USER MOD reduce.3.24.130724 H: found=0, std=0, add=127, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 127 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 35:sc= 1.32 USER MOD Single : A 3 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 4 DT C7 :methyl 150:sc= -1.22 (180deg=-1.22) USER MOD Single : A 7 DT C7 :methyl 150:sc= -0.0572 (180deg=-0.0572) USER MOD Single : A 9 DT C7 :methyl -30:sc= 0 (180deg=-0.00349) USER MOD Single : A 11 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -4.715 0.707 -6.026 1.00 0.00 O ATOM 2 C5' DG A 1 -5.140 0.294 -7.317 1.00 0.00 C ATOM 3 C4' DG A 1 -5.824 -1.085 -7.341 1.00 0.00 C ATOM 4 O4' DG A 1 -4.837 -2.086 -7.152 1.00 0.00 O ATOM 5 C3' DG A 1 -6.911 -1.231 -6.259 1.00 0.00 C ATOM 6 O3' DG A 1 -8.189 -1.677 -6.731 1.00 0.00 O ATOM 7 C2' DG A 1 -6.227 -2.130 -5.234 1.00 0.00 C ATOM 8 C1' DG A 1 -5.182 -2.897 -6.046 1.00 0.00 C ATOM 9 N9 DG A 1 -3.964 -3.238 -5.280 1.00 0.00 N ATOM 10 C8 DG A 1 -3.429 -4.492 -5.100 1.00 0.00 C ATOM 11 N7 DG A 1 -2.366 -4.520 -4.344 1.00 0.00 N ATOM 12 C5 DG A 1 -2.182 -3.175 -3.995 1.00 0.00 C ATOM 13 C6 DG A 1 -1.186 -2.545 -3.178 1.00 0.00 C ATOM 14 O6 DG A 1 -0.245 -3.080 -2.596 1.00 0.00 O ATOM 15 N1 DG A 1 -1.347 -1.181 -3.067 1.00 0.00 N ATOM 16 C2 DG A 1 -2.337 -0.475 -3.662 1.00 0.00 C ATOM 17 N2 DG A 1 -2.390 0.824 -3.488 1.00 0.00 N ATOM 18 N3 DG A 1 -3.278 -1.021 -4.430 1.00 0.00 N ATOM 19 C4 DG A 1 -3.153 -2.381 -4.561 1.00 0.00 C ATOM 0 H5' DG A 1 -4.277 0.271 -7.982 1.00 0.00 H new ATOM 0 H5'' DG A 1 -5.830 1.037 -7.716 1.00 0.00 H new ATOM 0 H4' DG A 1 -6.317 -1.193 -8.307 1.00 0.00 H new ATOM 0 H3' DG A 1 -7.222 -0.277 -5.833 1.00 0.00 H new ATOM 0 H2' DG A 1 -5.764 -1.546 -4.439 1.00 0.00 H new ATOM 0 H2'' DG A 1 -6.938 -2.806 -4.760 1.00 0.00 H new ATOM 0 HO5' DG A 1 -4.409 -0.073 -5.517 1.00 0.00 H new ATOM 0 H1' DG A 1 -5.616 -3.850 -6.347 1.00 0.00 H new ATOM 0 H8 DG A 1 -3.853 -5.379 -5.547 1.00 0.00 H new ATOM 0 H1 DG A 1 -0.674 -0.668 -2.497 1.00 0.00 H new ATOM 0 H21 DG A 1 -3.131 1.368 -3.931 1.00 0.00 H new ATOM 0 H22 DG A 1 -1.691 1.290 -2.910 1.00 0.00 H new ATOM 32 P DG A 2 -8.559 -3.187 -7.136 1.00 0.00 P ATOM 33 OP1 DG A 2 -7.458 -3.757 -7.940 1.00 0.00 O ATOM 34 OP2 DG A 2 -9.906 -3.155 -7.741 1.00 0.00 O ATOM 35 O5' DG A 2 -8.655 -3.943 -5.729 1.00 0.00 O ATOM 36 C5' DG A 2 -8.532 -5.349 -5.618 1.00 0.00 C ATOM 37 C4' DG A 2 -8.620 -5.892 -4.173 1.00 0.00 C ATOM 38 O4' DG A 2 -7.315 -5.821 -3.594 1.00 0.00 O ATOM 39 C3' DG A 2 -9.609 -5.104 -3.282 1.00 0.00 C ATOM 40 O3' DG A 2 -10.515 -5.824 -2.434 1.00 0.00 O ATOM 41 C2' DG A 2 -8.656 -4.231 -2.491 1.00 0.00 C ATOM 42 C1' DG A 2 -7.390 -5.087 -2.381 1.00 0.00 C ATOM 43 N9 DG A 2 -6.183 -4.276 -2.086 1.00 0.00 N ATOM 44 C8 DG A 2 -6.056 -2.906 -2.083 1.00 0.00 C ATOM 45 N7 DG A 2 -4.965 -2.467 -1.544 1.00 0.00 N ATOM 46 C5 DG A 2 -4.299 -3.620 -1.149 1.00 0.00 C ATOM 47 C6 DG A 2 -3.040 -3.791 -0.491 1.00 0.00 C ATOM 48 O6 DG A 2 -2.241 -2.940 -0.113 1.00 0.00 O ATOM 49 N1 DG A 2 -2.722 -5.114 -0.268 1.00 0.00 N ATOM 50 C2 DG A 2 -3.517 -6.150 -0.631 1.00 0.00 C ATOM 51 N2 DG A 2 -3.099 -7.359 -0.362 1.00 0.00 N ATOM 52 N3 DG A 2 -4.694 -6.046 -1.241 1.00 0.00 N ATOM 53 C4 DG A 2 -5.036 -4.739 -1.476 1.00 0.00 C ATOM 0 H5' DG A 2 -7.577 -5.652 -6.048 1.00 0.00 H new ATOM 0 H5'' DG A 2 -9.314 -5.817 -6.216 1.00 0.00 H new ATOM 0 H4' DG A 2 -8.992 -6.915 -4.225 1.00 0.00 H new ATOM 0 H3' DG A 2 -10.348 -4.599 -3.905 1.00 0.00 H new ATOM 0 H2' DG A 2 -8.459 -3.288 -3.001 1.00 0.00 H new ATOM 0 H2'' DG A 2 -9.060 -3.984 -1.509 1.00 0.00 H new ATOM 0 H1' DG A 2 -7.437 -5.772 -1.534 1.00 0.00 H new ATOM 0 H8 DG A 2 -6.807 -2.250 -2.497 1.00 0.00 H new ATOM 0 H1 DG A 2 -1.839 -5.325 0.196 1.00 0.00 H new ATOM 0 H21 DG A 2 -3.669 -8.165 -0.619 1.00 0.00 H new ATOM 0 H22 DG A 2 -2.203 -7.497 0.105 1.00 0.00 H new ATOM 65 P DT A 3 -10.104 -6.887 -1.293 1.00 0.00 P ATOM 66 OP1 DT A 3 -9.188 -7.869 -1.894 1.00 0.00 O ATOM 67 OP2 DT A 3 -11.383 -7.384 -0.741 1.00 0.00 O ATOM 68 O5' DT A 3 -9.329 -6.087 -0.130 1.00 0.00 O ATOM 69 C5' DT A 3 -10.004 -5.182 0.732 1.00 0.00 C ATOM 70 C4' DT A 3 -9.174 -4.541 1.867 1.00 0.00 C ATOM 71 O4' DT A 3 -9.002 -5.462 2.937 1.00 0.00 O ATOM 72 C3' DT A 3 -7.785 -3.981 1.536 1.00 0.00 C ATOM 73 O3' DT A 3 -7.480 -2.862 2.363 1.00 0.00 O ATOM 74 C2' DT A 3 -6.869 -5.151 1.880 1.00 0.00 C ATOM 75 C1' DT A 3 -7.627 -5.816 3.041 1.00 0.00 C ATOM 76 N1 DT A 3 -7.541 -7.304 3.090 1.00 0.00 N ATOM 77 C2 DT A 3 -7.315 -7.920 4.335 1.00 0.00 C ATOM 78 O2 DT A 3 -7.010 -7.320 5.369 1.00 0.00 O ATOM 79 N3 DT A 3 -7.467 -9.288 4.395 1.00 0.00 N ATOM 80 C4 DT A 3 -7.850 -10.098 3.352 1.00 0.00 C ATOM 81 O4 DT A 3 -8.086 -11.284 3.579 1.00 0.00 O ATOM 82 C5 DT A 3 -7.992 -9.416 2.068 1.00 0.00 C ATOM 83 C7 DT A 3 -8.361 -10.208 0.825 1.00 0.00 C ATOM 84 C6 DT A 3 -7.841 -8.067 1.976 1.00 0.00 C ATOM 0 H5' DT A 3 -10.845 -5.708 1.183 1.00 0.00 H new ATOM 0 H5'' DT A 3 -10.420 -4.380 0.122 1.00 0.00 H new ATOM 0 H4' DT A 3 -9.784 -3.672 2.114 1.00 0.00 H new ATOM 0 H3' DT A 3 -7.693 -3.632 0.507 1.00 0.00 H new ATOM 0 H2' DT A 3 -6.738 -5.829 1.036 1.00 0.00 H new ATOM 0 H2'' DT A 3 -5.875 -4.818 2.179 1.00 0.00 H new ATOM 0 H1' DT A 3 -7.151 -5.453 3.952 1.00 0.00 H new ATOM 0 H3 DT A 3 -7.279 -9.739 5.290 1.00 0.00 H new ATOM 0 H71 DT A 3 -8.923 -9.571 0.141 1.00 0.00 H new ATOM 0 H72 DT A 3 -7.453 -10.557 0.333 1.00 0.00 H new ATOM 0 H73 DT A 3 -8.972 -11.065 1.108 1.00 0.00 H new ATOM 0 H6 DT A 3 -7.957 -7.584 1.017 1.00 0.00 H new ATOM 97 P DT A 4 -6.363 -1.807 1.892 1.00 0.00 P ATOM 98 OP1 DT A 4 -6.839 -1.244 0.617 1.00 0.00 O ATOM 99 OP2 DT A 4 -5.045 -2.469 1.960 1.00 0.00 O ATOM 100 O5' DT A 4 -6.357 -0.622 2.981 1.00 0.00 O ATOM 101 C5' DT A 4 -5.427 0.437 2.819 1.00 0.00 C ATOM 102 C4' DT A 4 -5.645 1.710 3.632 1.00 0.00 C ATOM 103 O4' DT A 4 -6.967 2.177 3.390 1.00 0.00 O ATOM 104 C3' DT A 4 -5.468 1.499 5.134 1.00 0.00 C ATOM 105 O3' DT A 4 -4.707 2.499 5.821 1.00 0.00 O ATOM 106 C2' DT A 4 -6.887 1.286 5.626 1.00 0.00 C ATOM 107 C1' DT A 4 -7.744 1.997 4.566 1.00 0.00 C ATOM 108 N1 DT A 4 -9.066 1.337 4.298 1.00 0.00 N ATOM 109 C2 DT A 4 -10.209 2.154 4.241 1.00 0.00 C ATOM 110 O2 DT A 4 -10.185 3.386 4.255 1.00 0.00 O ATOM 111 N3 DT A 4 -11.429 1.524 4.177 1.00 0.00 N ATOM 112 C4 DT A 4 -11.640 0.167 4.177 1.00 0.00 C ATOM 113 O4 DT A 4 -12.796 -0.249 4.141 1.00 0.00 O ATOM 114 C5 DT A 4 -10.424 -0.637 4.213 1.00 0.00 C ATOM 115 C7 DT A 4 -10.524 -2.152 4.211 1.00 0.00 C ATOM 116 C6 DT A 4 -9.202 -0.042 4.241 1.00 0.00 C ATOM 0 H5' DT A 4 -5.414 0.712 1.764 1.00 0.00 H new ATOM 0 H5'' DT A 4 -4.436 0.052 3.060 1.00 0.00 H new ATOM 0 H4' DT A 4 -4.893 2.433 3.317 1.00 0.00 H new ATOM 0 H3' DT A 4 -4.829 0.644 5.355 1.00 0.00 H new ATOM 0 H2' DT A 4 -7.133 0.226 5.696 1.00 0.00 H new ATOM 0 H2'' DT A 4 -7.037 1.714 6.617 1.00 0.00 H new ATOM 0 H1' DT A 4 -8.026 2.972 4.964 1.00 0.00 H new ATOM 0 H3 DT A 4 -12.255 2.120 4.125 1.00 0.00 H new ATOM 0 H71 DT A 4 -9.645 -2.574 3.723 1.00 0.00 H new ATOM 0 H72 DT A 4 -10.578 -2.514 5.238 1.00 0.00 H new ATOM 0 H73 DT A 4 -11.420 -2.457 3.671 1.00 0.00 H new ATOM 0 H6 DT A 4 -8.315 -0.658 4.218 1.00 0.00 H new ATOM 129 P DG A 5 -5.012 4.084 5.957 1.00 0.00 P ATOM 130 OP1 DG A 5 -4.107 4.518 7.046 1.00 0.00 O ATOM 131 OP2 DG A 5 -6.456 4.327 6.153 1.00 0.00 O ATOM 132 O5' DG A 5 -4.517 4.885 4.663 1.00 0.00 O ATOM 133 C5' DG A 5 -5.333 5.211 3.533 1.00 0.00 C ATOM 134 C4' DG A 5 -4.553 6.086 2.525 1.00 0.00 C ATOM 135 O4' DG A 5 -3.213 5.621 2.443 1.00 0.00 O ATOM 136 C3' DG A 5 -5.104 6.099 1.086 1.00 0.00 C ATOM 137 O3' DG A 5 -4.903 7.424 0.568 1.00 0.00 O ATOM 138 C2' DG A 5 -4.314 4.922 0.504 1.00 0.00 C ATOM 139 C1' DG A 5 -2.963 4.928 1.231 1.00 0.00 C ATOM 140 N9 DG A 5 -2.375 3.599 1.591 1.00 0.00 N ATOM 141 C8 DG A 5 -1.500 3.389 2.627 1.00 0.00 C ATOM 142 N7 DG A 5 -1.249 2.141 2.916 1.00 0.00 N ATOM 143 C5 DG A 5 -2.027 1.446 1.990 1.00 0.00 C ATOM 144 C6 DG A 5 -2.183 0.031 1.796 1.00 0.00 C ATOM 145 O6 DG A 5 -1.641 -0.876 2.439 1.00 0.00 O ATOM 146 N1 DG A 5 -3.047 -0.283 0.769 1.00 0.00 N ATOM 147 C2 DG A 5 -3.682 0.656 0.020 1.00 0.00 C ATOM 148 N2 DG A 5 -4.479 0.276 -0.927 1.00 0.00 N ATOM 149 N3 DG A 5 -3.562 1.969 0.170 1.00 0.00 N ATOM 150 C4 DG A 5 -2.716 2.321 1.177 1.00 0.00 C ATOM 0 H5' DG A 5 -6.227 5.740 3.865 1.00 0.00 H new ATOM 0 H5'' DG A 5 -5.667 4.296 3.044 1.00 0.00 H new ATOM 0 H4' DG A 5 -4.646 7.100 2.914 1.00 0.00 H new ATOM 0 H3' DG A 5 -6.164 5.947 0.883 1.00 0.00 H new ATOM 0 H2' DG A 5 -4.840 3.981 0.663 1.00 0.00 H new ATOM 0 H2'' DG A 5 -4.180 5.034 -0.572 1.00 0.00 H new ATOM 0 H1' DG A 5 -2.235 5.370 0.550 1.00 0.00 H new ATOM 0 H8 DG A 5 -1.047 4.206 3.170 1.00 0.00 H new ATOM 0 H1 DG A 5 -3.218 -1.267 0.561 1.00 0.00 H new ATOM 0 H21 DG A 5 -4.962 0.971 -1.497 1.00 0.00 H new ATOM 0 H22 DG A 5 -4.624 -0.718 -1.103 1.00 0.00 H new ATOM 162 P DG A 6 -4.601 7.846 -0.958 1.00 0.00 P ATOM 163 OP1 DG A 6 -5.050 9.242 -1.195 1.00 0.00 O ATOM 164 OP2 DG A 6 -5.067 6.817 -1.910 1.00 0.00 O ATOM 165 O5' DG A 6 -3.003 7.866 -0.987 1.00 0.00 O ATOM 166 C5' DG A 6 -2.274 8.685 -0.071 1.00 0.00 C ATOM 167 C4' DG A 6 -0.758 8.449 -0.130 1.00 0.00 C ATOM 168 O4' DG A 6 -0.526 7.069 0.113 1.00 0.00 O ATOM 169 C3' DG A 6 -0.135 8.812 -1.492 1.00 0.00 C ATOM 170 O3' DG A 6 0.980 9.717 -1.517 1.00 0.00 O ATOM 171 C2' DG A 6 0.177 7.455 -2.115 1.00 0.00 C ATOM 172 C1' DG A 6 0.258 6.502 -0.915 1.00 0.00 C ATOM 173 N9 DG A 6 -0.246 5.127 -1.173 1.00 0.00 N ATOM 174 C8 DG A 6 -1.275 4.704 -1.988 1.00 0.00 C ATOM 175 N7 DG A 6 -1.430 3.405 -2.057 1.00 0.00 N ATOM 176 C5 DG A 6 -0.410 2.942 -1.210 1.00 0.00 C ATOM 177 C6 DG A 6 -0.015 1.619 -0.837 1.00 0.00 C ATOM 178 O6 DG A 6 -0.497 0.553 -1.179 1.00 0.00 O ATOM 179 N1 DG A 6 1.052 1.566 0.022 1.00 0.00 N ATOM 180 C2 DG A 6 1.695 2.650 0.496 1.00 0.00 C ATOM 181 N2 DG A 6 2.696 2.451 1.310 1.00 0.00 N ATOM 182 N3 DG A 6 1.374 3.901 0.188 1.00 0.00 N ATOM 183 C4 DG A 6 0.312 3.982 -0.672 1.00 0.00 C ATOM 0 H5' DG A 6 -2.627 8.491 0.942 1.00 0.00 H new ATOM 0 H5'' DG A 6 -2.481 9.733 -0.285 1.00 0.00 H new ATOM 0 H4' DG A 6 -0.293 9.094 0.616 1.00 0.00 H new ATOM 0 H3' DG A 6 -0.843 9.420 -2.055 1.00 0.00 H new ATOM 0 H2' DG A 6 -0.601 7.149 -2.815 1.00 0.00 H new ATOM 0 H2'' DG A 6 1.115 7.477 -2.670 1.00 0.00 H new ATOM 0 H1' DG A 6 1.313 6.393 -0.662 1.00 0.00 H new ATOM 0 H8 DG A 6 -1.906 5.393 -2.529 1.00 0.00 H new ATOM 0 H1 DG A 6 1.380 0.647 0.321 1.00 0.00 H new ATOM 0 H21 DG A 6 3.209 3.246 1.691 1.00 0.00 H new ATOM 0 H22 DG A 6 2.965 1.501 1.565 1.00 0.00 H new ATOM 195 P DT A 7 2.315 9.622 -0.614 1.00 0.00 P ATOM 196 OP1 DT A 7 1.949 9.617 0.814 1.00 0.00 O ATOM 197 OP2 DT A 7 3.199 10.717 -1.077 1.00 0.00 O ATOM 198 O5' DT A 7 3.031 8.245 -0.992 1.00 0.00 O ATOM 199 C5' DT A 7 3.952 7.647 -0.091 1.00 0.00 C ATOM 200 C4' DT A 7 4.758 6.495 -0.707 1.00 0.00 C ATOM 201 O4' DT A 7 3.951 5.339 -0.912 1.00 0.00 O ATOM 202 C3' DT A 7 5.438 6.853 -2.048 1.00 0.00 C ATOM 203 O3' DT A 7 6.863 6.774 -2.182 1.00 0.00 O ATOM 204 C2' DT A 7 4.697 5.962 -3.035 1.00 0.00 C ATOM 205 C1' DT A 7 4.300 4.771 -2.157 1.00 0.00 C ATOM 206 N1 DT A 7 3.257 3.855 -2.708 1.00 0.00 N ATOM 207 C2 DT A 7 3.417 2.483 -2.464 1.00 0.00 C ATOM 208 O2 DT A 7 4.295 2.010 -1.753 1.00 0.00 O ATOM 209 N3 DT A 7 2.520 1.633 -3.065 1.00 0.00 N ATOM 210 C4 DT A 7 1.520 1.999 -3.934 1.00 0.00 C ATOM 211 O4 DT A 7 0.841 1.116 -4.459 1.00 0.00 O ATOM 212 C5 DT A 7 1.369 3.444 -4.113 1.00 0.00 C ATOM 213 C7 DT A 7 0.229 3.997 -4.954 1.00 0.00 C ATOM 214 C6 DT A 7 2.210 4.311 -3.485 1.00 0.00 C ATOM 0 H5' DT A 7 3.408 7.275 0.777 1.00 0.00 H new ATOM 0 H5'' DT A 7 4.642 8.410 0.269 1.00 0.00 H new ATOM 0 H4' DT A 7 5.539 6.290 0.025 1.00 0.00 H new ATOM 0 H3' DT A 7 5.355 7.929 -2.203 1.00 0.00 H new ATOM 0 H2' DT A 7 3.827 6.462 -3.462 1.00 0.00 H new ATOM 0 H2'' DT A 7 5.332 5.660 -3.868 1.00 0.00 H new ATOM 0 H1' DT A 7 5.139 4.079 -2.083 1.00 0.00 H new ATOM 0 H3 DT A 7 2.604 0.640 -2.846 1.00 0.00 H new ATOM 0 H71 DT A 7 -0.059 4.978 -4.576 1.00 0.00 H new ATOM 0 H72 DT A 7 0.553 4.088 -5.991 1.00 0.00 H new ATOM 0 H73 DT A 7 -0.625 3.322 -4.898 1.00 0.00 H new ATOM 0 H6 DT A 7 2.056 5.374 -3.596 1.00 0.00 H new ATOM 227 P DG A 8 7.800 5.522 -1.809 1.00 0.00 P ATOM 228 OP1 DG A 8 7.579 5.182 -0.392 1.00 0.00 O ATOM 229 OP2 DG A 8 9.178 5.885 -2.210 1.00 0.00 O ATOM 230 O5' DG A 8 7.377 4.278 -2.726 1.00 0.00 O ATOM 231 C5' DG A 8 7.706 2.948 -2.326 1.00 0.00 C ATOM 232 C4' DG A 8 8.004 1.990 -3.493 1.00 0.00 C ATOM 233 O4' DG A 8 6.799 1.547 -4.110 1.00 0.00 O ATOM 234 C3' DG A 8 8.923 2.630 -4.549 1.00 0.00 C ATOM 235 O3' DG A 8 10.226 2.043 -4.698 1.00 0.00 O ATOM 236 C2' DG A 8 7.987 2.777 -5.748 1.00 0.00 C ATOM 237 C1' DG A 8 6.835 1.777 -5.508 1.00 0.00 C ATOM 238 N9 DG A 8 5.515 2.309 -5.975 1.00 0.00 N ATOM 239 C8 DG A 8 5.128 3.626 -6.038 1.00 0.00 C ATOM 240 N7 DG A 8 4.006 3.850 -6.663 1.00 0.00 N ATOM 241 C5 DG A 8 3.542 2.559 -6.943 1.00 0.00 C ATOM 242 C6 DG A 8 2.300 2.119 -7.528 1.00 0.00 C ATOM 243 O6 DG A 8 1.433 2.777 -8.112 1.00 0.00 O ATOM 244 N1 DG A 8 2.063 0.775 -7.349 1.00 0.00 N ATOM 245 C2 DG A 8 2.972 -0.078 -6.815 1.00 0.00 C ATOM 246 N2 DG A 8 2.572 -1.307 -6.630 1.00 0.00 N ATOM 247 N3 DG A 8 4.197 0.254 -6.405 1.00 0.00 N ATOM 248 C4 DG A 8 4.416 1.607 -6.446 1.00 0.00 C ATOM 0 H5' DG A 8 6.881 2.543 -1.741 1.00 0.00 H new ATOM 0 H5'' DG A 8 8.575 2.983 -1.669 1.00 0.00 H new ATOM 0 H4' DG A 8 8.526 1.133 -3.068 1.00 0.00 H new ATOM 0 H3' DG A 8 9.328 3.605 -4.278 1.00 0.00 H new ATOM 0 H2' DG A 8 7.610 3.797 -5.827 1.00 0.00 H new ATOM 0 H2'' DG A 8 8.508 2.557 -6.680 1.00 0.00 H new ATOM 0 H1' DG A 8 7.010 0.862 -6.073 1.00 0.00 H new ATOM 0 H8 DG A 8 5.713 4.421 -5.600 1.00 0.00 H new ATOM 0 H1 DG A 8 1.157 0.401 -7.633 1.00 0.00 H new ATOM 0 H21 DG A 8 3.210 -1.996 -6.232 1.00 0.00 H new ATOM 0 H22 DG A 8 1.622 -1.578 -6.884 1.00 0.00 H new ATOM 260 P DT A 9 10.646 0.824 -5.655 1.00 0.00 P ATOM 261 OP1 DT A 9 12.054 0.520 -5.327 1.00 0.00 O ATOM 262 OP2 DT A 9 10.349 1.173 -7.054 1.00 0.00 O ATOM 263 O5' DT A 9 9.777 -0.445 -5.273 1.00 0.00 O ATOM 264 C5' DT A 9 9.999 -1.169 -4.073 1.00 0.00 C ATOM 265 C4' DT A 9 9.056 -2.375 -3.913 1.00 0.00 C ATOM 266 O4' DT A 9 7.837 -2.097 -4.592 1.00 0.00 O ATOM 267 C3' DT A 9 9.610 -3.664 -4.544 1.00 0.00 C ATOM 268 O3' DT A 9 9.173 -4.822 -3.853 1.00 0.00 O ATOM 269 C2' DT A 9 8.964 -3.678 -5.919 1.00 0.00 C ATOM 270 C1' DT A 9 7.602 -3.061 -5.600 1.00 0.00 C ATOM 271 N1 DT A 9 6.928 -2.411 -6.754 1.00 0.00 N ATOM 272 C2 DT A 9 5.598 -2.750 -7.042 1.00 0.00 C ATOM 273 O2 DT A 9 4.869 -3.414 -6.297 1.00 0.00 O ATOM 274 N3 DT A 9 5.086 -2.281 -8.230 1.00 0.00 N ATOM 275 C4 DT A 9 5.697 -1.372 -9.063 1.00 0.00 C ATOM 276 O4 DT A 9 5.092 -1.020 -10.073 1.00 0.00 O ATOM 277 C5 DT A 9 7.025 -0.936 -8.623 1.00 0.00 C ATOM 278 C7 DT A 9 7.808 0.118 -9.380 1.00 0.00 C ATOM 279 C6 DT A 9 7.591 -1.469 -7.511 1.00 0.00 C ATOM 0 H5' DT A 9 9.871 -0.499 -3.223 1.00 0.00 H new ATOM 0 H5'' DT A 9 11.032 -1.517 -4.051 1.00 0.00 H new ATOM 0 H4' DT A 9 8.931 -2.527 -2.841 1.00 0.00 H new ATOM 0 H3' DT A 9 10.700 -3.676 -4.537 1.00 0.00 H new ATOM 0 H2' DT A 9 9.525 -3.090 -6.645 1.00 0.00 H new ATOM 0 H2'' DT A 9 8.877 -4.686 -6.325 1.00 0.00 H new ATOM 0 H1' DT A 9 6.927 -3.861 -5.295 1.00 0.00 H new ATOM 0 H3 DT A 9 4.175 -2.638 -8.518 1.00 0.00 H new ATOM 0 H71 DT A 9 7.548 0.075 -10.438 1.00 0.00 H new ATOM 0 H72 DT A 9 7.565 1.105 -8.986 1.00 0.00 H new ATOM 0 H73 DT A 9 8.876 -0.067 -9.261 1.00 0.00 H new ATOM 0 H6 DT A 9 8.579 -1.149 -7.214 1.00 0.00 H new ATOM 292 P DG A 10 9.938 -5.400 -2.571 1.00 0.00 P ATOM 293 OP1 DG A 10 11.391 -5.236 -2.779 1.00 0.00 O ATOM 294 OP2 DG A 10 9.426 -6.779 -2.396 1.00 0.00 O ATOM 295 O5' DG A 10 9.488 -4.509 -1.307 1.00 0.00 O ATOM 296 C5' DG A 10 10.370 -3.541 -0.742 1.00 0.00 C ATOM 297 C4' DG A 10 9.879 -2.811 0.525 1.00 0.00 C ATOM 298 O4' DG A 10 8.961 -1.742 0.285 1.00 0.00 O ATOM 299 C3' DG A 10 9.284 -3.713 1.628 1.00 0.00 C ATOM 300 O3' DG A 10 9.972 -3.783 2.889 1.00 0.00 O ATOM 301 C2' DG A 10 7.853 -3.201 1.740 1.00 0.00 C ATOM 302 C1' DG A 10 7.998 -1.736 1.335 1.00 0.00 C ATOM 303 N9 DG A 10 6.670 -1.142 1.014 1.00 0.00 N ATOM 304 C8 DG A 10 5.856 -0.431 1.867 1.00 0.00 C ATOM 305 N7 DG A 10 4.650 -0.200 1.420 1.00 0.00 N ATOM 306 C5 DG A 10 4.662 -0.809 0.159 1.00 0.00 C ATOM 307 C6 DG A 10 3.648 -0.919 -0.854 1.00 0.00 C ATOM 308 O6 DG A 10 2.497 -0.504 -0.869 1.00 0.00 O ATOM 309 N1 DG A 10 4.044 -1.603 -1.976 1.00 0.00 N ATOM 310 C2 DG A 10 5.274 -2.127 -2.123 1.00 0.00 C ATOM 311 N2 DG A 10 5.510 -2.749 -3.238 1.00 0.00 N ATOM 312 N3 DG A 10 6.251 -2.062 -1.232 1.00 0.00 N ATOM 313 C4 DG A 10 5.890 -1.385 -0.098 1.00 0.00 C ATOM 0 H5' DG A 10 10.586 -2.792 -1.504 1.00 0.00 H new ATOM 0 H5'' DG A 10 11.312 -4.036 -0.506 1.00 0.00 H new ATOM 0 H4' DG A 10 10.820 -2.400 0.890 1.00 0.00 H new ATOM 0 H3' DG A 10 9.375 -4.761 1.344 1.00 0.00 H new ATOM 0 H2' DG A 10 7.175 -3.740 1.078 1.00 0.00 H new ATOM 0 H2'' DG A 10 7.462 -3.306 2.752 1.00 0.00 H new ATOM 0 H1' DG A 10 8.357 -1.082 2.130 1.00 0.00 H new ATOM 0 H8 DG A 10 6.190 -0.089 2.835 1.00 0.00 H new ATOM 0 H1 DG A 10 3.373 -1.720 -2.735 1.00 0.00 H new ATOM 0 H21 DG A 10 6.425 -3.167 -3.405 1.00 0.00 H new ATOM 0 H22 DG A 10 4.780 -2.820 -3.947 1.00 0.00 H new ATOM 325 P DG A 11 10.373 -2.538 3.849 1.00 0.00 P ATOM 326 OP1 DG A 11 10.771 -1.374 3.039 1.00 0.00 O ATOM 327 OP2 DG A 11 11.318 -3.082 4.852 1.00 0.00 O ATOM 328 O5' DG A 11 9.025 -2.166 4.626 1.00 0.00 O ATOM 329 C5' DG A 11 8.916 -0.927 5.323 1.00 0.00 C ATOM 330 C4' DG A 11 7.544 -0.732 5.983 1.00 0.00 C ATOM 331 O4' DG A 11 6.516 -0.883 5.023 1.00 0.00 O ATOM 332 C3' DG A 11 7.236 -1.740 7.095 1.00 0.00 C ATOM 333 O3' DG A 11 7.533 -1.228 8.387 1.00 0.00 O ATOM 334 C2' DG A 11 5.727 -1.944 6.994 1.00 0.00 C ATOM 335 C1' DG A 11 5.325 -1.270 5.676 1.00 0.00 C ATOM 336 N9 DG A 11 4.556 -2.184 4.804 1.00 0.00 N ATOM 337 C8 DG A 11 4.858 -3.475 4.448 1.00 0.00 C ATOM 338 N7 DG A 11 3.913 -4.085 3.786 1.00 0.00 N ATOM 339 C5 DG A 11 2.902 -3.115 3.696 1.00 0.00 C ATOM 340 C6 DG A 11 1.597 -3.150 3.089 1.00 0.00 C ATOM 341 O6 DG A 11 1.050 -4.076 2.494 1.00 0.00 O ATOM 342 N1 DG A 11 0.891 -1.972 3.213 1.00 0.00 N ATOM 343 C2 DG A 11 1.376 -0.882 3.850 1.00 0.00 C ATOM 344 N2 DG A 11 0.603 0.165 3.894 1.00 0.00 N ATOM 345 N3 DG A 11 2.568 -0.794 4.428 1.00 0.00 N ATOM 346 C4 DG A 11 3.291 -1.951 4.317 1.00 0.00 C ATOM 0 H5' DG A 11 9.099 -0.108 4.628 1.00 0.00 H new ATOM 0 H5'' DG A 11 9.692 -0.876 6.087 1.00 0.00 H new ATOM 0 H4' DG A 11 7.582 0.269 6.413 1.00 0.00 H new ATOM 0 H3' DG A 11 7.829 -2.647 6.975 1.00 0.00 H new ATOM 0 H2' DG A 11 5.471 -3.003 6.990 1.00 0.00 H new ATOM 0 H2'' DG A 11 5.210 -1.494 7.842 1.00 0.00 H new ATOM 0 HO3' DG A 11 7.319 -1.904 9.064 1.00 0.00 H new ATOM 0 H1' DG A 11 4.685 -0.413 5.887 1.00 0.00 H new ATOM 0 H8 DG A 11 5.798 -3.946 4.695 1.00 0.00 H new ATOM 0 H1 DG A 11 -0.042 -1.920 2.805 1.00 0.00 H new ATOM 0 H21 DG A 11 0.920 1.014 4.362 1.00 0.00 H new ATOM 0 H22 DG A 11 -0.320 0.136 3.460 1.00 0.00 H new TER 359 DG A 11