USER MOD reduce.3.24.130724 H: found=0, std=0, add=274, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 274 hydrogens (11 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 Set 1.1: A 6 DT C7 :methyl -30:sc= -1.94 (180deg=-2.02) USER MOD Set 1.2: A 7 DT C7 :methyl 150:sc= -0.508 (180deg=-0.508) USER MOD Single : A 1 DT C7 :methyl 150:sc= -0.138 (180deg=-0.138) USER MOD Single : A 1 DT O5' : rot 104:sc= 0.0183 USER MOD Single : A 2 DT C7 :methyl 150:sc= -0.485 (180deg=-0.485) USER MOD Single : A 12 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 13 DT C7 :methyl 150:sc= -0.0606 (180deg=-0.0606) USER MOD Single : A 18 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 19 DT C7 :methyl -30:sc= -0.212 (180deg=-0.921) USER MOD Single : A 24 DA O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 4.094 -7.530 -8.110 1.00 0.00 O ATOM 2 C5' DT A 1 4.431 -7.621 -6.726 1.00 0.00 C ATOM 3 C4' DT A 1 3.213 -7.632 -5.781 1.00 0.00 C ATOM 4 O4' DT A 1 2.555 -6.364 -5.747 1.00 0.00 O ATOM 5 C3' DT A 1 2.164 -8.704 -6.158 1.00 0.00 C ATOM 6 O3' DT A 1 1.967 -9.605 -5.066 1.00 0.00 O ATOM 7 C2' DT A 1 0.953 -7.832 -6.492 1.00 0.00 C ATOM 8 C1' DT A 1 1.171 -6.631 -5.587 1.00 0.00 C ATOM 9 N1 DT A 1 0.283 -5.506 -5.987 1.00 0.00 N ATOM 10 C2 DT A 1 -0.929 -5.346 -5.299 1.00 0.00 C ATOM 11 O2 DT A 1 -1.231 -5.994 -4.300 1.00 0.00 O ATOM 12 N3 DT A 1 -1.820 -4.422 -5.802 1.00 0.00 N ATOM 13 C4 DT A 1 -1.623 -3.661 -6.933 1.00 0.00 C ATOM 14 O4 DT A 1 -2.496 -2.865 -7.267 1.00 0.00 O ATOM 15 C5 DT A 1 -0.346 -3.878 -7.609 1.00 0.00 C ATOM 16 C7 DT A 1 -0.010 -3.087 -8.859 1.00 0.00 C ATOM 17 C6 DT 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ATOM 74 N9 DG A 3 2.051 -7.055 -0.519 1.00 0.00 N ATOM 75 C8 DG A 3 2.658 -6.226 -1.434 1.00 0.00 C ATOM 76 N7 DG A 3 1.880 -5.310 -1.950 1.00 0.00 N ATOM 77 C5 DG A 3 0.656 -5.538 -1.312 1.00 0.00 C ATOM 78 C6 DG A 3 -0.602 -4.847 -1.421 1.00 0.00 C ATOM 79 O6 DG A 3 -0.888 -3.868 -2.104 1.00 0.00 O ATOM 80 N1 DG A 3 -1.587 -5.356 -0.607 1.00 0.00 N ATOM 81 C2 DG A 3 -1.394 -6.395 0.230 1.00 0.00 C ATOM 82 N2 DG A 3 -2.433 -6.750 0.937 1.00 0.00 N ATOM 83 N3 DG A 3 -0.252 -7.048 0.390 1.00 0.00 N ATOM 84 C4 DG A 3 0.752 -6.586 -0.418 1.00 0.00 C ATOM 0 H5' DG A 3 1.004 -11.802 -0.863 1.00 0.00 H new ATOM 0 H5'' DG A 3 1.556 -12.527 0.634 1.00 0.00 H new ATOM 0 H4' DG A 3 3.227 -11.116 -0.097 1.00 0.00 H new ATOM 0 H3' DG A 3 2.143 -10.502 2.510 1.00 0.00 H new ATOM 0 H2' DG A 3 1.345 -8.337 1.840 1.00 0.00 H new ATOM 0 H2'' DG A 3 3.015 -7.953 2.206 1.00 0.00 H new ATOM 0 H1' DG A 3 3.707 -8.116 -0.062 1.00 0.00 H new ATOM 0 H8 DG A 3 3.699 -6.324 -1.706 1.00 0.00 H new ATOM 0 H1 DG A 3 -2.511 -4.925 -0.638 1.00 0.00 H new ATOM 0 H21 DG A 3 -2.362 -7.529 1.592 1.00 0.00 H new ATOM 0 H22 DG A 3 -3.315 -6.249 0.834 1.00 0.00 H new ATOM 96 P DG A 4 4.850 -9.871 3.293 1.00 0.00 P ATOM 97 OP1 DG A 4 6.051 -10.736 3.450 1.00 0.00 O ATOM 98 OP2 DG A 4 3.885 -9.791 4.425 1.00 0.00 O ATOM 99 O5' DG A 4 5.348 -8.374 2.931 1.00 0.00 O ATOM 100 C5' DG A 4 6.224 -8.136 1.833 1.00 0.00 C ATOM 101 C4' DG A 4 6.374 -6.643 1.499 1.00 0.00 C ATOM 102 O4' DG A 4 5.132 -6.091 1.065 1.00 0.00 O ATOM 103 C3' DG A 4 6.911 -5.825 2.687 1.00 0.00 C ATOM 104 O3' DG A 4 8.129 -5.183 2.305 1.00 0.00 O ATOM 105 C2' DG A 4 5.742 -4.887 2.995 1.00 0.00 C ATOM 106 C1' DG A 4 4.950 -4.830 1.686 1.00 0.00 C ATOM 107 N9 DG A 4 3.496 -4.579 1.865 1.00 0.00 N ATOM 108 C8 DG A 4 2.620 -5.164 2.750 1.00 0.00 C ATOM 109 N7 DG A 4 1.384 -4.747 2.654 1.00 0.00 N ATOM 110 C5 DG A 4 1.446 -3.808 1.620 1.00 0.00 C ATOM 111 C6 DG A 4 0.420 -3.004 1.016 1.00 0.00 C ATOM 112 O6 DG A 4 -0.774 -2.959 1.287 1.00 0.00 O ATOM 113 N1 DG A 4 0.862 -2.219 -0.020 1.00 0.00 N ATOM 114 C2 DG A 4 2.148 -2.184 -0.427 1.00 0.00 C ATOM 115 N2 DG A 4 2.439 -1.387 -1.417 1.00 0.00 N ATOM 116 N3 DG A 4 3.142 -2.886 0.116 1.00 0.00 N ATOM 117 C4 DG A 4 2.729 -3.697 1.134 1.00 0.00 C ATOM 0 H5' DG A 4 5.850 -8.663 0.956 1.00 0.00 H new ATOM 0 H5'' DG A 4 7.205 -8.552 2.061 1.00 0.00 H new ATOM 0 H4' DG A 4 7.104 -6.581 0.692 1.00 0.00 H new ATOM 0 H3' DG A 4 7.188 -6.389 3.578 1.00 0.00 H new ATOM 0 H2' DG A 4 5.131 -5.268 3.814 1.00 0.00 H new ATOM 0 H2'' DG A 4 6.092 -3.898 3.292 1.00 0.00 H new ATOM 0 H1' DG A 4 5.317 -3.993 1.093 1.00 0.00 H new ATOM 0 H8 DG A 4 2.929 -5.909 3.468 1.00 0.00 H new ATOM 0 H1 DG A 4 0.184 -1.633 -0.507 1.00 0.00 H new ATOM 0 H21 DG A 4 3.398 -1.327 -1.759 1.00 0.00 H new ATOM 0 H22 DG A 4 1.707 -0.823 -1.850 1.00 0.00 H new ATOM 129 P DG A 5 9.104 -4.392 3.339 1.00 0.00 P ATOM 130 OP1 DG A 5 10.465 -4.988 3.236 1.00 0.00 O ATOM 131 OP2 DG A 5 8.463 -4.330 4.682 1.00 0.00 O ATOM 132 O5' DG A 5 9.155 -2.883 2.749 1.00 0.00 O ATOM 133 C5' DG A 5 9.869 -2.584 1.545 1.00 0.00 C ATOM 134 C4' DG A 5 9.515 -1.221 0.917 1.00 0.00 C ATOM 135 O4' DG A 5 8.117 -1.197 0.623 1.00 0.00 O ATOM 136 C3' DG A 5 9.809 -0.024 1.845 1.00 0.00 C ATOM 137 O3' DG A 5 10.135 1.178 1.150 1.00 0.00 O ATOM 138 C2' DG A 5 8.461 0.203 2.513 1.00 0.00 C ATOM 139 C1' DG A 5 7.519 -0.138 1.356 1.00 0.00 C ATOM 140 N9 DG A 5 6.148 -0.469 1.808 1.00 0.00 N ATOM 141 C8 DG A 5 5.754 -1.191 2.909 1.00 0.00 C ATOM 142 N7 DG A 5 4.464 -1.204 3.122 1.00 0.00 N ATOM 143 C5 DG A 5 3.969 -0.387 2.099 1.00 0.00 C ATOM 144 C6 DG A 5 2.632 0.055 1.808 1.00 0.00 C ATOM 145 O6 DG A 5 1.587 -0.249 2.381 1.00 0.00 O ATOM 146 N1 DG A 5 2.559 0.935 0.749 1.00 0.00 N ATOM 147 C2 DG A 5 3.638 1.344 0.040 1.00 0.00 C ATOM 148 N2 DG A 5 3.457 2.241 -0.891 1.00 0.00 N ATOM 149 N3 DG A 5 4.888 0.926 0.233 1.00 0.00 N ATOM 150 C4 DG A 5 4.991 0.066 1.292 1.00 0.00 C ATOM 0 H5' DG A 5 9.671 -3.369 0.815 1.00 0.00 H 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0.00 H new ATOM 0 H71 DT A 6 6.926 -5.048 -1.219 1.00 0.00 H new ATOM 0 H72 DT A 6 7.606 -3.776 -0.176 1.00 0.00 H new ATOM 0 H73 DT A 6 7.107 -3.389 -1.839 1.00 0.00 H new ATOM 0 H6 DT A 6 9.224 -2.545 -2.469 1.00 0.00 H new ATOM 194 P DT A 7 13.473 0.118 -5.606 1.00 0.00 P ATOM 195 OP1 DT A 7 14.813 0.261 -6.239 1.00 0.00 O ATOM 196 OP2 DT A 7 12.616 1.329 -5.485 1.00 0.00 O ATOM 197 O5' DT A 7 12.641 -1.025 -6.392 1.00 0.00 O ATOM 198 C5' DT A 7 13.289 -2.132 -7.009 1.00 0.00 C ATOM 199 C4' DT A 7 12.335 -3.274 -7.395 1.00 0.00 C ATOM 200 O4' DT A 7 12.067 -4.181 -6.322 1.00 0.00 O ATOM 201 C3' DT A 7 10.960 -2.836 -7.953 1.00 0.00 C ATOM 202 O3' DT A 7 10.772 -3.350 -9.273 1.00 0.00 O ATOM 203 C2' DT A 7 10.030 -3.537 -6.958 1.00 0.00 C ATOM 204 C1' DT A 7 10.848 -4.798 -6.698 1.00 0.00 C ATOM 205 N1 DT A 7 10.295 -5.809 -5.746 1.00 0.00 N ATOM 206 C2 DT A 7 11.029 -7.003 -5.614 1.00 0.00 C ATOM 207 O2 DT A 7 12.122 -7.212 -6.143 1.00 0.00 O ATOM 208 N3 DT A 7 10.453 -8.015 -4.880 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0.00 C ATOM 0 H5' DA A 8 8.641 -5.255 -9.191 1.00 0.00 H new ATOM 0 H5'' DA A 8 7.720 -5.015 -10.662 1.00 0.00 H new ATOM 0 H4' DA A 8 6.270 -5.997 -9.005 1.00 0.00 H new ATOM 0 H3' DA A 8 5.727 -3.462 -10.214 1.00 0.00 H new ATOM 0 H2' DA A 8 5.112 -2.247 -8.258 1.00 0.00 H new ATOM 0 H2'' DA A 8 3.820 -3.408 -8.034 1.00 0.00 H new ATOM 0 H1' DA A 8 4.979 -4.547 -6.383 1.00 0.00 H new ATOM 0 H8 DA A 8 7.208 -1.529 -7.384 1.00 0.00 H new ATOM 0 H61 DA A 8 5.892 0.212 -1.476 1.00 0.00 H new ATOM 0 H62 DA A 8 6.738 0.760 -2.928 1.00 0.00 H new ATOM 0 H2 DA A 8 4.248 -3.716 -2.109 1.00 0.00 H new ATOM 258 P DG A 9 3.397 -4.211 -11.116 1.00 0.00 P ATOM 259 OP1 DG A 9 2.201 -5.079 -11.288 1.00 0.00 O ATOM 260 OP2 DG A 9 4.292 -4.000 -12.289 1.00 0.00 O ATOM 261 O5' DG A 9 2.908 -2.772 -10.531 1.00 0.00 O ATOM 262 C5' DG A 9 3.218 -1.527 -11.149 1.00 0.00 C ATOM 263 C4' DG A 9 2.840 -0.276 -10.319 1.00 0.00 C ATOM 264 O4' DG A 9 1.653 -0.433 -9.535 1.00 0.00 O ATOM 265 C3' DG A 9 3.923 0.242 -9.344 1.00 0.00 C ATOM 266 O3' DG A 9 4.189 1.593 -9.735 1.00 0.00 O ATOM 267 C2' DG A 9 3.251 0.091 -7.972 1.00 0.00 C ATOM 268 C1' DG A 9 1.807 0.359 -8.365 1.00 0.00 C ATOM 269 N9 DG A 9 0.756 0.121 -7.336 1.00 0.00 N ATOM 270 C8 DG A 9 -0.419 0.830 -7.258 1.00 0.00 C ATOM 271 N7 DG A 9 -1.233 0.449 -6.318 1.00 0.00 N ATOM 272 C5 DG A 9 -0.536 -0.585 -5.699 1.00 0.00 C ATOM 273 C6 DG A 9 -0.931 -1.408 -4.597 1.00 0.00 C ATOM 274 O6 DG A 9 -1.996 -1.401 -3.986 1.00 0.00 O ATOM 275 N1 DG A 9 0.027 -2.308 -4.209 1.00 0.00 N ATOM 276 C2 DG A 9 1.239 -2.413 -4.797 1.00 0.00 C ATOM 277 N2 DG A 9 2.035 -3.312 -4.278 1.00 0.00 N ATOM 278 N3 DG A 9 1.646 -1.690 -5.845 1.00 0.00 N ATOM 279 C4 DG A 9 0.706 -0.779 -6.272 1.00 0.00 C ATOM 0 H5' DG A 9 2.705 -1.477 -12.109 1.00 0.00 H new ATOM 0 H5'' DG A 9 4.288 -1.498 -11.357 1.00 0.00 H new ATOM 0 H4' DG A 9 2.697 0.450 -11.119 1.00 0.00 H new ATOM 0 H3' DG A 9 4.884 -0.273 -9.334 1.00 0.00 H new ATOM 0 H2' DG A 9 3.391 -0.902 -7.545 1.00 0.00 H new ATOM 0 H2'' DG A 9 3.626 0.808 -7.241 1.00 0.00 H new ATOM 0 H1' DG A 9 1.644 1.426 -8.515 1.00 0.00 H new ATOM 0 H8 DG A 9 -0.650 1.644 -7.929 1.00 0.00 H new ATOM 0 H1 DG A 9 -0.187 -2.934 -3.433 1.00 0.00 H new ATOM 0 H21 DG A 9 2.968 -3.452 -4.666 1.00 0.00 H new ATOM 0 H22 DG A 9 1.723 -3.873 -3.485 1.00 0.00 H new ATOM 291 P DG A 10 5.066 2.651 -8.875 1.00 0.00 P ATOM 292 OP1 DG A 10 5.535 3.713 -9.807 1.00 0.00 O ATOM 293 OP2 DG A 10 6.077 1.916 -8.068 1.00 0.00 O ATOM 294 O5' DG A 10 3.954 3.295 -7.882 1.00 0.00 O ATOM 295 C5' DG A 10 2.841 4.020 -8.404 1.00 0.00 C ATOM 296 C4' DG A 10 1.843 4.489 -7.331 1.00 0.00 C ATOM 297 O4' DG A 10 1.272 3.390 -6.622 1.00 0.00 O ATOM 298 C3' DG A 10 2.497 5.423 -6.299 1.00 0.00 C ATOM 299 O3' DG A 10 1.847 6.693 -6.313 1.00 0.00 O ATOM 300 C2' DG A 10 2.259 4.699 -4.974 1.00 0.00 C ATOM 301 C1' DG A 10 1.054 3.813 -5.287 1.00 0.00 C ATOM 302 N9 DG A 10 0.909 2.658 -4.362 1.00 0.00 N ATOM 303 C8 DG A 10 1.820 1.666 -4.083 1.00 0.00 C ATOM 304 N7 DG A 10 1.407 0.784 -3.209 1.00 0.00 N ATOM 305 C5 DG A 10 0.126 1.233 -2.873 1.00 0.00 C ATOM 306 C6 DG A 10 -0.857 0.694 -1.969 1.00 0.00 C ATOM 307 O6 DG A 10 -0.776 -0.313 -1.268 1.00 0.00 O ATOM 308 N1 DG A 10 -2.024 1.428 -1.916 1.00 0.00 N ATOM 309 C2 DG A 10 -2.220 2.569 -2.620 1.00 0.00 C ATOM 310 N2 DG A 10 -3.355 3.196 -2.459 1.00 0.00 N ATOM 311 N3 DG A 10 -1.340 3.110 -3.462 1.00 0.00 N ATOM 312 C4 DG A 10 -0.181 2.388 -3.560 1.00 0.00 C ATOM 0 H5' DG A 10 2.316 3.392 -9.124 1.00 0.00 H new ATOM 0 H5'' DG A 10 3.209 4.890 -8.948 1.00 0.00 H new ATOM 0 H4' DG A 10 1.066 5.028 -7.873 1.00 0.00 H new ATOM 0 H3' DG A 10 3.553 5.617 -6.488 1.00 0.00 H new ATOM 0 H2' DG A 10 3.126 4.111 -4.672 1.00 0.00 H new ATOM 0 H2'' DG A 10 2.049 5.397 -4.163 1.00 0.00 H new ATOM 0 H1' DG A 10 0.120 4.361 -5.160 1.00 0.00 H new ATOM 0 H8 DG A 10 2.794 1.619 -4.546 1.00 0.00 H new ATOM 0 H1 DG A 10 -2.778 1.094 -1.316 1.00 0.00 H new ATOM 0 H21 DG A 10 -3.539 4.058 -2.972 1.00 0.00 H new ATOM 0 H22 DG A 10 -4.057 2.823 -1.820 1.00 0.00 H new ATOM 324 P DG A 11 2.644 8.090 -6.084 1.00 0.00 P ATOM 325 OP1 DG A 11 2.302 9.003 -7.209 1.00 0.00 O ATOM 326 OP2 DG A 11 4.081 7.813 -5.808 1.00 0.00 O ATOM 327 O5' DG A 11 1.994 8.675 -4.725 1.00 0.00 O ATOM 328 C5' DG A 11 0.716 9.307 -4.712 1.00 0.00 C ATOM 329 C4' DG A 11 0.138 9.485 -3.294 1.00 0.00 C ATOM 330 O4' DG A 11 -0.193 8.210 -2.747 1.00 0.00 O ATOM 331 C3' DG A 11 1.112 10.180 -2.319 1.00 0.00 C ATOM 332 O3' DG A 11 0.392 11.066 -1.460 1.00 0.00 O ATOM 333 C2' DG A 11 1.685 8.976 -1.566 1.00 0.00 C ATOM 334 C1' DG A 11 0.448 8.084 -1.490 1.00 0.00 C ATOM 335 N9 DG A 11 0.721 6.659 -1.188 1.00 0.00 N ATOM 336 C8 DG A 11 1.813 5.885 -1.506 1.00 0.00 C ATOM 337 N7 DG A 11 1.716 4.637 -1.125 1.00 0.00 N ATOM 338 C5 DG A 11 0.479 4.592 -0.477 1.00 0.00 C ATOM 339 C6 DG A 11 -0.199 3.517 0.193 1.00 0.00 C ATOM 340 O6 DG A 11 0.177 2.359 0.346 1.00 0.00 O ATOM 341 N1 DG A 11 -1.421 3.872 0.725 1.00 0.00 N ATOM 342 C2 DG A 11 -1.936 5.123 0.641 1.00 0.00 C ATOM 343 N2 DG A 11 -3.103 5.345 1.181 1.00 0.00 N ATOM 344 N3 DG A 11 -1.341 6.153 0.048 1.00 0.00 N ATOM 345 C4 DG A 11 -0.133 5.825 -0.502 1.00 0.00 C ATOM 0 H5' DG A 11 0.021 8.717 -5.309 1.00 0.00 H new ATOM 0 H5'' DG A 11 0.797 10.284 -5.189 1.00 0.00 H new ATOM 0 H4' DG A 11 -0.741 10.120 -3.402 1.00 0.00 H new ATOM 0 H3' DG A 11 1.878 10.801 -2.784 1.00 0.00 H new ATOM 0 H2' DG A 11 2.506 8.502 -2.104 1.00 0.00 H new ATOM 0 H2'' DG A 11 2.064 9.245 -0.580 1.00 0.00 H new ATOM 0 H1' DG A 11 -0.170 8.413 -0.654 1.00 0.00 H new ATOM 0 H8 DG A 11 2.676 6.274 -2.026 1.00 0.00 H new ATOM 0 H1 DG A 11 -1.965 3.156 1.206 1.00 0.00 H new ATOM 0 H21 DG A 11 -3.518 6.276 1.135 1.00 0.00 H new ATOM 0 H22 DG A 11 -3.601 4.588 1.649 1.00 0.00 H new ATOM 357 P DT A 12 1.118 12.189 -0.539 1.00 0.00 P ATOM 358 OP1 DT A 12 0.058 13.103 -0.031 1.00 0.00 O ATOM 359 OP2 DT A 12 2.244 12.781 -1.312 1.00 0.00 O ATOM 360 O5' DT A 12 1.740 11.386 0.723 1.00 0.00 O ATOM 361 C5' DT A 12 0.912 10.654 1.624 1.00 0.00 C ATOM 362 C4' DT A 12 1.701 10.020 2.782 1.00 0.00 C ATOM 363 O4' DT A 12 2.695 9.129 2.286 1.00 0.00 O ATOM 364 C3' DT A 12 2.412 11.075 3.656 1.00 0.00 C ATOM 365 O3' DT A 12 2.235 10.884 5.059 1.00 0.00 O ATOM 366 C2' DT A 12 3.881 10.863 3.311 1.00 0.00 C ATOM 367 C1' DT A 12 3.884 9.363 3.019 1.00 0.00 C ATOM 368 N1 DT A 12 5.081 8.896 2.264 1.00 0.00 N ATOM 369 C2 DT A 12 5.909 7.931 2.855 1.00 0.00 C ATOM 370 O2 DT A 12 5.716 7.444 3.971 1.00 0.00 O ATOM 371 N3 DT A 12 7.010 7.527 2.130 1.00 0.00 N ATOM 372 C4 DT A 12 7.379 8.007 0.891 1.00 0.00 C ATOM 373 O4 DT A 12 8.398 7.560 0.365 1.00 0.00 O ATOM 374 C5 DT A 12 6.488 9.029 0.339 1.00 0.00 C ATOM 375 C7 DT A 12 6.782 9.648 -1.018 1.00 0.00 C ATOM 376 C6 DT A 12 5.389 9.437 1.030 1.00 0.00 C ATOM 0 H5' DT A 12 0.390 9.870 1.075 1.00 0.00 H new ATOM 0 H5'' DT A 12 0.150 11.319 2.031 1.00 0.00 H new ATOM 0 H4' DT A 12 0.969 9.487 3.389 1.00 0.00 H new ATOM 0 H3' DT A 12 2.017 12.071 3.458 1.00 0.00 H new ATOM 0 H2' DT A 12 4.194 11.454 2.450 1.00 0.00 H new ATOM 0 H2'' DT A 12 4.543 11.126 4.136 1.00 0.00 H new ATOM 0 H1' DT A 12 3.927 8.800 3.951 1.00 0.00 H new ATOM 0 H3 DT A 12 7.604 6.810 2.547 1.00 0.00 H new ATOM 0 H71 DT A 12 5.846 9.938 -1.496 1.00 0.00 H new ATOM 0 H72 DT A 12 7.411 10.529 -0.888 1.00 0.00 H new ATOM 0 H73 DT A 12 7.300 8.922 -1.645 1.00 0.00 H new ATOM 0 H6 DT A 12 4.747 10.196 0.607 1.00 0.00 H new ATOM 389 P DT A 13 0.835 11.192 5.815 1.00 0.00 P ATOM 390 OP1 DT A 13 0.204 12.385 5.186 1.00 0.00 O ATOM 391 OP2 DT A 13 1.126 11.233 7.273 1.00 0.00 O ATOM 392 O5' DT A 13 -0.074 9.877 5.536 1.00 0.00 O ATOM 393 C5' DT A 13 -1.268 9.918 4.755 1.00 0.00 C ATOM 394 C4' DT A 13 -1.908 8.531 4.560 1.00 0.00 C ATOM 395 O4' DT A 13 -1.108 7.698 3.719 1.00 0.00 O ATOM 396 C3' DT A 13 -2.117 7.784 5.892 1.00 0.00 C ATOM 397 O3' DT A 13 -3.497 7.494 6.106 1.00 0.00 O ATOM 398 C2' DT A 13 -1.302 6.511 5.678 1.00 0.00 C ATOM 399 C1' DT A 13 -1.283 6.358 4.154 1.00 0.00 C ATOM 400 N1 DT A 13 -0.202 5.422 3.715 1.00 0.00 N ATOM 401 C2 DT A 13 -0.353 4.065 4.038 1.00 0.00 C ATOM 402 O2 DT A 13 -1.368 3.588 4.543 1.00 0.00 O ATOM 403 N3 DT A 13 0.714 3.241 3.783 1.00 0.00 N ATOM 404 C4 DT A 13 1.913 3.623 3.233 1.00 0.00 C ATOM 405 O4 DT A 13 2.825 2.801 3.161 1.00 0.00 O ATOM 406 C5 DT A 13 1.968 5.018 2.802 1.00 0.00 C ATOM 407 C7 DT A 13 3.202 5.518 2.074 1.00 0.00 C ATOM 408 C6 DT A 13 0.931 5.865 3.057 1.00 0.00 C ATOM 0 H5' DT A 13 -1.043 10.348 3.779 1.00 0.00 H new ATOM 0 H5'' DT A 13 -1.988 10.580 5.237 1.00 0.00 H new ATOM 0 H4' DT A 13 -2.876 8.723 4.097 1.00 0.00 H new ATOM 0 H3' DT A 13 -1.811 8.352 6.770 1.00 0.00 H new ATOM 0 H2' DT A 13 -0.295 6.604 6.086 1.00 0.00 H new ATOM 0 H2'' DT A 13 -1.764 5.651 6.163 1.00 0.00 H new ATOM 0 H1' DT A 13 -2.180 5.908 3.729 1.00 0.00 H new ATOM 0 H3 DT A 13 0.607 2.256 4.024 1.00 0.00 H new ATOM 0 H71 DT A 13 2.921 6.317 1.388 1.00 0.00 H new ATOM 0 H72 DT A 13 3.922 5.899 2.798 1.00 0.00 H new ATOM 0 H73 DT A 13 3.650 4.698 1.513 1.00 0.00 H new ATOM 0 H6 DT A 13 0.995 6.896 2.741 1.00 0.00 H new ATOM 421 P DA A 14 -4.102 7.228 7.593 1.00 0.00 P ATOM 422 OP1 DA A 14 -5.569 7.478 7.529 1.00 0.00 O ATOM 423 OP2 DA A 14 -3.309 8.007 8.583 1.00 0.00 O ATOM 424 O5' DA A 14 -3.851 5.650 7.886 1.00 0.00 O ATOM 425 C5' DA A 14 -4.624 4.636 7.246 1.00 0.00 C ATOM 426 C4' DA A 14 -4.544 3.249 7.916 1.00 0.00 C ATOM 427 O4' DA A 14 -3.223 2.718 7.807 1.00 0.00 O ATOM 428 C3' DA A 14 -4.903 3.271 9.412 1.00 0.00 C ATOM 429 O3' DA A 14 -5.565 2.073 9.813 1.00 0.00 O ATOM 430 C2' DA A 14 -3.530 3.337 10.071 1.00 0.00 C ATOM 431 C1' DA A 14 -2.699 2.487 9.111 1.00 0.00 C ATOM 432 N9 DA A 14 -1.258 2.828 9.187 1.00 0.00 N ATOM 433 C8 DA A 14 -0.484 3.500 8.269 1.00 0.00 C ATOM 434 N7 DA A 14 0.789 3.563 8.579 1.00 0.00 N ATOM 435 C5 DA A 14 0.844 2.890 9.812 1.00 0.00 C ATOM 436 C6 DA A 14 1.872 2.565 10.736 1.00 0.00 C ATOM 437 N6 DA A 14 3.153 2.855 10.592 1.00 0.00 N ATOM 438 N1 DA A 14 1.607 1.917 11.871 1.00 0.00 N ATOM 439 C2 DA A 14 0.348 1.574 12.113 1.00 0.00 C ATOM 440 N3 DA A 14 -0.716 1.788 11.347 1.00 0.00 N ATOM 441 C4 DA A 14 -0.399 2.457 10.198 1.00 0.00 C ATOM 0 H5' DA A 14 -4.294 4.545 6.211 1.00 0.00 H new ATOM 0 H5'' DA A 14 -5.666 4.953 7.221 1.00 0.00 H new ATOM 0 H4' DA A 14 -5.273 2.632 7.390 1.00 0.00 H new ATOM 0 H3' DA A 14 -5.577 4.087 9.672 1.00 0.00 H new ATOM 0 H2' DA A 14 -3.157 4.359 10.144 1.00 0.00 H new ATOM 0 H2'' DA A 14 -3.538 2.928 11.081 1.00 0.00 H new ATOM 0 H1' DA A 14 -2.766 1.431 9.374 1.00 0.00 H new ATOM 0 H8 DA A 14 -0.890 3.938 7.369 1.00 0.00 H new ATOM 0 H61 DA A 14 3.822 2.580 11.311 1.00 0.00 H new ATOM 0 H62 DA A 14 3.473 3.354 9.762 1.00 0.00 H new ATOM 0 H2 DA A 14 0.167 1.059 13.045 1.00 0.00 H new ATOM 453 P DG A 15 -7.161 2.019 10.072 1.00 0.00 P ATOM 454 OP1 DG A 15 -7.512 3.073 11.065 1.00 0.00 O ATOM 455 OP2 DG A 15 -7.508 0.608 10.393 1.00 0.00 O ATOM 456 O5' DG A 15 -7.838 2.374 8.639 1.00 0.00 O ATOM 457 C5' DG A 15 -8.334 3.679 8.350 1.00 0.00 C ATOM 458 C4' DG A 15 -8.737 3.898 6.881 1.00 0.00 C ATOM 459 O4' DG A 15 -7.596 4.005 6.038 1.00 0.00 O ATOM 460 C3' DG A 15 -9.664 2.817 6.282 1.00 0.00 C ATOM 461 O3' DG A 15 -10.880 3.450 5.868 1.00 0.00 O ATOM 462 C2' DG A 15 -8.800 2.255 5.140 1.00 0.00 C ATOM 463 C1' DG A 15 -7.957 3.475 4.780 1.00 0.00 C ATOM 464 N9 DG A 15 -6.761 3.241 3.932 1.00 0.00 N ATOM 465 C8 DG A 15 -6.381 3.994 2.847 1.00 0.00 C ATOM 466 N7 DG A 15 -5.227 3.663 2.330 1.00 0.00 N ATOM 467 C5 DG A 15 -4.809 2.593 3.128 1.00 0.00 C ATOM 468 C6 DG A 15 -3.623 1.782 3.060 1.00 0.00 C ATOM 469 O6 DG A 15 -2.673 1.878 2.286 1.00 0.00 O ATOM 470 N1 DG A 15 -3.592 0.769 3.992 1.00 0.00 N ATOM 471 C2 DG A 15 -4.551 0.585 4.926 1.00 0.00 C ATOM 472 N2 DG A 15 -4.397 -0.397 5.773 1.00 0.00 N ATOM 473 N3 DG A 15 -5.647 1.328 5.050 1.00 0.00 N ATOM 474 C4 DG A 15 -5.740 2.320 4.108 1.00 0.00 C ATOM 0 H5' DG A 15 -7.572 4.411 8.617 1.00 0.00 H new ATOM 0 H5'' DG A 15 -9.199 3.874 8.984 1.00 0.00 H new ATOM 0 H4' DG A 15 -9.301 4.830 6.912 1.00 0.00 H new ATOM 0 H3' DG A 15 -9.987 2.015 6.947 1.00 0.00 H new ATOM 0 H2' DG A 15 -8.188 1.413 5.463 1.00 0.00 H new ATOM 0 H2'' DG A 15 -9.402 1.908 4.300 1.00 0.00 H new ATOM 0 H1' DG A 15 -8.540 4.141 4.144 1.00 0.00 H new ATOM 0 H8 DG A 15 -6.988 4.796 2.453 1.00 0.00 H new ATOM 0 H1 DG A 15 -2.803 0.123 3.977 1.00 0.00 H new ATOM 0 H21 DG A 15 -5.101 -0.566 6.492 1.00 0.00 H new ATOM 0 H22 DG A 15 -3.573 -0.995 5.716 1.00 0.00 H new ATOM 486 P DG A 16 -12.024 2.724 4.978 1.00 0.00 P ATOM 487 OP1 DG A 16 -13.298 3.464 5.198 1.00 0.00 O ATOM 488 OP2 DG A 16 -12.003 1.262 5.256 1.00 0.00 O ATOM 489 O5' DG A 16 -11.541 2.982 3.450 1.00 0.00 O ATOM 490 C5' DG A 16 -11.499 4.300 2.910 1.00 0.00 C ATOM 491 C4' DG A 16 -10.996 4.378 1.458 1.00 0.00 C ATOM 492 O4' DG A 16 -9.596 4.115 1.342 1.00 0.00 O ATOM 493 C3' DG A 16 -11.737 3.434 0.482 1.00 0.00 C ATOM 494 O3' DG A 16 -12.353 4.225 -0.540 1.00 0.00 O ATOM 495 C2' DG A 16 -10.588 2.557 -0.032 1.00 0.00 C ATOM 496 C1' DG A 16 -9.432 3.544 0.057 1.00 0.00 C ATOM 497 N9 DG A 16 -8.080 2.986 -0.210 1.00 0.00 N ATOM 498 C8 DG A 16 -7.177 3.487 -1.118 1.00 0.00 C ATOM 499 N7 DG A 16 -6.041 2.845 -1.170 1.00 0.00 N ATOM 500 C5 DG A 16 -6.197 1.848 -0.205 1.00 0.00 C ATOM 501 C6 DG A 16 -5.279 0.833 0.227 1.00 0.00 C ATOM 502 O6 DG A 16 -4.134 0.629 -0.174 1.00 0.00 O ATOM 503 N1 DG A 16 -5.782 0.013 1.215 1.00 0.00 N ATOM 504 C2 DG A 16 -7.019 0.156 1.749 1.00 0.00 C ATOM 505 N2 DG A 16 -7.366 -0.683 2.693 1.00 0.00 N ATOM 506 N3 DG A 16 -7.900 1.091 1.389 1.00 0.00 N ATOM 507 C4 DG A 16 -7.438 1.916 0.395 1.00 0.00 C ATOM 0 H5' DG A 16 -10.855 4.916 3.538 1.00 0.00 H new ATOM 0 H5'' DG A 16 -12.499 4.731 2.959 1.00 0.00 H new ATOM 0 H4' DG A 16 -11.208 5.409 1.175 1.00 0.00 H new ATOM 0 H3' DG A 16 -12.544 2.836 0.905 1.00 0.00 H new ATOM 0 H2' DG A 16 -10.430 1.675 0.588 1.00 0.00 H new ATOM 0 H2'' DG A 16 -10.757 2.205 -1.050 1.00 0.00 H new ATOM 0 H1' DG A 16 -9.473 4.284 -0.742 1.00 0.00 H new ATOM 0 H8 DG A 16 -7.391 4.344 -1.739 1.00 0.00 H new ATOM 0 H1 DG A 16 -5.191 -0.742 1.563 1.00 0.00 H new ATOM 0 H21 DG A 16 -8.288 -0.613 3.124 1.00 0.00 H new ATOM 0 H22 DG A 16 -6.714 -1.406 2.997 1.00 0.00 H new ATOM 519 P DG A 17 -13.189 3.598 -1.785 1.00 0.00 P ATOM 520 OP1 DG A 17 -14.107 4.659 -2.284 1.00 0.00 O ATOM 521 OP2 DG A 17 -13.777 2.297 -1.367 1.00 0.00 O ATOM 522 O5' DG A 17 -12.071 3.318 -2.927 1.00 0.00 O ATOM 523 C5' DG A 17 -11.367 4.392 -3.546 1.00 0.00 C ATOM 524 C4' DG A 17 -10.211 3.940 -4.456 1.00 0.00 C ATOM 525 O4' DG A 17 -9.217 3.241 -3.706 1.00 0.00 O ATOM 526 C3' DG A 17 -10.647 3.013 -5.607 1.00 0.00 C ATOM 527 O3' DG A 17 -9.964 3.403 -6.797 1.00 0.00 O ATOM 528 C2' DG A 17 -10.146 1.648 -5.146 1.00 0.00 C ATOM 529 C1' DG A 17 -8.866 2.081 -4.442 1.00 0.00 C ATOM 530 N9 DG A 17 -8.270 1.047 -3.569 1.00 0.00 N ATOM 531 C8 DG A 17 -8.849 0.322 -2.556 1.00 0.00 C ATOM 532 N7 DG A 17 -8.043 -0.538 -1.983 1.00 0.00 N ATOM 533 C5 DG A 17 -6.837 -0.367 -2.678 1.00 0.00 C ATOM 534 C6 DG A 17 -5.550 -0.997 -2.531 1.00 0.00 C ATOM 535 O6 DG A 17 -5.206 -1.850 -1.712 1.00 0.00 O ATOM 536 N1 DG A 17 -4.611 -0.554 -3.444 1.00 0.00 N ATOM 537 C2 DG A 17 -4.866 0.390 -4.381 1.00 0.00 C ATOM 538 N2 DG A 17 -3.900 0.720 -5.193 1.00 0.00 N ATOM 539 N3 DG A 17 -6.026 1.011 -4.544 1.00 0.00 N ATOM 540 C4 DG A 17 -6.978 0.590 -3.660 1.00 0.00 C ATOM 0 H5' DG A 17 -10.971 5.048 -2.771 1.00 0.00 H new ATOM 0 H5'' DG A 17 -12.070 4.982 -4.134 1.00 0.00 H new ATOM 0 H4' DG A 17 -9.820 4.863 -4.884 1.00 0.00 H new ATOM 0 H3' DG A 17 -11.716 3.032 -5.818 1.00 0.00 H new ATOM 0 H2' DG A 17 -10.845 1.149 -4.476 1.00 0.00 H new ATOM 0 H2'' DG A 17 -9.959 0.967 -5.976 1.00 0.00 H new ATOM 0 H1' DG A 17 -8.086 2.269 -5.180 1.00 0.00 H new ATOM 0 H8 DG A 17 -9.879 0.450 -2.258 1.00 0.00 H new ATOM 0 H1 DG A 17 -3.676 -0.960 -3.410 1.00 0.00 H new ATOM 0 H21 DG A 17 -4.057 1.427 -5.911 1.00 0.00 H new ATOM 0 H22 DG A 17 -2.988 0.271 -5.110 1.00 0.00 H new ATOM 552 P DT A 18 -10.729 3.748 -8.176 1.00 0.00 P ATOM 553 OP1 DT A 18 -9.754 4.428 -9.071 1.00 0.00 O ATOM 554 OP2 DT A 18 -12.010 4.440 -7.863 1.00 0.00 O ATOM 555 O5' DT A 18 -11.020 2.280 -8.795 1.00 0.00 O ATOM 556 C5' DT A 18 -12.337 1.810 -9.070 1.00 0.00 C ATOM 557 C4' DT A 18 -12.358 0.322 -9.466 1.00 0.00 C ATOM 558 O4' DT A 18 -11.426 0.090 -10.522 1.00 0.00 O ATOM 559 C3' DT A 18 -12.013 -0.604 -8.286 1.00 0.00 C ATOM 560 O3' DT A 18 -13.007 -1.616 -8.132 1.00 0.00 O ATOM 561 C2' DT A 18 -10.653 -1.189 -8.652 1.00 0.00 C ATOM 562 C1' DT A 18 -10.545 -0.964 -10.167 1.00 0.00 C ATOM 563 N1 DT A 18 -9.155 -0.650 -10.616 1.00 0.00 N ATOM 564 C2 DT A 18 -8.591 -1.430 -11.638 1.00 0.00 C ATOM 565 O2 DT A 18 -9.195 -2.321 -12.239 1.00 0.00 O ATOM 566 N3 DT A 18 -7.277 -1.172 -11.965 1.00 0.00 N ATOM 567 C4 DT A 18 -6.466 -0.230 -11.369 1.00 0.00 C ATOM 568 O4 DT A 18 -5.299 -0.127 -11.754 1.00 0.00 O ATOM 569 C5 DT A 18 -7.114 0.562 -10.323 1.00 0.00 C ATOM 570 C7 DT A 18 -6.344 1.646 -9.583 1.00 0.00 C ATOM 571 C6 DT A 18 -8.414 0.341 -9.998 1.00 0.00 C ATOM 0 H5' DT A 18 -12.771 2.404 -9.875 1.00 0.00 H new ATOM 0 H5'' DT A 18 -12.964 1.958 -8.191 1.00 0.00 H new ATOM 0 H4' DT A 18 -13.373 0.092 -9.790 1.00 0.00 H new ATOM 0 H3' DT A 18 -11.982 -0.081 -7.330 1.00 0.00 H new ATOM 0 H2' DT A 18 -9.846 -0.689 -8.116 1.00 0.00 H new ATOM 0 H2'' DT A 18 -10.594 -2.248 -8.401 1.00 0.00 H new ATOM 0 H1' DT A 18 -10.820 -1.892 -10.669 1.00 0.00 H new ATOM 0 H3 DT A 18 -6.868 -1.728 -12.716 1.00 0.00 H new ATOM 0 H71 DT A 18 -7.031 2.434 -9.275 1.00 0.00 H new ATOM 0 H72 DT A 18 -5.866 1.216 -8.703 1.00 0.00 H new ATOM 0 H73 DT A 18 -5.583 2.065 -10.241 1.00 0.00 H new ATOM 0 H6 DT A 18 -8.880 0.953 -9.240 1.00 0.00 H new ATOM 584 P DT A 19 -13.209 -2.420 -6.735 1.00 0.00 P ATOM 585 OP1 DT A 19 -14.662 -2.737 -6.629 1.00 0.00 O ATOM 586 OP2 DT A 19 -12.576 -1.650 -5.632 1.00 0.00 O ATOM 587 O5' DT A 19 -12.370 -3.801 -6.923 1.00 0.00 O ATOM 588 C5' DT A 19 -12.987 -4.995 -7.402 1.00 0.00 C ATOM 589 C4' DT A 19 -12.130 -6.261 -7.224 1.00 0.00 C ATOM 590 O4' DT A 19 -11.061 -6.312 -8.166 1.00 0.00 O ATOM 591 C3' DT A 19 -11.507 -6.398 -5.821 1.00 0.00 C ATOM 592 O3' DT A 19 -11.841 -7.633 -5.187 1.00 0.00 O ATOM 593 C2' DT A 19 -10.007 -6.354 -6.095 1.00 0.00 C ATOM 594 C1' DT A 19 -9.967 -6.925 -7.507 1.00 0.00 C ATOM 595 N1 DT A 19 -8.690 -6.696 -8.239 1.00 0.00 N ATOM 596 C2 DT A 19 -7.948 -7.812 -8.651 1.00 0.00 C ATOM 597 O2 DT A 19 -8.284 -8.980 -8.443 1.00 0.00 O ATOM 598 N3 DT A 19 -6.782 -7.564 -9.342 1.00 0.00 N ATOM 599 C4 DT A 19 -6.286 -6.318 -9.663 1.00 0.00 C ATOM 600 O4 DT A 19 -5.236 -6.248 -10.301 1.00 0.00 O ATOM 601 C5 DT A 19 -7.099 -5.194 -9.194 1.00 0.00 C ATOM 602 C7 DT A 19 -6.672 -3.767 -9.493 1.00 0.00 C ATOM 603 C6 DT A 19 -8.245 -5.415 -8.496 1.00 0.00 C ATOM 0 H5' DT A 19 -13.219 -4.872 -8.460 1.00 0.00 H new ATOM 0 H5'' DT A 19 -13.935 -5.135 -6.882 1.00 0.00 H new ATOM 0 H4' DT A 19 -12.831 -7.080 -7.381 1.00 0.00 H new ATOM 0 H3' DT A 19 -11.867 -5.620 -5.148 1.00 0.00 H new ATOM 0 H2' DT A 19 -9.606 -5.342 -6.045 1.00 0.00 H new ATOM 0 H2'' DT A 19 -9.438 -6.957 -5.387 1.00 0.00 H new ATOM 0 H1' DT A 19 -10.033 -8.012 -7.473 1.00 0.00 H new ATOM 0 H3 DT A 19 -6.238 -8.373 -9.642 1.00 0.00 H new ATOM 0 H71 DT A 19 -5.585 -3.718 -9.558 1.00 0.00 H new ATOM 0 H72 DT A 19 -7.107 -3.448 -10.440 1.00 0.00 H new ATOM 0 H73 DT A 19 -7.018 -3.109 -8.696 1.00 0.00 H new ATOM 0 H6 DT A 19 -8.817 -4.573 -8.136 1.00 0.00 H new ATOM 616 P DA A 20 -13.025 -7.691 -4.087 1.00 0.00 P ATOM 617 OP1 DA A 20 -13.028 -9.045 -3.467 1.00 0.00 O ATOM 618 OP2 DA A 20 -14.277 -7.193 -4.719 1.00 0.00 O ATOM 619 O5' DA A 20 -12.517 -6.599 -3.003 1.00 0.00 O ATOM 620 C5' DA A 20 -11.517 -6.898 -2.032 1.00 0.00 C ATOM 621 C4' DA A 20 -10.672 -5.664 -1.651 1.00 0.00 C ATOM 622 O4' DA A 20 -9.700 -5.452 -2.678 1.00 0.00 O ATOM 623 C3' DA A 20 -11.465 -4.342 -1.483 1.00 0.00 C ATOM 624 O3' DA A 20 -11.186 -3.625 -0.279 1.00 0.00 O ATOM 625 C2' DA A 20 -10.920 -3.505 -2.637 1.00 0.00 C ATOM 626 C1' DA A 20 -9.500 -4.058 -2.740 1.00 0.00 C ATOM 627 N9 DA A 20 -8.756 -3.590 -3.932 1.00 0.00 N ATOM 628 C8 DA A 20 -9.210 -2.878 -5.021 1.00 0.00 C ATOM 629 N7 DA A 20 -8.272 -2.514 -5.859 1.00 0.00 N ATOM 630 C5 DA A 20 -7.110 -3.037 -5.270 1.00 0.00 C ATOM 631 C6 DA A 20 -5.730 -3.025 -5.596 1.00 0.00 C ATOM 632 N6 DA A 20 -5.216 -2.414 -6.644 1.00 0.00 N ATOM 633 N1 DA A 20 -4.822 -3.633 -4.831 1.00 0.00 N ATOM 634 C2 DA A 20 -5.255 -4.221 -3.724 1.00 0.00 C ATOM 635 N3 DA A 20 -6.501 -4.297 -3.264 1.00 0.00 N ATOM 636 C4 DA A 20 -7.393 -3.692 -4.101 1.00 0.00 C ATOM 0 H5' DA A 20 -10.861 -7.677 -2.420 1.00 0.00 H new ATOM 0 H5'' DA A 20 -11.993 -7.298 -1.137 1.00 0.00 H new ATOM 0 H4' DA A 20 -10.241 -5.893 -0.676 1.00 0.00 H new ATOM 0 H3' DA A 20 -12.536 -4.541 -1.461 1.00 0.00 H new ATOM 0 H2' DA A 20 -11.488 -3.648 -3.556 1.00 0.00 H new ATOM 0 H2'' DA A 20 -10.934 -2.438 -2.417 1.00 0.00 H new ATOM 0 H1' DA A 20 -8.847 -3.701 -1.944 1.00 0.00 H new ATOM 0 H8 DA A 20 -10.253 -2.640 -5.171 1.00 0.00 H new ATOM 0 H61 DA A 20 -4.211 -2.450 -6.813 1.00 0.00 H new ATOM 0 H62 DA A 20 -5.823 -1.905 -7.286 1.00 0.00 H new ATOM 0 H2 DA A 20 -4.499 -4.699 -3.118 1.00 0.00 H new HETATM 648 P 8OG A 21 -12.262 -3.472 0.933 1.00 0.00 P HETATM 649 OP1 8OG A 21 -13.650 -3.682 0.427 1.00 0.00 O HETATM 650 OP2 8OG A 21 -11.955 -2.194 1.630 1.00 0.00 O HETATM 651 O5' 8OG A 21 -11.888 -4.669 1.956 1.00 0.00 O HETATM 652 C5' 8OG A 21 -12.324 -6.008 1.758 1.00 0.00 C HETATM 653 C4' 8OG A 21 -11.475 -7.035 2.532 1.00 0.00 C HETATM 654 O4' 8OG A 21 -10.230 -7.253 1.861 1.00 0.00 O HETATM 655 C3' 8OG A 21 -11.164 -6.609 3.985 1.00 0.00 C HETATM 656 O3' 8OG A 21 -11.300 -7.732 4.862 1.00 0.00 O HETATM 657 C2' 8OG A 21 -9.717 -6.131 3.842 1.00 0.00 C HETATM 658 C1' 8OG A 21 -9.199 -7.148 2.832 1.00 0.00 C HETATM 659 N9 8OG A 21 -7.870 -6.821 2.257 1.00 0.00 N HETATM 660 C8 8OG A 21 -6.762 -7.630 2.217 1.00 0.00 C HETATM 661 N7 8OG A 21 -5.717 -7.117 1.658 1.00 0.00 N HETATM 662 C5 8OG A 21 -6.168 -5.883 1.185 1.00 0.00 C HETATM 663 C6 8OG A 21 -5.504 -4.871 0.414 1.00 0.00 C HETATM 664 O6 8OG A 21 -4.341 -4.865 0.018 1.00 0.00 O HETATM 665 N1 8OG A 21 -6.306 -3.791 0.114 1.00 0.00 N HETATM 666 C2 8OG A 21 -7.604 -3.696 0.507 1.00 0.00 C HETATM 667 N2 8OG A 21 -8.297 -2.647 0.141 1.00 0.00 N HETATM 668 N3 8OG A 21 -8.251 -4.609 1.228 1.00 0.00 N HETATM 669 C4 8OG A 21 -7.488 -5.693 1.545 1.00 0.00 C HETATM 670 O8 8OG A 21 -6.726 -8.779 2.657 1.00 0.00 O HETATM 0 H5'' 8OG A 21 -13.365 -6.096 2.070 1.00 0.00 H new HETATM 0 H2'' 8OG A 21 -9.651 -5.107 3.473 1.00 0.00 H new HETATM 0 H7 8OG A 21 -4.783 -7.518 1.580 1.00 0.00 H new HETATM 0 H5' 8OG A 21 -12.289 -6.243 0.694 1.00 0.00 H new HETATM 0 H4' 8OG A 21 -12.074 -7.945 2.568 1.00 0.00 H new HETATM 0 H3' 8OG A 21 -11.822 -5.851 4.411 1.00 0.00 H new HETATM 0 H22 8OG A 21 -9.272 -2.556 0.425 1.00 0.00 H new HETATM 0 H21 8OG A 21 -7.861 -1.921 -0.428 1.00 0.00 H new HETATM 0 H2' 8OG A 21 -9.172 -6.166 4.785 1.00 0.00 H new HETATM 0 H1' 8OG A 21 -8.998 -8.106 3.313 1.00 0.00 H new HETATM 0 H1 8OG A 21 -5.906 -3.026 -0.429 1.00 0.00 H new ATOM 682 P DG A 22 -11.240 -7.600 6.479 1.00 0.00 P ATOM 683 OP1 DG A 22 -11.727 -8.884 7.052 1.00 0.00 O ATOM 684 OP2 DG A 22 -11.931 -6.344 6.881 1.00 0.00 O ATOM 685 O5' DG A 22 -9.667 -7.449 6.835 1.00 0.00 O ATOM 686 C5' DG A 22 -8.755 -8.525 6.629 1.00 0.00 C ATOM 687 C4' DG A 22 -7.276 -8.098 6.671 1.00 0.00 C ATOM 688 O4' DG A 22 -6.943 -7.273 5.556 1.00 0.00 O ATOM 689 C3' DG A 22 -6.887 -7.337 7.957 1.00 0.00 C ATOM 690 O3' DG A 22 -5.864 -8.059 8.641 1.00 0.00 O ATOM 691 C2' DG A 22 -6.417 -5.983 7.412 1.00 0.00 C ATOM 692 C1' DG A 22 -5.976 -6.343 5.998 1.00 0.00 C ATOM 693 N9 DG A 22 -5.876 -5.178 5.087 1.00 0.00 N ATOM 694 C8 DG A 22 -6.789 -4.175 4.849 1.00 0.00 C ATOM 695 N7 DG A 22 -6.372 -3.241 4.031 1.00 0.00 N ATOM 696 C5 DG A 22 -5.067 -3.644 3.735 1.00 0.00 C ATOM 697 C6 DG A 22 -4.057 -3.030 2.920 1.00 0.00 C ATOM 698 O6 DG A 22 -4.132 -1.996 2.260 1.00 0.00 O ATOM 699 N1 DG A 22 -2.865 -3.718 2.907 1.00 0.00 N ATOM 700 C2 DG A 22 -2.636 -4.843 3.623 1.00 0.00 C ATOM 701 N2 DG A 22 -1.422 -5.331 3.616 1.00 0.00 N ATOM 702 N3 DG A 22 -3.551 -5.478 4.351 1.00 0.00 N ATOM 703 C4 DG A 22 -4.752 -4.821 4.378 1.00 0.00 C ATOM 0 H5' DG A 22 -8.964 -8.987 5.664 1.00 0.00 H new ATOM 0 H5'' DG A 22 -8.926 -9.286 7.390 1.00 0.00 H new ATOM 0 H4' DG A 22 -6.717 -9.033 6.643 1.00 0.00 H new ATOM 0 H3' DG A 22 -7.685 -7.217 8.690 1.00 0.00 H new ATOM 0 H2' DG A 22 -7.217 -5.243 7.413 1.00 0.00 H new ATOM 0 H2'' DG A 22 -5.599 -5.568 8.001 1.00 0.00 H new ATOM 0 H1' DG A 22 -4.964 -6.749 5.998 1.00 0.00 H new ATOM 0 H8 DG A 22 -7.770 -4.160 5.301 1.00 0.00 H new ATOM 0 H1 DG A 22 -2.110 -3.359 2.323 1.00 0.00 H new ATOM 0 H21 DG A 22 -1.210 -6.178 4.144 1.00 0.00 H new ATOM 0 H22 DG A 22 -0.688 -4.865 3.083 1.00 0.00 H new ATOM 715 P DG A 23 -5.237 -7.585 10.060 1.00 0.00 P ATOM 716 OP1 DG A 23 -5.048 -8.800 10.901 1.00 0.00 O ATOM 717 OP2 DG A 23 -6.042 -6.462 10.614 1.00 0.00 O ATOM 718 O5' DG A 23 -3.780 -7.011 9.641 1.00 0.00 O ATOM 719 C5' DG A 23 -2.727 -7.891 9.247 1.00 0.00 C ATOM 720 C4' DG A 23 -1.372 -7.189 9.056 1.00 0.00 C ATOM 721 O4' DG A 23 -1.376 -6.378 7.886 1.00 0.00 O ATOM 722 C3' DG A 23 -0.973 -6.310 10.259 1.00 0.00 C ATOM 723 O3' DG A 23 0.326 -6.683 10.718 1.00 0.00 O ATOM 724 C2' DG A 23 -1.036 -4.900 9.665 1.00 0.00 C ATOM 725 C1' DG A 23 -0.731 -5.157 8.193 1.00 0.00 C ATOM 726 N9 DG A 23 -1.218 -4.096 7.279 1.00 0.00 N ATOM 727 C8 DG A 23 -2.502 -3.632 7.110 1.00 0.00 C ATOM 728 N7 DG A 23 -2.626 -2.726 6.174 1.00 0.00 N ATOM 729 C5 DG A 23 -1.321 -2.584 5.687 1.00 0.00 C ATOM 730 C6 DG A 23 -0.793 -1.773 4.623 1.00 0.00 C ATOM 731 O6 DG A 23 -1.394 -1.005 3.878 1.00 0.00 O ATOM 732 N1 DG A 23 0.567 -1.897 4.451 1.00 0.00 N ATOM 733 C2 DG A 23 1.351 -2.690 5.221 1.00 0.00 C ATOM 734 N2 DG A 23 2.642 -2.664 5.009 1.00 0.00 N ATOM 735 N3 DG A 23 0.906 -3.483 6.195 1.00 0.00 N ATOM 736 C4 DG A 23 -0.448 -3.393 6.379 1.00 0.00 C ATOM 0 H5' DG A 23 -3.006 -8.382 8.315 1.00 0.00 H new ATOM 0 H5'' DG A 23 -2.618 -8.672 9.999 1.00 0.00 H new ATOM 0 H4' DG A 23 -0.639 -7.990 8.960 1.00 0.00 H new ATOM 0 H3' DG A 23 -1.608 -6.403 11.140 1.00 0.00 H new ATOM 0 H2' DG A 23 -2.016 -4.443 9.804 1.00 0.00 H new ATOM 0 H2'' DG A 23 -0.305 -4.233 10.122 1.00 0.00 H new ATOM 0 H1' DG A 23 0.349 -5.180 8.048 1.00 0.00 H new ATOM 0 H8 DG A 23 -3.336 -3.985 7.699 1.00 0.00 H new ATOM 0 H1 DG A 23 1.009 -1.363 3.703 1.00 0.00 H new ATOM 0 H21 DG A 23 3.263 -3.248 5.570 1.00 0.00 H new ATOM 0 H22 DG A 23 3.028 -2.060 4.283 1.00 0.00 H new ATOM 748 P DA A 24 0.986 -6.083 12.072 1.00 0.00 P ATOM 749 OP1 DA A 24 1.932 -7.101 12.606 1.00 0.00 O ATOM 750 OP2 DA A 24 -0.094 -5.586 12.967 1.00 0.00 O ATOM 751 O5' DA A 24 1.841 -4.810 11.557 1.00 0.00 O ATOM 752 C5' DA A 24 3.047 -4.975 10.816 1.00 0.00 C ATOM 753 C4' DA A 24 3.651 -3.643 10.340 1.00 0.00 C ATOM 754 O4' DA A 24 2.818 -3.056 9.341 1.00 0.00 O ATOM 755 C3' DA A 24 3.813 -2.616 11.482 1.00 0.00 C ATOM 756 O3' DA A 24 5.085 -1.965 11.424 1.00 0.00 O ATOM 757 C2' DA A 24 2.699 -1.617 11.180 1.00 0.00 C ATOM 758 C1' DA A 24 2.666 -1.685 9.656 1.00 0.00 C ATOM 759 N9 DA A 24 1.439 -1.139 9.031 1.00 0.00 N ATOM 760 C8 DA A 24 0.126 -1.244 9.431 1.00 0.00 C ATOM 761 N7 DA A 24 -0.726 -0.625 8.652 1.00 0.00 N ATOM 762 C5 DA A 24 0.101 -0.052 7.676 1.00 0.00 C ATOM 763 C6 DA A 24 -0.106 0.771 6.543 1.00 0.00 C ATOM 764 N6 DA A 24 -1.275 1.222 6.136 1.00 0.00 N ATOM 765 N1 DA A 24 0.913 1.183 5.789 1.00 0.00 N ATOM 766 C2 DA A 24 2.139 0.827 6.147 1.00 0.00 C ATOM 767 N3 DA A 24 2.496 0.072 7.181 1.00 0.00 N ATOM 768 C4 DA A 24 1.419 -0.347 7.905 1.00 0.00 C ATOM 0 H5' DA A 24 2.851 -5.608 9.950 1.00 0.00 H new ATOM 0 H5'' DA A 24 3.777 -5.498 11.434 1.00 0.00 H new ATOM 0 H4' DA A 24 4.638 -3.881 9.945 1.00 0.00 H new ATOM 0 H3' DA A 24 3.757 -3.067 12.473 1.00 0.00 H new ATOM 0 H2' DA A 24 1.749 -1.908 11.628 1.00 0.00 H new ATOM 0 H2'' DA A 24 2.930 -0.616 11.545 1.00 0.00 H new ATOM 0 HO3' DA A 24 5.156 -1.320 12.158 1.00 0.00 H new ATOM 0 H1' DA A 24 3.459 -1.055 9.254 1.00 0.00 H new ATOM 0 H8 DA A 24 -0.176 -1.790 10.312 1.00 0.00 H new ATOM 0 H61 DA A 24 -1.333 1.812 5.306 1.00 0.00 H new ATOM 0 H62 DA A 24 -2.122 0.981 6.651 1.00 0.00 H new ATOM 0 H2 DA A 24 2.942 1.194 5.525 1.00 0.00 H new TER 781 DA A 24