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 56:sc= 1.31 USER MOD Single : A 3 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 4 DT C7 :methyl 150:sc= -0.898 (180deg=-0.898) USER MOD Single : A 7 DT C7 :methyl -30:sc= -0.0181 (180deg=-0.501) USER MOD Single : A 9 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 -5.346 1.082 -6.105 1.00 0.00 O ATOM 2 C5' DG A 1 -5.750 0.841 -7.444 1.00 0.00 C ATOM 3 C4' DG A 1 -6.219 -0.603 -7.717 1.00 0.00 C ATOM 4 O4' DG A 1 -5.115 -1.498 -7.658 1.00 0.00 O ATOM 5 C3' DG A 1 -7.282 -1.124 -6.730 1.00 0.00 C ATOM 6 O3' DG A 1 -8.157 -2.035 -7.386 1.00 0.00 O ATOM 7 C2' DG A 1 -6.417 -1.868 -5.729 1.00 0.00 C ATOM 8 C1' DG A 1 -5.350 -2.453 -6.637 1.00 0.00 C ATOM 9 N9 DG A 1 -4.107 -2.789 -5.913 1.00 0.00 N ATOM 10 C8 DG A 1 -3.547 -4.034 -5.815 1.00 0.00 C ATOM 11 N7 DG A 1 -2.398 -4.060 -5.198 1.00 0.00 N ATOM 12 C5 DG A 1 -2.182 -2.713 -4.857 1.00 0.00 C ATOM 13 C6 DG A 1 -1.103 -2.066 -4.163 1.00 0.00 C ATOM 14 O6 DG A 1 -0.076 -2.560 -3.697 1.00 0.00 O ATOM 15 N1 DG A 1 -1.279 -0.705 -4.025 1.00 0.00 N ATOM 16 C2 DG A 1 -2.348 -0.015 -4.489 1.00 0.00 C ATOM 17 N2 DG A 1 -2.396 1.281 -4.294 1.00 0.00 N ATOM 18 N3 DG A 1 -3.367 -0.572 -5.140 1.00 0.00 N ATOM 19 C4 DG A 1 -3.229 -1.927 -5.293 1.00 0.00 C ATOM 0 H5' DG A 1 -4.918 1.072 -8.109 1.00 0.00 H new ATOM 0 H5'' DG A 1 -6.559 1.527 -7.696 1.00 0.00 H new ATOM 0 H4' DG A 1 -6.670 -0.567 -8.709 1.00 0.00 H new ATOM 0 H3' DG A 1 -7.914 -0.348 -6.297 1.00 0.00 H new ATOM 0 H2' DG A 1 -5.996 -1.203 -4.975 1.00 0.00 H new ATOM 0 H2'' DG A 1 -6.974 -2.640 -5.198 1.00 0.00 H new ATOM 0 HO5' DG A 1 -4.644 0.445 -5.856 1.00 0.00 H new ATOM 0 H1' DG A 1 -5.696 -3.398 -7.055 1.00 0.00 H new ATOM 0 H8 DG A 1 -4.017 -4.920 -6.215 1.00 0.00 H new ATOM 0 H1 DG A 1 -0.552 -0.181 -3.539 1.00 0.00 H new ATOM 0 H21 DG A 1 -3.192 1.819 -4.636 1.00 0.00 H new ATOM 0 H22 DG A 1 -1.637 1.751 -3.801 1.00 0.00 H new ATOM 32 P DG A 2 -9.576 -2.472 -6.770 1.00 0.00 P ATOM 33 OP1 DG A 2 -10.235 -3.290 -7.814 1.00 0.00 O ATOM 34 OP2 DG A 2 -10.265 -1.261 -6.301 1.00 0.00 O ATOM 35 O5' DG A 2 -9.289 -3.404 -5.499 1.00 0.00 O ATOM 36 C5' DG A 2 -8.907 -4.768 -5.621 1.00 0.00 C ATOM 37 C4' DG A 2 -8.817 -5.536 -4.281 1.00 0.00 C ATOM 38 O4' DG A 2 -7.461 -5.581 -3.834 1.00 0.00 O ATOM 39 C3' DG A 2 -9.636 -4.976 -3.106 1.00 0.00 C ATOM 40 O3' DG A 2 -9.930 -6.054 -2.211 1.00 0.00 O ATOM 41 C2' DG A 2 -8.634 -3.981 -2.540 1.00 0.00 C ATOM 42 C1' DG A 2 -7.350 -4.796 -2.647 1.00 0.00 C ATOM 43 N9 DG A 2 -6.136 -3.951 -2.618 1.00 0.00 N ATOM 44 C8 DG A 2 -6.044 -2.578 -2.656 1.00 0.00 C ATOM 45 N7 DG A 2 -4.900 -2.103 -2.274 1.00 0.00 N ATOM 46 C5 DG A 2 -4.162 -3.235 -1.951 1.00 0.00 C ATOM 47 C6 DG A 2 -2.824 -3.370 -1.462 1.00 0.00 C ATOM 48 O6 DG A 2 -2.002 -2.498 -1.210 1.00 0.00 O ATOM 49 N1 DG A 2 -2.445 -4.676 -1.259 1.00 0.00 N ATOM 50 C2 DG A 2 -3.254 -5.732 -1.496 1.00 0.00 C ATOM 51 N2 DG A 2 -2.762 -6.914 -1.260 1.00 0.00 N ATOM 52 N3 DG A 2 -4.501 -5.667 -1.947 1.00 0.00 N ATOM 53 C4 DG A 2 -4.907 -4.375 -2.159 1.00 0.00 C ATOM 0 H5' DG A 2 -7.938 -4.817 -6.118 1.00 0.00 H new ATOM 0 H5'' DG A 2 -9.623 -5.275 -6.268 1.00 0.00 H new ATOM 0 H4' DG A 2 -9.238 -6.510 -4.529 1.00 0.00 H new ATOM 0 H3' DG A 2 -10.601 -4.523 -3.334 1.00 0.00 H new ATOM 0 H2' DG A 2 -8.591 -3.059 -3.120 1.00 0.00 H new ATOM 0 H2'' DG A 2 -8.863 -3.700 -1.512 1.00 0.00 H new ATOM 0 H1' DG A 2 -7.234 -5.446 -1.780 1.00 0.00 H new ATOM 0 H8 DG A 2 -6.859 -1.947 -2.978 1.00 0.00 H new ATOM 0 H1 DG A 2 -1.503 -4.857 -0.911 1.00 0.00 H new ATOM 0 H21 DG A 2 -3.331 -7.745 -1.422 1.00 0.00 H new ATOM 0 H22 DG A 2 -1.808 -7.009 -0.913 1.00 0.00 H new ATOM 65 P DT A 3 -10.414 -5.856 -0.699 1.00 0.00 P ATOM 66 OP1 DT A 3 -11.090 -7.094 -0.264 1.00 0.00 O ATOM 67 OP2 DT A 3 -11.210 -4.612 -0.623 1.00 0.00 O ATOM 68 O5' DT A 3 -9.079 -5.650 0.167 1.00 0.00 O ATOM 69 C5' DT A 3 -9.159 -5.351 1.555 1.00 0.00 C ATOM 70 C4' DT A 3 -7.801 -5.269 2.265 1.00 0.00 C ATOM 71 O4' DT A 3 -7.226 -6.570 2.299 1.00 0.00 O ATOM 72 C3' DT A 3 -6.785 -4.272 1.686 1.00 0.00 C ATOM 73 O3' DT A 3 -6.260 -3.375 2.667 1.00 0.00 O ATOM 74 C2' DT A 3 -5.719 -5.210 1.139 1.00 0.00 C ATOM 75 C1' DT A 3 -5.858 -6.492 1.967 1.00 0.00 C ATOM 76 N1 DT A 3 -5.469 -7.742 1.248 1.00 0.00 N ATOM 77 C2 DT A 3 -4.655 -8.672 1.912 1.00 0.00 C ATOM 78 O2 DT A 3 -4.302 -8.588 3.088 1.00 0.00 O ATOM 79 N3 DT A 3 -4.222 -9.751 1.178 1.00 0.00 N ATOM 80 C4 DT A 3 -4.476 -9.969 -0.155 1.00 0.00 C ATOM 81 O4 DT A 3 -3.865 -10.875 -0.714 1.00 0.00 O ATOM 82 C5 DT A 3 -5.412 -9.029 -0.768 1.00 0.00 C ATOM 83 C7 DT A 3 -5.820 -9.185 -2.222 1.00 0.00 C ATOM 84 C6 DT A 3 -5.882 -7.974 -0.052 1.00 0.00 C ATOM 0 H5' DT A 3 -9.766 -6.113 2.044 1.00 0.00 H new ATOM 0 H5'' DT A 3 -9.679 -4.401 1.680 1.00 0.00 H new ATOM 0 H4' DT A 3 -8.021 -4.880 3.259 1.00 0.00 H new ATOM 0 H3' DT A 3 -7.214 -3.599 0.943 1.00 0.00 H new ATOM 0 H2' DT A 3 -5.873 -5.407 0.078 1.00 0.00 H new ATOM 0 H2'' DT A 3 -4.723 -4.779 1.242 1.00 0.00 H new ATOM 0 H1' DT A 3 -5.185 -6.431 2.822 1.00 0.00 H new ATOM 0 H3 DT A 3 -3.663 -10.451 1.666 1.00 0.00 H new ATOM 0 H71 DT A 3 -6.831 -8.803 -2.359 1.00 0.00 H new ATOM 0 H72 DT A 3 -5.132 -8.625 -2.855 1.00 0.00 H new ATOM 0 H73 DT A 3 -5.790 -10.239 -2.497 1.00 0.00 H new ATOM 0 H6 DT A 3 -6.594 -7.302 -0.508 1.00 0.00 H new ATOM 97 P DT A 4 -5.128 -2.282 2.280 1.00 0.00 P ATOM 98 OP1 DT A 4 -5.168 -2.097 0.822 1.00 0.00 O ATOM 99 OP2 DT A 4 -3.884 -2.760 2.924 1.00 0.00 O ATOM 100 O5' DT A 4 -5.563 -0.893 2.956 1.00 0.00 O ATOM 101 C5' DT A 4 -4.758 0.274 2.783 1.00 0.00 C ATOM 102 C4' DT A 4 -5.389 1.579 3.308 1.00 0.00 C ATOM 103 O4' DT A 4 -6.472 1.972 2.471 1.00 0.00 O ATOM 104 C3' DT A 4 -5.934 1.415 4.732 1.00 0.00 C ATOM 105 O3' DT A 4 -5.595 2.462 5.653 1.00 0.00 O ATOM 106 C2' DT A 4 -7.425 1.187 4.500 1.00 0.00 C ATOM 107 C1' DT A 4 -7.691 1.943 3.199 1.00 0.00 C ATOM 108 N1 DT A 4 -8.770 1.318 2.389 1.00 0.00 N ATOM 109 C2 DT A 4 -10.019 1.955 2.352 1.00 0.00 C ATOM 110 O2 DT A 4 -10.261 3.050 2.855 1.00 0.00 O ATOM 111 N3 DT A 4 -11.025 1.318 1.665 1.00 0.00 N ATOM 112 C4 DT A 4 -10.895 0.144 0.961 1.00 0.00 C ATOM 113 O4 DT A 4 -11.886 -0.315 0.388 1.00 0.00 O ATOM 114 C5 DT A 4 -9.547 -0.422 0.962 1.00 0.00 C ATOM 115 C7 DT A 4 -9.243 -1.649 0.131 1.00 0.00 C ATOM 116 C6 DT A 4 -8.543 0.160 1.672 1.00 0.00 C ATOM 0 H5' DT A 4 -4.540 0.394 1.722 1.00 0.00 H new ATOM 0 H5'' DT A 4 -3.805 0.119 3.289 1.00 0.00 H new ATOM 0 H4' DT A 4 -4.602 2.333 3.308 1.00 0.00 H new ATOM 0 H3' DT A 4 -5.468 0.584 5.262 1.00 0.00 H new ATOM 0 H2' DT A 4 -7.661 0.127 4.406 1.00 0.00 H new ATOM 0 H2'' DT A 4 -8.025 1.576 5.323 1.00 0.00 H new ATOM 0 H1' DT A 4 -8.036 2.950 3.431 1.00 0.00 H new ATOM 0 H3 DT A 4 -11.947 1.754 1.679 1.00 0.00 H new ATOM 0 H71 DT A 4 -8.200 -1.626 -0.184 1.00 0.00 H new ATOM 0 H72 DT A 4 -9.423 -2.545 0.725 1.00 0.00 H new ATOM 0 H73 DT A 4 -9.887 -1.662 -0.748 1.00 0.00 H new ATOM 0 H6 DT A 4 -7.560 -0.288 1.675 1.00 0.00 H new ATOM 129 P DG A 5 -5.984 4.024 5.568 1.00 0.00 P ATOM 130 OP1 DG A 5 -5.364 4.638 6.766 1.00 0.00 O ATOM 131 OP2 DG A 5 -7.437 4.205 5.413 1.00 0.00 O ATOM 132 O5' DG A 5 -5.191 4.722 4.379 1.00 0.00 O ATOM 133 C5' DG A 5 -5.790 5.180 3.169 1.00 0.00 C ATOM 134 C4' DG A 5 -4.756 5.992 2.379 1.00 0.00 C ATOM 135 O4' DG A 5 -3.528 5.282 2.377 1.00 0.00 O ATOM 136 C3' DG A 5 -5.111 6.317 0.919 1.00 0.00 C ATOM 137 O3' DG A 5 -4.752 7.684 0.735 1.00 0.00 O ATOM 138 C2' DG A 5 -4.250 5.312 0.156 1.00 0.00 C ATOM 139 C1' DG A 5 -3.023 5.163 1.060 1.00 0.00 C ATOM 140 N9 DG A 5 -2.259 3.882 1.031 1.00 0.00 N ATOM 141 C8 DG A 5 -1.177 3.648 1.835 1.00 0.00 C ATOM 142 N7 DG A 5 -0.773 2.410 1.886 1.00 0.00 N ATOM 143 C5 DG A 5 -1.663 1.747 1.038 1.00 0.00 C ATOM 144 C6 DG A 5 -1.741 0.357 0.672 1.00 0.00 C ATOM 145 O6 DG A 5 -1.018 -0.567 1.045 1.00 0.00 O ATOM 146 N1 DG A 5 -2.771 0.082 -0.205 1.00 0.00 N ATOM 147 C2 DG A 5 -3.620 1.027 -0.671 1.00 0.00 C ATOM 148 N2 DG A 5 -4.555 0.660 -1.494 1.00 0.00 N ATOM 149 N3 DG A 5 -3.583 2.317 -0.359 1.00 0.00 N ATOM 150 C4 DG A 5 -2.578 2.636 0.508 1.00 0.00 C ATOM 0 H5' DG A 5 -6.663 5.794 3.390 1.00 0.00 H new ATOM 0 H5'' DG A 5 -6.137 4.334 2.576 1.00 0.00 H new ATOM 0 H4' DG A 5 -4.710 6.953 2.891 1.00 0.00 H new ATOM 0 H3' DG A 5 -6.150 6.228 0.600 1.00 0.00 H new ATOM 0 H2' DG A 5 -4.766 4.362 0.014 1.00 0.00 H new ATOM 0 H2'' DG A 5 -3.981 5.679 -0.834 1.00 0.00 H new ATOM 0 H1' DG A 5 -2.311 5.909 0.707 1.00 0.00 H new ATOM 0 H8 DG A 5 -0.690 4.436 2.390 1.00 0.00 H new ATOM 0 H1 DG A 5 -2.898 -0.881 -0.517 1.00 0.00 H new ATOM 0 H21 DG A 5 -5.210 1.350 -1.862 1.00 0.00 H new ATOM 0 H22 DG A 5 -4.634 -0.318 -1.772 1.00 0.00 H new ATOM 162 P DG A 6 -4.854 8.498 -0.639 1.00 0.00 P ATOM 163 OP1 DG A 6 -5.340 9.861 -0.343 1.00 0.00 O ATOM 164 OP2 DG A 6 -5.558 7.701 -1.670 1.00 0.00 O ATOM 165 O5' DG A 6 -3.308 8.604 -1.063 1.00 0.00 O ATOM 166 C5' DG A 6 -2.395 9.324 -0.238 1.00 0.00 C ATOM 167 C4' DG A 6 -0.927 8.934 -0.464 1.00 0.00 C ATOM 168 O4' DG A 6 -0.827 7.519 -0.319 1.00 0.00 O ATOM 169 C3' DG A 6 -0.393 9.313 -1.863 1.00 0.00 C ATOM 170 O3' DG A 6 0.818 10.082 -1.975 1.00 0.00 O ATOM 171 C2' DG A 6 -0.275 7.971 -2.565 1.00 0.00 C ATOM 172 C1' DG A 6 -0.116 6.976 -1.414 1.00 0.00 C ATOM 173 N9 DG A 6 -0.554 5.589 -1.731 1.00 0.00 N ATOM 174 C8 DG A 6 -1.452 5.138 -2.679 1.00 0.00 C ATOM 175 N7 DG A 6 -1.413 3.849 -2.904 1.00 0.00 N ATOM 176 C5 DG A 6 -0.407 3.420 -2.031 1.00 0.00 C ATOM 177 C6 DG A 6 0.135 2.118 -1.788 1.00 0.00 C ATOM 178 O6 DG A 6 -0.177 1.057 -2.306 1.00 0.00 O ATOM 179 N1 DG A 6 1.128 2.091 -0.848 1.00 0.00 N ATOM 180 C2 DG A 6 1.579 3.182 -0.194 1.00 0.00 C ATOM 181 N2 DG A 6 2.534 2.992 0.674 1.00 0.00 N ATOM 182 N3 DG A 6 1.116 4.416 -0.378 1.00 0.00 N ATOM 183 C4 DG A 6 0.120 4.470 -1.315 1.00 0.00 C ATOM 0 H5' DG A 6 -2.651 9.154 0.808 1.00 0.00 H new ATOM 0 H5'' DG A 6 -2.512 10.391 -0.426 1.00 0.00 H new ATOM 0 H4' DG A 6 -0.328 9.481 0.264 1.00 0.00 H new ATOM 0 H3' DG A 6 -1.085 10.030 -2.304 1.00 0.00 H new ATOM 0 H2' DG A 6 -1.159 7.753 -3.164 1.00 0.00 H new ATOM 0 H2'' DG A 6 0.581 7.945 -3.239 1.00 0.00 H new ATOM 0 H1' DG A 6 0.944 6.855 -1.189 1.00 0.00 H new ATOM 0 H8 DG A 6 -2.134 5.798 -3.195 1.00 0.00 H new ATOM 0 H1 DG A 6 1.554 1.191 -0.628 1.00 0.00 H new ATOM 0 H21 DG A 6 2.913 3.782 1.197 1.00 0.00 H new ATOM 0 H22 DG A 6 2.902 2.054 0.830 1.00 0.00 H new ATOM 195 P DT A 7 2.209 9.815 -1.199 1.00 0.00 P ATOM 196 OP1 DT A 7 1.944 9.840 0.252 1.00 0.00 O ATOM 197 OP2 DT A 7 3.162 10.828 -1.704 1.00 0.00 O ATOM 198 O5' DT A 7 2.812 8.386 -1.595 1.00 0.00 O ATOM 199 C5' DT A 7 3.607 7.679 -0.647 1.00 0.00 C ATOM 200 C4' DT A 7 4.509 6.570 -1.207 1.00 0.00 C ATOM 201 O4' DT A 7 3.736 5.453 -1.611 1.00 0.00 O ATOM 202 C3' DT A 7 5.411 6.989 -2.380 1.00 0.00 C ATOM 203 O3' DT A 7 6.833 6.905 -2.221 1.00 0.00 O ATOM 204 C2' DT A 7 4.874 6.195 -3.563 1.00 0.00 C ATOM 205 C1' DT A 7 4.095 5.035 -2.914 1.00 0.00 C ATOM 206 N1 DT A 7 2.861 4.628 -3.654 1.00 0.00 N ATOM 207 C2 DT A 7 2.582 3.261 -3.756 1.00 0.00 C ATOM 208 O2 DT A 7 3.223 2.382 -3.199 1.00 0.00 O ATOM 209 N3 DT A 7 1.517 2.896 -4.543 1.00 0.00 N ATOM 210 C4 DT A 7 0.712 3.752 -5.256 1.00 0.00 C ATOM 211 O4 DT A 7 -0.168 3.276 -5.970 1.00 0.00 O ATOM 212 C5 DT A 7 1.002 5.170 -5.057 1.00 0.00 C ATOM 213 C7 DT A 7 0.149 6.224 -5.745 1.00 0.00 C ATOM 214 C6 DT A 7 2.030 5.558 -4.254 1.00 0.00 C ATOM 0 H5' DT A 7 2.942 7.237 0.095 1.00 0.00 H new ATOM 0 H5'' DT A 7 4.236 8.399 -0.123 1.00 0.00 H new ATOM 0 H4' DT A 7 5.172 6.319 -0.379 1.00 0.00 H new ATOM 0 H3' DT A 7 5.344 8.070 -2.503 1.00 0.00 H new ATOM 0 H2' DT A 7 4.228 6.806 -4.193 1.00 0.00 H new ATOM 0 H2'' DT A 7 5.682 5.828 -4.196 1.00 0.00 H new ATOM 0 H1' DT A 7 4.743 4.158 -2.920 1.00 0.00 H new ATOM 0 H3 DT A 7 1.304 1.900 -4.604 1.00 0.00 H new ATOM 0 H71 DT A 7 -0.231 5.827 -6.686 1.00 0.00 H new ATOM 0 H72 DT A 7 -0.688 6.492 -5.100 1.00 0.00 H new ATOM 0 H73 DT A 7 0.753 7.109 -5.942 1.00 0.00 H new ATOM 0 H6 DT A 7 2.200 6.610 -4.082 1.00 0.00 H new ATOM 227 P DG A 8 7.672 5.641 -1.694 1.00 0.00 P ATOM 228 OP1 DG A 8 7.432 5.452 -0.244 1.00 0.00 O ATOM 229 OP2 DG A 8 9.069 5.860 -2.140 1.00 0.00 O ATOM 230 O5' DG A 8 7.143 4.363 -2.491 1.00 0.00 O ATOM 231 C5' DG A 8 7.201 3.057 -1.930 1.00 0.00 C ATOM 232 C4' DG A 8 7.336 1.933 -2.976 1.00 0.00 C ATOM 233 O4' DG A 8 6.101 1.653 -3.646 1.00 0.00 O ATOM 234 C3' DG A 8 8.365 2.245 -4.070 1.00 0.00 C ATOM 235 O3' DG A 8 8.956 1.016 -4.454 1.00 0.00 O ATOM 236 C2' DG A 8 7.476 2.776 -5.172 1.00 0.00 C ATOM 237 C1' DG A 8 6.283 1.828 -5.050 1.00 0.00 C ATOM 238 N9 DG A 8 5.101 2.321 -5.816 1.00 0.00 N ATOM 239 C8 DG A 8 4.957 3.552 -6.415 1.00 0.00 C ATOM 240 N7 DG A 8 3.930 3.665 -7.209 1.00 0.00 N ATOM 241 C5 DG A 8 3.318 2.402 -7.116 1.00 0.00 C ATOM 242 C6 DG A 8 2.119 1.879 -7.723 1.00 0.00 C ATOM 243 O6 DG A 8 1.355 2.394 -8.538 1.00 0.00 O ATOM 244 N1 DG A 8 1.773 0.621 -7.274 1.00 0.00 N ATOM 245 C2 DG A 8 2.552 -0.119 -6.443 1.00 0.00 C ATOM 246 N2 DG A 8 2.086 -1.288 -6.088 1.00 0.00 N ATOM 247 N3 DG A 8 3.701 0.285 -5.903 1.00 0.00 N ATOM 248 C4 DG A 8 4.022 1.576 -6.255 1.00 0.00 C ATOM 0 H5' DG A 8 6.300 2.885 -1.341 1.00 0.00 H new ATOM 0 H5'' DG A 8 8.046 3.004 -1.243 1.00 0.00 H new ATOM 0 H4' DG A 8 7.661 1.073 -2.390 1.00 0.00 H new ATOM 0 H3' DG A 8 9.167 2.931 -3.797 1.00 0.00 H new ATOM 0 H2' DG A 8 7.196 3.817 -5.013 1.00 0.00 H new ATOM 0 H2'' DG A 8 7.951 2.720 -6.151 1.00 0.00 H new ATOM 0 H1' DG A 8 6.447 0.854 -5.510 1.00 0.00 H new ATOM 0 H8 DG A 8 5.645 4.365 -6.240 1.00 0.00 H new ATOM 0 H1 DG A 8 0.885 0.226 -7.583 1.00 0.00 H new ATOM 0 H21 DG A 8 2.629 -1.886 -5.465 1.00 0.00 H new ATOM 0 H22 DG A 8 1.179 -1.602 -6.434 1.00 0.00 H new ATOM 260 P DT A 9 10.300 0.908 -5.285 1.00 0.00 P ATOM 261 OP1 DT A 9 11.437 1.467 -4.527 1.00 0.00 O ATOM 262 OP2 DT A 9 10.065 1.359 -6.669 1.00 0.00 O ATOM 263 O5' DT A 9 10.447 -0.691 -5.318 1.00 0.00 O ATOM 264 C5' DT A 9 10.673 -1.410 -4.110 1.00 0.00 C ATOM 265 C4' DT A 9 9.729 -2.601 -3.848 1.00 0.00 C ATOM 266 O4' DT A 9 8.456 -2.298 -4.385 1.00 0.00 O ATOM 267 C3' DT A 9 10.187 -3.932 -4.483 1.00 0.00 C ATOM 268 O3' DT A 9 9.984 -5.067 -3.650 1.00 0.00 O ATOM 269 C2' DT A 9 9.244 -4.086 -5.665 1.00 0.00 C ATOM 270 C1' DT A 9 7.994 -3.390 -5.148 1.00 0.00 C ATOM 271 N1 DT A 9 7.152 -2.879 -6.254 1.00 0.00 N ATOM 272 C2 DT A 9 6.011 -3.596 -6.615 1.00 0.00 C ATOM 273 O2 DT A 9 5.707 -4.679 -6.112 1.00 0.00 O ATOM 274 N3 DT A 9 5.201 -3.027 -7.574 1.00 0.00 N ATOM 275 C4 DT A 9 5.418 -1.813 -8.193 1.00 0.00 C ATOM 276 O4 DT A 9 4.584 -1.426 -9.009 1.00 0.00 O ATOM 277 C5 DT A 9 6.651 -1.131 -7.785 1.00 0.00 C ATOM 278 C7 DT A 9 7.078 0.203 -8.361 1.00 0.00 C ATOM 279 C6 DT A 9 7.462 -1.681 -6.850 1.00 0.00 C ATOM 0 H5' DT A 9 10.589 -0.714 -3.275 1.00 0.00 H new ATOM 0 H5'' DT A 9 11.699 -1.779 -4.116 1.00 0.00 H new ATOM 0 H4' DT A 9 9.719 -2.741 -2.767 1.00 0.00 H new ATOM 0 H3' DT A 9 11.254 -3.894 -4.704 1.00 0.00 H new ATOM 0 H2' DT A 9 9.634 -3.612 -6.566 1.00 0.00 H new ATOM 0 H2'' DT A 9 9.060 -5.132 -5.909 1.00 0.00 H new ATOM 0 H1' DT A 9 7.383 -4.087 -4.574 1.00 0.00 H new ATOM 0 H3 DT A 9 4.369 -3.548 -7.850 1.00 0.00 H new ATOM 0 H71 DT A 9 7.651 0.755 -7.616 1.00 0.00 H new ATOM 0 H72 DT A 9 7.696 0.037 -9.244 1.00 0.00 H new ATOM 0 H73 DT A 9 6.195 0.779 -8.639 1.00 0.00 H new ATOM 0 H6 DT A 9 8.369 -1.168 -6.568 1.00 0.00 H new ATOM 292 P DG A 10 10.892 -5.369 -2.361 1.00 0.00 P ATOM 293 OP1 DG A 10 12.280 -4.981 -2.675 1.00 0.00 O ATOM 294 OP2 DG A 10 10.634 -6.777 -1.988 1.00 0.00 O ATOM 295 O5' DG A 10 10.333 -4.425 -1.192 1.00 0.00 O ATOM 296 C5' DG A 10 11.091 -3.331 -0.690 1.00 0.00 C ATOM 297 C4' DG A 10 10.385 -2.546 0.426 1.00 0.00 C ATOM 298 O4' DG A 10 9.389 -1.606 0.000 1.00 0.00 O ATOM 299 C3' DG A 10 9.770 -3.427 1.528 1.00 0.00 C ATOM 300 O3' DG A 10 10.190 -2.900 2.778 1.00 0.00 O ATOM 301 C2' DG A 10 8.279 -3.204 1.323 1.00 0.00 C ATOM 302 C1' DG A 10 8.328 -1.734 0.936 1.00 0.00 C ATOM 303 N9 DG A 10 7.007 -1.099 0.699 1.00 0.00 N ATOM 304 C8 DG A 10 6.171 -0.712 1.717 1.00 0.00 C ATOM 305 N7 DG A 10 4.963 -0.408 1.351 1.00 0.00 N ATOM 306 C5 DG A 10 4.986 -0.606 -0.028 1.00 0.00 C ATOM 307 C6 DG A 10 3.949 -0.434 -1.002 1.00 0.00 C ATOM 308 O6 DG A 10 2.790 -0.075 -0.837 1.00 0.00 O ATOM 309 N1 DG A 10 4.345 -0.724 -2.286 1.00 0.00 N ATOM 310 C2 DG A 10 5.590 -1.133 -2.602 1.00 0.00 C ATOM 311 N2 DG A 10 5.800 -1.364 -3.865 1.00 0.00 N ATOM 312 N3 DG A 10 6.591 -1.312 -1.740 1.00 0.00 N ATOM 313 C4 DG A 10 6.231 -1.030 -0.448 1.00 0.00 C ATOM 0 H5' DG A 10 11.318 -2.651 -1.511 1.00 0.00 H new ATOM 0 H5'' DG A 10 12.043 -3.704 -0.312 1.00 0.00 H new ATOM 0 H4' DG A 10 11.223 -1.980 0.832 1.00 0.00 H new ATOM 0 H3' DG A 10 10.045 -4.481 1.499 1.00 0.00 H new ATOM 0 H2' DG A 10 7.860 -3.835 0.539 1.00 0.00 H new ATOM 0 H2'' DG A 10 7.695 -3.386 2.225 1.00 0.00 H new ATOM 0 H1' DG A 10 8.585 -1.075 1.765 1.00 0.00 H new ATOM 0 H8 DG A 10 6.494 -0.664 2.746 1.00 0.00 H new ATOM 0 H1 DG A 10 3.662 -0.625 -3.037 1.00 0.00 H new ATOM 0 H21 DG A 10 6.718 -1.677 -4.180 1.00 0.00 H new ATOM 0 H22 DG A 10 5.046 -1.232 -4.540 1.00 0.00 H new ATOM 325 P DG A 11 10.081 -3.689 4.157 1.00 0.00 P ATOM 326 OP1 DG A 11 11.306 -3.294 4.883 1.00 0.00 O ATOM 327 OP2 DG A 11 9.816 -5.118 3.885 1.00 0.00 O ATOM 328 O5' DG A 11 8.796 -3.069 4.886 1.00 0.00 O ATOM 329 C5' DG A 11 8.864 -1.851 5.624 1.00 0.00 C ATOM 330 C4' DG A 11 7.485 -1.445 6.166 1.00 0.00 C ATOM 331 O4' DG A 11 6.585 -1.193 5.101 1.00 0.00 O ATOM 332 C3' DG A 11 6.824 -2.499 7.060 1.00 0.00 C ATOM 333 O3' DG A 11 7.223 -2.308 8.411 1.00 0.00 O ATOM 334 C2' DG A 11 5.342 -2.176 6.883 1.00 0.00 C ATOM 335 C1' DG A 11 5.259 -1.459 5.527 1.00 0.00 C ATOM 336 N9 DG A 11 4.593 -2.274 4.486 1.00 0.00 N ATOM 337 C8 DG A 11 4.915 -3.532 4.040 1.00 0.00 C ATOM 338 N7 DG A 11 4.129 -3.983 3.098 1.00 0.00 N ATOM 339 C5 DG A 11 3.211 -2.934 2.905 1.00 0.00 C ATOM 340 C6 DG A 11 2.089 -2.793 2.011 1.00 0.00 C ATOM 341 O6 DG A 11 1.670 -3.603 1.182 1.00 0.00 O ATOM 342 N1 DG A 11 1.430 -1.586 2.134 1.00 0.00 N ATOM 343 C2 DG A 11 1.800 -0.622 3.012 1.00 0.00 C ATOM 344 N2 DG A 11 1.103 0.478 3.039 1.00 0.00 N ATOM 345 N3 DG A 11 2.824 -0.701 3.858 1.00 0.00 N ATOM 346 C4 DG A 11 3.493 -1.888 3.754 1.00 0.00 C ATOM 0 H5' DG A 11 9.253 -1.058 4.985 1.00 0.00 H new ATOM 0 H5'' DG A 11 9.563 -1.965 6.453 1.00 0.00 H new ATOM 0 H4' DG A 11 7.679 -0.555 6.765 1.00 0.00 H new ATOM 0 H3' DG A 11 7.081 -3.528 6.810 1.00 0.00 H new ATOM 0 H2' DG A 11 4.736 -3.082 6.890 1.00 0.00 H new ATOM 0 H2'' DG A 11 4.976 -1.541 7.690 1.00 0.00 H new ATOM 0 HO3' DG A 11 6.795 -2.984 8.977 1.00 0.00 H new ATOM 0 H1' DG A 11 4.669 -0.552 5.659 1.00 0.00 H new ATOM 0 H8 DG A 11 5.745 -4.100 4.433 1.00 0.00 H new ATOM 0 H1 DG A 11 0.624 -1.411 1.534 1.00 0.00 H new ATOM 0 H21 DG A 11 1.353 1.225 3.687 1.00 0.00 H new ATOM 0 H22 DG A 11 0.307 0.593 2.412 1.00 0.00 H new TER 359 DG A 11