USER MOD reduce.3.24.130724 H: found=0, std=0, add=127, rem=0, adj=3 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 150:sc= 0 (180deg=0) USER MOD Single : A 8 DT C7 :methyl -30:sc= 0 (180deg=-0.0651) 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 -1.494 9.406 -5.003 1.00 0.00 O ATOM 2 C5' DG A 1 -1.675 9.059 -6.380 1.00 0.00 C ATOM 3 C4' DG A 1 -2.556 7.814 -6.596 1.00 0.00 C ATOM 4 O4' DG A 1 -1.927 6.654 -6.058 1.00 0.00 O ATOM 5 C3' DG A 1 -3.955 7.941 -5.971 1.00 0.00 C ATOM 6 O3' DG A 1 -4.935 7.518 -6.918 1.00 0.00 O ATOM 7 C2' DG A 1 -3.841 7.045 -4.740 1.00 0.00 C ATOM 8 C1' DG A 1 -2.827 5.992 -5.180 1.00 0.00 C ATOM 9 N9 DG A 1 -2.087 5.439 -4.024 1.00 0.00 N ATOM 10 C8 DG A 1 -1.093 6.051 -3.298 1.00 0.00 C ATOM 11 N7 DG A 1 -0.647 5.345 -2.293 1.00 0.00 N ATOM 12 C5 DG A 1 -1.420 4.177 -2.347 1.00 0.00 C ATOM 13 C6 DG A 1 -1.422 3.004 -1.513 1.00 0.00 C ATOM 14 O6 DG A 1 -0.718 2.711 -0.547 1.00 0.00 O ATOM 15 N1 DG A 1 -2.357 2.074 -1.885 1.00 0.00 N ATOM 16 C2 DG A 1 -3.139 2.180 -2.978 1.00 0.00 C ATOM 17 N2 DG A 1 -3.876 1.128 -3.211 1.00 0.00 N ATOM 18 N3 DG A 1 -3.172 3.231 -3.799 1.00 0.00 N ATOM 19 C4 DG A 1 -2.292 4.216 -3.419 1.00 0.00 C ATOM 0 H5' DG A 1 -0.699 8.885 -6.833 1.00 0.00 H new ATOM 0 H5'' DG A 1 -2.122 9.905 -6.902 1.00 0.00 H new ATOM 0 H4' DG A 1 -2.677 7.724 -7.676 1.00 0.00 H new ATOM 0 H3' DG A 1 -4.266 8.949 -5.696 1.00 0.00 H new ATOM 0 H2' DG A 1 -3.496 7.599 -3.867 1.00 0.00 H new ATOM 0 H2'' DG A 1 -4.799 6.598 -4.475 1.00 0.00 H new ATOM 0 HO5' DG A 1 -0.925 10.201 -4.938 1.00 0.00 H new ATOM 0 H1' DG A 1 -3.330 5.154 -5.664 1.00 0.00 H new ATOM 0 H8 DG A 1 -0.713 7.033 -3.538 1.00 0.00 H new ATOM 0 H1 DG A 1 -2.469 1.248 -1.297 1.00 0.00 H new ATOM 0 H21 DG A 1 -4.502 1.112 -4.016 1.00 0.00 H new ATOM 0 H22 DG A 1 -3.826 0.322 -2.588 1.00 0.00 H new ATOM 32 P DT A 2 -6.524 7.689 -6.672 1.00 0.00 P ATOM 33 OP1 DT A 2 -7.162 7.806 -8.009 1.00 0.00 O ATOM 34 OP2 DT A 2 -6.767 8.764 -5.673 1.00 0.00 O ATOM 35 O5' DT A 2 -6.935 6.270 -6.022 1.00 0.00 O ATOM 36 C5' DT A 2 -8.278 5.799 -6.039 1.00 0.00 C ATOM 37 C4' DT A 2 -8.403 4.337 -5.581 1.00 0.00 C ATOM 38 O4' DT A 2 -7.682 3.479 -6.466 1.00 0.00 O ATOM 39 C3' DT A 2 -7.883 4.101 -4.155 1.00 0.00 C ATOM 40 O3' DT A 2 -8.744 3.182 -3.480 1.00 0.00 O ATOM 41 C2' DT A 2 -6.514 3.481 -4.401 1.00 0.00 C ATOM 42 C1' DT A 2 -6.736 2.728 -5.712 1.00 0.00 C ATOM 43 N1 DT A 2 -5.462 2.550 -6.469 1.00 0.00 N ATOM 44 C2 DT A 2 -4.815 1.312 -6.385 1.00 0.00 C ATOM 45 O2 DT A 2 -5.214 0.383 -5.684 1.00 0.00 O ATOM 46 N3 DT A 2 -3.658 1.157 -7.109 1.00 0.00 N ATOM 47 C4 DT A 2 -3.063 2.127 -7.886 1.00 0.00 C ATOM 48 O4 DT A 2 -2.040 1.836 -8.507 1.00 0.00 O ATOM 49 C5 DT A 2 -3.758 3.417 -7.892 1.00 0.00 C ATOM 50 C7 DT A 2 -3.197 4.582 -8.690 1.00 0.00 C ATOM 51 C6 DT A 2 -4.914 3.586 -7.195 1.00 0.00 C ATOM 0 H5' DT A 2 -8.679 5.894 -7.048 1.00 0.00 H new ATOM 0 H5'' DT A 2 -8.888 6.431 -5.393 1.00 0.00 H new ATOM 0 H4' DT A 2 -9.469 4.110 -5.593 1.00 0.00 H new ATOM 0 H3' DT A 2 -7.841 4.998 -3.537 1.00 0.00 H new ATOM 0 H2' DT A 2 -5.734 4.237 -4.492 1.00 0.00 H new ATOM 0 H2'' DT A 2 -6.217 2.813 -3.592 1.00 0.00 H new ATOM 0 H1' DT A 2 -7.109 1.723 -5.513 1.00 0.00 H new ATOM 0 H3 DT A 2 -3.200 0.246 -7.068 1.00 0.00 H new ATOM 0 H71 DT A 2 -4.014 5.222 -9.023 1.00 0.00 H new ATOM 0 H72 DT A 2 -2.517 5.159 -8.063 1.00 0.00 H new ATOM 0 H73 DT A 2 -2.657 4.202 -9.557 1.00 0.00 H new ATOM 0 H6 DT A 2 -5.410 4.545 -7.211 1.00 0.00 H new ATOM 64 P DG A 3 -9.087 3.311 -1.905 1.00 0.00 P ATOM 65 OP1 DG A 3 -10.184 2.352 -1.608 1.00 0.00 O ATOM 66 OP2 DG A 3 -9.314 4.748 -1.599 1.00 0.00 O ATOM 67 O5' DG A 3 -7.749 2.838 -1.121 1.00 0.00 O ATOM 68 C5' DG A 3 -7.348 1.471 -1.065 1.00 0.00 C ATOM 69 C4' DG A 3 -6.276 1.196 0.010 1.00 0.00 C ATOM 70 O4' DG A 3 -5.067 1.895 -0.291 1.00 0.00 O ATOM 71 C3' DG A 3 -6.737 1.633 1.416 1.00 0.00 C ATOM 72 O3' DG A 3 -6.291 0.706 2.407 1.00 0.00 O ATOM 73 C2' DG A 3 -6.082 3.003 1.542 1.00 0.00 C ATOM 74 C1' DG A 3 -4.793 2.825 0.747 1.00 0.00 C ATOM 75 N9 DG A 3 -4.316 4.111 0.187 1.00 0.00 N ATOM 76 C8 DG A 3 -4.880 4.887 -0.800 1.00 0.00 C ATOM 77 N7 DG A 3 -4.242 6.007 -1.033 1.00 0.00 N ATOM 78 C5 DG A 3 -3.177 5.971 -0.121 1.00 0.00 C ATOM 79 C6 DG A 3 -2.113 6.909 0.154 1.00 0.00 C ATOM 80 O6 DG A 3 -1.900 8.016 -0.348 1.00 0.00 O ATOM 81 N1 DG A 3 -1.237 6.475 1.133 1.00 0.00 N ATOM 82 C2 DG A 3 -1.364 5.291 1.784 1.00 0.00 C ATOM 83 N2 DG A 3 -0.499 5.006 2.721 1.00 0.00 N ATOM 84 N3 DG A 3 -2.335 4.412 1.584 1.00 0.00 N ATOM 85 C4 DG A 3 -3.211 4.806 0.614 1.00 0.00 C ATOM 0 H5' DG A 3 -6.961 1.172 -2.039 1.00 0.00 H new ATOM 0 H5'' DG A 3 -8.222 0.851 -0.865 1.00 0.00 H new ATOM 0 H4' DG A 3 -6.109 0.119 0.006 1.00 0.00 H new ATOM 0 H3' DG A 3 -7.817 1.667 1.556 1.00 0.00 H new ATOM 0 H2' DG A 3 -6.709 3.793 1.128 1.00 0.00 H new ATOM 0 H2'' DG A 3 -5.885 3.265 2.582 1.00 0.00 H new ATOM 0 H1' DG A 3 -3.999 2.459 1.398 1.00 0.00 H new ATOM 0 H8 DG A 3 -5.772 4.597 -1.336 1.00 0.00 H new ATOM 0 H1 DG A 3 -0.452 7.078 1.379 1.00 0.00 H new ATOM 0 H21 DG A 3 -0.569 4.124 3.228 1.00 0.00 H new ATOM 0 H22 DG A 3 0.246 5.666 2.945 1.00 0.00 H new ATOM 97 P DT A 4 -6.683 0.840 3.981 1.00 0.00 P ATOM 98 OP1 DT A 4 -6.696 -0.531 4.561 1.00 0.00 O ATOM 99 OP2 DT A 4 -7.922 1.656 4.099 1.00 0.00 O ATOM 100 O5' DT A 4 -5.465 1.679 4.661 1.00 0.00 O ATOM 101 C5' DT A 4 -4.164 1.109 4.776 1.00 0.00 C ATOM 102 C4' DT A 4 -3.135 1.985 5.515 1.00 0.00 C ATOM 103 O4' DT A 4 -2.809 3.155 4.766 1.00 0.00 O ATOM 104 C3' DT A 4 -3.604 2.444 6.914 1.00 0.00 C ATOM 105 O3' DT A 4 -2.610 2.202 7.912 1.00 0.00 O ATOM 106 C2' DT A 4 -3.765 3.951 6.737 1.00 0.00 C ATOM 107 C1' DT A 4 -2.696 4.231 5.682 1.00 0.00 C ATOM 108 N1 DT A 4 -2.873 5.557 5.023 1.00 0.00 N ATOM 109 C2 DT A 4 -1.963 6.582 5.329 1.00 0.00 C ATOM 110 O2 DT A 4 -1.017 6.456 6.108 1.00 0.00 O ATOM 111 N3 DT A 4 -2.161 7.796 4.705 1.00 0.00 N ATOM 112 C4 DT A 4 -3.183 8.091 3.825 1.00 0.00 C ATOM 113 O4 DT A 4 -3.241 9.224 3.345 1.00 0.00 O ATOM 114 C5 DT A 4 -4.099 6.981 3.553 1.00 0.00 C ATOM 115 C7 DT A 4 -5.260 7.161 2.589 1.00 0.00 C ATOM 116 C6 DT A 4 -3.921 5.775 4.152 1.00 0.00 C ATOM 0 H5' DT A 4 -3.787 0.896 3.776 1.00 0.00 H new ATOM 0 H5'' DT A 4 -4.246 0.154 5.295 1.00 0.00 H new ATOM 0 H4' DT A 4 -2.263 1.342 5.632 1.00 0.00 H new ATOM 0 H3' DT A 4 -4.503 1.920 7.239 1.00 0.00 H new ATOM 0 H2' DT A 4 -4.764 4.223 6.395 1.00 0.00 H new ATOM 0 H2'' DT A 4 -3.585 4.497 7.663 1.00 0.00 H new ATOM 0 H1' DT A 4 -1.701 4.290 6.123 1.00 0.00 H new ATOM 0 H3 DT A 4 -1.495 8.540 4.912 1.00 0.00 H new ATOM 0 H71 DT A 4 -5.485 6.209 2.109 1.00 0.00 H new ATOM 0 H72 DT A 4 -6.137 7.508 3.136 1.00 0.00 H new ATOM 0 H73 DT A 4 -4.992 7.896 1.830 1.00 0.00 H new ATOM 0 H6 DT A 4 -4.612 4.972 3.943 1.00 0.00 H new ATOM 129 P DG A 5 -2.843 1.112 9.086 1.00 0.00 P ATOM 130 OP1 DG A 5 -4.173 1.364 9.703 1.00 0.00 O ATOM 131 OP2 DG A 5 -1.642 1.124 9.964 1.00 0.00 O ATOM 132 O5' DG A 5 -2.905 -0.310 8.310 1.00 0.00 O ATOM 133 C5' DG A 5 -1.735 -0.960 7.829 1.00 0.00 C ATOM 134 C4' DG A 5 -2.098 -2.232 7.041 1.00 0.00 C ATOM 135 O4' DG A 5 -2.744 -1.891 5.820 1.00 0.00 O ATOM 136 C3' DG A 5 -0.875 -3.101 6.671 1.00 0.00 C ATOM 137 O3' DG A 5 -1.016 -4.449 7.121 1.00 0.00 O ATOM 138 C2' DG A 5 -0.879 -3.047 5.146 1.00 0.00 C ATOM 139 C1' DG A 5 -2.365 -2.866 4.868 1.00 0.00 C ATOM 140 N9 DG A 5 -2.674 -2.470 3.469 1.00 0.00 N ATOM 141 C8 DG A 5 -3.423 -3.194 2.577 1.00 0.00 C ATOM 142 N7 DG A 5 -3.528 -2.659 1.389 1.00 0.00 N ATOM 143 C5 DG A 5 -2.772 -1.481 1.502 1.00 0.00 C ATOM 144 C6 DG A 5 -2.463 -0.460 0.533 1.00 0.00 C ATOM 145 O6 DG A 5 -2.786 -0.382 -0.653 1.00 0.00 O ATOM 146 N1 DG A 5 -1.667 0.550 1.029 1.00 0.00 N ATOM 147 C2 DG A 5 -1.191 0.577 2.290 1.00 0.00 C ATOM 148 N2 DG A 5 -0.406 1.581 2.585 1.00 0.00 N ATOM 149 N3 DG A 5 -1.432 -0.341 3.220 1.00 0.00 N ATOM 150 C4 DG A 5 -2.239 -1.356 2.769 1.00 0.00 C ATOM 0 H5' DG A 5 -1.087 -1.219 8.667 1.00 0.00 H new ATOM 0 H5'' DG A 5 -1.173 -0.279 7.190 1.00 0.00 H new ATOM 0 H4' DG A 5 -2.748 -2.802 7.705 1.00 0.00 H new ATOM 0 H3' DG A 5 0.047 -2.744 7.130 1.00 0.00 H new ATOM 0 H2' DG A 5 -0.283 -2.220 4.761 1.00 0.00 H new ATOM 0 H2'' DG A 5 -0.484 -3.959 4.700 1.00 0.00 H new ATOM 0 H1' DG A 5 -2.922 -3.798 4.963 1.00 0.00 H new ATOM 0 H8 DG A 5 -3.890 -4.133 2.836 1.00 0.00 H new ATOM 0 H1 DG A 5 -1.424 1.321 0.407 1.00 0.00 H new ATOM 0 H21 DG A 5 -0.011 1.662 3.522 1.00 0.00 H new ATOM 0 H22 DG A 5 -0.189 2.283 1.878 1.00 0.00 H new ATOM 162 P DG A 6 -0.409 -4.938 8.547 1.00 0.00 P ATOM 163 OP1 DG A 6 -1.306 -5.998 9.079 1.00 0.00 O ATOM 164 OP2 DG A 6 -0.136 -3.751 9.403 1.00 0.00 O ATOM 165 O5' DG A 6 1.012 -5.643 8.195 1.00 0.00 O ATOM 166 C5' DG A 6 1.951 -5.034 7.316 1.00 0.00 C ATOM 167 C4' DG A 6 1.865 -5.639 5.900 1.00 0.00 C ATOM 168 O4' DG A 6 2.244 -4.638 4.963 1.00 0.00 O ATOM 169 C3' DG A 6 2.824 -6.838 5.720 1.00 0.00 C ATOM 170 O3' DG A 6 2.464 -7.795 4.715 1.00 0.00 O ATOM 171 C2' DG A 6 4.069 -6.108 5.206 1.00 0.00 C ATOM 172 C1' DG A 6 3.393 -5.099 4.281 1.00 0.00 C ATOM 173 N9 DG A 6 4.219 -3.959 3.822 1.00 0.00 N ATOM 174 C8 DG A 6 4.964 -3.052 4.542 1.00 0.00 C ATOM 175 N7 DG A 6 5.456 -2.074 3.821 1.00 0.00 N ATOM 176 C5 DG A 6 5.011 -2.365 2.519 1.00 0.00 C ATOM 177 C6 DG A 6 5.178 -1.674 1.260 1.00 0.00 C ATOM 178 O6 DG A 6 5.772 -0.620 0.998 1.00 0.00 O ATOM 179 N1 DG A 6 4.564 -2.323 0.206 1.00 0.00 N ATOM 180 C2 DG A 6 3.908 -3.492 0.312 1.00 0.00 C ATOM 181 N2 DG A 6 3.420 -3.973 -0.794 1.00 0.00 N ATOM 182 N3 DG A 6 3.718 -4.163 1.437 1.00 0.00 N ATOM 183 C4 DG A 6 4.292 -3.542 2.514 1.00 0.00 C ATOM 0 H5' DG A 6 2.959 -5.165 7.709 1.00 0.00 H new ATOM 0 H5'' DG A 6 1.765 -3.961 7.268 1.00 0.00 H new ATOM 0 H4' DG A 6 0.843 -5.986 5.745 1.00 0.00 H new ATOM 0 H3' DG A 6 2.883 -7.422 6.639 1.00 0.00 H new ATOM 0 H2' DG A 6 4.637 -5.631 6.005 1.00 0.00 H new ATOM 0 H2'' DG A 6 4.756 -6.769 4.677 1.00 0.00 H new ATOM 0 H1' DG A 6 3.168 -5.619 3.350 1.00 0.00 H new ATOM 0 H8 DG A 6 5.128 -3.139 5.606 1.00 0.00 H new ATOM 0 H1 DG A 6 4.612 -1.886 -0.714 1.00 0.00 H new ATOM 0 H21 DG A 6 2.911 -4.857 -0.785 1.00 0.00 H new ATOM 0 H22 DG A 6 3.547 -3.466 -1.670 1.00 0.00 H new ATOM 195 P DG A 7 1.122 -8.710 4.759 1.00 0.00 P ATOM 196 OP1 DG A 7 0.368 -8.457 6.014 1.00 0.00 O ATOM 197 OP2 DG A 7 1.528 -10.112 4.453 1.00 0.00 O ATOM 198 O5' DG A 7 0.243 -8.181 3.498 1.00 0.00 O ATOM 199 C5' DG A 7 -0.132 -6.816 3.381 1.00 0.00 C ATOM 200 C4' DG A 7 -0.912 -6.487 2.100 1.00 0.00 C ATOM 201 O4' DG A 7 -0.986 -5.061 2.050 1.00 0.00 O ATOM 202 C3' DG A 7 -0.200 -6.950 0.806 1.00 0.00 C ATOM 203 O3' DG A 7 -1.159 -7.208 -0.229 1.00 0.00 O ATOM 204 C2' DG A 7 0.622 -5.707 0.484 1.00 0.00 C ATOM 205 C1' DG A 7 -0.407 -4.637 0.828 1.00 0.00 C ATOM 206 N9 DG A 7 0.207 -3.293 0.860 1.00 0.00 N ATOM 207 C8 DG A 7 0.925 -2.673 1.850 1.00 0.00 C ATOM 208 N7 DG A 7 1.435 -1.518 1.501 1.00 0.00 N ATOM 209 C5 DG A 7 1.046 -1.378 0.160 1.00 0.00 C ATOM 210 C6 DG A 7 1.306 -0.352 -0.823 1.00 0.00 C ATOM 211 O6 DG A 7 1.938 0.699 -0.720 1.00 0.00 O ATOM 212 N1 DG A 7 0.750 -0.620 -2.056 1.00 0.00 N ATOM 213 C2 DG A 7 -0.003 -1.711 -2.322 1.00 0.00 C ATOM 214 N2 DG A 7 -0.466 -1.814 -3.538 1.00 0.00 N ATOM 215 N3 DG A 7 -0.276 -2.677 -1.455 1.00 0.00 N ATOM 216 C4 DG A 7 0.282 -2.457 -0.228 1.00 0.00 C ATOM 0 H5' DG A 7 0.766 -6.200 3.415 1.00 0.00 H new ATOM 0 H5'' DG A 7 -0.739 -6.542 4.244 1.00 0.00 H new ATOM 0 H4' DG A 7 -1.875 -6.996 2.139 1.00 0.00 H new ATOM 0 H3' DG A 7 0.379 -7.868 0.901 1.00 0.00 H new ATOM 0 H2' DG A 7 1.525 -5.632 1.090 1.00 0.00 H new ATOM 0 H2'' DG A 7 0.935 -5.669 -0.559 1.00 0.00 H new ATOM 0 H1' DG A 7 -1.188 -4.532 0.075 1.00 0.00 H new ATOM 0 H8 DG A 7 1.059 -3.100 2.833 1.00 0.00 H new ATOM 0 H1 DG A 7 0.917 0.044 -2.812 1.00 0.00 H new ATOM 0 H21 DG A 7 -1.041 -2.615 -3.799 1.00 0.00 H new ATOM 0 H22 DG A 7 -0.253 -1.093 -4.227 1.00 0.00 H new ATOM 228 P DT A 8 -0.821 -8.076 -1.559 1.00 0.00 P ATOM 229 OP1 DT A 8 -2.089 -8.236 -2.321 1.00 0.00 O ATOM 230 OP2 DT A 8 -0.107 -9.309 -1.130 1.00 0.00 O ATOM 231 O5' DT A 8 0.215 -7.216 -2.470 1.00 0.00 O ATOM 232 C5' DT A 8 -0.155 -5.999 -3.120 1.00 0.00 C ATOM 233 C4' DT A 8 0.977 -5.357 -3.957 1.00 0.00 C ATOM 234 O4' DT A 8 2.145 -5.167 -3.160 1.00 0.00 O ATOM 235 C3' DT A 8 1.401 -6.220 -5.163 1.00 0.00 C ATOM 236 O3' DT A 8 1.825 -5.457 -6.298 1.00 0.00 O ATOM 237 C2' DT A 8 2.599 -6.986 -4.600 1.00 0.00 C ATOM 238 C1' DT A 8 3.226 -5.909 -3.717 1.00 0.00 C ATOM 239 N1 DT A 8 4.105 -6.442 -2.641 1.00 0.00 N ATOM 240 C2 DT A 8 5.476 -6.142 -2.689 1.00 0.00 C ATOM 241 O2 DT A 8 6.035 -5.649 -3.669 1.00 0.00 O ATOM 242 N3 DT A 8 6.219 -6.451 -1.572 1.00 0.00 N ATOM 243 C4 DT A 8 5.743 -7.072 -0.436 1.00 0.00 C ATOM 244 O4 DT A 8 6.528 -7.285 0.493 1.00 0.00 O ATOM 245 C5 DT A 8 4.325 -7.427 -0.479 1.00 0.00 C ATOM 246 C7 DT A 8 3.677 -8.136 0.696 1.00 0.00 C ATOM 247 C6 DT A 8 3.567 -7.121 -1.566 1.00 0.00 C ATOM 0 H5' DT A 8 -0.485 -5.284 -2.367 1.00 0.00 H new ATOM 0 H5'' DT A 8 -1.008 -6.193 -3.771 1.00 0.00 H new ATOM 0 H4' DT A 8 0.570 -4.411 -4.314 1.00 0.00 H new ATOM 0 H3' DT A 8 0.574 -6.828 -5.530 1.00 0.00 H new ATOM 0 H2' DT A 8 2.299 -7.866 -4.031 1.00 0.00 H new ATOM 0 H2'' DT A 8 3.277 -7.328 -5.382 1.00 0.00 H new ATOM 0 H1' DT A 8 3.885 -5.291 -4.327 1.00 0.00 H new ATOM 0 H3 DT A 8 7.207 -6.199 -1.586 1.00 0.00 H new ATOM 0 H71 DT A 8 4.419 -8.753 1.203 1.00 0.00 H new ATOM 0 H72 DT A 8 3.281 -7.398 1.393 1.00 0.00 H new ATOM 0 H73 DT A 8 2.864 -8.767 0.337 1.00 0.00 H new ATOM 0 H6 DT A 8 2.528 -7.414 -1.589 1.00 0.00 H new ATOM 260 P DG A 9 0.821 -4.499 -7.144 1.00 0.00 P ATOM 261 OP1 DG A 9 -0.579 -4.794 -6.735 1.00 0.00 O ATOM 262 OP2 DG A 9 1.185 -4.624 -8.581 1.00 0.00 O ATOM 263 O5' DG A 9 1.199 -2.994 -6.662 1.00 0.00 O ATOM 264 C5' DG A 9 0.360 -1.882 -6.974 1.00 0.00 C ATOM 265 C4' DG A 9 0.985 -0.501 -6.675 1.00 0.00 C ATOM 266 O4' DG A 9 1.428 -0.460 -5.316 1.00 0.00 O ATOM 267 C3' DG A 9 2.190 -0.176 -7.580 1.00 0.00 C ATOM 268 O3' DG A 9 2.190 1.196 -7.980 1.00 0.00 O ATOM 269 C2' DG A 9 3.353 -0.515 -6.659 1.00 0.00 C ATOM 270 C1' DG A 9 2.804 -0.115 -5.291 1.00 0.00 C ATOM 271 N9 DG A 9 3.531 -0.840 -4.230 1.00 0.00 N ATOM 272 C8 DG A 9 3.584 -2.194 -4.026 1.00 0.00 C ATOM 273 N7 DG A 9 4.539 -2.575 -3.219 1.00 0.00 N ATOM 274 C5 DG A 9 5.166 -1.373 -2.863 1.00 0.00 C ATOM 275 C6 DG A 9 6.309 -1.104 -2.028 1.00 0.00 C ATOM 276 O6 DG A 9 7.070 -1.903 -1.485 1.00 0.00 O ATOM 277 N1 DG A 9 6.499 0.237 -1.767 1.00 0.00 N ATOM 278 C2 DG A 9 5.772 1.221 -2.358 1.00 0.00 C ATOM 279 N2 DG A 9 6.090 2.458 -2.085 1.00 0.00 N ATOM 280 N3 DG A 9 4.756 1.019 -3.194 1.00 0.00 N ATOM 281 C4 DG A 9 4.490 -0.304 -3.402 1.00 0.00 C ATOM 0 H5' DG A 9 -0.569 -1.975 -6.411 1.00 0.00 H new ATOM 0 H5'' DG A 9 0.098 -1.927 -8.031 1.00 0.00 H new ATOM 0 H4' DG A 9 0.208 0.239 -6.867 1.00 0.00 H new ATOM 0 H3' DG A 9 2.208 -0.721 -8.524 1.00 0.00 H new ATOM 0 H2' DG A 9 3.611 -1.573 -6.701 1.00 0.00 H new ATOM 0 H2'' DG A 9 4.253 0.043 -6.916 1.00 0.00 H new ATOM 0 H1' DG A 9 2.930 0.948 -5.083 1.00 0.00 H new ATOM 0 H8 DG A 9 2.897 -2.886 -4.491 1.00 0.00 H new ATOM 0 H1 DG A 9 7.221 0.503 -1.097 1.00 0.00 H new ATOM 0 H21 DG A 9 5.568 3.224 -2.509 1.00 0.00 H new ATOM 0 H22 DG A 9 6.861 2.658 -1.448 1.00 0.00 H new ATOM 293 P DT A 10 3.263 1.818 -9.037 1.00 0.00 P ATOM 294 OP1 DT A 10 2.683 3.071 -9.593 1.00 0.00 O ATOM 295 OP2 DT A 10 3.660 0.748 -9.997 1.00 0.00 O ATOM 296 O5' DT A 10 4.576 2.216 -8.167 1.00 0.00 O ATOM 297 C5' DT A 10 4.526 3.255 -7.188 1.00 0.00 C ATOM 298 C4' DT A 10 5.836 3.455 -6.405 1.00 0.00 C ATOM 299 O4' DT A 10 6.149 2.284 -5.653 1.00 0.00 O ATOM 300 C3' DT A 10 7.064 3.756 -7.304 1.00 0.00 C ATOM 301 O3' DT A 10 7.894 4.835 -6.858 1.00 0.00 O ATOM 302 C2' DT A 10 7.878 2.470 -7.172 1.00 0.00 C ATOM 303 C1' DT A 10 7.547 2.098 -5.727 1.00 0.00 C ATOM 304 N1 DT A 10 7.944 0.715 -5.335 1.00 0.00 N ATOM 305 C2 DT A 10 8.849 0.548 -4.275 1.00 0.00 C ATOM 306 O2 DT A 10 9.349 1.481 -3.644 1.00 0.00 O ATOM 307 N3 DT A 10 9.187 -0.746 -3.938 1.00 0.00 N ATOM 308 C4 DT A 10 8.720 -1.884 -4.554 1.00 0.00 C ATOM 309 O4 DT A 10 9.120 -2.979 -4.157 1.00 0.00 O ATOM 310 C5 DT A 10 7.781 -1.644 -5.650 1.00 0.00 C ATOM 311 C7 DT A 10 7.175 -2.817 -6.404 1.00 0.00 C ATOM 312 C6 DT A 10 7.441 -0.379 -6.008 1.00 0.00 C ATOM 0 H5' DT A 10 3.725 3.034 -6.482 1.00 0.00 H new ATOM 0 H5'' DT A 10 4.266 4.191 -7.682 1.00 0.00 H new ATOM 0 H4' DT A 10 5.654 4.318 -5.765 1.00 0.00 H new ATOM 0 H3' DT A 10 6.736 4.045 -8.303 1.00 0.00 H new ATOM 0 H2' DT A 10 7.566 1.704 -7.882 1.00 0.00 H new ATOM 0 H2'' DT A 10 8.944 2.633 -7.327 1.00 0.00 H new ATOM 0 H1' DT A 10 8.111 2.713 -5.026 1.00 0.00 H new ATOM 0 H3 DT A 10 9.840 -0.870 -3.165 1.00 0.00 H new ATOM 0 H71 DT A 10 6.184 -2.544 -6.767 1.00 0.00 H new ATOM 0 H72 DT A 10 7.813 -3.074 -7.250 1.00 0.00 H new ATOM 0 H73 DT A 10 7.093 -3.675 -5.737 1.00 0.00 H new ATOM 0 H6 DT A 10 6.764 -0.227 -6.835 1.00 0.00 H new ATOM 325 P DG A 11 7.420 6.387 -6.886 1.00 0.00 P ATOM 326 OP1 DG A 11 6.580 6.609 -8.093 1.00 0.00 O ATOM 327 OP2 DG A 11 8.633 7.229 -6.698 1.00 0.00 O ATOM 328 O5' DG A 11 6.525 6.510 -5.536 1.00 0.00 O ATOM 329 C5' DG A 11 5.635 7.594 -5.264 1.00 0.00 C ATOM 330 C4' DG A 11 4.362 7.605 -6.134 1.00 0.00 C ATOM 331 O4' DG A 11 3.749 6.320 -6.193 1.00 0.00 O ATOM 332 C3' DG A 11 3.301 8.587 -5.589 1.00 0.00 C ATOM 333 O3' DG A 11 2.861 9.497 -6.601 1.00 0.00 O ATOM 334 C2' DG A 11 2.158 7.656 -5.187 1.00 0.00 C ATOM 335 C1' DG A 11 2.349 6.515 -6.188 1.00 0.00 C ATOM 336 N9 DG A 11 1.601 5.283 -5.838 1.00 0.00 N ATOM 337 C8 DG A 11 0.571 4.711 -6.549 1.00 0.00 C ATOM 338 N7 DG A 11 0.090 3.618 -6.022 1.00 0.00 N ATOM 339 C5 DG A 11 0.864 3.447 -4.869 1.00 0.00 C ATOM 340 C6 DG A 11 0.807 2.448 -3.835 1.00 0.00 C ATOM 341 O6 DG A 11 0.054 1.483 -3.724 1.00 0.00 O ATOM 342 N1 DG A 11 1.714 2.646 -2.814 1.00 0.00 N ATOM 343 C2 DG A 11 2.546 3.712 -2.756 1.00 0.00 C ATOM 344 N2 DG A 11 3.256 3.848 -1.664 1.00 0.00 N ATOM 345 N3 DG A 11 2.644 4.659 -3.685 1.00 0.00 N ATOM 346 C4 DG A 11 1.775 4.474 -4.731 1.00 0.00 C ATOM 0 H5' DG A 11 6.169 8.533 -5.411 1.00 0.00 H new ATOM 0 H5'' DG A 11 5.343 7.554 -4.215 1.00 0.00 H new ATOM 0 H4' DG A 11 4.692 7.915 -7.126 1.00 0.00 H new ATOM 0 H3' DG A 11 3.677 9.208 -4.776 1.00 0.00 H new ATOM 0 H2' DG A 11 2.245 7.318 -4.154 1.00 0.00 H new ATOM 0 H2'' DG A 11 1.183 8.133 -5.286 1.00 0.00 H new ATOM 0 HO3' DG A 11 2.189 10.104 -6.226 1.00 0.00 H new ATOM 0 H1' DG A 11 1.948 6.762 -7.171 1.00 0.00 H new ATOM 0 H8 DG A 11 0.191 5.132 -7.468 1.00 0.00 H new ATOM 0 H1 DG A 11 1.760 1.954 -2.066 1.00 0.00 H new ATOM 0 H21 DG A 11 3.899 4.634 -1.568 1.00 0.00 H new ATOM 0 H22 DG A 11 3.166 3.168 -0.909 1.00 0.00 H new TER 358 DG A 11