USER MOD reduce.3.24.130724 H: found=0, std=0, add=222, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 222 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 DA O5' : rot 180:sc= 0 USER MOD Single : A 12 DT C7 :methyl -30:sc= -0.558 (180deg=-1.24) USER MOD Single : A 20 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 4.303 8.669 -5.859 1.00 0.34 O ATOM 2 C5' DA A 1 4.710 7.472 -6.526 1.00 0.22 C ATOM 3 C4' DA A 1 3.519 6.585 -6.858 1.00 0.20 C ATOM 4 O4' DA A 1 2.950 6.089 -5.650 1.00 0.23 O ATOM 5 C3' DA A 1 2.397 7.295 -7.635 1.00 0.23 C ATOM 6 O3' DA A 1 2.146 6.612 -8.877 1.00 0.21 O ATOM 7 C2' DA A 1 1.170 7.198 -6.727 1.00 0.28 C ATOM 8 C1' DA A 1 1.537 6.050 -5.798 1.00 0.25 C ATOM 9 N9 DA A 1 0.961 6.151 -4.448 1.00 0.28 N ATOM 10 C8 DA A 1 1.429 5.599 -3.291 1.00 0.30 C ATOM 11 N7 DA A 1 0.726 5.898 -2.240 1.00 0.31 N ATOM 12 C5 DA A 1 -0.285 6.712 -2.732 1.00 0.30 C ATOM 13 C6 DA A 1 -1.364 7.363 -2.112 1.00 0.31 C ATOM 14 N6 DA A 1 -1.602 7.298 -0.798 1.00 0.33 N ATOM 15 N1 DA A 1 -2.178 8.086 -2.900 1.00 0.33 N ATOM 16 C2 DA A 1 -1.928 8.152 -4.203 1.00 0.34 C ATOM 17 N3 DA A 1 -0.950 7.590 -4.899 1.00 0.32 N ATOM 18 C4 DA A 1 -0.153 6.871 -4.083 1.00 0.29 C ATOM 0 H5' DA A 1 5.409 6.923 -5.895 1.00 0.22 H new ATOM 0 H5'' DA A 1 5.241 7.728 -7.443 1.00 0.22 H new ATOM 0 H4' DA A 1 3.912 5.794 -7.496 1.00 0.20 H new ATOM 0 H3' DA A 1 2.652 8.326 -7.878 1.00 0.23 H new ATOM 0 H2' DA A 1 0.997 8.124 -6.179 1.00 0.28 H new ATOM 0 H2'' DA A 1 0.262 6.988 -7.293 1.00 0.28 H new ATOM 0 HO5' DA A 1 5.091 9.216 -5.658 1.00 0.34 H new ATOM 0 H1' DA A 1 1.147 5.134 -6.241 1.00 0.25 H new ATOM 0 H8 DA A 1 2.306 4.970 -3.252 1.00 0.30 H new ATOM 0 H61 DA A 1 -2.401 7.791 -0.399 1.00 0.33 H new ATOM 0 H62 DA A 1 -0.984 6.755 -0.194 1.00 0.33 H new ATOM 0 H2 DA A 1 -2.621 8.749 -4.777 1.00 0.34 H new ATOM 31 P DG A 2 2.049 5.003 -8.935 1.00 0.19 P ATOM 32 OP1 DG A 2 0.634 4.611 -8.742 1.00 0.27 O ATOM 33 OP2 DG A 2 3.090 4.458 -8.050 1.00 0.19 O ATOM 34 O5' DG A 2 2.467 4.664 -10.453 1.00 0.16 O ATOM 35 C5' DG A 2 3.796 4.920 -10.924 1.00 0.15 C ATOM 36 C4' DG A 2 4.786 3.824 -10.516 1.00 0.15 C ATOM 37 O4' DG A 2 4.957 3.810 -9.092 1.00 0.15 O ATOM 38 C3' DG A 2 4.372 2.405 -10.928 1.00 0.16 C ATOM 39 O3' DG A 2 5.488 1.767 -11.567 1.00 0.18 O ATOM 40 C2' DG A 2 4.052 1.712 -9.605 1.00 0.15 C ATOM 41 C1' DG A 2 4.985 2.448 -8.668 1.00 0.15 C ATOM 42 N9 DG A 2 4.623 2.402 -7.228 1.00 0.14 N ATOM 43 C8 DG A 2 5.470 2.368 -6.156 1.00 0.14 C ATOM 44 N7 DG A 2 4.871 2.382 -4.998 1.00 0.15 N ATOM 45 C5 DG A 2 3.520 2.428 -5.322 1.00 0.15 C ATOM 46 C6 DG A 2 2.379 2.467 -4.473 1.00 0.17 C ATOM 47 O6 DG A 2 2.341 2.468 -3.246 1.00 0.18 O ATOM 48 N1 DG A 2 1.202 2.516 -5.203 1.00 0.19 N ATOM 49 C2 DG A 2 1.122 2.520 -6.575 1.00 0.21 C ATOM 50 N2 DG A 2 -0.105 2.571 -7.095 1.00 0.26 N ATOM 51 N3 DG A 2 2.187 2.480 -7.374 1.00 0.18 N ATOM 52 C4 DG A 2 3.353 2.437 -6.685 1.00 0.16 C ATOM 0 H5' DG A 2 4.138 5.878 -10.532 1.00 0.15 H new ATOM 0 H5'' DG A 2 3.782 5.006 -12.010 1.00 0.15 H new ATOM 0 H4' DG A 2 5.705 4.077 -11.044 1.00 0.15 H new ATOM 0 H3' DG A 2 3.531 2.378 -11.621 1.00 0.16 H new ATOM 0 H2' DG A 2 3.006 1.826 -9.321 1.00 0.15 H new ATOM 0 H2'' DG A 2 4.258 0.642 -9.638 1.00 0.15 H new ATOM 0 H1' DG A 2 5.960 1.964 -8.727 1.00 0.15 H new ATOM 0 H8 DG A 2 6.544 2.333 -6.259 1.00 0.14 H new ATOM 0 H1 DG A 2 0.326 2.552 -4.681 1.00 0.19 H new ATOM 0 H21 DG A 2 -0.230 2.577 -8.107 1.00 0.26 H new ATOM 0 H22 DG A 2 -0.918 2.604 -6.480 1.00 0.26 H new ATOM 64 P DG A 3 5.460 0.198 -11.933 1.00 0.21 P ATOM 65 OP1 DG A 3 6.252 -0.005 -13.166 1.00 0.26 O ATOM 66 OP2 DG A 3 4.058 -0.269 -11.871 1.00 0.23 O ATOM 67 O5' DG A 3 6.266 -0.461 -10.704 1.00 0.19 O ATOM 68 C5' DG A 3 7.670 -0.228 -10.538 1.00 0.20 C ATOM 69 C4' DG A 3 8.210 -0.950 -9.308 1.00 0.18 C ATOM 70 O4' DG A 3 7.368 -0.665 -8.185 1.00 0.15 O ATOM 71 C3' DG A 3 8.265 -2.469 -9.463 1.00 0.19 C ATOM 72 O3' DG A 3 9.467 -2.970 -8.870 1.00 0.22 O ATOM 73 C2' DG A 3 7.057 -2.967 -8.686 1.00 0.17 C ATOM 74 C1' DG A 3 6.903 -1.894 -7.619 1.00 0.14 C ATOM 75 N9 DG A 3 5.509 -1.688 -7.182 1.00 0.13 N ATOM 76 C8 DG A 3 4.401 -1.437 -7.949 1.00 0.14 C ATOM 77 N7 DG A 3 3.298 -1.321 -7.263 1.00 0.14 N ATOM 78 C5 DG A 3 3.702 -1.509 -5.946 1.00 0.13 C ATOM 79 C6 DG A 3 2.934 -1.497 -4.750 1.00 0.14 C ATOM 80 O6 DG A 3 1.725 -1.315 -4.621 1.00 0.19 O ATOM 81 N1 DG A 3 3.727 -1.731 -3.634 1.00 0.13 N ATOM 82 C2 DG A 3 5.089 -1.949 -3.662 1.00 0.12 C ATOM 83 N2 DG A 3 5.679 -2.155 -2.485 1.00 0.15 N ATOM 84 N3 DG A 3 5.813 -1.960 -4.787 1.00 0.12 N ATOM 85 C4 DG A 3 5.055 -1.734 -5.886 1.00 0.11 C ATOM 0 H5' DG A 3 7.855 0.842 -10.444 1.00 0.20 H new ATOM 0 H5'' DG A 3 8.205 -0.567 -11.425 1.00 0.20 H new ATOM 0 H4' DG A 3 9.229 -0.588 -9.169 1.00 0.18 H new ATOM 0 H3' DG A 3 8.255 -2.790 -10.505 1.00 0.19 H new ATOM 0 H2' DG A 3 6.171 -3.046 -9.316 1.00 0.17 H new ATOM 0 H2'' DG A 3 7.229 -3.952 -8.252 1.00 0.17 H new ATOM 0 H1' DG A 3 7.469 -2.214 -6.744 1.00 0.14 H new ATOM 0 H8 DG A 3 4.438 -1.344 -9.024 1.00 0.14 H new ATOM 0 H1 DG A 3 3.267 -1.743 -2.724 1.00 0.13 H new ATOM 0 H21 DG A 3 6.684 -2.322 -2.441 1.00 0.15 H new ATOM 0 H22 DG A 3 5.125 -2.146 -1.628 1.00 0.15 H new ATOM 97 P DG A 4 9.843 -4.532 -8.985 1.00 0.24 P ATOM 98 OP1 DG A 4 11.297 -4.644 -9.236 1.00 0.35 O ATOM 99 OP2 DG A 4 8.883 -5.170 -9.915 1.00 0.30 O ATOM 100 O5' DG A 4 9.544 -5.078 -7.502 1.00 0.23 O ATOM 101 C5' DG A 4 10.450 -4.802 -6.430 1.00 0.27 C ATOM 102 C4' DG A 4 10.025 -5.504 -5.144 1.00 0.27 C ATOM 103 O4' DG A 4 8.721 -5.050 -4.759 1.00 0.27 O ATOM 104 C3' DG A 4 9.952 -7.028 -5.266 1.00 0.28 C ATOM 105 O3' DG A 4 10.493 -7.628 -4.082 1.00 0.31 O ATOM 106 C2' DG A 4 8.463 -7.314 -5.357 1.00 0.29 C ATOM 107 C1' DG A 4 7.904 -6.192 -4.504 1.00 0.28 C ATOM 108 N9 DG A 4 6.509 -5.833 -4.812 1.00 0.27 N ATOM 109 C8 DG A 4 5.951 -5.508 -6.021 1.00 0.27 C ATOM 110 N7 DG A 4 4.677 -5.241 -5.961 1.00 0.26 N ATOM 111 C5 DG A 4 4.366 -5.398 -4.614 1.00 0.25 C ATOM 112 C6 DG A 4 3.123 -5.240 -3.942 1.00 0.26 C ATOM 113 O6 DG A 4 2.034 -4.926 -4.416 1.00 0.26 O ATOM 114 N1 DG A 4 3.245 -5.493 -2.583 1.00 0.27 N ATOM 115 C2 DG A 4 4.415 -5.855 -1.947 1.00 0.28 C ATOM 116 N2 DG A 4 4.337 -6.057 -0.632 1.00 0.32 N ATOM 117 N3 DG A 4 5.583 -6.004 -2.578 1.00 0.27 N ATOM 118 C4 DG A 4 5.482 -5.760 -3.904 1.00 0.26 C ATOM 0 H5' DG A 4 10.497 -3.726 -6.260 1.00 0.27 H new ATOM 0 H5'' DG A 4 11.453 -5.125 -6.708 1.00 0.27 H new ATOM 0 H4' DG A 4 10.790 -5.258 -4.407 1.00 0.27 H new ATOM 0 H3' DG A 4 10.510 -7.419 -6.117 1.00 0.28 H new ATOM 0 H2' DG A 4 8.097 -7.275 -6.383 1.00 0.29 H new ATOM 0 H2'' DG A 4 8.207 -8.298 -4.965 1.00 0.29 H new ATOM 0 H1' DG A 4 7.910 -6.524 -3.466 1.00 0.28 H new ATOM 0 H8 DG A 4 6.516 -5.476 -6.941 1.00 0.27 H new ATOM 0 H1 DG A 4 2.406 -5.405 -2.010 1.00 0.27 H new ATOM 0 H21 DG A 4 5.169 -6.327 -0.107 1.00 0.32 H new ATOM 0 H22 DG A 4 3.445 -5.942 -0.150 1.00 0.32 H new ATOM 130 P DI A 5 10.210 -9.177 -3.745 1.00 0.34 P ATOM 131 OP1 DI A 5 11.179 -9.611 -2.714 1.00 0.44 O ATOM 132 OP2 DI A 5 10.110 -9.918 -5.022 1.00 0.33 O ATOM 133 O5' DI A 5 8.748 -9.130 -3.073 1.00 0.35 O ATOM 134 C5' DI A 5 7.985 -10.327 -2.902 1.00 0.33 C ATOM 135 C4' DI A 5 6.563 -10.023 -2.439 1.00 0.35 C ATOM 136 O4' DI A 5 5.926 -9.167 -3.391 1.00 0.34 O ATOM 137 C3' DI A 5 5.680 -11.268 -2.283 1.00 0.41 C ATOM 138 O3' DI A 5 5.126 -11.300 -0.962 1.00 0.43 O ATOM 139 C2' DI A 5 4.564 -11.088 -3.309 1.00 0.42 C ATOM 140 C1' DI A 5 4.573 -9.587 -3.534 1.00 0.38 C ATOM 141 N9 DI A 5 4.112 -9.173 -4.872 1.00 0.41 N ATOM 142 C8 DI A 5 4.700 -9.395 -6.090 1.00 0.47 C ATOM 143 N7 DI A 5 4.039 -8.895 -7.096 1.00 0.50 N ATOM 144 C5 DI A 5 2.931 -8.297 -6.506 1.00 0.46 C ATOM 145 C6 DI A 5 1.852 -7.592 -7.103 1.00 0.49 C ATOM 146 O6 DI A 5 1.660 -7.352 -8.294 1.00 0.54 O ATOM 147 N1 DI A 5 0.949 -7.154 -6.148 1.00 0.47 N ATOM 148 C2 DI A 5 1.074 -7.371 -4.794 1.00 0.45 C ATOM 149 N3 DI A 5 2.071 -8.025 -4.222 1.00 0.43 N ATOM 150 C4 DI A 5 2.966 -8.462 -5.142 1.00 0.42 C ATOM 0 H5'' DI A 5 7.953 -10.877 -3.843 1.00 0.33 H new ATOM 0 H2'' DI A 5 4.764 -11.639 -4.228 1.00 0.42 H new ATOM 0 H8 DI A 5 5.636 -9.941 -6.207 1.00 0.47 H new ATOM 0 H5' DI A 5 8.476 -10.972 -2.173 1.00 0.33 H new ATOM 0 H4' DI A 5 6.664 -9.557 -1.459 1.00 0.35 H new ATOM 0 H3' DI A 5 6.234 -12.195 -2.434 1.00 0.41 H new ATOM 0 H2' DI A 5 3.603 -11.437 -2.931 1.00 0.42 H new ATOM 0 H2 DI A 5 0.293 -6.974 -4.145 1.00 0.45 H new ATOM 0 H1' DI A 5 3.886 -9.137 -2.817 1.00 0.38 H new ATOM 0 H1 DI A 5 0.133 -6.634 -6.471 1.00 0.47 H new ATOM 161 P DA A 6 4.188 -10.104 -0.428 1.00 0.48 P ATOM 162 OP1 DA A 6 4.599 -8.855 -1.109 1.00 0.48 O ATOM 163 OP2 DA A 6 4.161 -10.162 1.050 1.00 0.55 O ATOM 164 O5' DA A 6 2.732 -10.519 -0.975 1.00 0.51 O ATOM 165 C5' DA A 6 1.577 -9.754 -0.613 1.00 0.52 C ATOM 166 C4' DA A 6 0.341 -10.190 -1.398 1.00 0.49 C ATOM 167 O4' DA A 6 0.666 -10.299 -2.786 1.00 0.56 O ATOM 168 C3' DA A 6 -0.218 -11.540 -0.975 1.00 0.41 C ATOM 169 O3' DA A 6 -1.208 -11.352 0.040 1.00 0.39 O ATOM 170 C2' DA A 6 -0.874 -12.054 -2.246 1.00 0.44 C ATOM 171 C1' DA A 6 0.014 -11.455 -3.336 1.00 0.53 C ATOM 172 N9 DA A 6 1.064 -12.368 -3.832 1.00 0.58 N ATOM 173 C8 DA A 6 1.937 -13.149 -3.118 1.00 0.56 C ATOM 174 N7 DA A 6 2.750 -13.847 -3.863 1.00 0.66 N ATOM 175 C5 DA A 6 2.390 -13.504 -5.162 1.00 0.73 C ATOM 176 C6 DA A 6 2.875 -13.904 -6.418 1.00 0.85 C ATOM 177 N6 DA A 6 3.871 -14.775 -6.573 1.00 0.92 N ATOM 178 N1 DA A 6 2.289 -13.369 -7.504 1.00 0.94 N ATOM 179 C2 DA A 6 1.297 -12.501 -7.342 1.00 0.92 C ATOM 180 N3 DA A 6 0.756 -12.049 -6.222 1.00 0.81 N ATOM 181 C4 DA A 6 1.364 -12.604 -5.151 1.00 0.70 C ATOM 0 H5' DA A 6 1.769 -8.697 -0.795 1.00 0.52 H new ATOM 0 H5'' DA A 6 1.388 -9.864 0.455 1.00 0.52 H new ATOM 0 H4' DA A 6 -0.411 -9.427 -1.197 1.00 0.49 H new ATOM 0 H3' DA A 6 0.535 -12.218 -0.572 1.00 0.41 H new ATOM 0 H2' DA A 6 -0.887 -13.143 -2.285 1.00 0.44 H new ATOM 0 H2'' DA A 6 -1.908 -11.719 -2.334 1.00 0.44 H new ATOM 0 H1' DA A 6 -0.635 -11.227 -4.181 1.00 0.53 H new ATOM 0 H8 DA A 6 1.950 -13.183 -2.039 1.00 0.56 H new ATOM 0 H61 DA A 6 4.184 -15.031 -7.510 1.00 0.92 H new ATOM 0 H62 DA A 6 4.321 -15.186 -5.755 1.00 0.92 H new ATOM 0 H2 DA A 6 0.871 -12.108 -8.254 1.00 0.92 H new ATOM 193 P DG A 7 -1.507 -12.512 1.117 1.00 0.20 P ATOM 194 OP1 DG A 7 -0.271 -12.753 1.895 1.00 0.41 O ATOM 195 OP2 DG A 7 -2.169 -13.635 0.415 1.00 0.28 O ATOM 196 O5' DG A 7 -2.587 -11.817 2.088 1.00 0.34 O ATOM 197 C5' DG A 7 -2.338 -10.521 2.636 1.00 0.33 C ATOM 198 C4' DG A 7 -3.302 -9.482 2.069 1.00 0.33 C ATOM 199 O4' DG A 7 -3.377 -9.640 0.660 1.00 0.32 O ATOM 200 C3' DG A 7 -4.726 -9.613 2.601 1.00 0.43 C ATOM 201 O3' DG A 7 -4.954 -8.629 3.623 1.00 0.46 O ATOM 202 C2' DG A 7 -5.633 -9.338 1.398 1.00 0.44 C ATOM 203 C1' DG A 7 -4.664 -9.215 0.218 1.00 0.37 C ATOM 204 N9 DG A 7 -5.025 -10.059 -0.937 1.00 0.38 N ATOM 205 C8 DG A 7 -5.061 -11.428 -1.017 1.00 0.40 C ATOM 206 N7 DG A 7 -5.414 -11.880 -2.187 1.00 0.43 N ATOM 207 C5 DG A 7 -5.628 -10.731 -2.941 1.00 0.42 C ATOM 208 C6 DG A 7 -6.032 -10.597 -4.296 1.00 0.45 C ATOM 209 O6 DG A 7 -6.282 -11.483 -5.110 1.00 0.51 O ATOM 210 N1 DG A 7 -6.131 -9.262 -4.666 1.00 0.44 N ATOM 211 C2 DG A 7 -5.875 -8.190 -3.838 1.00 0.41 C ATOM 212 N2 DG A 7 -6.027 -6.981 -4.376 1.00 0.41 N ATOM 213 N3 DG A 7 -5.495 -8.315 -2.562 1.00 0.39 N ATOM 214 C4 DG A 7 -5.393 -9.610 -2.183 1.00 0.39 C ATOM 0 H5' DG A 7 -1.312 -10.224 2.420 1.00 0.33 H new ATOM 0 H5'' DG A 7 -2.437 -10.558 3.721 1.00 0.33 H new ATOM 0 H4' DG A 7 -2.910 -8.511 2.370 1.00 0.33 H new ATOM 0 H3' DG A 7 -4.914 -10.594 3.038 1.00 0.43 H new ATOM 0 H2' DG A 7 -6.347 -10.147 1.244 1.00 0.44 H new ATOM 0 H2'' DG A 7 -6.211 -8.424 1.536 1.00 0.44 H new ATOM 0 H1' DG A 7 -4.692 -8.175 -0.107 1.00 0.37 H new ATOM 0 H8 DG A 7 -4.819 -12.073 -0.185 1.00 0.40 H new ATOM 0 H1 DG A 7 -6.415 -9.059 -5.624 1.00 0.44 H new ATOM 0 H21 DG A 7 -5.853 -6.147 -3.815 1.00 0.41 H new ATOM 0 H22 DG A 7 -6.318 -6.889 -5.349 1.00 0.41 H new ATOM 226 P DG A 8 -4.696 -7.057 3.359 1.00 0.37 P ATOM 227 OP1 DG A 8 -5.567 -6.285 4.274 1.00 0.46 O ATOM 228 OP2 DG A 8 -4.758 -6.810 1.901 1.00 0.43 O ATOM 229 O5' DG A 8 -3.169 -6.859 3.834 1.00 0.40 O ATOM 230 C5' DG A 8 -2.771 -7.172 5.172 1.00 0.32 C ATOM 231 C4' DG A 8 -1.313 -6.795 5.421 1.00 0.27 C ATOM 232 O4' DG A 8 -0.518 -7.242 4.315 1.00 0.25 O ATOM 233 C3' DG A 8 -1.074 -5.287 5.573 1.00 0.27 C ATOM 234 O3' DG A 8 -0.218 -5.045 6.699 1.00 0.27 O ATOM 235 C2' DG A 8 -0.356 -4.895 4.292 1.00 0.24 C ATOM 236 C1' DG A 8 0.363 -6.187 3.948 1.00 0.24 C ATOM 237 N9 DG A 8 0.697 -6.324 2.518 1.00 0.24 N ATOM 238 C8 DG A 8 1.906 -6.623 1.949 1.00 0.25 C ATOM 239 N7 DG A 8 1.897 -6.604 0.647 1.00 0.25 N ATOM 240 C5 DG A 8 0.587 -6.271 0.324 1.00 0.26 C ATOM 241 C6 DG A 8 -0.020 -6.100 -0.949 1.00 0.27 C ATOM 242 O6 DG A 8 0.498 -6.200 -2.059 1.00 0.29 O ATOM 243 N1 DG A 8 -1.363 -5.767 -0.832 1.00 0.28 N ATOM 244 C2 DG A 8 -2.040 -5.616 0.360 1.00 0.29 C ATOM 245 N2 DG A 8 -3.330 -5.296 0.271 1.00 0.32 N ATOM 246 N3 DG A 8 -1.469 -5.775 1.559 1.00 0.27 N ATOM 247 C4 DG A 8 -0.158 -6.100 1.463 1.00 0.26 C ATOM 0 H5' DG A 8 -2.909 -8.238 5.355 1.00 0.32 H new ATOM 0 H5'' DG A 8 -3.411 -6.642 5.877 1.00 0.32 H new ATOM 0 H4' DG A 8 -1.037 -7.272 6.361 1.00 0.27 H new ATOM 0 H3' DG A 8 -1.995 -4.726 5.732 1.00 0.27 H new ATOM 0 H2' DG A 8 -1.050 -4.589 3.509 1.00 0.24 H new ATOM 0 H2'' DG A 8 0.336 -4.067 4.445 1.00 0.24 H new ATOM 0 H1' DG A 8 1.314 -6.205 4.480 1.00 0.24 H new ATOM 0 H8 DG A 8 2.788 -6.854 2.528 1.00 0.25 H new ATOM 0 H1 DG A 8 -1.889 -5.623 -1.694 1.00 0.28 H new ATOM 0 H21 DG A 8 -3.884 -5.171 1.118 1.00 0.32 H new ATOM 0 H22 DG A 8 -3.764 -5.176 -0.644 1.00 0.32 H new ATOM 259 P DG A 9 0.034 -3.543 7.237 1.00 0.30 P ATOM 260 OP1 DG A 9 -0.286 -3.512 8.681 1.00 0.38 O ATOM 261 OP2 DG A 9 -0.639 -2.600 6.316 1.00 0.36 O ATOM 262 O5' DG A 9 1.629 -3.359 7.072 1.00 0.30 O ATOM 263 C5' DG A 9 2.244 -3.455 5.785 1.00 0.23 C ATOM 264 C4' DG A 9 3.746 -3.197 5.848 1.00 0.20 C ATOM 265 O4' DG A 9 4.341 -3.550 4.594 1.00 0.20 O ATOM 266 C3' DG A 9 4.109 -1.742 6.113 1.00 0.20 C ATOM 267 O3' DG A 9 5.351 -1.668 6.820 1.00 0.20 O ATOM 268 C2' DG A 9 4.275 -1.171 4.717 1.00 0.20 C ATOM 269 C1' DG A 9 4.847 -2.366 3.964 1.00 0.19 C ATOM 270 N9 DG A 9 4.462 -2.415 2.540 1.00 0.18 N ATOM 271 C8 DG A 9 5.269 -2.494 1.435 1.00 0.19 C ATOM 272 N7 DG A 9 4.621 -2.493 0.304 1.00 0.19 N ATOM 273 C5 DG A 9 3.285 -2.407 0.683 1.00 0.16 C ATOM 274 C6 DG A 9 2.113 -2.367 -0.119 1.00 0.18 C ATOM 275 O6 DG A 9 2.027 -2.394 -1.344 1.00 0.20 O ATOM 276 N1 DG A 9 0.966 -2.282 0.660 1.00 0.20 N ATOM 277 C2 DG A 9 0.946 -2.241 2.037 1.00 0.23 C ATOM 278 N2 DG A 9 -0.257 -2.162 2.608 1.00 0.30 N ATOM 279 N3 DG A 9 2.048 -2.278 2.794 1.00 0.21 N ATOM 280 C4 DG A 9 3.177 -2.361 2.052 1.00 0.17 C ATOM 0 H5' DG A 9 1.781 -2.737 5.108 1.00 0.23 H new ATOM 0 H5'' DG A 9 2.064 -4.447 5.370 1.00 0.23 H new ATOM 0 H4' DG A 9 4.116 -3.800 6.678 1.00 0.20 H new ATOM 0 H3' DG A 9 3.369 -1.214 6.714 1.00 0.20 H new ATOM 0 H2' DG A 9 3.327 -0.837 4.296 1.00 0.20 H new ATOM 0 H2'' DG A 9 4.950 -0.315 4.702 1.00 0.20 H new ATOM 0 H1' DG A 9 5.933 -2.284 3.998 1.00 0.19 H new ATOM 0 H8 DG A 9 6.346 -2.552 1.496 1.00 0.19 H new ATOM 0 H1 DG A 9 0.069 -2.247 0.175 1.00 0.20 H new ATOM 0 H21 DG A 9 -0.338 -2.128 3.624 1.00 0.30 H new ATOM 0 H22 DG A 9 -1.096 -2.135 2.028 1.00 0.30 H new ATOM 292 P DG A 10 5.968 -0.239 7.237 1.00 0.19 P ATOM 293 OP1 DG A 10 7.047 -0.467 8.224 1.00 0.26 O ATOM 294 OP2 DG A 10 4.847 0.669 7.569 1.00 0.24 O ATOM 295 O5' DG A 10 6.640 0.274 5.866 1.00 0.14 O ATOM 296 C5' DG A 10 7.925 -0.209 5.460 1.00 0.12 C ATOM 297 C4' DG A 10 8.480 0.597 4.288 1.00 0.11 C ATOM 298 O4' DG A 10 7.605 0.470 3.161 1.00 0.13 O ATOM 299 C3' DG A 10 8.625 2.092 4.584 1.00 0.11 C ATOM 300 O3' DG A 10 9.869 2.569 4.061 1.00 0.12 O ATOM 301 C2' DG A 10 7.472 2.730 3.826 1.00 0.12 C ATOM 302 C1' DG A 10 7.318 1.774 2.656 1.00 0.10 C ATOM 303 N9 DG A 10 5.962 1.748 2.083 1.00 0.13 N ATOM 304 C8 DG A 10 4.761 1.699 2.738 1.00 0.14 C ATOM 305 N7 DG A 10 3.726 1.695 1.948 1.00 0.16 N ATOM 306 C5 DG A 10 4.277 1.746 0.673 1.00 0.15 C ATOM 307 C6 DG A 10 3.635 1.769 -0.593 1.00 0.17 C ATOM 308 O6 DG A 10 2.430 1.748 -0.837 1.00 0.19 O ATOM 309 N1 DG A 10 4.557 1.824 -1.629 1.00 0.18 N ATOM 310 C2 DG A 10 5.926 1.855 -1.472 1.00 0.17 C ATOM 311 N2 DG A 10 6.645 1.911 -2.594 1.00 0.21 N ATOM 312 N3 DG A 10 6.533 1.833 -0.281 1.00 0.16 N ATOM 313 C4 DG A 10 5.649 1.779 0.744 1.00 0.14 C ATOM 0 H5' DG A 10 7.848 -1.259 5.177 1.00 0.12 H new ATOM 0 H5'' DG A 10 8.617 -0.156 6.300 1.00 0.12 H new ATOM 0 H4' DG A 10 9.472 0.191 4.092 1.00 0.11 H new ATOM 0 H3' DG A 10 8.609 2.317 5.650 1.00 0.11 H new ATOM 0 H2' DG A 10 6.566 2.790 4.430 1.00 0.12 H new ATOM 0 H2'' DG A 10 7.705 3.744 3.500 1.00 0.12 H new ATOM 0 H1' DG A 10 7.988 2.101 1.860 1.00 0.10 H new ATOM 0 H8 DG A 10 4.679 1.667 3.814 1.00 0.14 H new ATOM 0 H1 DG A 10 4.193 1.843 -2.582 1.00 0.18 H new ATOM 0 H21 DG A 10 7.664 1.936 -2.546 1.00 0.21 H new ATOM 0 H22 DG A 10 6.176 1.928 -3.500 1.00 0.21 H new ATOM 325 P DC A 11 10.690 3.723 4.830 1.00 0.13 P ATOM 326 OP1 DC A 11 11.866 4.081 4.006 1.00 0.26 O ATOM 327 OP2 DC A 11 10.877 3.298 6.236 1.00 0.23 O ATOM 328 O5' DC A 11 9.664 4.965 4.811 1.00 0.13 O ATOM 329 C5' DC A 11 9.711 5.958 5.841 1.00 0.23 C ATOM 330 C4' DC A 11 8.696 7.073 5.600 1.00 0.27 C ATOM 331 O4' DC A 11 9.032 7.792 4.426 1.00 0.33 O ATOM 332 C3' DC A 11 7.267 6.585 5.391 1.00 0.18 C ATOM 333 O3' DC A 11 6.560 6.634 6.634 1.00 0.22 O ATOM 334 C2' DC A 11 6.659 7.594 4.407 1.00 0.25 C ATOM 335 C1' DC A 11 7.852 8.464 3.996 1.00 0.37 C ATOM 336 N1 DC A 11 7.966 8.683 2.542 1.00 0.46 N ATOM 337 C2 DC A 11 7.476 9.877 2.037 1.00 0.61 C ATOM 338 O2 DC A 11 6.972 10.704 2.793 1.00 0.67 O ATOM 339 N3 DC A 11 7.571 10.099 0.698 1.00 0.72 N ATOM 340 C4 DC A 11 8.124 9.187 -0.114 1.00 0.72 C ATOM 341 N4 DC A 11 8.201 9.435 -1.421 1.00 0.88 N ATOM 342 C5 DC A 11 8.632 7.954 0.404 1.00 0.61 C ATOM 343 C6 DC A 11 8.534 7.744 1.731 1.00 0.46 C ATOM 0 H5' DC A 11 10.713 6.383 5.890 1.00 0.23 H new ATOM 0 H5'' DC A 11 9.515 5.490 6.806 1.00 0.23 H new ATOM 0 H4' DC A 11 8.736 7.681 6.504 1.00 0.27 H new ATOM 0 H3' DC A 11 7.219 5.561 5.022 1.00 0.18 H new ATOM 0 H2' DC A 11 6.212 7.095 3.547 1.00 0.25 H new ATOM 0 H2'' DC A 11 5.873 8.187 4.876 1.00 0.25 H new ATOM 0 H1' DC A 11 7.712 9.444 4.453 1.00 0.37 H new ATOM 0 H41 DC A 11 8.620 8.747 -2.047 1.00 0.88 H new ATOM 0 H42 DC A 11 7.841 10.313 -1.796 1.00 0.88 H new ATOM 0 H5 DC A 11 9.079 7.217 -0.247 1.00 0.61 H new ATOM 0 H6 DC A 11 8.908 6.825 2.157 1.00 0.46 H new ATOM 355 P DT A 12 5.748 5.346 7.158 1.00 0.23 P ATOM 356 OP1 DT A 12 5.381 5.573 8.574 1.00 0.35 O ATOM 357 OP2 DT A 12 6.510 4.134 6.779 1.00 0.31 O ATOM 358 O5' DT A 12 4.402 5.389 6.276 1.00 0.20 O ATOM 359 C5' DT A 12 3.215 5.994 6.795 1.00 0.17 C ATOM 360 C4' DT A 12 2.002 5.698 5.916 1.00 0.17 C ATOM 361 O4' DT A 12 2.151 6.330 4.654 1.00 0.21 O ATOM 362 C3' DT A 12 1.794 4.213 5.627 1.00 0.18 C ATOM 363 O3' DT A 12 0.752 3.704 6.466 1.00 0.17 O ATOM 364 C2' DT A 12 1.352 4.155 4.159 1.00 0.28 C ATOM 365 C1' DT A 12 1.329 5.622 3.734 1.00 0.22 C ATOM 366 N1 DT A 12 1.863 5.863 2.380 1.00 0.20 N ATOM 367 C2 DT A 12 1.023 6.462 1.457 1.00 0.20 C ATOM 368 O2 DT A 12 -0.135 6.778 1.723 1.00 0.23 O ATOM 369 N3 DT A 12 1.560 6.670 0.203 1.00 0.20 N ATOM 370 C4 DT A 12 2.837 6.337 -0.206 1.00 0.19 C ATOM 371 O4 DT A 12 3.208 6.570 -1.355 1.00 0.24 O ATOM 372 C5 DT A 12 3.639 5.717 0.819 1.00 0.19 C ATOM 373 C7 DT A 12 5.065 5.287 0.494 1.00 0.20 C ATOM 374 C6 DT A 12 3.143 5.503 2.055 1.00 0.20 C ATOM 0 H5' DT A 12 3.358 7.072 6.868 1.00 0.17 H new ATOM 0 H5'' DT A 12 3.031 5.628 7.805 1.00 0.17 H new ATOM 0 H4' DT A 12 1.147 6.071 6.479 1.00 0.17 H new ATOM 0 H3' DT A 12 2.691 3.623 5.812 1.00 0.18 H new ATOM 0 H2' DT A 12 2.047 3.573 3.554 1.00 0.28 H new ATOM 0 H2'' DT A 12 0.371 3.691 4.053 1.00 0.28 H new ATOM 0 H1' DT A 12 0.289 5.948 3.726 1.00 0.22 H new ATOM 0 H3 DT A 12 0.955 7.113 -0.489 1.00 0.20 H new ATOM 0 H71 DT A 12 5.133 5.020 -0.561 1.00 0.20 H new ATOM 0 H72 DT A 12 5.750 6.108 0.706 1.00 0.20 H new ATOM 0 H73 DT A 12 5.333 4.425 1.104 1.00 0.20 H new ATOM 0 H6 DT A 12 3.768 5.038 2.803 1.00 0.20 H new ATOM 387 P DG A 13 0.371 2.139 6.431 1.00 0.21 P ATOM 388 OP1 DG A 13 0.293 1.649 7.826 1.00 0.31 O ATOM 389 OP2 DG A 13 1.267 1.467 5.462 1.00 0.22 O ATOM 390 O5' DG A 13 -1.116 2.150 5.816 1.00 0.20 O ATOM 391 C5' DG A 13 -2.218 2.622 6.596 1.00 0.24 C ATOM 392 C4' DG A 13 -3.544 2.071 6.078 1.00 0.21 C ATOM 393 O4' DG A 13 -3.768 2.526 4.735 1.00 0.22 O ATOM 394 C3' DG A 13 -3.605 0.541 6.044 1.00 0.18 C ATOM 395 O3' DG A 13 -4.906 0.110 6.471 1.00 0.22 O ATOM 396 C2' DG A 13 -3.400 0.213 4.574 1.00 0.16 C ATOM 397 C1' DG A 13 -4.104 1.394 3.936 1.00 0.20 C ATOM 398 N9 DG A 13 -3.705 1.674 2.541 1.00 0.21 N ATOM 399 C8 DG A 13 -4.508 1.904 1.455 1.00 0.25 C ATOM 400 N7 DG A 13 -3.853 2.107 0.347 1.00 0.27 N ATOM 401 C5 DG A 13 -2.519 2.005 0.722 1.00 0.22 C ATOM 402 C6 DG A 13 -1.341 2.133 -0.064 1.00 0.23 C ATOM 403 O6 DG A 13 -1.249 2.364 -1.267 1.00 0.26 O ATOM 404 N1 DG A 13 -0.197 1.959 0.703 1.00 0.20 N ATOM 405 C2 DG A 13 -0.184 1.696 2.057 1.00 0.17 C ATOM 406 N2 DG A 13 1.015 1.560 2.621 1.00 0.17 N ATOM 407 N3 DG A 13 -1.290 1.574 2.797 1.00 0.17 N ATOM 408 C4 DG A 13 -2.417 1.740 2.065 1.00 0.19 C ATOM 0 H5' DG A 13 -2.241 3.712 6.573 1.00 0.24 H new ATOM 0 H5'' DG A 13 -2.082 2.328 7.637 1.00 0.24 H new ATOM 0 H4' DG A 13 -4.301 2.432 6.774 1.00 0.21 H new ATOM 0 H3' DG A 13 -2.873 0.058 6.692 1.00 0.18 H new ATOM 0 H2' DG A 13 -2.346 0.161 4.302 1.00 0.16 H new ATOM 0 H2'' DG A 13 -3.849 -0.740 4.294 1.00 0.16 H new ATOM 0 H1' DG A 13 -5.170 1.170 3.895 1.00 0.20 H new ATOM 0 H8 DG A 13 -5.586 1.916 1.512 1.00 0.25 H new ATOM 0 H1 DG A 13 0.703 2.031 0.229 1.00 0.20 H new ATOM 0 H21 DG A 13 1.090 1.365 3.619 1.00 0.17 H new ATOM 0 H22 DG A 13 1.858 1.651 2.055 1.00 0.17 H new ATOM 420 P DG A 14 -5.349 -1.435 6.349 1.00 0.24 P ATOM 421 OP1 DG A 14 -6.359 -1.713 7.395 1.00 0.32 O ATOM 422 OP2 DG A 14 -4.124 -2.263 6.270 1.00 0.29 O ATOM 423 O5' DG A 14 -6.081 -1.480 4.915 1.00 0.25 O ATOM 424 C5' DG A 14 -7.388 -0.922 4.745 1.00 0.25 C ATOM 425 C4' DG A 14 -7.936 -1.199 3.347 1.00 0.25 C ATOM 426 O4' DG A 14 -6.947 -0.855 2.367 1.00 0.23 O ATOM 427 C3' DG A 14 -8.306 -2.662 3.109 1.00 0.28 C ATOM 428 O3' DG A 14 -9.457 -2.727 2.258 1.00 0.33 O ATOM 429 C2' DG A 14 -7.090 -3.217 2.389 1.00 0.25 C ATOM 430 C1' DG A 14 -6.674 -2.010 1.566 1.00 0.23 C ATOM 431 N9 DG A 14 -5.244 -1.988 1.208 1.00 0.19 N ATOM 432 C8 DG A 14 -4.156 -2.183 2.017 1.00 0.18 C ATOM 433 N7 DG A 14 -3.012 -2.113 1.394 1.00 0.18 N ATOM 434 C5 DG A 14 -3.368 -1.852 0.073 1.00 0.16 C ATOM 435 C6 DG A 14 -2.545 -1.673 -1.073 1.00 0.16 C ATOM 436 O6 DG A 14 -1.319 -1.709 -1.145 1.00 0.19 O ATOM 437 N1 DG A 14 -3.304 -1.432 -2.211 1.00 0.16 N ATOM 438 C2 DG A 14 -4.681 -1.367 -2.245 1.00 0.19 C ATOM 439 N2 DG A 14 -5.233 -1.123 -3.434 1.00 0.23 N ATOM 440 N3 DG A 14 -5.456 -1.536 -1.168 1.00 0.21 N ATOM 441 C4 DG A 14 -4.733 -1.774 -0.050 1.00 0.18 C ATOM 0 H5' DG A 14 -7.351 0.154 4.916 1.00 0.25 H new ATOM 0 H5'' DG A 14 -8.063 -1.340 5.491 1.00 0.25 H new ATOM 0 H4' DG A 14 -8.841 -0.597 3.261 1.00 0.25 H new ATOM 0 H3' DG A 14 -8.546 -3.209 4.021 1.00 0.28 H new ATOM 0 H2' DG A 14 -6.310 -3.535 3.080 1.00 0.25 H new ATOM 0 H2'' DG A 14 -7.335 -4.078 1.767 1.00 0.25 H new ATOM 0 H1' DG A 14 -7.227 -2.039 0.627 1.00 0.23 H new ATOM 0 H8 DG A 14 -4.238 -2.377 3.076 1.00 0.18 H new ATOM 0 H1 DG A 14 -2.804 -1.292 -3.089 1.00 0.16 H new ATOM 0 H21 DG A 14 -6.247 -1.063 -3.523 1.00 0.23 H new ATOM 0 H22 DG A 14 -4.641 -0.996 -4.255 1.00 0.23 H new ATOM 453 P DG A 15 -10.105 -4.145 1.855 1.00 0.36 P ATOM 454 OP1 DG A 15 -11.535 -4.129 2.237 1.00 0.45 O ATOM 455 OP2 DG A 15 -9.219 -5.218 2.359 1.00 0.38 O ATOM 456 O5' DG A 15 -10.011 -4.128 0.248 1.00 0.32 O ATOM 457 C5' DG A 15 -10.861 -3.275 -0.528 1.00 0.28 C ATOM 458 C4' DG A 15 -10.497 -3.334 -2.009 1.00 0.20 C ATOM 459 O4' DG A 15 -9.096 -3.099 -2.158 1.00 0.22 O ATOM 460 C3' DG A 15 -10.809 -4.682 -2.664 1.00 0.20 C ATOM 461 O3' DG A 15 -11.712 -4.489 -3.763 1.00 0.22 O ATOM 462 C2' DG A 15 -9.465 -5.202 -3.174 1.00 0.19 C ATOM 463 C1' DG A 15 -8.602 -3.950 -3.186 1.00 0.19 C ATOM 464 N9 DG A 15 -7.174 -4.201 -2.908 1.00 0.20 N ATOM 465 C8 DG A 15 -6.582 -4.551 -1.722 1.00 0.22 C ATOM 466 N7 DG A 15 -5.289 -4.696 -1.799 1.00 0.23 N ATOM 467 C5 DG A 15 -5.000 -4.423 -3.133 1.00 0.22 C ATOM 468 C6 DG A 15 -3.752 -4.425 -3.812 1.00 0.25 C ATOM 469 O6 DG A 15 -2.637 -4.674 -3.357 1.00 0.28 O ATOM 470 N1 DG A 15 -3.903 -4.095 -5.153 1.00 0.27 N ATOM 471 C2 DG A 15 -5.103 -3.803 -5.766 1.00 0.26 C ATOM 472 N2 DG A 15 -5.047 -3.513 -7.066 1.00 0.30 N ATOM 473 N3 DG A 15 -6.277 -3.801 -5.129 1.00 0.23 N ATOM 474 C4 DG A 15 -6.150 -4.120 -3.820 1.00 0.21 C ATOM 0 H5' DG A 15 -10.775 -2.249 -0.170 1.00 0.28 H new ATOM 0 H5'' DG A 15 -11.901 -3.574 -0.394 1.00 0.28 H new ATOM 0 H4' DG A 15 -11.102 -2.573 -2.501 1.00 0.20 H new ATOM 0 H3' DG A 15 -11.278 -5.379 -1.970 1.00 0.20 H new ATOM 0 H2' DG A 15 -9.054 -5.970 -2.519 1.00 0.19 H new ATOM 0 H2'' DG A 15 -9.552 -5.643 -4.167 1.00 0.19 H new ATOM 0 H1' DG A 15 -8.659 -3.520 -4.186 1.00 0.19 H new ATOM 0 H8 DG A 15 -7.137 -4.694 -0.807 1.00 0.22 H new ATOM 0 H1 DG A 15 -3.061 -4.067 -5.728 1.00 0.27 H new ATOM 0 H21 DG A 15 -5.901 -3.288 -7.576 1.00 0.30 H new ATOM 0 H22 DG A 15 -4.150 -3.516 -7.551 1.00 0.30 H new ATOM 486 P DA A 16 -11.308 -3.586 -5.037 1.00 0.23 P ATOM 487 OP1 DA A 16 -12.328 -3.795 -6.089 1.00 0.30 O ATOM 488 OP2 DA A 16 -9.880 -3.823 -5.344 1.00 0.27 O ATOM 489 O5' DA A 16 -11.465 -2.083 -4.480 1.00 0.25 O ATOM 490 C5' DA A 16 -12.759 -1.484 -4.363 1.00 0.23 C ATOM 491 C4' DA A 16 -12.679 0.041 -4.411 1.00 0.19 C ATOM 492 O4' DA A 16 -13.990 0.595 -4.250 1.00 0.19 O ATOM 493 C3' DA A 16 -11.789 0.656 -3.324 1.00 0.21 C ATOM 494 O3' DA A 16 -10.870 1.571 -3.930 1.00 0.21 O ATOM 495 C2' DA A 16 -12.758 1.417 -2.423 1.00 0.24 C ATOM 496 C1' DA A 16 -13.890 1.724 -3.388 1.00 0.17 C ATOM 497 N9 DA A 16 -15.203 1.925 -2.746 1.00 0.18 N ATOM 498 C8 DA A 16 -15.749 1.269 -1.671 1.00 0.25 C ATOM 499 N7 DA A 16 -16.941 1.688 -1.348 1.00 0.25 N ATOM 500 C5 DA A 16 -17.205 2.691 -2.275 1.00 0.19 C ATOM 501 C6 DA A 16 -18.312 3.534 -2.472 1.00 0.21 C ATOM 502 N6 DA A 16 -19.406 3.493 -1.712 1.00 0.26 N ATOM 503 N1 DA A 16 -18.242 4.416 -3.484 1.00 0.24 N ATOM 504 C2 DA A 16 -17.150 4.451 -4.238 1.00 0.25 C ATOM 505 N3 DA A 16 -16.052 3.716 -4.152 1.00 0.20 N ATOM 506 C4 DA A 16 -16.151 2.842 -3.129 1.00 0.16 C ATOM 0 H5' DA A 16 -13.221 -1.795 -3.426 1.00 0.23 H new ATOM 0 H5'' DA A 16 -13.400 -1.841 -5.169 1.00 0.23 H new ATOM 0 H4' DA A 16 -12.239 0.280 -5.379 1.00 0.19 H new ATOM 0 H3' DA A 16 -11.210 -0.088 -2.777 1.00 0.21 H new ATOM 0 H2' DA A 16 -13.091 0.815 -1.578 1.00 0.24 H new ATOM 0 H2'' DA A 16 -12.312 2.323 -2.013 1.00 0.24 H new ATOM 0 H1' DA A 16 -13.656 2.660 -3.895 1.00 0.17 H new ATOM 0 H8 DA A 16 -15.238 0.478 -1.141 1.00 0.25 H new ATOM 0 H61 DA A 16 -20.181 4.129 -1.899 1.00 0.26 H new ATOM 0 H62 DA A 16 -19.468 2.826 -0.943 1.00 0.26 H new ATOM 0 H2 DA A 16 -17.158 5.182 -5.033 1.00 0.25 H new ATOM 518 P DG A 17 -9.971 2.557 -3.027 1.00 0.21 P ATOM 519 OP1 DG A 17 -9.217 1.739 -2.052 1.00 0.25 O ATOM 520 OP2 DG A 17 -10.831 3.663 -2.554 1.00 0.25 O ATOM 521 O5' DG A 17 -8.928 3.153 -4.099 1.00 0.21 O ATOM 522 C5' DG A 17 -9.381 4.007 -5.153 1.00 0.21 C ATOM 523 C4' DG A 17 -8.636 3.734 -6.456 1.00 0.19 C ATOM 524 O4' DG A 17 -7.252 4.039 -6.297 1.00 0.20 O ATOM 525 C3' DG A 17 -8.722 2.276 -6.926 1.00 0.21 C ATOM 526 O3' DG A 17 -9.354 2.226 -8.209 1.00 0.24 O ATOM 527 C2' DG A 17 -7.268 1.817 -7.050 1.00 0.23 C ATOM 528 C1' DG A 17 -6.524 3.138 -7.120 1.00 0.22 C ATOM 529 N9 DG A 17 -5.136 3.082 -6.625 1.00 0.24 N ATOM 530 C8 DG A 17 -3.968 3.182 -7.336 1.00 0.28 C ATOM 531 N7 DG A 17 -2.893 3.081 -6.605 1.00 0.30 N ATOM 532 C5 DG A 17 -3.381 2.901 -5.316 1.00 0.29 C ATOM 533 C6 DG A 17 -2.678 2.731 -4.092 1.00 0.33 C ATOM 534 O6 DG A 17 -1.462 2.704 -3.909 1.00 0.37 O ATOM 535 N1 DG A 17 -3.547 2.583 -3.021 1.00 0.34 N ATOM 536 C2 DG A 17 -4.924 2.597 -3.112 1.00 0.31 C ATOM 537 N2 DG A 17 -5.593 2.440 -1.969 1.00 0.34 N ATOM 538 N3 DG A 17 -5.587 2.756 -4.261 1.00 0.26 N ATOM 539 C4 DG A 17 -4.754 2.901 -5.317 1.00 0.26 C ATOM 0 H5' DG A 17 -9.240 5.049 -4.864 1.00 0.21 H new ATOM 0 H5'' DG A 17 -10.450 3.860 -5.307 1.00 0.21 H new ATOM 0 H4' DG A 17 -9.118 4.365 -7.202 1.00 0.19 H new ATOM 0 H3' DG A 17 -9.297 1.650 -6.243 1.00 0.21 H new ATOM 0 H2' DG A 17 -6.955 1.218 -6.195 1.00 0.23 H new ATOM 0 H2'' DG A 17 -7.106 1.210 -7.941 1.00 0.23 H new ATOM 0 H1' DG A 17 -6.457 3.437 -8.166 1.00 0.22 H new ATOM 0 H8 DG A 17 -3.941 3.331 -8.405 1.00 0.28 H new ATOM 0 H1 DG A 17 -3.137 2.454 -2.096 1.00 0.34 H new ATOM 0 H21 DG A 17 -6.613 2.441 -1.971 1.00 0.34 H new ATOM 0 H22 DG A 17 -5.085 2.319 -1.093 1.00 0.34 H new ATOM 551 P DG A 18 -9.581 0.816 -8.954 1.00 0.28 P ATOM 552 OP1 DG A 18 -10.493 1.034 -10.099 1.00 0.38 O ATOM 553 OP2 DG A 18 -9.911 -0.200 -7.930 1.00 0.32 O ATOM 554 O5' DG A 18 -8.116 0.487 -9.535 1.00 0.20 O ATOM 555 C5' DG A 18 -7.547 1.295 -10.568 1.00 0.21 C ATOM 556 C4' DG A 18 -6.150 0.815 -10.950 1.00 0.19 C ATOM 557 O4' DG A 18 -5.287 0.902 -9.815 1.00 0.20 O ATOM 558 C3' DG A 18 -6.109 -0.633 -11.446 1.00 0.17 C ATOM 559 O3' DG A 18 -5.480 -0.676 -12.731 1.00 0.24 O ATOM 560 C2' DG A 18 -5.253 -1.375 -10.422 1.00 0.16 C ATOM 561 C1' DG A 18 -4.447 -0.248 -9.799 1.00 0.18 C ATOM 562 N9 DG A 18 -4.046 -0.490 -8.400 1.00 0.16 N ATOM 563 C8 DG A 18 -4.844 -0.629 -7.294 1.00 0.17 C ATOM 564 N7 DG A 18 -4.184 -0.820 -6.186 1.00 0.17 N ATOM 565 C5 DG A 18 -2.850 -0.808 -6.584 1.00 0.15 C ATOM 566 C6 DG A 18 -1.668 -0.966 -5.810 1.00 0.15 C ATOM 567 O6 DG A 18 -1.569 -1.153 -4.599 1.00 0.17 O ATOM 568 N1 DG A 18 -0.529 -0.888 -6.598 1.00 0.15 N ATOM 569 C2 DG A 18 -0.524 -0.683 -7.963 1.00 0.17 C ATOM 570 N2 DG A 18 0.673 -0.641 -8.549 1.00 0.21 N ATOM 571 N3 DG A 18 -1.634 -0.534 -8.692 1.00 0.17 N ATOM 572 C4 DG A 18 -2.756 -0.606 -7.939 1.00 0.15 C ATOM 0 H5' DG A 18 -7.498 2.332 -10.235 1.00 0.21 H new ATOM 0 H5'' DG A 18 -8.193 1.273 -11.446 1.00 0.21 H new ATOM 0 H4' DG A 18 -5.828 1.461 -11.767 1.00 0.19 H new ATOM 0 H3' DG A 18 -7.102 -1.071 -11.545 1.00 0.17 H new ATOM 0 H2' DG A 18 -5.862 -1.896 -9.683 1.00 0.16 H new ATOM 0 H2'' DG A 18 -4.613 -2.122 -10.891 1.00 0.16 H new ATOM 0 H1' DG A 18 -3.525 -0.141 -10.371 1.00 0.18 H new ATOM 0 H8 DG A 18 -5.922 -0.584 -7.337 1.00 0.17 H new ATOM 0 H1 DG A 18 0.373 -0.990 -6.133 1.00 0.15 H new ATOM 0 H21 DG A 18 0.743 -0.492 -9.556 1.00 0.21 H new ATOM 0 H22 DG A 18 1.519 -0.757 -7.991 1.00 0.21 H new ATOM 584 P DG A 19 -5.458 -2.041 -13.584 1.00 0.27 P ATOM 585 OP1 DG A 19 -5.631 -1.698 -15.014 1.00 0.34 O ATOM 586 OP2 DG A 19 -6.378 -3.003 -12.939 1.00 0.27 O ATOM 587 O5' DG A 19 -3.951 -2.564 -13.370 1.00 0.32 O ATOM 588 C5' DG A 19 -2.858 -1.907 -14.017 1.00 0.44 C ATOM 589 C4' DG A 19 -1.521 -2.520 -13.617 1.00 0.41 C ATOM 590 O4' DG A 19 -1.341 -2.391 -12.204 1.00 0.35 O ATOM 591 C3' DG A 19 -1.396 -4.009 -13.959 1.00 0.38 C ATOM 592 O3' DG A 19 -0.179 -4.230 -14.679 1.00 0.47 O ATOM 593 C2' DG A 19 -1.331 -4.711 -12.606 1.00 0.25 C ATOM 594 C1' DG A 19 -0.797 -3.609 -11.709 1.00 0.26 C ATOM 595 N9 DG A 19 -1.190 -3.736 -10.294 1.00 0.21 N ATOM 596 C8 DG A 19 -2.440 -3.643 -9.739 1.00 0.20 C ATOM 597 N7 DG A 19 -2.457 -3.807 -8.446 1.00 0.23 N ATOM 598 C5 DG A 19 -1.123 -4.024 -8.117 1.00 0.25 C ATOM 599 C6 DG A 19 -0.525 -4.266 -6.851 1.00 0.30 C ATOM 600 O6 DG A 19 -1.069 -4.337 -5.751 1.00 0.36 O ATOM 601 N1 DG A 19 0.849 -4.431 -6.961 1.00 0.32 N ATOM 602 C2 DG A 19 1.561 -4.374 -8.141 1.00 0.30 C ATOM 603 N2 DG A 19 2.878 -4.559 -8.046 1.00 0.34 N ATOM 604 N3 DG A 19 1.000 -4.146 -9.331 1.00 0.26 N ATOM 605 C4 DG A 19 -0.340 -3.982 -9.244 1.00 0.23 C ATOM 0 H5' DG A 19 -2.865 -0.848 -13.760 1.00 0.44 H new ATOM 0 H5'' DG A 19 -2.981 -1.973 -15.098 1.00 0.44 H new ATOM 0 H4' DG A 19 -0.764 -1.979 -14.185 1.00 0.41 H new ATOM 0 H3' DG A 19 -2.219 -4.371 -14.575 1.00 0.38 H new ATOM 0 H2' DG A 19 -2.310 -5.064 -12.281 1.00 0.25 H new ATOM 0 H2'' DG A 19 -0.670 -5.578 -12.626 1.00 0.25 H new ATOM 0 H1' DG A 19 0.292 -3.657 -11.732 1.00 0.26 H new ATOM 0 H8 DG A 19 -3.330 -3.451 -10.320 1.00 0.20 H new ATOM 0 H1 DG A 19 1.372 -4.608 -6.103 1.00 0.32 H new ATOM 0 H21 DG A 19 3.459 -4.528 -8.884 1.00 0.34 H new ATOM 0 H22 DG A 19 3.304 -4.731 -7.136 1.00 0.34 H new ATOM 617 P DC A 20 0.107 -5.648 -15.386 1.00 0.51 P ATOM 618 OP1 DC A 20 1.207 -5.467 -16.360 1.00 0.63 O ATOM 619 OP2 DC A 20 -1.186 -6.213 -15.831 1.00 0.62 O ATOM 620 O5' DC A 20 0.656 -6.548 -14.169 1.00 0.33 O ATOM 621 C5' DC A 20 1.983 -6.359 -13.668 1.00 0.25 C ATOM 622 C4' DC A 20 2.363 -7.443 -12.664 1.00 0.23 C ATOM 623 O4' DC A 20 1.467 -7.413 -11.553 1.00 0.35 O ATOM 624 C3' DC A 20 2.300 -8.854 -13.225 1.00 0.31 C ATOM 625 O3' DC A 20 3.523 -9.220 -13.874 1.00 0.33 O ATOM 626 C2' DC A 20 2.051 -9.699 -11.985 1.00 0.47 C ATOM 627 C1' DC A 20 1.244 -8.754 -11.095 1.00 0.51 C ATOM 628 N1 DC A 20 -0.211 -8.998 -11.122 1.00 0.64 N ATOM 629 C2 DC A 20 -0.788 -9.538 -9.985 1.00 0.83 C ATOM 630 O2 DC A 20 -0.091 -9.799 -9.006 1.00 0.90 O ATOM 631 N3 DC A 20 -2.129 -9.768 -9.987 1.00 0.98 N ATOM 632 C4 DC A 20 -2.874 -9.479 -11.063 1.00 0.96 C ATOM 633 N4 DC A 20 -4.185 -9.715 -11.032 1.00 1.14 N ATOM 634 C5 DC A 20 -2.283 -8.920 -12.240 1.00 0.80 C ATOM 635 C6 DC A 20 -0.955 -8.697 -12.226 1.00 0.63 C ATOM 0 H5' DC A 20 2.058 -5.380 -13.194 1.00 0.25 H new ATOM 0 H5'' DC A 20 2.690 -6.366 -14.497 1.00 0.25 H new ATOM 0 H4' DC A 20 3.393 -7.222 -12.385 1.00 0.23 H new ATOM 0 H3' DC A 20 1.534 -8.977 -13.991 1.00 0.31 H new ATOM 0 H2' DC A 20 1.497 -10.608 -12.218 1.00 0.47 H new ATOM 0 H2'' DC A 20 2.983 -10.007 -11.510 1.00 0.47 H new ATOM 0 HO3' DC A 20 3.448 -10.133 -14.221 1.00 0.33 H new ATOM 0 H1' DC A 20 1.581 -8.922 -10.072 1.00 0.51 H new ATOM 0 H41 DC A 20 -4.761 -9.499 -11.845 1.00 1.14 H new ATOM 0 H42 DC A 20 -4.612 -10.112 -10.195 1.00 1.14 H new ATOM 0 H5 DC A 20 -2.880 -8.685 -13.109 1.00 0.80 H new ATOM 0 H6 DC A 20 -0.474 -8.276 -13.097 1.00 0.63 H new TER 648 DC A 20