USER MOD reduce.3.24.130724 H: found=0, std=0, add=188, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 188 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 Set 1.1: A 8 DT C7 :methyl 150:sc= -0.349 (180deg=0) USER MOD Set 1.2: B 12 DT C7 :methyl 150:sc= -0.398 (180deg=-0.0508) USER MOD Set 2.1: A 4 DT C7 :methyl 150:sc= -0.749 (180deg=0) USER MOD Set 2.2: B 16 DT C7 :methyl 150:sc= -0.749 (180deg=0) USER MOD Set 3.1: A 1 DT C7 :methyl -30:sc= 0 (180deg=-0.402) USER MOD Set 3.2: A 8 DT O3' : rot 180:sc= 0 USER MOD Single : A 1 DT O5' : rot 180:sc= 0 USER MOD Single : A 5 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 9 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 9 DT O5' : rot 180:sc= 0 USER MOD Single : B 13 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 16 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 -14.048 -2.105 7.777 1.00 0.00 O ATOM 2 C5' DT A 1 -13.050 -1.594 6.915 1.00 0.00 C ATOM 3 C4' DT A 1 -13.307 -0.118 6.623 1.00 0.00 C ATOM 4 O4' DT A 1 -12.937 0.670 7.736 1.00 0.00 O ATOM 5 C3' DT A 1 -12.423 0.392 5.490 1.00 0.00 C ATOM 6 O3' DT A 1 -12.946 0.037 4.224 1.00 0.00 O ATOM 7 C2' DT A 1 -12.425 1.894 5.763 1.00 0.00 C ATOM 8 C1' DT A 1 -12.712 1.980 7.266 1.00 0.00 C ATOM 9 N1 DT A 1 -11.590 2.552 8.050 1.00 0.00 N ATOM 10 C2 DT A 1 -11.880 3.579 8.949 1.00 0.00 C ATOM 11 O2 DT A 1 -13.006 4.021 9.139 1.00 0.00 O ATOM 12 N3 DT A 1 -10.819 4.124 9.636 1.00 0.00 N ATOM 13 C4 DT A 1 -9.496 3.741 9.518 1.00 0.00 C ATOM 14 O4 DT A 1 -8.656 4.328 10.198 1.00 0.00 O ATOM 15 C5 DT A 1 -9.259 2.654 8.568 1.00 0.00 C ATOM 16 C7 DT A 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-0.335 1.913 1.00 0.00 H new ATOM 94 P DT A 4 -4.990 -5.759 -2.275 1.00 0.00 P ATOM 95 OP1 DT A 4 -6.402 -5.326 -2.216 1.00 0.00 O ATOM 96 OP2 DT A 4 -4.668 -7.179 -2.013 1.00 0.00 O ATOM 97 O5' DT A 4 -4.431 -5.435 -3.738 1.00 0.00 O ATOM 98 C5' DT A 4 -4.658 -4.161 -4.327 1.00 0.00 C ATOM 99 C4' DT A 4 -3.866 -3.916 -5.617 1.00 0.00 C ATOM 100 O4' DT A 4 -2.586 -3.430 -5.265 1.00 0.00 O ATOM 101 C3' DT A 4 -3.664 -5.186 -6.449 1.00 0.00 C ATOM 102 O3' DT A 4 -3.777 -4.918 -7.836 1.00 0.00 O ATOM 103 C2' DT A 4 -2.238 -5.562 -6.076 1.00 0.00 C ATOM 104 C1' DT A 4 -1.629 -4.173 -5.979 1.00 0.00 C ATOM 105 N1 DT A 4 -0.355 -4.176 -5.235 1.00 0.00 N ATOM 106 C2 DT A 4 0.842 -4.112 -5.954 1.00 0.00 C ATOM 107 O2 DT A 4 0.908 -4.048 -7.176 1.00 0.00 O ATOM 108 N3 DT A 4 2.012 -4.130 -5.223 1.00 0.00 N ATOM 109 C4 DT A 4 2.097 -4.162 -3.848 1.00 0.00 C ATOM 110 O4 DT A 4 3.213 -4.134 -3.339 1.00 0.00 O ATOM 111 C5 DT A 4 0.809 -4.216 -3.156 1.00 0.00 C ATOM 112 C7 DT A 4 0.750 -4.234 -1.643 1.00 0.00 C ATOM 113 C6 DT A 4 -0.355 -4.236 -3.857 1.00 0.00 C ATOM 0 H5' DT A 4 -4.401 -3.387 -3.603 1.00 0.00 H new ATOM 0 H5'' DT A 4 -5.722 -4.056 -4.541 1.00 0.00 H new ATOM 0 H4' DT A 4 -4.438 -3.208 -6.217 1.00 0.00 H new ATOM 0 H3' DT A 4 -4.399 -5.967 -6.256 1.00 0.00 H new ATOM 0 H2' DT A 4 -2.182 -6.111 -5.136 1.00 0.00 H new ATOM 0 H2'' DT A 4 -1.756 -6.179 -6.834 1.00 0.00 H new ATOM 0 H1' DT A 4 -1.402 -3.770 -6.966 1.00 0.00 H new ATOM 0 H3 DT A 4 2.888 -4.119 -5.745 1.00 0.00 H new ATOM 0 H71 DT A 4 -0.171 -3.757 -1.309 1.00 0.00 H new ATOM 0 H72 DT A 4 0.773 -5.265 -1.290 1.00 0.00 H new ATOM 0 H73 DT A 4 1.606 -3.693 -1.239 1.00 0.00 H new ATOM 0 H6 DT A 4 -1.294 -4.300 -3.327 1.00 0.00 H new ATOM 126 P DT A 5 -4.338 -6.037 -8.855 1.00 0.00 P ATOM 127 OP1 DT A 5 -4.048 -7.367 -8.268 1.00 0.00 O ATOM 128 OP2 DT A 5 -3.851 -5.703 -10.208 1.00 0.00 O ATOM 129 O5' DT A 5 -5.950 -5.837 -8.845 1.00 0.00 O ATOM 130 C5' DT A 5 -6.738 -6.050 -7.683 1.00 0.00 C ATOM 131 C4' DT 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-0.507 -2.834 1.00 0.00 C ATOM 169 N9 DG A 6 -5.060 -0.530 -3.806 1.00 0.00 N ATOM 170 C8 DG A 6 -5.218 -0.678 -5.143 1.00 0.00 C ATOM 171 N7 DG A 6 -4.108 -0.616 -5.825 1.00 0.00 N ATOM 172 C5 DG A 6 -3.116 -0.523 -4.833 1.00 0.00 C ATOM 173 C6 DG A 6 -1.672 -0.535 -4.902 1.00 0.00 C ATOM 174 O6 DG A 6 -0.905 -0.569 -5.866 1.00 0.00 O ATOM 175 N1 DG A 6 -1.070 -0.548 -3.658 1.00 0.00 N ATOM 176 C2 DG A 6 -1.743 -0.540 -2.478 1.00 0.00 C ATOM 177 N2 DG A 6 -0.986 -0.571 -1.404 1.00 0.00 N ATOM 178 N3 DG A 6 -3.073 -0.509 -2.366 1.00 0.00 N ATOM 179 C4 DG A 6 -3.703 -0.514 -3.581 1.00 0.00 C ATOM 0 H5' DG A 6 -7.508 -2.531 -5.226 1.00 0.00 H new ATOM 0 H5'' DG A 6 -7.641 -3.850 -4.079 1.00 0.00 H new ATOM 0 H4' DG A 6 -8.618 -2.311 -2.445 1.00 0.00 H new ATOM 0 H3' DG A 6 -9.009 -0.479 -4.436 1.00 0.00 H new ATOM 0 H2' DG A 6 -7.066 0.881 -4.244 1.00 0.00 H new ATOM 0 H2'' DG A 6 -7.505 1.182 -2.575 1.00 0.00 H new ATOM 0 H1' DG A 6 -5.811 -0.126 -1.873 1.00 0.00 H new ATOM 0 H8 DG A 6 -6.182 -0.834 -5.605 1.00 0.00 H new ATOM 0 H1 DG A 6 -0.051 -0.565 -3.624 1.00 0.00 H new ATOM 0 H21 DG A 6 -1.414 -0.567 -0.478 1.00 0.00 H new ATOM 0 H22 DG A 6 0.029 -0.599 -1.496 1.00 0.00 H new ATOM 191 P DC A 7 -9.685 -0.229 -0.982 1.00 0.00 P ATOM 192 OP1 DC A 7 -9.928 -1.650 -0.650 1.00 0.00 O ATOM 193 OP2 DC A 7 -10.678 0.769 -0.527 1.00 0.00 O ATOM 194 O5' DC A 7 -8.279 0.204 -0.321 1.00 0.00 O ATOM 195 C5' DC A 7 -8.024 1.556 0.029 1.00 0.00 C ATOM 196 C4' DC A 7 -6.611 1.798 0.574 1.00 0.00 C ATOM 197 O4' DC A 7 -5.570 1.320 -0.233 1.00 0.00 O ATOM 198 C3' DC A 7 -6.407 3.302 0.731 1.00 0.00 C ATOM 199 O3' DC A 7 -6.996 3.734 1.941 1.00 0.00 O ATOM 200 C2' DC A 7 -4.893 3.426 0.662 1.00 0.00 C ATOM 201 C1' DC A 7 -4.448 2.174 -0.097 1.00 0.00 C ATOM 202 N1 DC A 7 -4.030 2.526 -1.471 1.00 0.00 N ATOM 203 C2 DC A 7 -2.683 2.614 -1.798 1.00 0.00 C ATOM 204 O2 DC A 7 -1.817 2.524 -0.928 1.00 0.00 O ATOM 205 N3 DC A 7 -2.303 2.785 -3.093 1.00 0.00 N ATOM 206 C4 DC A 7 -3.249 2.907 -4.013 1.00 0.00 C ATOM 207 N4 DC A 7 -2.837 3.030 -5.250 1.00 0.00 N ATOM 208 C5 DC A 7 -4.647 2.896 -3.717 1.00 0.00 C ATOM 209 C6 DC A 7 -4.989 2.709 -2.420 1.00 0.00 C ATOM 0 H5' DC A 7 -8.751 1.871 0.777 1.00 0.00 H new ATOM 0 H5'' DC A 7 -8.177 2.184 -0.849 1.00 0.00 H new ATOM 0 H4' DC A 7 -6.560 1.246 1.513 1.00 0.00 H new ATOM 0 H3' DC A 7 -6.879 3.936 -0.019 1.00 0.00 H new ATOM 0 H2' DC A 7 -4.591 4.335 0.142 1.00 0.00 H new ATOM 0 H2'' DC A 7 -4.451 3.466 1.658 1.00 0.00 H new ATOM 0 H1' DC A 7 -3.626 1.708 0.447 1.00 0.00 H new ATOM 0 H41 DC A 7 -3.515 3.128 -6.006 1.00 0.00 H new ATOM 0 H42 DC A 7 -1.838 3.028 -5.457 1.00 0.00 H new ATOM 0 H5 DC A 7 -5.392 3.030 -4.487 1.00 0.00 H new ATOM 0 H6 DC A 7 -6.031 2.705 -2.136 1.00 0.00 H new ATOM 221 P DT A 8 -6.913 5.247 2.474 1.00 0.00 P ATOM 222 OP1 DT A 8 -8.249 5.626 2.989 1.00 0.00 O ATOM 223 OP2 DT A 8 -6.289 6.112 1.455 1.00 0.00 O ATOM 224 O5' DT A 8 -5.920 5.127 3.728 1.00 0.00 O ATOM 225 C5' DT A 8 -6.203 4.198 4.763 1.00 0.00 C ATOM 226 C4' DT A 8 -5.281 4.362 5.972 1.00 0.00 C ATOM 227 O4' DT A 8 -3.955 4.021 5.659 1.00 0.00 O ATOM 228 C3' DT A 8 -5.256 5.785 6.527 1.00 0.00 C ATOM 229 O3' DT A 8 -6.218 5.901 7.555 1.00 0.00 O ATOM 230 C2' DT A 8 -3.847 5.923 7.091 1.00 0.00 C ATOM 231 C1' DT A 8 -3.097 4.695 6.562 1.00 0.00 C ATOM 232 N1 DT A 8 -1.870 5.114 5.851 1.00 0.00 N ATOM 233 C2 DT A 8 -0.724 5.372 6.607 1.00 0.00 C ATOM 234 O2 DT A 8 -0.669 5.228 7.824 1.00 0.00 O ATOM 235 N3 DT A 8 0.375 5.846 5.920 1.00 0.00 N ATOM 236 C4 DT A 8 0.433 6.083 4.559 1.00 0.00 C ATOM 237 O4 DT A 8 1.472 6.528 4.078 1.00 0.00 O ATOM 238 C5 DT A 8 -0.800 5.771 3.836 1.00 0.00 C ATOM 239 C7 DT A 8 -0.887 5.921 2.336 1.00 0.00 C ATOM 240 C6 DT A 8 -1.897 5.324 4.491 1.00 0.00 C ATOM 0 H5' DT A 8 -6.107 3.185 4.373 1.00 0.00 H new ATOM 0 H5'' DT A 8 -7.238 4.320 5.082 1.00 0.00 H new ATOM 0 H4' DT A 8 -5.694 3.690 6.724 1.00 0.00 H new ATOM 0 H3' DT A 8 -5.485 6.551 5.786 1.00 0.00 H new ATOM 0 H2' DT A 8 -3.376 6.848 6.759 1.00 0.00 H new ATOM 0 H2'' DT A 8 -3.856 5.943 8.181 1.00 0.00 H new ATOM 0 HO3' DT A 8 -6.204 6.812 7.915 1.00 0.00 H new ATOM 0 H1' DT A 8 -2.813 4.044 7.389 1.00 0.00 H new ATOM 0 H3 DT A 8 1.217 6.038 6.463 1.00 0.00 H new ATOM 0 H71 DT A 8 -1.597 5.196 1.938 1.00 0.00 H new ATOM 0 H72 DT A 8 -1.221 6.929 2.090 1.00 0.00 H new ATOM 0 H73 DT A 8 0.095 5.747 1.895 1.00 0.00 H new ATOM 0 H6 DT A 8 -2.805 5.130 3.939 1.00 0.00 H new TER 254 DT A 8 ATOM 255 O5' DT B 9 11.141 -4.451 4.575 1.00 0.00 O ATOM 256 C5' DT B 9 11.946 -3.996 3.503 1.00 0.00 C ATOM 257 C4' DT B 9 12.855 -2.852 3.959 1.00 0.00 C ATOM 258 O4' DT B 9 13.856 -3.366 4.808 1.00 0.00 O ATOM 259 C3' DT B 9 13.603 -2.204 2.782 1.00 0.00 C ATOM 260 O3' DT B 9 13.069 -0.954 2.382 1.00 0.00 O ATOM 261 C2' DT B 9 15.012 -1.972 3.309 1.00 0.00 C ATOM 262 C1' DT B 9 14.950 -2.488 4.745 1.00 0.00 C ATOM 263 N1 DT B 9 16.157 -3.260 5.096 1.00 0.00 N ATOM 264 C2 DT B 9 16.938 -2.829 6.167 1.00 0.00 C ATOM 265 O2 DT B 9 16.705 -1.815 6.815 1.00 0.00 O ATOM 266 N3 DT B 9 18.032 -3.604 6.486 1.00 0.00 N ATOM 267 C4 DT B 9 18.426 -4.753 5.826 1.00 0.00 C ATOM 268 O4 DT B 9 19.434 -5.334 6.221 1.00 0.00 O ATOM 269 C5 DT B 9 17.561 -5.152 4.716 1.00 0.00 C ATOM 270 C7 DT B 9 17.841 -6.431 3.943 1.00 0.00 C ATOM 271 C6 DT B 9 16.473 -4.406 4.395 1.00 0.00 C ATOM 0 H5' DT B 9 11.312 -3.659 2.683 1.00 0.00 H new ATOM 0 H5'' DT B 9 12.551 -4.818 3.121 1.00 0.00 H new ATOM 0 H4' DT B 9 12.215 -2.118 4.449 1.00 0.00 H new ATOM 0 H3' DT B 9 13.537 -2.851 1.907 1.00 0.00 H new ATOM 0 H2' DT B 9 15.754 -2.512 2.721 1.00 0.00 H new ATOM 0 H2'' DT B 9 15.284 -0.917 3.274 1.00 0.00 H new ATOM 0 HO5' DT B 9 10.565 -5.181 4.265 1.00 0.00 H new ATOM 0 H1' DT B 9 14.867 -1.644 5.430 1.00 0.00 H new ATOM 0 H3 DT B 9 18.600 -3.304 7.278 1.00 0.00 H new ATOM 0 H71 DT B 9 16.904 -6.841 3.567 1.00 0.00 H new ATOM 0 H72 DT B 9 18.503 -6.212 3.105 1.00 0.00 H new ATOM 0 H73 DT B 9 18.317 -7.158 4.602 1.00 0.00 H new ATOM 0 H6 DT B 9 15.842 -4.716 3.575 1.00 0.00 H new ATOM 285 P DC B 10 11.722 -0.856 1.519 1.00 0.00 P ATOM 286 OP1 DC B 10 11.677 -1.994 0.572 1.00 0.00 O ATOM 287 OP2 DC B 10 11.569 0.536 1.031 1.00 0.00 O ATOM 288 O5' DC B 10 10.605 -1.152 2.635 1.00 0.00 O ATOM 289 C5' DC B 10 10.106 -0.137 3.480 1.00 0.00 C ATOM 290 C4' DC B 10 8.882 0.504 2.823 1.00 0.00 C ATOM 291 O4' DC B 10 7.696 0.013 3.418 1.00 0.00 O ATOM 292 C3' DC B 10 8.846 2.023 2.892 1.00 0.00 C ATOM 293 O3' DC B 10 8.982 2.510 1.566 1.00 0.00 O ATOM 294 C2' DC B 10 7.464 2.282 3.468 1.00 0.00 C ATOM 295 C1' DC B 10 6.694 0.985 3.249 1.00 0.00 C ATOM 296 N1 DC B 10 5.572 0.729 4.184 1.00 0.00 N ATOM 297 C2 DC B 10 4.351 0.253 3.683 1.00 0.00 C ATOM 298 O2 DC B 10 4.170 0.080 2.476 1.00 0.00 O ATOM 299 N3 DC B 10 3.321 -0.010 4.529 1.00 0.00 N ATOM 300 C4 DC B 10 3.488 0.218 5.823 1.00 0.00 C ATOM 301 N4 DC B 10 2.488 -0.106 6.606 1.00 0.00 N ATOM 302 C5 DC B 10 4.702 0.733 6.377 1.00 0.00 C ATOM 303 C6 DC B 10 5.721 0.970 5.521 1.00 0.00 C ATOM 0 H5' DC B 10 10.874 0.615 3.658 1.00 0.00 H new ATOM 0 H5'' DC B 10 9.837 -0.554 4.450 1.00 0.00 H new ATOM 0 H4' DC B 10 8.955 0.230 1.770 1.00 0.00 H new ATOM 0 H3' DC B 10 9.626 2.502 3.485 1.00 0.00 H new ATOM 0 H2' DC B 10 7.519 2.534 4.527 1.00 0.00 H new ATOM 0 H2'' DC B 10 6.978 3.119 2.966 1.00 0.00 H new ATOM 0 H1' DC B 10 6.195 0.999 2.280 1.00 0.00 H new ATOM 0 H41 DC B 10 2.558 0.046 7.612 1.00 0.00 H new ATOM 0 H42 DC B 10 1.640 -0.510 6.209 1.00 0.00 H new ATOM 0 H5 DC B 10 4.800 0.925 7.435 1.00 0.00 H new ATOM 0 H6 DC B 10 6.659 1.352 5.896 1.00 0.00 H new ATOM 315 P DG B 11 9.073 4.066 1.204 1.00 0.00 P ATOM 316 OP1 DG B 11 9.981 4.125 0.040 1.00 0.00 O ATOM 317 OP2 DG B 11 9.434 4.800 2.439 1.00 0.00 O ATOM 318 O5' DG B 11 7.576 4.465 0.780 1.00 0.00 O ATOM 319 C5' DG B 11 7.029 4.009 -0.444 1.00 0.00 C ATOM 320 C4' DG B 11 5.509 4.078 -0.478 1.00 0.00 C ATOM 321 O4' DG B 11 4.912 3.241 0.482 1.00 0.00 O ATOM 322 C3' DG B 11 4.956 5.482 -0.282 1.00 0.00 C ATOM 323 O3' DG B 11 4.737 6.019 -1.567 1.00 0.00 O ATOM 324 C2' DG B 11 3.644 5.204 0.432 1.00 0.00 C ATOM 325 C1' DG B 11 3.577 3.684 0.603 1.00 0.00 C ATOM 326 N9 DG B 11 3.133 3.358 1.961 1.00 0.00 N ATOM 327 C8 DG B 11 3.908 3.475 3.067 1.00 0.00 C ATOM 328 N7 DG B 11 3.285 3.265 4.194 1.00 0.00 N ATOM 329 C5 DG B 11 1.977 2.951 3.785 1.00 0.00 C ATOM 330 C6 DG B 11 0.789 2.596 4.526 1.00 0.00 C ATOM 331 O6 DG B 11 0.603 2.499 5.737 1.00 0.00 O ATOM 332 N1 DG B 11 -0.301 2.335 3.715 1.00 0.00 N ATOM 333 C2 DG B 11 -0.279 2.418 2.361 1.00 0.00 C ATOM 334 N2 DG B 11 -1.402 2.130 1.757 1.00 0.00 N ATOM 335 N3 DG B 11 0.786 2.762 1.634 1.00 0.00 N ATOM 336 C4 DG B 11 1.885 3.005 2.407 1.00 0.00 C ATOM 0 H5' DG B 11 7.344 2.980 -0.616 1.00 0.00 H new ATOM 0 H5'' DG B 11 7.433 4.607 -1.261 1.00 0.00 H new ATOM 0 H4' DG B 11 5.255 3.738 -1.482 1.00 0.00 H new ATOM 0 H3' DG B 11 5.587 6.180 0.267 1.00 0.00 H new ATOM 0 H2' DG B 11 3.610 5.708 1.398 1.00 0.00 H new ATOM 0 H2'' DG B 11 2.797 5.570 -0.149 1.00 0.00 H new ATOM 0 H1' DG B 11 2.897 3.232 -0.119 1.00 0.00 H new ATOM 0 H8 DG B 11 4.958 3.722 3.019 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.176 2.063 4.163 1.00 0.00 H new ATOM 0 H21 DG B 11 -1.459 2.171 0.739 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.221 1.864 2.303 1.00 0.00 H new ATOM 348 P DT B 12 4.471 7.567 -1.865 1.00 0.00 P ATOM 349 OP1 DT B 12 5.797 8.215 -1.978 1.00 0.00 O ATOM 350 OP2 DT B 12 3.493 8.087 -0.886 1.00 0.00 O ATOM 351 O5' DT B 12 3.786 7.453 -3.315 1.00 0.00 O ATOM 352 C5' DT B 12 4.437 6.712 -4.336 1.00 0.00 C ATOM 353 C4' DT B 12 3.592 6.435 -5.584 1.00 0.00 C ATOM 354 O4' DT B 12 2.496 5.628 -5.167 1.00 0.00 O ATOM 355 C3' DT B 12 2.989 7.647 -6.291 1.00 0.00 C ATOM 356 O3' DT B 12 2.745 7.328 -7.653 1.00 0.00 O ATOM 357 C2' DT B 12 1.633 7.754 -5.625 1.00 0.00 C ATOM 358 C1' DT B 12 1.295 6.272 -5.554 1.00 0.00 C ATOM 359 N1 DT B 12 0.182 6.072 -4.609 1.00 0.00 N ATOM 360 C2 DT B 12 -1.119 6.062 -5.120 1.00 0.00 C ATOM 361 O2 DT B 12 -1.383 6.103 -6.316 1.00 0.00 O ATOM 362 N3 DT B 12 -2.152 6.042 -4.206 1.00 0.00 N ATOM 363 C4 DT B 12 -2.010 5.997 -2.836 1.00 0.00 C ATOM 364 O4 DT B 12 -3.027 5.962 -2.148 1.00 0.00 O ATOM 365 C5 DT B 12 -0.625 6.010 -2.368 1.00 0.00 C ATOM 366 C7 DT B 12 -0.341 5.971 -0.881 1.00 0.00 C ATOM 367 C6 DT B 12 0.411 6.065 -3.252 1.00 0.00 C ATOM 0 H5' DT B 12 4.763 5.759 -3.919 1.00 0.00 H new ATOM 0 H5'' DT B 12 5.335 7.252 -4.638 1.00 0.00 H new ATOM 0 H4' DT B 12 4.275 5.981 -6.302 1.00 0.00 H new ATOM 0 H3' DT B 12 3.619 8.535 -6.238 1.00 0.00 H new ATOM 0 H2' DT B 12 1.681 8.224 -4.643 1.00 0.00 H new ATOM 0 H2'' DT B 12 0.916 8.323 -6.216 1.00 0.00 H new ATOM 0 H1' DT B 12 0.952 5.854 -6.500 1.00 0.00 H new ATOM 0 H3 DT B 12 -3.102 6.062 -4.576 1.00 0.00 H new ATOM 0 H71 DT B 12 0.611 5.470 -0.705 1.00 0.00 H new ATOM 0 H72 DT B 12 -0.293 6.988 -0.493 1.00 0.00 H new ATOM 0 H73 DT B 12 -1.137 5.426 -0.373 1.00 0.00 H new ATOM 0 H6 DT B 12 1.425 6.104 -2.883 1.00 0.00 H new ATOM 380 P DT B 13 3.624 7.897 -8.860 1.00 0.00 P ATOM 381 OP1 DT B 13 3.656 9.373 -8.707 1.00 0.00 O ATOM 382 OP2 DT B 13 3.077 7.305 -10.093 1.00 0.00 O ATOM 383 O5' DT B 13 5.082 7.270 -8.597 1.00 0.00 O ATOM 384 C5' DT B 13 5.971 7.802 -7.636 1.00 0.00 C ATOM 385 C4' DT B 13 7.417 7.536 -8.057 1.00 0.00 C ATOM 386 O4' DT B 13 7.688 8.010 -9.373 1.00 0.00 O ATOM 387 C3' DT B 13 8.392 8.271 -7.119 1.00 0.00 C ATOM 388 O3' DT B 13 9.415 7.466 -6.572 1.00 0.00 O ATOM 389 C2' DT B 13 9.070 9.284 -8.034 1.00 0.00 C ATOM 390 C1' DT B 13 8.211 9.317 -9.294 1.00 0.00 C ATOM 391 N1 DT B 13 7.117 10.319 -9.363 1.00 0.00 N ATOM 392 C2 DT B 13 6.575 10.613 -10.617 1.00 0.00 C ATOM 393 O2 DT B 13 6.964 10.116 -11.667 1.00 0.00 O ATOM 394 N3 DT B 13 5.571 11.558 -10.661 1.00 0.00 N ATOM 395 C4 DT B 13 5.043 12.219 -9.567 1.00 0.00 C ATOM 396 O4 DT B 13 4.059 12.941 -9.732 1.00 0.00 O ATOM 397 C5 DT B 13 5.700 11.918 -8.295 1.00 0.00 C ATOM 398 C7 DT B 13 5.260 12.585 -6.999 1.00 0.00 C ATOM 399 C6 DT B 13 6.693 10.993 -8.244 1.00 0.00 C ATOM 0 H5' DT B 13 5.779 7.352 -6.662 1.00 0.00 H new ATOM 0 H5'' DT B 13 5.806 8.874 -7.530 1.00 0.00 H new ATOM 0 H4' DT B 13 7.551 6.455 -8.014 1.00 0.00 H new ATOM 0 H3' DT B 13 7.837 8.667 -6.268 1.00 0.00 H new ATOM 0 H2' DT B 13 9.121 10.267 -7.565 1.00 0.00 H new ATOM 0 H2'' DT B 13 10.093 8.986 -8.262 1.00 0.00 H new ATOM 0 H1' DT B 13 8.838 9.633 -10.128 1.00 0.00 H new ATOM 0 H3 DT B 13 5.186 11.788 -11.577 1.00 0.00 H new ATOM 0 H71 DT B 13 5.445 11.912 -6.162 1.00 0.00 H new ATOM 0 H72 DT B 13 5.824 13.507 -6.854 1.00 0.00 H new ATOM 0 H73 DT B 13 4.196 12.815 -7.051 1.00 0.00 H new ATOM 0 H6 DT B 13 7.163 10.781 -7.295 1.00 0.00 H new ATOM 412 P DG B 14 9.153 6.454 -5.358 1.00 0.00 P ATOM 413 OP1 DG B 14 8.110 7.047 -4.486 1.00 0.00 O ATOM 414 OP2 DG B 14 10.446 6.077 -4.762 1.00 0.00 O ATOM 415 O5' DG B 14 8.529 5.174 -6.111 1.00 0.00 O ATOM 416 C5' DG B 14 7.279 4.616 -5.758 1.00 0.00 C ATOM 417 C4' DG B 14 7.393 3.799 -4.466 1.00 0.00 C ATOM 418 O4' DG B 14 6.181 3.756 -3.740 1.00 0.00 O ATOM 419 C3' DG B 14 7.951 2.395 -4.611 1.00 0.00 C ATOM 420 O3' DG B 14 8.768 2.122 -3.476 1.00 0.00 O ATOM 421 C2' DG B 14 6.660 1.610 -4.592 1.00 0.00 C ATOM 422 C1' DG B 14 5.639 2.461 -3.816 1.00 0.00 C ATOM 423 N9 DG B 14 4.372 2.608 -4.544 1.00 0.00 N ATOM 424 C8 DG B 14 4.270 2.914 -5.859 1.00 0.00 C ATOM 425 N7 DG B 14 3.059 2.892 -6.346 1.00 0.00 N ATOM 426 C5 DG B 14 2.279 2.693 -5.187 1.00 0.00 C ATOM 427 C6 DG B 14 0.853 2.721 -4.981 1.00 0.00 C ATOM 428 O6 DG B 14 -0.056 2.883 -5.792 1.00 0.00 O ATOM 429 N1 DG B 14 0.489 2.588 -3.654 1.00 0.00 N ATOM 430 C2 DG B 14 1.366 2.451 -2.622 1.00 0.00 C ATOM 431 N2 DG B 14 0.822 2.349 -1.429 1.00 0.00 N ATOM 432 N3 DG B 14 2.694 2.422 -2.764 1.00 0.00 N ATOM 433 C4 DG B 14 3.085 2.558 -4.070 1.00 0.00 C ATOM 0 H5' DG B 14 6.919 3.979 -6.566 1.00 0.00 H new ATOM 0 H5'' DG B 14 6.545 5.411 -5.627 1.00 0.00 H new ATOM 0 H4' DG B 14 8.140 4.359 -3.903 1.00 0.00 H new ATOM 0 H3' DG B 14 8.575 2.189 -5.481 1.00 0.00 H new ATOM 0 H2' DG B 14 6.311 1.415 -5.606 1.00 0.00 H new ATOM 0 H2'' DG B 14 6.802 0.642 -4.112 1.00 0.00 H new ATOM 0 H1' DG B 14 5.450 1.985 -2.854 1.00 0.00 H new ATOM 0 H8 DG B 14 5.131 3.159 -6.463 1.00 0.00 H new ATOM 0 H1 DG B 14 -0.507 2.593 -3.433 1.00 0.00 H new ATOM 0 H21 DG B 14 1.415 2.244 -0.606 1.00 0.00 H new ATOM 0 H22 DG B 14 -0.193 2.375 -1.327 1.00 0.00 H new ATOM 445 P DC B 15 9.474 0.694 -3.197 1.00 0.00 P ATOM 446 OP1 DC B 15 10.611 0.943 -2.281 1.00 0.00 O ATOM 447 OP2 DC B 15 9.671 -0.006 -4.482 1.00 0.00 O ATOM 448 O5' DC B 15 8.334 -0.090 -2.364 1.00 0.00 O ATOM 449 C5' DC B 15 8.076 0.250 -1.017 1.00 0.00 C ATOM 450 C4' DC B 15 6.707 -0.221 -0.514 1.00 0.00 C ATOM 451 O4' DC B 15 5.594 0.395 -1.119 1.00 0.00 O ATOM 452 C3' DC B 15 6.510 -1.731 -0.597 1.00 0.00 C ATOM 453 O3' DC B 15 7.285 -2.375 0.405 1.00 0.00 O ATOM 454 C2' DC B 15 4.997 -1.805 -0.404 1.00 0.00 C ATOM 455 C1' DC B 15 4.472 -0.457 -0.913 1.00 0.00 C ATOM 456 N1 DC B 15 3.803 -0.644 -2.221 1.00 0.00 N ATOM 457 C2 DC B 15 2.415 -0.716 -2.311 1.00 0.00 C ATOM 458 O2 DC B 15 1.717 -0.716 -1.298 1.00 0.00 O ATOM 459 N3 DC B 15 1.807 -0.768 -3.528 1.00 0.00 N ATOM 460 C4 DC B 15 2.571 -0.799 -4.610 1.00 0.00 C ATOM 461 N4 DC B 15 1.953 -0.800 -5.766 1.00 0.00 N ATOM 462 C5 DC B 15 4.002 -0.812 -4.566 1.00 0.00 C ATOM 463 C6 DC B 15 4.573 -0.746 -3.338 1.00 0.00 C ATOM 0 H5' DC B 15 8.141 1.332 -0.906 1.00 0.00 H new ATOM 0 H5'' DC B 15 8.853 -0.183 -0.387 1.00 0.00 H new ATOM 0 H4' DC B 15 6.740 0.094 0.529 1.00 0.00 H new ATOM 0 H3' DC B 15 6.835 -2.233 -1.508 1.00 0.00 H new ATOM 0 H2' DC B 15 4.567 -2.635 -0.965 1.00 0.00 H new ATOM 0 H2'' DC B 15 4.739 -1.960 0.644 1.00 0.00 H new ATOM 0 H1' DC B 15 3.770 -0.036 -0.193 1.00 0.00 H new ATOM 0 H41 DC B 15 2.491 -0.823 -6.632 1.00 0.00 H new ATOM 0 H42 DC B 15 0.934 -0.778 -5.799 1.00 0.00 H new ATOM 0 H5 DC B 15 4.597 -0.871 -5.466 1.00 0.00 H new ATOM 0 H6 DC B 15 5.649 -0.775 -3.246 1.00 0.00 H new ATOM 475 P DT B 16 7.088 -3.916 0.845 1.00 0.00 P ATOM 476 OP1 DT B 16 8.449 -4.414 1.157 1.00 0.00 O ATOM 477 OP2 DT B 16 6.271 -4.607 -0.169 1.00 0.00 O ATOM 478 O5' DT B 16 6.250 -3.788 2.211 1.00 0.00 O ATOM 479 C5' DT B 16 6.664 -2.862 3.200 1.00 0.00 C ATOM 480 C4' DT B 16 6.029 -3.079 4.575 1.00 0.00 C ATOM 481 O4' DT B 16 4.676 -2.693 4.571 1.00 0.00 O ATOM 482 C3' DT B 16 6.090 -4.533 5.045 1.00 0.00 C ATOM 483 O3' DT B 16 7.189 -4.770 5.903 1.00 0.00 O ATOM 484 C2' DT B 16 4.788 -4.727 5.809 1.00 0.00 C ATOM 485 C1' DT B 16 3.957 -3.478 5.503 1.00 0.00 C ATOM 486 N1 DT B 16 2.655 -3.860 4.910 1.00 0.00 N ATOM 487 C2 DT B 16 1.600 -4.185 5.767 1.00 0.00 C ATOM 488 O2 DT B 16 1.695 -4.167 6.990 1.00 0.00 O ATOM 489 N3 DT B 16 0.410 -4.571 5.178 1.00 0.00 N ATOM 490 C4 DT B 16 0.187 -4.680 3.818 1.00 0.00 C ATOM 491 O4 DT B 16 -0.921 -5.040 3.430 1.00 0.00 O ATOM 492 C5 DT B 16 1.340 -4.342 2.984 1.00 0.00 C ATOM 493 C7 DT B 16 1.260 -4.389 1.474 1.00 0.00 C ATOM 494 C6 DT B 16 2.514 -3.959 3.543 1.00 0.00 C ATOM 0 H5' DT B 16 6.427 -1.854 2.859 1.00 0.00 H new ATOM 0 H5'' DT B 16 7.748 -2.917 3.301 1.00 0.00 H new ATOM 0 H4' DT B 16 6.613 -2.463 5.259 1.00 0.00 H new ATOM 0 H3' DT B 16 6.214 -5.219 4.207 1.00 0.00 H new ATOM 0 H2' DT B 16 4.273 -5.632 5.487 1.00 0.00 H new ATOM 0 H2'' DT B 16 4.970 -4.827 6.879 1.00 0.00 H new ATOM 0 HO3' DT B 16 7.190 -5.710 6.181 1.00 0.00 H new ATOM 0 H1' DT B 16 3.773 -2.923 6.423 1.00 0.00 H new ATOM 0 H3 DT B 16 -0.368 -4.794 5.799 1.00 0.00 H new ATOM 0 H71 DT B 16 1.941 -3.651 1.050 1.00 0.00 H new ATOM 0 H72 DT B 16 1.540 -5.383 1.126 1.00 0.00 H new ATOM 0 H73 DT B 16 0.241 -4.166 1.157 1.00 0.00 H new ATOM 0 H6 DT B 16 3.354 -3.727 2.905 1.00 0.00 H new TER 508 DT B 16