USER MOD reduce.3.24.130724 H: found=0, std=0, add=127, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 126 hydrogens (0 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 2 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 4 DT C7 :methyl -30:sc= -0.0623 (180deg=-0.308) USER MOD Single : A 8 DT C7 :methyl -30:sc= 0 (180deg=-0.0827) USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 11 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -2.009 9.624 -7.912 1.00 0.00 O ATOM 2 C5' DG A 1 -1.501 8.550 -7.119 1.00 0.00 C ATOM 3 C4' DG A 1 -2.406 7.309 -7.168 1.00 0.00 C ATOM 4 O4' DG A 1 -1.811 6.287 -6.373 1.00 0.00 O ATOM 5 C3' DG A 1 -3.821 7.572 -6.624 1.00 0.00 C ATOM 6 O3' DG A 1 -4.795 6.969 -7.475 1.00 0.00 O ATOM 7 C2' DG A 1 -3.741 6.946 -5.232 1.00 0.00 C ATOM 8 C1' DG A 1 -2.759 5.796 -5.436 1.00 0.00 C ATOM 9 N9 DG A 1 -2.089 5.396 -4.174 1.00 0.00 N ATOM 10 C8 DG A 1 -1.134 6.094 -3.472 1.00 0.00 C ATOM 11 N7 DG A 1 -0.743 5.515 -2.367 1.00 0.00 N ATOM 12 C5 DG A 1 -1.501 4.335 -2.329 1.00 0.00 C ATOM 13 C6 DG A 1 -1.528 3.248 -1.375 1.00 0.00 C ATOM 14 O6 DG A 1 -0.898 3.070 -0.329 1.00 0.00 O ATOM 15 N1 DG A 1 -2.396 2.246 -1.725 1.00 0.00 N ATOM 16 C2 DG A 1 -3.141 2.239 -2.848 1.00 0.00 C ATOM 17 N2 DG A 1 -3.847 1.146 -3.001 1.00 0.00 N ATOM 18 N3 DG A 1 -3.156 3.207 -3.767 1.00 0.00 N ATOM 19 C4 DG A 1 -2.314 4.241 -3.445 1.00 0.00 C ATOM 0 H5' DG A 1 -1.398 8.881 -6.086 1.00 0.00 H new ATOM 0 H5'' DG A 1 -0.504 8.283 -7.469 1.00 0.00 H new ATOM 0 H4' DG A 1 -2.502 7.019 -8.214 1.00 0.00 H new ATOM 0 H3' DG A 1 -4.123 8.619 -6.583 1.00 0.00 H new ATOM 0 H2' DG A 1 -3.382 7.657 -4.488 1.00 0.00 H new ATOM 0 H2'' DG A 1 -4.714 6.592 -4.891 1.00 0.00 H new ATOM 0 HO5' DG A 1 -1.403 10.392 -7.850 1.00 0.00 H new ATOM 0 H1' DG A 1 -3.272 4.900 -5.786 1.00 0.00 H new ATOM 0 H8 DG A 1 -0.740 7.042 -3.806 1.00 0.00 H new ATOM 0 H1 DG A 1 -2.484 1.451 -1.092 1.00 0.00 H new ATOM 0 H21 DG A 1 -4.447 1.037 -3.819 1.00 0.00 H new ATOM 0 H22 DG A 1 -3.797 0.404 -2.303 1.00 0.00 H new ATOM 32 P DT A 2 -6.387 7.220 -7.313 1.00 0.00 P ATOM 33 OP1 DT A 2 -6.996 7.052 -8.660 1.00 0.00 O ATOM 34 OP2 DT A 2 -6.630 8.492 -6.575 1.00 0.00 O ATOM 35 O5' DT A 2 -6.841 5.982 -6.383 1.00 0.00 O ATOM 36 C5' DT A 2 -8.196 5.554 -6.294 1.00 0.00 C ATOM 37 C4' DT A 2 -8.343 4.185 -5.606 1.00 0.00 C ATOM 38 O4' DT A 2 -7.660 3.190 -6.372 1.00 0.00 O ATOM 39 C3' DT A 2 -7.770 4.156 -4.175 1.00 0.00 C ATOM 40 O3' DT A 2 -8.589 3.342 -3.337 1.00 0.00 O ATOM 41 C2' DT A 2 -6.414 3.496 -4.383 1.00 0.00 C ATOM 42 C1' DT A 2 -6.691 2.553 -5.554 1.00 0.00 C ATOM 43 N1 DT A 2 -5.453 2.227 -6.321 1.00 0.00 N ATOM 44 C2 DT A 2 -4.862 0.976 -6.109 1.00 0.00 C ATOM 45 O2 DT A 2 -5.287 0.147 -5.304 1.00 0.00 O ATOM 46 N3 DT A 2 -3.721 0.692 -6.825 1.00 0.00 N ATOM 47 C4 DT A 2 -3.093 1.544 -7.706 1.00 0.00 C ATOM 48 O4 DT A 2 -2.086 1.143 -8.295 1.00 0.00 O ATOM 49 C5 DT A 2 -3.735 2.854 -7.850 1.00 0.00 C ATOM 50 C7 DT A 2 -3.140 3.895 -8.781 1.00 0.00 C ATOM 51 C6 DT A 2 -4.877 3.147 -7.171 1.00 0.00 C ATOM 0 H5' DT A 2 -8.622 5.500 -7.296 1.00 0.00 H new ATOM 0 H5'' DT A 2 -8.772 6.297 -5.742 1.00 0.00 H new ATOM 0 H4' DT A 2 -9.413 3.987 -5.544 1.00 0.00 H new ATOM 0 H3' DT A 2 -7.715 5.136 -3.700 1.00 0.00 H new ATOM 0 H2' DT A 2 -5.639 4.224 -4.621 1.00 0.00 H new ATOM 0 H2'' DT A 2 -6.083 2.957 -3.495 1.00 0.00 H new ATOM 0 H1' DT A 2 -7.062 1.596 -5.187 1.00 0.00 H new ATOM 0 H3 DT A 2 -3.305 -0.229 -6.691 1.00 0.00 H new ATOM 0 H71 DT A 2 -3.935 4.528 -9.175 1.00 0.00 H new ATOM 0 H72 DT A 2 -2.427 4.509 -8.232 1.00 0.00 H new ATOM 0 H73 DT A 2 -2.630 3.397 -9.606 1.00 0.00 H new ATOM 0 H6 DT A 2 -5.339 4.115 -7.300 1.00 0.00 H new ATOM 64 P DG A 3 -9.024 3.798 -1.848 1.00 0.00 P ATOM 65 OP1 DG A 3 -10.005 2.802 -1.338 1.00 0.00 O ATOM 66 OP2 DG A 3 -9.433 5.227 -1.903 1.00 0.00 O ATOM 67 O5' DG A 3 -7.671 3.700 -0.965 1.00 0.00 O ATOM 68 C5' DG A 3 -7.097 2.449 -0.592 1.00 0.00 C ATOM 69 C4' DG A 3 -5.891 2.576 0.359 1.00 0.00 C ATOM 70 O4' DG A 3 -4.846 3.300 -0.279 1.00 0.00 O ATOM 71 C3' DG A 3 -6.232 3.312 1.673 1.00 0.00 C ATOM 72 O3' DG A 3 -5.502 2.836 2.795 1.00 0.00 O ATOM 73 C2' DG A 3 -5.758 4.728 1.372 1.00 0.00 C ATOM 74 C1' DG A 3 -4.540 4.447 0.496 1.00 0.00 C ATOM 75 N9 DG A 3 -4.221 5.600 -0.372 1.00 0.00 N ATOM 76 C8 DG A 3 -4.947 6.095 -1.428 1.00 0.00 C ATOM 77 N7 DG A 3 -4.437 7.172 -1.966 1.00 0.00 N ATOM 78 C5 DG A 3 -3.284 7.410 -1.204 1.00 0.00 C ATOM 79 C6 DG A 3 -2.267 8.430 -1.295 1.00 0.00 C ATOM 80 O6 DG A 3 -2.176 9.369 -2.090 1.00 0.00 O ATOM 81 N1 DG A 3 -1.278 8.314 -0.337 1.00 0.00 N ATOM 82 C2 DG A 3 -1.250 7.326 0.595 1.00 0.00 C ATOM 83 N2 DG A 3 -0.268 7.339 1.463 1.00 0.00 N ATOM 84 N3 DG A 3 -2.165 6.370 0.724 1.00 0.00 N ATOM 85 C4 DG A 3 -3.155 6.454 -0.218 1.00 0.00 C ATOM 0 H5' DG A 3 -6.783 1.921 -1.493 1.00 0.00 H new ATOM 0 H5'' DG A 3 -7.862 1.837 -0.114 1.00 0.00 H new ATOM 0 H4' DG A 3 -5.588 1.557 0.601 1.00 0.00 H new ATOM 0 H3' DG A 3 -7.284 3.193 1.933 1.00 0.00 H new ATOM 0 H2' DG A 3 -6.515 5.314 0.850 1.00 0.00 H new ATOM 0 H2'' DG A 3 -5.497 5.277 2.277 1.00 0.00 H new ATOM 0 H1' DG A 3 -3.659 4.276 1.114 1.00 0.00 H new ATOM 0 H8 DG A 3 -5.858 5.635 -1.782 1.00 0.00 H new ATOM 0 H1 DG A 3 -0.529 9.007 -0.329 1.00 0.00 H new ATOM 0 H21 DG A 3 -0.211 6.615 2.179 1.00 0.00 H new ATOM 0 H22 DG A 3 0.439 8.073 1.422 1.00 0.00 H new ATOM 97 P DT A 4 -5.917 1.496 3.602 1.00 0.00 P ATOM 98 OP1 DT A 4 -5.561 0.301 2.793 1.00 0.00 O ATOM 99 OP2 DT A 4 -7.319 1.656 4.079 1.00 0.00 O ATOM 100 O5' DT A 4 -4.935 1.609 4.884 1.00 0.00 O ATOM 101 C5' DT A 4 -3.530 1.424 4.740 1.00 0.00 C ATOM 102 C4' DT A 4 -2.659 2.174 5.771 1.00 0.00 C ATOM 103 O4' DT A 4 -2.837 3.583 5.616 1.00 0.00 O ATOM 104 C3' DT A 4 -2.986 1.826 7.240 1.00 0.00 C ATOM 105 O3' DT A 4 -1.884 1.870 8.158 1.00 0.00 O ATOM 106 C2' DT A 4 -3.940 2.953 7.613 1.00 0.00 C ATOM 107 C1' DT A 4 -3.327 4.121 6.837 1.00 0.00 C ATOM 108 N1 DT A 4 -4.295 5.230 6.604 1.00 0.00 N ATOM 109 C2 DT A 4 -4.141 6.415 7.341 1.00 0.00 C ATOM 110 O2 DT A 4 -3.233 6.613 8.151 1.00 0.00 O ATOM 111 N3 DT A 4 -5.072 7.409 7.129 1.00 0.00 N ATOM 112 C4 DT A 4 -6.142 7.334 6.266 1.00 0.00 C ATOM 113 O4 DT A 4 -6.899 8.303 6.178 1.00 0.00 O ATOM 114 C5 DT A 4 -6.255 6.073 5.533 1.00 0.00 C ATOM 115 C7 DT A 4 -7.402 5.860 4.556 1.00 0.00 C ATOM 116 C6 DT A 4 -5.346 5.078 5.720 1.00 0.00 C ATOM 0 H5' DT A 4 -3.238 1.745 3.740 1.00 0.00 H new ATOM 0 H5'' DT A 4 -3.311 0.359 4.810 1.00 0.00 H new ATOM 0 H4' DT A 4 -1.634 1.861 5.572 1.00 0.00 H new ATOM 0 H3' DT A 4 -3.350 0.801 7.308 1.00 0.00 H new ATOM 0 H2' DT A 4 -4.965 2.745 7.305 1.00 0.00 H new ATOM 0 H2'' DT A 4 -3.961 3.137 8.687 1.00 0.00 H new ATOM 0 H1' DT A 4 -2.523 4.574 7.417 1.00 0.00 H new ATOM 0 H3 DT A 4 -4.958 8.274 7.657 1.00 0.00 H new ATOM 0 H71 DT A 4 -8.271 6.428 4.886 1.00 0.00 H new ATOM 0 H72 DT A 4 -7.103 6.198 3.564 1.00 0.00 H new ATOM 0 H73 DT A 4 -7.655 4.800 4.517 1.00 0.00 H new ATOM 0 H6 DT A 4 -5.448 4.155 5.169 1.00 0.00 H new ATOM 129 P DG A 5 -0.512 1.015 7.965 1.00 0.00 P ATOM 130 OP1 DG A 5 0.019 0.715 9.322 1.00 0.00 O ATOM 131 OP2 DG A 5 0.364 1.769 7.029 1.00 0.00 O ATOM 132 O5' DG A 5 -0.915 -0.384 7.252 1.00 0.00 O ATOM 133 C5' DG A 5 -1.703 -1.371 7.917 1.00 0.00 C ATOM 134 C4' DG A 5 -2.027 -2.590 7.028 1.00 0.00 C ATOM 135 O4' DG A 5 -2.692 -2.196 5.828 1.00 0.00 O ATOM 136 C3' DG A 5 -0.787 -3.411 6.615 1.00 0.00 C ATOM 137 O3' DG A 5 -0.902 -4.792 6.956 1.00 0.00 O ATOM 138 C2' DG A 5 -0.776 -3.259 5.101 1.00 0.00 C ATOM 139 C1' DG A 5 -2.260 -3.082 4.808 1.00 0.00 C ATOM 140 N9 DG A 5 -2.557 -2.597 3.437 1.00 0.00 N ATOM 141 C8 DG A 5 -3.323 -3.251 2.506 1.00 0.00 C ATOM 142 N7 DG A 5 -3.439 -2.638 1.357 1.00 0.00 N ATOM 143 C5 DG A 5 -2.676 -1.476 1.537 1.00 0.00 C ATOM 144 C6 DG A 5 -2.390 -0.381 0.641 1.00 0.00 C ATOM 145 O6 DG A 5 -2.768 -0.208 -0.519 1.00 0.00 O ATOM 146 N1 DG A 5 -1.568 0.592 1.175 1.00 0.00 N ATOM 147 C2 DG A 5 -1.052 0.512 2.427 1.00 0.00 C ATOM 148 N2 DG A 5 -0.296 1.507 2.813 1.00 0.00 N ATOM 149 N3 DG A 5 -1.282 -0.472 3.293 1.00 0.00 N ATOM 150 C4 DG A 5 -2.113 -1.446 2.799 1.00 0.00 C ATOM 0 H5' DG A 5 -2.635 -0.917 8.253 1.00 0.00 H new ATOM 0 H5'' DG A 5 -1.174 -1.709 8.808 1.00 0.00 H new ATOM 0 H4' DG A 5 -2.667 -3.215 7.651 1.00 0.00 H new ATOM 0 H3' DG A 5 0.116 -3.065 7.118 1.00 0.00 H new ATOM 0 H2' DG A 5 -0.188 -2.400 4.778 1.00 0.00 H new ATOM 0 H2'' DG A 5 -0.360 -4.135 4.603 1.00 0.00 H new ATOM 0 H1' DG A 5 -2.794 -4.032 4.822 1.00 0.00 H new ATOM 0 H8 DG A 5 -3.795 -4.201 2.707 1.00 0.00 H new ATOM 0 H1 DG A 5 -1.339 1.405 0.604 1.00 0.00 H new ATOM 0 H21 DG A 5 0.119 1.501 3.745 1.00 0.00 H new ATOM 0 H22 DG A 5 -0.121 2.289 2.182 1.00 0.00 H new ATOM 162 P DG A 6 -0.340 -5.346 8.368 1.00 0.00 P ATOM 163 OP1 DG A 6 -0.700 -6.784 8.491 1.00 0.00 O ATOM 164 OP2 DG A 6 -0.781 -4.420 9.444 1.00 0.00 O ATOM 165 O5' DG A 6 1.274 -5.213 8.240 1.00 0.00 O ATOM 166 C5' DG A 6 2.087 -6.191 7.591 1.00 0.00 C ATOM 167 C4' DG A 6 1.912 -6.303 6.061 1.00 0.00 C ATOM 168 O4' DG A 6 2.224 -5.062 5.418 1.00 0.00 O ATOM 169 C3' DG A 6 2.920 -7.351 5.513 1.00 0.00 C ATOM 170 O3' DG A 6 2.489 -8.120 4.383 1.00 0.00 O ATOM 171 C2' DG A 6 4.054 -6.447 5.024 1.00 0.00 C ATOM 172 C1' DG A 6 3.204 -5.330 4.435 1.00 0.00 C ATOM 173 N9 DG A 6 3.949 -4.116 4.028 1.00 0.00 N ATOM 174 C8 DG A 6 4.569 -3.159 4.795 1.00 0.00 C ATOM 175 N7 DG A 6 5.053 -2.150 4.108 1.00 0.00 N ATOM 176 C5 DG A 6 4.735 -2.472 2.778 1.00 0.00 C ATOM 177 C6 DG A 6 4.960 -1.780 1.527 1.00 0.00 C ATOM 178 O6 DG A 6 5.509 -0.694 1.302 1.00 0.00 O ATOM 179 N1 DG A 6 4.472 -2.472 0.436 1.00 0.00 N ATOM 180 C2 DG A 6 3.882 -3.681 0.499 1.00 0.00 C ATOM 181 N2 DG A 6 3.490 -4.183 -0.637 1.00 0.00 N ATOM 182 N3 DG A 6 3.661 -4.363 1.615 1.00 0.00 N ATOM 183 C4 DG A 6 4.101 -3.698 2.727 1.00 0.00 C ATOM 0 H5' DG A 6 1.875 -7.164 8.034 1.00 0.00 H new ATOM 0 H5'' DG A 6 3.132 -5.965 7.803 1.00 0.00 H new ATOM 0 H4' DG A 6 0.878 -6.582 5.861 1.00 0.00 H new ATOM 0 H3' DG A 6 3.132 -8.093 6.282 1.00 0.00 H new ATOM 0 H2' DG A 6 4.703 -6.106 5.831 1.00 0.00 H new ATOM 0 H2'' DG A 6 4.692 -6.930 4.284 1.00 0.00 H new ATOM 0 H1' DG A 6 2.772 -5.653 3.488 1.00 0.00 H new ATOM 0 H8 DG A 6 4.651 -3.231 5.869 1.00 0.00 H new ATOM 0 H1 DG A 6 4.565 -2.037 -0.482 1.00 0.00 H new ATOM 0 H21 DG A 6 3.035 -5.096 -0.661 1.00 0.00 H new ATOM 0 H22 DG A 6 3.638 -3.663 -1.502 1.00 0.00 H new ATOM 195 P DG A 7 1.205 -9.115 4.390 1.00 0.00 P ATOM 196 OP1 DG A 7 0.530 -9.069 5.714 1.00 0.00 O ATOM 197 OP2 DG A 7 1.655 -10.438 3.876 1.00 0.00 O ATOM 198 O5' DG A 7 0.227 -8.466 3.269 1.00 0.00 O ATOM 199 C5' DG A 7 -0.138 -7.091 3.292 1.00 0.00 C ATOM 200 C4' DG A 7 -0.898 -6.643 2.030 1.00 0.00 C ATOM 201 O4' DG A 7 -0.920 -5.212 2.054 1.00 0.00 O ATOM 202 C3' DG A 7 -0.219 -7.065 0.704 1.00 0.00 C ATOM 203 O3' DG A 7 -1.195 -7.276 -0.322 1.00 0.00 O ATOM 204 C2' DG A 7 0.614 -5.822 0.414 1.00 0.00 C ATOM 205 C1' DG A 7 -0.385 -4.751 0.825 1.00 0.00 C ATOM 206 N9 DG A 7 0.224 -3.405 0.853 1.00 0.00 N ATOM 207 C8 DG A 7 0.952 -2.787 1.837 1.00 0.00 C ATOM 208 N7 DG A 7 1.432 -1.616 1.502 1.00 0.00 N ATOM 209 C5 DG A 7 1.001 -1.455 0.179 1.00 0.00 C ATOM 210 C6 DG A 7 1.200 -0.394 -0.778 1.00 0.00 C ATOM 211 O6 DG A 7 1.777 0.688 -0.656 1.00 0.00 O ATOM 212 N1 DG A 7 0.638 -0.658 -2.007 1.00 0.00 N ATOM 213 C2 DG A 7 -0.092 -1.757 -2.287 1.00 0.00 C ATOM 214 N2 DG A 7 -0.558 -1.848 -3.499 1.00 0.00 N ATOM 215 N3 DG A 7 -0.323 -2.752 -1.440 1.00 0.00 N ATOM 216 C4 DG A 7 0.255 -2.546 -0.217 1.00 0.00 C ATOM 0 H5' DG A 7 0.761 -6.485 3.401 1.00 0.00 H new ATOM 0 H5'' DG A 7 -0.758 -6.901 4.168 1.00 0.00 H new ATOM 0 H4' DG A 7 -1.882 -7.111 2.052 1.00 0.00 H new ATOM 0 H3' DG A 7 0.348 -7.995 0.754 1.00 0.00 H new ATOM 0 H2' DG A 7 1.532 -5.786 1.001 1.00 0.00 H new ATOM 0 H2'' DG A 7 0.903 -5.746 -0.634 1.00 0.00 H new ATOM 0 H1' DG A 7 -1.192 -4.613 0.106 1.00 0.00 H new ATOM 0 H8 DG A 7 1.116 -3.230 2.808 1.00 0.00 H new ATOM 0 H1 DG A 7 0.783 0.021 -2.754 1.00 0.00 H new ATOM 0 H21 DG A 7 -1.117 -2.656 -3.771 1.00 0.00 H new ATOM 0 H22 DG A 7 -0.364 -1.111 -4.177 1.00 0.00 H new ATOM 228 P DT A 8 -0.893 -8.115 -1.680 1.00 0.00 P ATOM 229 OP1 DT A 8 -2.173 -8.215 -2.436 1.00 0.00 O ATOM 230 OP2 DT A 8 -0.207 -9.379 -1.294 1.00 0.00 O ATOM 231 O5' DT A 8 0.152 -7.245 -2.563 1.00 0.00 O ATOM 232 C5' DT A 8 -0.192 -5.990 -3.147 1.00 0.00 C ATOM 233 C4' DT A 8 0.955 -5.352 -3.959 1.00 0.00 C ATOM 234 O4' DT A 8 2.129 -5.212 -3.158 1.00 0.00 O ATOM 235 C3' DT A 8 1.352 -6.194 -5.187 1.00 0.00 C ATOM 236 O3' DT A 8 1.763 -5.415 -6.315 1.00 0.00 O ATOM 237 C2' DT A 8 2.549 -6.984 -4.668 1.00 0.00 C ATOM 238 C1' DT A 8 3.191 -5.949 -3.752 1.00 0.00 C ATOM 239 N1 DT A 8 4.069 -6.534 -2.704 1.00 0.00 N ATOM 240 C2 DT A 8 5.444 -6.257 -2.750 1.00 0.00 C ATOM 241 O2 DT A 8 6.003 -5.708 -3.699 1.00 0.00 O ATOM 242 N3 DT A 8 6.188 -6.638 -1.657 1.00 0.00 N ATOM 243 C4 DT A 8 5.713 -7.302 -0.544 1.00 0.00 C ATOM 244 O4 DT A 8 6.503 -7.576 0.359 1.00 0.00 O ATOM 245 C5 DT A 8 4.283 -7.621 -0.588 1.00 0.00 C ATOM 246 C7 DT A 8 3.628 -8.374 0.559 1.00 0.00 C ATOM 247 C6 DT A 8 3.523 -7.248 -1.654 1.00 0.00 C ATOM 0 H5' DT A 8 -0.494 -5.302 -2.357 1.00 0.00 H new ATOM 0 H5'' DT A 8 -1.055 -6.126 -3.798 1.00 0.00 H new ATOM 0 H4' DT A 8 0.577 -4.383 -4.285 1.00 0.00 H new ATOM 0 H3' DT A 8 0.511 -6.786 -5.548 1.00 0.00 H new ATOM 0 H2' DT A 8 2.250 -7.884 -4.131 1.00 0.00 H new ATOM 0 H2'' DT A 8 3.217 -7.299 -5.470 1.00 0.00 H new ATOM 0 H1' DT A 8 3.850 -5.316 -4.347 1.00 0.00 H new ATOM 0 H3 DT A 8 7.182 -6.409 -1.670 1.00 0.00 H new ATOM 0 H71 DT A 8 4.359 -9.034 1.026 1.00 0.00 H new ATOM 0 H72 DT A 8 3.258 -7.662 1.297 1.00 0.00 H new ATOM 0 H73 DT A 8 2.796 -8.966 0.177 1.00 0.00 H new ATOM 0 H6 DT A 8 2.477 -7.514 -1.680 1.00 0.00 H new ATOM 260 P DG A 9 0.752 -4.437 -7.131 1.00 0.00 P ATOM 261 OP1 DG A 9 -0.644 -4.730 -6.710 1.00 0.00 O ATOM 262 OP2 DG A 9 1.099 -4.540 -8.574 1.00 0.00 O ATOM 263 O5' DG A 9 1.149 -2.949 -6.624 1.00 0.00 O ATOM 264 C5' DG A 9 0.331 -1.816 -6.923 1.00 0.00 C ATOM 265 C4' DG A 9 0.991 -0.462 -6.588 1.00 0.00 C ATOM 266 O4' DG A 9 1.394 -0.452 -5.213 1.00 0.00 O ATOM 267 C3' DG A 9 2.241 -0.190 -7.454 1.00 0.00 C ATOM 268 O3' DG A 9 2.282 1.172 -7.892 1.00 0.00 O ATOM 269 C2' DG A 9 3.363 -0.529 -6.482 1.00 0.00 C ATOM 270 C1' DG A 9 2.770 -0.112 -5.143 1.00 0.00 C ATOM 271 N9 DG A 9 3.460 -0.820 -4.042 1.00 0.00 N ATOM 272 C8 DG A 9 3.533 -2.174 -3.832 1.00 0.00 C ATOM 273 N7 DG A 9 4.466 -2.531 -2.987 1.00 0.00 N ATOM 274 C5 DG A 9 5.043 -1.313 -2.603 1.00 0.00 C ATOM 275 C6 DG A 9 6.142 -1.017 -1.722 1.00 0.00 C ATOM 276 O6 DG A 9 6.922 -1.798 -1.174 1.00 0.00 O ATOM 277 N1 DG A 9 6.264 0.323 -1.425 1.00 0.00 N ATOM 278 C2 DG A 9 5.539 1.293 -2.040 1.00 0.00 C ATOM 279 N2 DG A 9 5.785 2.535 -1.721 1.00 0.00 N ATOM 280 N3 DG A 9 4.578 1.071 -2.937 1.00 0.00 N ATOM 281 C4 DG A 9 4.356 -0.259 -3.164 1.00 0.00 C ATOM 0 H5' DG A 9 -0.605 -1.900 -6.370 1.00 0.00 H new ATOM 0 H5'' DG A 9 0.077 -1.833 -7.983 1.00 0.00 H new ATOM 0 H4' DG A 9 0.252 0.313 -6.791 1.00 0.00 H new ATOM 0 H3' DG A 9 2.286 -0.763 -8.380 1.00 0.00 H new ATOM 0 H2' DG A 9 3.613 -1.590 -6.503 1.00 0.00 H new ATOM 0 H2'' DG A 9 4.278 0.018 -6.710 1.00 0.00 H new ATOM 0 H1' DG A 9 2.892 0.953 -4.945 1.00 0.00 H new ATOM 0 H8 DG A 9 2.879 -2.881 -4.320 1.00 0.00 H new ATOM 0 H1 DG A 9 6.933 0.601 -0.707 1.00 0.00 H new ATOM 0 H21 DG A 9 5.259 3.289 -2.163 1.00 0.00 H new ATOM 0 H22 DG A 9 6.503 2.751 -1.029 1.00 0.00 H new ATOM 293 P DT A 10 3.407 1.736 -8.930 1.00 0.00 P ATOM 294 OP1 DT A 10 2.877 2.990 -9.542 1.00 0.00 O ATOM 295 OP2 DT A 10 3.814 0.632 -9.843 1.00 0.00 O ATOM 296 O5' DT A 10 4.697 2.121 -8.018 1.00 0.00 O ATOM 297 C5' DT A 10 4.628 3.177 -7.063 1.00 0.00 C ATOM 298 C4' DT A 10 5.886 3.345 -6.200 1.00 0.00 C ATOM 299 O4' DT A 10 6.129 2.165 -5.438 1.00 0.00 O ATOM 300 C3' DT A 10 7.169 3.640 -7.011 1.00 0.00 C ATOM 301 O3' DT A 10 7.959 4.727 -6.510 1.00 0.00 O ATOM 302 C2' DT A 10 7.977 2.358 -6.815 1.00 0.00 C ATOM 303 C1' DT A 10 7.526 1.956 -5.411 1.00 0.00 C ATOM 304 N1 DT A 10 7.871 0.555 -5.034 1.00 0.00 N ATOM 305 C2 DT A 10 8.692 0.353 -3.914 1.00 0.00 C ATOM 306 O2 DT A 10 9.144 1.263 -3.219 1.00 0.00 O ATOM 307 N3 DT A 10 8.986 -0.952 -3.589 1.00 0.00 N ATOM 308 C4 DT A 10 8.553 -2.072 -4.267 1.00 0.00 C ATOM 309 O4 DT A 10 8.915 -3.181 -3.868 1.00 0.00 O ATOM 310 C5 DT A 10 7.699 -1.793 -5.424 1.00 0.00 C ATOM 311 C7 DT A 10 7.139 -2.934 -6.258 1.00 0.00 C ATOM 312 C6 DT A 10 7.401 -0.512 -5.771 1.00 0.00 C ATOM 0 H5' DT A 10 3.775 3.000 -6.407 1.00 0.00 H new ATOM 0 H5'' DT A 10 4.437 4.112 -7.589 1.00 0.00 H new ATOM 0 H4' DT A 10 5.678 4.205 -5.564 1.00 0.00 H new ATOM 0 H3' DT A 10 6.914 3.917 -8.034 1.00 0.00 H new ATOM 0 H2' DT A 10 7.738 1.599 -7.560 1.00 0.00 H new ATOM 0 H2'' DT A 10 9.051 2.533 -6.871 1.00 0.00 H new ATOM 0 H1' DT A 10 8.040 2.543 -4.650 1.00 0.00 H new ATOM 0 H3 DT A 10 9.578 -1.104 -2.772 1.00 0.00 H new ATOM 0 H71 DT A 10 6.181 -2.637 -6.684 1.00 0.00 H new ATOM 0 H72 DT A 10 7.835 -3.173 -7.062 1.00 0.00 H new ATOM 0 H73 DT A 10 6.999 -3.812 -5.627 1.00 0.00 H new ATOM 0 H6 DT A 10 6.785 -0.327 -6.639 1.00 0.00 H new ATOM 325 P DG A 11 7.506 6.279 -6.639 1.00 0.00 P ATOM 326 OP1 DG A 11 6.818 6.463 -7.947 1.00 0.00 O ATOM 327 OP2 DG A 11 8.699 7.120 -6.346 1.00 0.00 O ATOM 328 O5' DG A 11 6.463 6.459 -5.408 1.00 0.00 O ATOM 329 C5' DG A 11 5.535 7.541 -5.312 1.00 0.00 C ATOM 330 C4' DG A 11 4.336 7.431 -6.277 1.00 0.00 C ATOM 331 O4' DG A 11 3.750 6.136 -6.232 1.00 0.00 O ATOM 332 C3' DG A 11 3.214 8.439 -5.948 1.00 0.00 C ATOM 333 O3' DG A 11 2.858 9.211 -7.093 1.00 0.00 O ATOM 334 C2' DG A 11 2.051 7.530 -5.549 1.00 0.00 C ATOM 335 C1' DG A 11 2.353 6.292 -6.389 1.00 0.00 C ATOM 336 N9 DG A 11 1.600 5.079 -5.972 1.00 0.00 N ATOM 337 C8 DG A 11 0.629 4.419 -6.685 1.00 0.00 C ATOM 338 N7 DG A 11 0.119 3.380 -6.078 1.00 0.00 N ATOM 339 C5 DG A 11 0.811 3.343 -4.866 1.00 0.00 C ATOM 340 C6 DG A 11 0.705 2.449 -3.746 1.00 0.00 C ATOM 341 O6 DG A 11 -0.052 1.494 -3.588 1.00 0.00 O ATOM 342 N1 DG A 11 1.555 2.745 -2.704 1.00 0.00 N ATOM 343 C2 DG A 11 2.381 3.819 -2.703 1.00 0.00 C ATOM 344 N2 DG A 11 3.043 4.065 -1.600 1.00 0.00 N ATOM 345 N3 DG A 11 2.519 4.678 -3.708 1.00 0.00 N ATOM 346 C4 DG A 11 1.708 4.385 -4.777 1.00 0.00 C ATOM 0 H5' DG A 11 6.061 8.475 -5.509 1.00 0.00 H new ATOM 0 H5'' DG A 11 5.161 7.595 -4.290 1.00 0.00 H new ATOM 0 H4' DG A 11 4.747 7.642 -7.264 1.00 0.00 H new ATOM 0 H3' DG A 11 3.502 9.157 -5.180 1.00 0.00 H new ATOM 0 H2' DG A 11 2.044 7.313 -4.481 1.00 0.00 H new ATOM 0 H2'' DG A 11 1.083 7.968 -5.792 1.00 0.00 H new ATOM 0 HO3' DG A 11 2.144 9.839 -6.855 1.00 0.00 H new ATOM 0 H1' DG A 11 2.041 6.418 -7.426 1.00 0.00 H new ATOM 0 H8 DG A 11 0.312 4.733 -7.668 1.00 0.00 H new ATOM 0 H1 DG A 11 1.563 2.126 -1.894 1.00 0.00 H new ATOM 0 H21 DG A 11 3.677 4.863 -1.553 1.00 0.00 H new ATOM 0 H22 DG A 11 2.925 3.459 -0.788 1.00 0.00 H new TER 358 DG A 11