG A 19 -5.241 -1.759 3.091 1.00 0.00 C ATOM 0 H5' DG A 19 -10.812 1.083 2.635 1.00 0.00 H new ATOM 0 H5'' DG A 19 -11.404 0.861 4.269 1.00 0.00 H new ATOM 0 H4' DG A 19 -10.545 -1.162 3.416 1.00 0.00 H new ATOM 0 H3' DG A 19 -8.957 -0.021 5.719 1.00 0.00 H new ATOM 0 H2' DG A 19 -7.380 -1.844 5.477 1.00 0.00 H new ATOM 0 H2'' DG A 19 -8.593 -2.901 4.782 1.00 0.00 H new ATOM 0 H1' DG A 19 -7.801 -2.358 2.718 1.00 0.00 H new ATOM 0 H8 DG A 19 -6.541 1.100 3.753 1.00 0.00 H new ATOM 0 H1 DG A 19 -1.949 -3.199 2.563 1.00 0.00 H new ATOM 0 H21 DG A 19 -4.561 -5.472 2.264 1.00 0.00 H new ATOM 0 H22 DG A 19 -2.819 -5.180 2.205 1.00 0.00 H new ATOM 617 P DT A 20 -10.373 -1.345 7.466 1.00 0.00 P ATOM 618 OP1 DT A 20 -11.575 -2.042 7.973 1.00 0.00 O ATOM 619 OP2 DT A 20 -10.155 0.082 7.793 1.00 0.00 O ATOM 620 O5' DT A 20 -9.074 -2.174 7.939 1.00 0.00 O ATOM 621 C5' DT A 20 -8.957 -3.578 7.698 1.00 0.00 C ATOM 622 C4' DT A 20 -7.581 -4.092 8.102 1.00 0.00 C ATOM 623 O4' DT A 20 -6.599 -3.442 7.289 1.00 0.00 O ATOM 624 C3' DT A 20 -7.218 -3.828 9.561 1.00 0.00 C ATOM 625 O3' DT A 20 -6.509 -4.937 10.118 1.00 0.00 O ATOM 626 C2' DT A 20 -6.335 -2.586 9.522 1.00 0.00 C ATOM 627 C1' DT A 20 -5.837 -2.522 8.077 1.00 0.00 C ATOM 628 N1 DT A 20 -5.902 -1.181 7.428 1.00 0.00 N ATOM 629 C2 DT A 20 -4.827 -0.829 6.636 1.00 0.00 C ATOM 630 O2 DT A 20 -3.883 -1.587 6.449 1.00 0.00 O ATOM 631 N3 DT A 20 -4.871 0.430 6.062 1.00 0.00 N ATOM 632 C4 DT A 20 -5.884 1.358 6.206 1.00 0.00 C ATOM 633 O4 DT A 20 -5.823 2.448 5.629 1.00 0.00 O ATOM 634 C5 DT A 20 -6.970 0.909 7.048 1.00 0.00 C ATOM 635 C7 DT A 20 -8.155 1.836 7.298 1.00 0.00 C ATOM 636 C6 DT A 20 -6.953 -0.318 7.618 1.00 0.00 C ATOM 0 H5' DT A 20 -9.130 -3.784 6.642 1.00 0.00 H new ATOM 0 H5'' DT A 20 -9.726 -4.111 8.257 1.00 0.00 H new ATOM 0 H4' DT A 20 -7.604 -5.173 7.965 1.00 0.00 H new ATOM 0 H3' DT A 20 -8.101 -3.687 10.185 1.00 0.00 H new ATOM 0 H2' DT A 20 -6.896 -1.691 9.790 1.00 0.00 H new ATOM 0 H2'' DT A 20 -5.506 -2.665 10.225 1.00 0.00 H new ATOM 0 HO3' DT A 20 -6.285 -4.746 11.053 1.00 0.00 H new ATOM 0 H1' DT A 20 -4.778 -2.774 8.125 1.00 0.00 H new ATOM 0 H3 DT A 20 -4.080 0.698 5.477 1.00 0.00 H new ATOM 0 H71 DT A 20 -7.821 2.873 7.256 1.00 0.00 H new ATOM 0 H72 DT A 20 -8.915 1.669 6.535 1.00 0.00 H new ATOM 0 H73 DT A 20 -8.577 1.630 8.282 1.00 0.00 H new ATOM 0 H6 DT A 20 -7.784 -0.625 8.236 1.00 0.00 H new TER 650 DT A 20 HETATM 651 O4 LOC A 101 7.194 4.891 6.961 1.00 0.00 O HETATM 652 C12 LOC A 101 6.007 4.620 6.794 1.00 0.00 C HETATM 653 C13 LOC A 101 4.910 5.618 7.172 1.00 0.00 C HETATM 654 N1 LOC A 101 5.571 3.492 6.215 1.00 0.00 N HETATM 655 C11 LOC A 101 4.308 2.844 6.598 1.00 0.00 C HETATM 656 C14 LOC A 101 4.474 1.466 6.518 1.00 0.00 C HETATM 657 C15 LOC A 101 5.843 1.336 6.714 1.00 0.00 C HETATM 658 C10 LOC A 101 3.224 3.269 5.619 1.00 0.00 C HETATM 659 C9 LOC A 101 1.847 3.085 6.237 1.00 0.00 C HETATM 660 C8 LOC A 101 1.415 1.780 6.032 1.00 0.00 C HETATM 661 C7 LOC A 101 0.028 1.704 6.099 1.00 0.00 C HETATM 662 C5 LOC A 101 -0.594 0.465 6.213 1.00 0.00 C HETATM 663 C3 LOC A 101 0.171 -0.692 6.285 1.00 0.00 C HETATM 664 C1 LOC A 101 1.553 -0.611 6.173 1.00 0.00 C HETATM 665 O1 LOC A 101 2.278 -1.662 6.642 1.00 0.00 O HETATM 666 C2 LOC A 101 2.201 -1.689 8.069 1.00 0.00 C HETATM 667 O2 LOC A 101 -0.421 -1.868 5.943 1.00 0.00 O HETATM 668 C4 LOC A 101 -1.339 -2.274 6.962 1.00 0.00 C HETATM 669 O3 LOC A 101 -1.944 0.329 6.289 1.00 0.00 O HETATM 670 C6 LOC A 101 -2.423 1.083 7.405 1.00 0.00 C HETATM 671 C22 LOC A 101 2.185 0.621 6.037 1.00 0.00 C HETATM 672 C21 LOC A 101 3.573 0.528 6.031 1.00 0.00 C HETATM 673 C20 LOC A 101 3.842 -0.571 5.221 1.00 0.00 C HETATM 674 C19 LOC A 101 5.069 -1.202 5.058 1.00 0.00 C HETATM 675 C17 LOC A 101 6.319 -0.785 5.502 1.00 0.00 C HETATM 676 C16 LOC A 101 6.688 0.391 6.144 1.00 0.00 C HETATM 677 O5 LOC A 101 7.891 0.602 6.283 1.00 0.00 O HETATM 678 O6 LOC A 101 7.353 -1.657 5.368 1.00 0.00 O HETATM 679 C18 LOC A 101 7.516 -2.355 6.605 1.00 0.00 C HETATM 0 H18B LOC A 101 7.731 -1.641 7.400 1.00 0.00 H new HETATM 0 H18A LOC A 101 6.600 -2.896 6.841 1.00 0.00 H new HETATM 0 H13B LOC A 101 4.971 5.840 8.237 1.00 0.00 H new HETATM 0 H13A LOC A 101 5.042 6.537 6.602 1.00 0.00 H new HETATM 0 H10A LOC A 101 3.367 4.313 5.339 1.00 0.00 H new HETATM 0 HN1 LOC A 101 6.137 3.067 5.481 1.00 0.00 H new HETATM 0 H9A LOC A 101 1.884 3.303 7.304 1.00 0.00 H new HETATM 0 H9 LOC A 101 1.141 3.787 5.793 1.00 0.00 H new HETATM 0 H7 LOC A 101 -0.571 2.614 6.062 1.00 0.00 H new HETATM 0 H6B LOC A 101 -1.963 0.710 8.320 1.00 0.00 H new HETATM 0 H6A LOC A 101 -2.166 2.134 7.272 1.00 0.00 H new HETATM 0 H6 LOC A 101 -3.506 0.981 7.475 1.00 0.00 H new HETATM 0 H4B LOC A 101 -0.804 -2.405 7.903 1.00 0.00 H new HETATM 0 H4A LOC A 101 -2.107 -1.511 7.085 1.00 0.00 H new HETATM 0 H4 LOC A 101 -1.806 -3.216 6.676 1.00 0.00 H new HETATM 0 H2B LOC A 101 2.603 -0.760 8.473 1.00 0.00 H new HETATM 0 H2A LOC A 101 1.161 -1.798 8.375 1.00 0.00 H new HETATM 0 H20 LOC A 101 3.004 -0.979 4.656 1.00 0.00 H new HETATM 0 H2 LOC A 101 2.781 -2.530 8.449 1.00 0.00 H new HETATM 0 H19 LOC A 101 5.049 -2.145 4.512 1.00 0.00 H new HETATM 0 H18 LOC A 101 8.342 -3.061 6.518 1.00 0.00 H new HETATM 0 H15 LOC A 101 6.306 2.055 7.390 1.00 0.00 H new HETATM 0 H13 LOC A 101 3.934 5.188 6.947 1.00 0.00 H new HETATM 0 H11 LOC A 101 4.028 3.130 7.612 1.00 0.00 H new HETATM 0 H10 LOC A 101 3.300 2.681 4.705 1.00 0.00 H new