USER MOD reduce.3.24.130724 H: found=0, std=0, add=261, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 261 hydrogens (10 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 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 1 DT O5' : rot 51:sc= -0.188 USER MOD Single : A 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 7 DT C7 :methyl 150:sc= -0.0199 (180deg=-0.0199) USER MOD Single : A 12 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 13 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 18 DT C7 :methyl -30:sc= -2.39! (180deg=-3.24!) USER MOD Single : A 19 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 23 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 0.141 9.816 -8.230 1.00 0.00 O ATOM 2 C5' DT A 1 -0.291 8.964 -9.283 1.00 0.00 C ATOM 3 C4' DT A 1 -0.926 7.695 -8.745 1.00 0.00 C ATOM 4 O4' DT A 1 0.052 6.948 -7.970 1.00 0.00 O ATOM 5 C3' DT A 1 -2.101 7.905 -7.793 1.00 0.00 C ATOM 6 O3' DT A 1 -3.005 6.786 -7.879 1.00 0.00 O ATOM 7 C2' DT A 1 -1.411 7.940 -6.446 1.00 0.00 C ATOM 8 C1' DT A 1 -0.376 6.857 -6.612 1.00 0.00 C ATOM 9 N1 DT A 1 0.793 7.004 -5.728 1.00 0.00 N ATOM 10 C2 DT A 1 0.621 6.779 -4.370 1.00 0.00 C ATOM 11 O2 DT A 1 -0.445 6.449 -3.876 1.00 0.00 O ATOM 12 N3 DT A 1 1.756 6.956 -3.610 1.00 0.00 N ATOM 13 C4 DT A 1 3.012 7.319 -4.061 1.00 0.00 C ATOM 14 O4 DT A 1 3.929 7.432 -3.255 1.00 0.00 O ATOM 15 C5 DT A 1 3.121 7.538 -5.494 1.00 0.00 C ATOM 16 C7 DT A 1 4.446 7.932 -6.069 1.00 0.00 C ATOM 17 C6 DT A 1 2.017 7.374 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0.00 H new ATOM 0 H22 DG A 3 -6.272 3.113 -1.377 1.00 0.00 H new ATOM 96 P DG A 4 -9.702 0.742 -9.205 1.00 0.00 P ATOM 97 OP1 DG A 4 -10.702 0.548 -10.286 1.00 0.00 O ATOM 98 OP2 DG A 4 -9.942 0.041 -7.918 1.00 0.00 O ATOM 99 O5' DG A 4 -8.259 0.346 -9.761 1.00 0.00 O ATOM 100 C5' DG A 4 -7.708 1.004 -10.900 1.00 0.00 C ATOM 101 C4' DG A 4 -6.318 0.489 -11.216 1.00 0.00 C ATOM 102 O4' DG A 4 -5.419 0.827 -10.129 1.00 0.00 O ATOM 103 C3' DG A 4 -6.218 -1.028 -11.397 1.00 0.00 C ATOM 104 O3' DG A 4 -5.456 -1.330 -12.579 1.00 0.00 O ATOM 105 C2' DG A 4 -5.492 -1.503 -10.147 1.00 0.00 C ATOM 106 C1' DG A 4 -4.645 -0.303 -9.779 1.00 0.00 C ATOM 107 N9 DG A 4 -4.320 -0.218 -8.351 1.00 0.00 N ATOM 108 C8 DG A 4 -5.210 -0.252 -7.307 1.00 0.00 C ATOM 109 N7 DG A 4 -4.634 -0.172 -6.139 1.00 0.00 N ATOM 110 C5 DG A 4 -3.283 -0.079 -6.426 1.00 0.00 C ATOM 111 C6 DG A 4 -2.163 0.031 -5.551 1.00 0.00 C ATOM 112 O6 DG A 4 -2.163 0.069 -4.317 1.00 0.00 O ATOM 113 N1 DG A 4 -0.959 0.099 -6.256 1.00 0.00 N ATOM 114 C2 DG A 4 -0.850 0.065 -7.634 1.00 0.00 C ATOM 115 N2 DG A 4 0.390 0.140 -8.138 1.00 0.00 N ATOM 116 N3 DG A 4 -1.891 -0.038 -8.459 1.00 0.00 N ATOM 117 C4 DG A 4 -3.069 -0.105 -7.792 1.00 0.00 C ATOM 0 H5' DG A 4 -7.667 2.078 -10.718 1.00 0.00 H new ATOM 0 H5'' DG A 4 -8.359 0.851 -11.761 1.00 0.00 H new ATOM 0 H4' DG A 4 -6.056 0.961 -12.163 1.00 0.00 H new ATOM 0 H3' DG A 4 -7.188 -1.511 -11.519 1.00 0.00 H new ATOM 0 H2' DG A 4 -6.187 -1.768 -9.350 1.00 0.00 H new ATOM 0 H2'' DG A 4 -4.882 -2.385 -10.343 1.00 0.00 H new ATOM 0 H1' DG A 4 -3.690 -0.373 -10.300 1.00 0.00 H new ATOM 0 H8 DG A 4 -6.279 -0.336 -7.439 1.00 0.00 H new ATOM 0 H1 DG A 4 -0.098 0.180 -5.715 1.00 0.00 H new ATOM 0 H21 DG A 4 0.532 0.120 -9.148 1.00 0.00 H new ATOM 0 H22 DG A 4 1.191 0.217 -7.512 1.00 0.00 H new ATOM 129 P DG A 5 -5.428 -2.826 -13.181 1.00 0.00 P ATOM 130 OP1 DG A 5 -5.737 -2.768 -14.632 1.00 0.00 O ATOM 131 OP2 DG A 5 -6.273 -3.705 -12.333 1.00 0.00 O ATOM 132 O5' DG A 5 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1.00 0.00 C ATOM 170 O3' DT A 6 4.725 -2.345 -17.396 1.00 0.00 O ATOM 171 C2' DT A 6 2.830 -0.818 -17.535 1.00 0.00 C ATOM 172 C1' DT A 6 1.360 -1.108 -17.857 1.00 0.00 C ATOM 173 N1 DT A 6 0.391 -0.463 -16.948 1.00 0.00 N ATOM 174 C2 DT A 6 -0.681 0.214 -17.514 1.00 0.00 C ATOM 175 O2 DT A 6 -0.864 0.281 -18.718 1.00 0.00 O ATOM 176 N3 DT A 6 -1.532 0.813 -16.610 1.00 0.00 N ATOM 177 C4 DT A 6 -1.419 0.804 -15.228 1.00 0.00 C ATOM 178 O4 DT A 6 -2.257 1.385 -14.543 1.00 0.00 O ATOM 179 C5 DT A 6 -0.274 0.077 -14.701 1.00 0.00 C ATOM 180 C7 DT A 6 -0.070 0.029 -13.218 1.00 0.00 C ATOM 181 C6 DT A 6 0.565 -0.517 -15.572 1.00 0.00 C ATOM 0 H5' DT A 6 1.813 -5.209 -17.542 1.00 0.00 H new ATOM 0 H5'' DT A 6 3.279 -4.866 -16.646 1.00 0.00 H new ATOM 0 H4' DT A 6 2.899 -3.469 -18.614 1.00 0.00 H new ATOM 0 H3' DT A 6 3.344 -2.195 -15.906 1.00 0.00 H new ATOM 0 H2' DT A 6 2.928 -0.020 -16.799 1.00 0.00 H new ATOM 0 H2'' DT A 6 3.378 -0.502 -18.423 1.00 0.00 H new ATOM 0 H1' DT A 6 1.163 -0.698 -18.848 1.00 0.00 H new ATOM 0 H3 DT A 6 -2.329 1.316 -16.999 1.00 0.00 H new ATOM 0 H71 DT A 6 0.429 -0.902 -12.949 1.00 0.00 H new ATOM 0 H72 DT A 6 0.546 0.873 -12.908 1.00 0.00 H new ATOM 0 H73 DT A 6 -1.036 0.081 -12.716 1.00 0.00 H new ATOM 0 H6 DT A 6 1.413 -1.061 -15.181 1.00 0.00 H new ATOM 194 P DT A 7 5.918 -2.280 -16.313 1.00 0.00 P ATOM 195 OP1 DT A 7 7.159 -2.810 -16.934 1.00 0.00 O ATOM 196 OP2 DT A 7 5.457 -2.912 -15.051 1.00 0.00 O ATOM 197 O5' DT A 7 6.086 -0.710 -16.080 1.00 0.00 O ATOM 198 C5' DT A 7 7.262 -0.166 -15.484 1.00 0.00 C ATOM 199 C4' DT A 7 7.573 1.208 -16.045 1.00 0.00 C ATOM 200 O4' DT A 7 7.865 1.094 -17.465 1.00 0.00 O ATOM 201 C3' DT A 7 6.432 2.223 -15.938 1.00 0.00 C ATOM 202 O3' DT A 7 6.964 3.535 -15.661 1.00 0.00 O ATOM 203 C2' DT A 7 5.797 2.166 -17.318 1.00 0.00 C ATOM 204 C1' DT A 7 7.006 1.947 -18.204 1.00 0.00 C ATOM 205 N1 DT A 7 6.712 1.309 -19.501 1.00 0.00 N ATOM 206 C2 DT A 7 7.110 1.964 -20.657 1.00 0.00 C ATOM 207 O2 DT A 7 7.690 3.038 -20.648 1.00 0.00 O ATOM 208 N3 DT A 7 6.798 1.310 -21.830 1.00 0.00 N ATOM 209 C4 DT A 7 6.143 0.094 -21.956 1.00 0.00 C ATOM 210 O4 DT A 7 5.931 -0.372 -23.073 1.00 0.00 O ATOM 211 C5 DT A 7 5.755 -0.537 -20.704 1.00 0.00 C ATOM 212 C7 DT A 7 5.042 -1.854 -20.748 1.00 0.00 C ATOM 213 C6 DT A 7 6.053 0.090 -19.551 1.00 0.00 C ATOM 0 H5' DT A 7 8.105 -0.834 -15.661 1.00 0.00 H new ATOM 0 H5'' DT A 7 7.129 -0.100 -14.404 1.00 0.00 H new ATOM 0 H4' DT A 7 8.410 1.567 -15.446 1.00 0.00 H new ATOM 0 H3' DT A 7 5.723 2.010 -15.138 1.00 0.00 H new ATOM 0 H2' DT A 7 5.075 1.354 -17.403 1.00 0.00 H new ATOM 0 H2'' DT A 7 5.270 3.088 -17.565 1.00 0.00 H new ATOM 0 H1' DT A 7 7.434 2.918 -18.452 1.00 0.00 H new ATOM 0 H3 DT A 7 7.079 1.769 -22.697 1.00 0.00 H new ATOM 0 H71 DT A 7 5.283 -2.428 -19.853 1.00 0.00 H new ATOM 0 H72 DT A 7 3.966 -1.684 -20.792 1.00 0.00 H new ATOM 0 H73 DT A 7 5.358 -2.409 -21.631 1.00 0.00 H new ATOM 0 H6 DT A 7 5.765 -0.378 -18.621 1.00 0.00 H new ATOM 226 P DA A 8 5.994 4.764 -15.262 1.00 0.00 P ATOM 227 OP1 DA A 8 5.151 5.120 -16.431 1.00 0.00 O ATOM 228 OP2 DA A 8 6.827 5.843 -14.674 1.00 0.00 O ATOM 229 O5' DA A 8 5.072 4.145 -14.112 1.00 0.00 O ATOM 230 C5' DA A 8 3.810 3.537 -14.389 1.00 0.00 C ATOM 231 C4' DA A 8 2.683 4.541 -14.268 1.00 0.00 C ATOM 232 O4' DA A 8 2.460 5.163 -15.549 1.00 0.00 O ATOM 233 C3' DA A 8 1.331 3.942 -13.913 1.00 0.00 C ATOM 234 O3' DA A 8 0.441 4.954 -13.406 1.00 0.00 O ATOM 235 C2' DA A 8 0.852 3.440 -15.264 1.00 0.00 C ATOM 236 C1' DA A 8 1.411 4.486 -16.236 1.00 0.00 C ATOM 237 N9 DA A 8 1.962 3.930 -17.487 1.00 0.00 N ATOM 238 C8 DA A 8 1.936 2.623 -17.914 1.00 0.00 C ATOM 239 N7 DA A 8 2.520 2.428 -19.071 1.00 0.00 N ATOM 240 C5 DA A 8 2.965 3.690 -19.438 1.00 0.00 C ATOM 241 C6 DA A 8 3.668 4.163 -20.573 1.00 0.00 C ATOM 242 N6 DA A 8 4.059 3.379 -21.582 1.00 0.00 N ATOM 243 N1 DA A 8 3.959 5.487 -20.632 1.00 0.00 N ATOM 244 C2 DA A 8 3.565 6.276 -19.616 1.00 0.00 C ATOM 245 N3 DA A 8 2.901 5.951 -18.501 1.00 0.00 N ATOM 246 C4 DA A 8 2.627 4.628 -18.470 1.00 0.00 C ATOM 0 H5' DA A 8 3.641 2.711 -13.698 1.00 0.00 H new ATOM 0 H5'' DA A 8 3.819 3.115 -15.394 1.00 0.00 H new ATOM 0 H4' DA A 8 3.006 5.216 -13.475 1.00 0.00 H new ATOM 0 H3' DA A 8 1.376 3.174 -13.141 1.00 0.00 H new ATOM 0 H2' DA A 8 1.232 2.442 -15.482 1.00 0.00 H new ATOM 0 H2'' DA A 8 -0.236 3.384 -15.312 1.00 0.00 H new ATOM 0 H1' DA A 8 0.586 5.133 -16.533 1.00 0.00 H new ATOM 0 H8 DA A 8 1.475 1.828 -17.346 1.00 0.00 H new ATOM 0 H61 DA A 8 4.563 3.779 -22.373 1.00 0.00 H new ATOM 0 H62 DA A 8 3.854 2.380 -21.561 1.00 0.00 H new ATOM 0 H2 DA A 8 3.821 7.321 -19.715 1.00 0.00 H new ATOM 258 P DG A 9 0.431 5.346 -11.842 1.00 0.00 P ATOM 259 OP1 DG A 9 -0.151 4.228 -11.054 1.00 0.00 O ATOM 260 OP2 DG A 9 -0.198 6.682 -11.702 1.00 0.00 O ATOM 261 O5' DG A 9 1.982 5.469 -11.488 1.00 0.00 O ATOM 262 C5' DG A 9 2.419 5.603 -10.141 1.00 0.00 C ATOM 263 C4' DG A 9 3.885 5.251 -10.009 1.00 0.00 C ATOM 264 O4' DG A 9 4.270 5.370 -8.616 1.00 0.00 O ATOM 265 C3' DG A 9 4.244 3.819 -10.402 1.00 0.00 C ATOM 266 O3' DG A 9 5.607 3.755 -10.867 1.00 0.00 O ATOM 267 C2' DG A 9 4.079 3.073 -9.093 1.00 0.00 C ATOM 268 C1' DG A 9 4.583 4.090 -8.082 1.00 0.00 C ATOM 269 N9 DG A 9 3.972 3.978 -6.749 1.00 0.00 N ATOM 270 C8 DG A 9 4.617 4.015 -5.537 1.00 0.00 C ATOM 271 N7 DG A 9 3.808 3.893 -4.521 1.00 0.00 N ATOM 272 C5 DG A 9 2.553 3.767 -5.089 1.00 0.00 C ATOM 273 C6 DG A 9 1.274 3.604 -4.475 1.00 0.00 C ATOM 274 O6 DG A 9 1.011 3.542 -3.268 1.00 0.00 O ATOM 275 N1 DG A 9 0.250 3.515 -5.427 1.00 0.00 N ATOM 276 C2 DG A 9 0.444 3.576 -6.798 1.00 0.00 C ATOM 277 N2 DG A 9 -0.645 3.475 -7.573 1.00 0.00 N ATOM 278 N3 DG A 9 1.632 3.728 -7.370 1.00 0.00 N ATOM 279 C4 DG A 9 2.635 3.817 -6.467 1.00 0.00 C ATOM 0 H5' DG A 9 1.826 4.954 -9.496 1.00 0.00 H new ATOM 0 H5'' DG A 9 2.255 6.626 -9.802 1.00 0.00 H new ATOM 0 H4' DG A 9 4.399 5.934 -10.685 1.00 0.00 H new ATOM 0 H3' DG A 9 3.635 3.413 -11.210 1.00 0.00 H new ATOM 0 H2' DG A 9 3.041 2.796 -8.910 1.00 0.00 H new ATOM 0 H2'' DG A 9 4.663 2.153 -9.072 1.00 0.00 H new ATOM 0 H1' DG A 9 5.649 3.919 -7.934 1.00 0.00 H new ATOM 0 H8 DG A 9 5.686 4.133 -5.435 1.00 0.00 H new ATOM 0 H1 DG A 9 -0.705 3.397 -5.088 1.00 0.00 H new ATOM 0 H21 DG A 9 -0.554 3.514 -8.588 1.00 0.00 H new ATOM 0 H22 DG A 9 -1.565 3.359 -7.148 1.00 0.00 H new ATOM 291 P DG A 10 6.243 2.357 -11.361 1.00 0.00 P ATOM 292 OP1 DG A 10 7.395 2.641 -12.255 1.00 0.00 O ATOM 293 OP2 DG A 10 5.157 1.496 -11.894 1.00 0.00 O ATOM 294 O5' DG A 10 6.786 1.727 -10.000 1.00 0.00 O ATOM 295 C5' DG A 10 7.770 2.397 -9.218 1.00 0.00 C ATOM 296 C4' DG A 10 7.963 1.712 -7.881 1.00 0.00 C ATOM 297 O4' DG A 10 6.752 1.833 -7.092 1.00 0.00 O ATOM 298 C3' DG A 10 8.268 0.213 -7.964 1.00 0.00 C ATOM 299 O3' DG A 10 9.471 -0.075 -7.233 1.00 0.00 O ATOM 300 C2' DG A 10 7.056 -0.457 -7.317 1.00 0.00 C ATOM 301 C1' DG A 10 6.525 0.625 -6.399 1.00 0.00 C ATOM 302 N9 DG A 10 5.086 0.522 -6.097 1.00 0.00 N ATOM 303 C8 DG A 10 4.057 0.430 -7.005 1.00 0.00 C ATOM 304 N7 DG A 10 2.882 0.351 -6.444 1.00 0.00 N ATOM 305 C5 DG A 10 3.143 0.392 -5.085 1.00 0.00 C ATOM 306 C6 DG A 10 2.248 0.342 -3.976 1.00 0.00 C ATOM 307 O6 DG A 10 1.016 0.251 -3.995 1.00 0.00 O ATOM 308 N1 DG A 10 2.928 0.411 -2.755 1.00 0.00 N ATOM 309 C2 DG A 10 4.301 0.516 -2.622 1.00 0.00 C ATOM 310 N2 DG A 10 4.786 0.568 -1.367 1.00 0.00 N ATOM 311 N3 DG A 10 5.144 0.564 -3.654 1.00 0.00 N ATOM 312 C4 DG A 10 4.502 0.497 -4.849 1.00 0.00 C ATOM 0 H5' DG A 10 7.470 3.433 -9.059 1.00 0.00 H new ATOM 0 H5'' DG A 10 8.716 2.419 -9.759 1.00 0.00 H new ATOM 0 H4' DG A 10 8.824 2.212 -7.438 1.00 0.00 H new ATOM 0 H3' DG A 10 8.428 -0.138 -8.983 1.00 0.00 H new ATOM 0 H2' DG A 10 6.316 -0.757 -8.059 1.00 0.00 H new ATOM 0 H2'' DG A 10 7.336 -1.354 -6.765 1.00 0.00 H new ATOM 0 H1' DG A 10 7.027 0.547 -5.435 1.00 0.00 H new ATOM 0 H8 DG A 10 4.207 0.424 -8.075 1.00 0.00 H new ATOM 0 H1 DG A 10 2.371 0.382 -1.901 1.00 0.00 H new ATOM 0 H21 DG A 10 5.791 0.646 -1.211 1.00 0.00 H new ATOM 0 H22 DG A 10 4.148 0.530 -0.572 1.00 0.00 H new ATOM 324 P DG A 11 10.124 -1.547 -7.271 1.00 0.00 P ATOM 325 OP1 DG A 11 11.600 -1.417 -7.377 1.00 0.00 O ATOM 326 OP2 DG A 11 9.429 -2.361 -8.301 1.00 0.00 O ATOM 327 O5' DG A 11 9.756 -2.107 -5.827 1.00 0.00 O ATOM 328 C5' DG A 11 10.107 -1.385 -4.652 1.00 0.00 C ATOM 329 C4' DG A 11 9.559 -2.065 -3.417 1.00 0.00 C ATOM 330 O4' DG A 11 8.128 -1.829 -3.330 1.00 0.00 O ATOM 331 C3' DG A 11 9.736 -3.589 -3.391 1.00 0.00 C ATOM 332 O3' DG A 11 10.247 -4.001 -2.112 1.00 0.00 O ATOM 333 C2' DG A 11 8.323 -4.115 -3.607 1.00 0.00 C ATOM 334 C1' DG A 11 7.493 -3.032 -2.959 1.00 0.00 C ATOM 335 N9 DG A 11 6.089 -2.981 -3.394 1.00 0.00 N ATOM 336 C8 DG A 11 5.613 -2.982 -4.684 1.00 0.00 C ATOM 337 N7 DG A 11 4.308 -2.973 -4.749 1.00 0.00 N ATOM 338 C5 DG A 11 3.896 -2.965 -3.427 1.00 0.00 C ATOM 339 C6 DG A 11 2.582 -2.955 -2.869 1.00 0.00 C ATOM 340 O6 DG A 11 1.501 -2.957 -3.465 1.00 0.00 O ATOM 341 N1 DG A 11 2.613 -2.949 -1.470 1.00 0.00 N ATOM 342 C2 DG A 11 3.770 -2.950 -0.710 1.00 0.00 C ATOM 343 N2 DG A 11 3.617 -2.942 0.620 1.00 0.00 N ATOM 344 N3 DG A 11 4.995 -2.961 -1.225 1.00 0.00 N ATOM 345 C4 DG A 11 4.986 -2.967 -2.578 1.00 0.00 C ATOM 0 H5' DG A 11 9.718 -0.369 -4.715 1.00 0.00 H new ATOM 0 H5'' DG A 11 11.192 -1.307 -4.578 1.00 0.00 H new ATOM 0 H4' DG A 11 10.126 -1.639 -2.590 1.00 0.00 H new ATOM 0 H3' DG A 11 10.439 -3.958 -4.138 1.00 0.00 H new ATOM 0 H2' DG A 11 8.087 -4.234 -4.665 1.00 0.00 H new ATOM 0 H2'' DG A 11 8.171 -5.086 -3.135 1.00 0.00 H new ATOM 0 H1' DG A 11 7.444 -3.218 -1.886 1.00 0.00 H new ATOM 0 H8 DG A 11 6.252 -2.989 -5.554 1.00 0.00 H new ATOM 0 H1 DG A 11 1.721 -2.944 -0.976 1.00 0.00 H new ATOM 0 H21 DG A 11 4.436 -2.942 1.228 1.00 0.00 H new ATOM 0 H22 DG A 11 2.681 -2.936 1.026 1.00 0.00 H new ATOM 357 P DT A 12 10.794 -5.501 -1.892 1.00 0.00 P ATOM 358 OP1 DT A 12 12.072 -5.441 -1.137 1.00 0.00 O ATOM 359 OP2 DT A 12 10.801 -6.210 -3.197 1.00 0.00 O ATOM 360 O5' DT A 12 9.671 -6.135 -0.954 1.00 0.00 O ATOM 361 C5' DT A 12 8.830 -7.194 -1.400 1.00 0.00 C ATOM 362 C4' DT A 12 7.595 -7.285 -0.532 1.00 0.00 C ATOM 363 O4' DT A 12 6.515 -6.527 -1.147 1.00 0.00 O ATOM 364 C3' DT A 12 7.048 -8.708 -0.336 1.00 0.00 C ATOM 365 O3' DT A 12 6.795 -8.953 1.062 1.00 0.00 O ATOM 366 C2' DT A 12 5.747 -8.700 -1.121 1.00 0.00 C ATOM 367 C1' DT A 12 5.322 -7.257 -0.979 1.00 0.00 C ATOM 368 N1 DT A 12 4.326 -6.804 -1.970 1.00 0.00 N ATOM 369 C2 DT A 12 3.059 -6.494 -1.502 1.00 0.00 C ATOM 370 O2 DT A 12 2.775 -6.464 -0.317 1.00 0.00 O ATOM 371 N3 DT A 12 2.137 -6.203 -2.476 1.00 0.00 N ATOM 372 C4 DT A 12 2.342 -6.174 -3.840 1.00 0.00 C ATOM 373 O4 DT A 12 1.394 -5.910 -4.581 1.00 0.00 O ATOM 374 C5 DT A 12 3.698 -6.490 -4.272 1.00 0.00 C ATOM 375 C7 DT A 12 4.016 -6.471 -5.735 1.00 0.00 C ATOM 376 C6 DT A 12 4.616 -6.788 -3.328 1.00 0.00 C ATOM 0 H5' DT A 12 9.375 -8.138 -1.369 1.00 0.00 H new ATOM 0 H5'' DT A 12 8.542 -7.026 -2.438 1.00 0.00 H new ATOM 0 H4' DT A 12 7.909 -6.900 0.438 1.00 0.00 H new ATOM 0 H3' DT A 12 7.737 -9.484 -0.668 1.00 0.00 H new ATOM 0 H2' DT A 12 5.894 -8.984 -2.163 1.00 0.00 H new ATOM 0 H2'' DT A 12 5.011 -9.388 -0.704 1.00 0.00 H new ATOM 0 H1' DT A 12 4.829 -7.116 -0.017 1.00 0.00 H new ATOM 0 H3 DT A 12 1.194 -5.983 -2.155 1.00 0.00 H new ATOM 0 H71 DT A 12 5.061 -6.196 -5.877 1.00 0.00 H new ATOM 0 H72 DT A 12 3.840 -7.460 -6.158 1.00 0.00 H new ATOM 0 H73 DT A 12 3.378 -5.743 -6.236 1.00 0.00 H new ATOM 0 H6 DT A 12 5.621 -7.025 -3.643 1.00 0.00 H new ATOM 389 P DT A 13 6.597 -10.458 1.614 1.00 0.00 P ATOM 390 OP1 DT A 13 7.319 -10.595 2.906 1.00 0.00 O ATOM 391 OP2 DT A 13 6.937 -11.417 0.534 1.00 0.00 O ATOM 392 O5' DT A 13 5.025 -10.526 1.893 1.00 0.00 O ATOM 393 C5' DT A 13 4.357 -9.520 2.655 1.00 0.00 C ATOM 394 C4' DT A 13 3.023 -9.150 2.030 1.00 0.00 C ATOM 395 O4' DT A 13 3.159 -9.075 0.596 1.00 0.00 O ATOM 396 C3' DT A 13 1.899 -10.150 2.257 1.00 0.00 C ATOM 397 O3' DT A 13 1.244 -9.867 3.512 1.00 0.00 O ATOM 398 C2' DT A 13 0.981 -9.891 1.066 1.00 0.00 C ATOM 399 C1' DT A 13 1.938 -9.436 -0.035 1.00 0.00 C ATOM 400 N1 DT A 13 2.228 -10.457 -1.059 1.00 0.00 N ATOM 401 C2 DT A 13 1.791 -10.225 -2.355 1.00 0.00 C ATOM 402 O2 DT A 13 1.176 -9.222 -2.681 1.00 0.00 O ATOM 403 N3 DT A 13 2.102 -11.219 -3.258 1.00 0.00 N ATOM 404 C4 DT A 13 2.792 -12.394 -2.998 1.00 0.00 C ATOM 405 O4 DT A 13 2.999 -13.194 -3.907 1.00 0.00 O ATOM 406 C5 DT A 13 3.220 -12.573 -1.619 1.00 0.00 C ATOM 407 C7 DT A 13 3.972 -13.814 -1.248 1.00 0.00 C ATOM 408 C6 DT A 13 2.923 -11.610 -0.726 1.00 0.00 C ATOM 0 H5' DT A 13 4.988 -8.634 2.723 1.00 0.00 H new ATOM 0 H5'' DT A 13 4.198 -9.877 3.673 1.00 0.00 H new ATOM 0 H4' DT A 13 2.763 -8.207 2.511 1.00 0.00 H new ATOM 0 H3' DT A 13 2.221 -11.190 2.318 1.00 0.00 H new ATOM 0 H2' DT A 13 0.436 -10.790 0.777 1.00 0.00 H new ATOM 0 H2'' DT A 13 0.238 -9.127 1.292 1.00 0.00 H new ATOM 0 H1' DT A 13 1.457 -8.612 -0.562 1.00 0.00 H new ATOM 0 H3 DT A 13 1.792 -11.075 -4.219 1.00 0.00 H new ATOM 0 H71 DT A 13 4.650 -13.596 -0.423 1.00 0.00 H new ATOM 0 H72 DT A 13 3.268 -14.589 -0.944 1.00 0.00 H new ATOM 0 H73 DT A 13 4.546 -14.162 -2.107 1.00 0.00 H new ATOM 0 H6 DT A 13 3.241 -11.742 0.298 1.00 0.00 H new ATOM 421 P DA A 14 -0.282 -10.314 3.789 1.00 0.00 P ATOM 422 OP1 DA A 14 -0.490 -10.424 5.256 1.00 0.00 O ATOM 423 OP2 DA A 14 -0.601 -11.506 2.963 1.00 0.00 O ATOM 424 O5' DA A 14 -1.107 -9.059 3.246 1.00 0.00 O ATOM 425 C5' DA A 14 -0.974 -7.776 3.851 1.00 0.00 C ATOM 426 C4' DA A 14 -2.064 -6.831 3.386 1.00 0.00 C ATOM 427 O4' DA A 14 -1.676 -6.224 2.126 1.00 0.00 O ATOM 428 C3' DA A 14 -3.428 -7.480 3.124 1.00 0.00 C ATOM 429 O3' DA A 14 -4.483 -6.614 3.592 1.00 0.00 O ATOM 430 C2' DA A 14 -3.463 -7.596 1.605 1.00 0.00 C ATOM 431 C1' DA A 14 -2.751 -6.324 1.209 1.00 0.00 C ATOM 432 N9 DA A 14 -2.204 -6.280 -0.162 1.00 0.00 N ATOM 433 C8 DA A 14 -0.893 -6.107 -0.532 1.00 0.00 C ATOM 434 N7 DA A 14 -0.706 -6.054 -1.823 1.00 0.00 N ATOM 435 C5 DA A 14 -1.972 -6.202 -2.355 1.00 0.00 C ATOM 436 C6 DA A 14 -2.445 -6.229 -3.689 1.00 0.00 C ATOM 437 N6 DA A 14 -1.653 -6.080 -4.764 1.00 0.00 N ATOM 438 N1 DA A 14 -3.780 -6.391 -3.881 1.00 0.00 N ATOM 439 C2 DA A 14 -4.574 -6.515 -2.799 1.00 0.00 C ATOM 440 N3 DA A 14 -4.246 -6.505 -1.500 1.00 0.00 N ATOM 441 C4 DA A 14 -2.915 -6.343 -1.342 1.00 0.00 C ATOM 0 H5' DA A 14 0.002 -7.356 3.607 1.00 0.00 H new ATOM 0 H5'' DA A 14 -1.016 -7.877 4.935 1.00 0.00 H new ATOM 0 H4' DA A 14 -2.173 -6.125 4.209 1.00 0.00 H new ATOM 0 H3' DA A 14 -3.565 -8.436 3.630 1.00 0.00 H new ATOM 0 H2' DA A 14 -2.948 -8.487 1.246 1.00 0.00 H new ATOM 0 H2'' DA A 14 -4.481 -7.638 1.217 1.00 0.00 H new ATOM 0 H1' DA A 14 -3.474 -5.509 1.230 1.00 0.00 H new ATOM 0 H8 DA A 14 -0.087 -6.022 0.182 1.00 0.00 H new ATOM 0 H61 DA A 14 -2.054 -6.109 -5.701 1.00 0.00 H new ATOM 0 H62 DA A 14 -0.650 -5.938 -4.643 1.00 0.00 H new ATOM 0 H2 DA A 14 -5.626 -6.640 -3.009 1.00 0.00 H new ATOM 453 P DG A 15 -4.922 -6.611 5.146 1.00 0.00 P ATOM 454 OP1 DG A 15 -5.020 -8.015 5.623 1.00 0.00 O ATOM 455 OP2 DG A 15 -6.123 -5.752 5.297 1.00 0.00 O ATOM 456 O5' DG A 15 -3.682 -5.906 5.868 1.00 0.00 O ATOM 457 C5' DG A 15 -3.668 -4.505 6.140 1.00 0.00 C ATOM 458 C4' DG A 15 -2.299 -4.065 6.625 1.00 0.00 C ATOM 459 O4' DG A 15 -1.325 -4.284 5.562 1.00 0.00 O ATOM 460 C3' DG A 15 -2.182 -2.573 6.970 1.00 0.00 C ATOM 461 O3' DG A 15 -1.208 -2.370 8.022 1.00 0.00 O ATOM 462 C2' DG A 15 -1.685 -1.999 5.661 1.00 0.00 C ATOM 463 C1' DG A 15 -0.685 -3.058 5.266 1.00 0.00 C ATOM 464 N9 DG A 15 -0.302 -3.047 3.851 1.00 0.00 N ATOM 465 C8 DG A 15 0.973 -3.003 3.344 1.00 0.00 C ATOM 466 N7 DG A 15 1.005 -2.987 2.042 1.00 0.00 N ATOM 467 C5 DG A 15 -0.324 -3.021 1.663 1.00 0.00 C ATOM 468 C6 DG A 15 -0.908 -3.024 0.365 1.00 0.00 C ATOM 469 O6 DG A 15 -0.331 -2.996 -0.730 1.00 0.00 O ATOM 470 N1 DG A 15 -2.306 -3.066 0.431 1.00 0.00 N ATOM 471 C2 DG A 15 -3.038 -3.100 1.605 1.00 0.00 C ATOM 472 N2 DG A 15 -4.371 -3.146 1.483 1.00 0.00 N ATOM 473 N3 DG A 15 -2.497 -3.097 2.815 1.00 0.00 N ATOM 474 C4 DG A 15 -1.146 -3.058 2.772 1.00 0.00 C ATOM 0 H5' DG A 15 -4.419 -4.269 6.894 1.00 0.00 H new ATOM 0 H5'' DG A 15 -3.935 -3.952 5.239 1.00 0.00 H new ATOM 0 H4' DG A 15 -2.126 -4.648 7.529 1.00 0.00 H new ATOM 0 H3' DG A 15 -3.106 -2.122 7.333 1.00 0.00 H new ATOM 0 H2' DG A 15 -2.483 -1.886 4.927 1.00 0.00 H new ATOM 0 H2'' DG A 15 -1.225 -1.019 5.785 1.00 0.00 H new ATOM 0 H1' DG A 15 0.247 -2.886 5.805 1.00 0.00 H new ATOM 0 H8 DG A 15 1.859 -2.984 3.962 1.00 0.00 H new ATOM 0 H1 DG A 15 -2.822 -3.072 -0.449 1.00 0.00 H new ATOM 0 H21 DG A 15 -4.959 -3.173 2.316 1.00 0.00 H new ATOM 0 H22 DG A 15 -4.798 -3.154 0.557 1.00 0.00 H new HETATM 486 P BGM A 16 -0.885 -0.888 8.588 1.00 0.00 P HETATM 487 OP1 BGM A 16 -1.176 -0.857 10.044 1.00 0.00 O HETATM 488 OP2 BGM A 16 -1.567 0.119 7.734 1.00 0.00 O HETATM 489 O5' BGM A 16 0.698 -0.762 8.378 1.00 0.00 O HETATM 490 C5' BGM A 16 1.313 -1.083 7.133 1.00 0.00 C HETATM 491 C4' BGM A 16 2.662 -0.416 6.991 1.00 0.00 C HETATM 492 O4' BGM A 16 3.142 -0.618 5.631 1.00 0.00 O HETATM 493 C1' BGM A 16 3.408 0.634 5.021 1.00 0.00 C HETATM 494 N9 BGM A 16 3.089 0.538 3.578 1.00 0.00 N HETATM 495 C8 BGM A 16 3.976 0.546 2.525 1.00 0.00 C HETATM 496 N7 BGM A 16 3.416 0.473 1.351 1.00 0.00 N HETATM 497 C5 BGM A 16 2.061 0.409 1.634 1.00 0.00 C HETATM 498 C4 BGM A 16 1.836 0.447 3.004 1.00 0.00 C HETATM 499 N3 BGM A 16 0.648 0.404 3.658 1.00 0.00 N HETATM 500 C2 BGM A 16 -0.386 0.316 2.824 1.00 0.00 C HETATM 501 N2 BGM A 16 -1.633 0.259 3.318 1.00 0.00 N HETATM 502 N1 BGM A 16 -0.266 0.274 1.447 1.00 0.00 N HETATM 503 C6 BGM A 16 0.946 0.316 0.751 1.00 0.00 C HETATM 504 O6 BGM A 16 0.955 0.275 -0.483 1.00 0.00 O HETATM 505 C2' BGM A 16 2.579 1.642 5.793 1.00 0.00 C HETATM 506 C3' BGM A 16 2.659 1.097 7.207 1.00 0.00 C HETATM 507 O3' BGM A 16 3.880 1.509 7.849 1.00 0.00 O HETATM 508 BR BGM A 16 5.861 0.646 2.739 1.00 0.00 BR HETATM 0 H5'' BGM A 16 1.430 -2.164 7.052 1.00 0.00 H new HETATM 0 H2'' BGM A 16 2.989 2.649 5.720 1.00 0.00 H new HETATM 0 H5' BGM A 16 0.664 -0.771 6.315 1.00 0.00 H new HETATM 0 H4' BGM A 16 3.285 -0.869 7.762 1.00 0.00 H new HETATM 0 H3' BGM A 16 1.848 1.448 7.845 1.00 0.00 H new HETATM 0 H22 BGM A 16 -2.430 0.192 2.685 1.00 0.00 H new HETATM 0 H21 BGM A 16 -1.784 0.283 4.327 1.00 0.00 H new HETATM 0 H2' BGM A 16 1.552 1.689 5.431 1.00 0.00 H new HETATM 0 H1' BGM A 16 4.452 0.945 5.060 1.00 0.00 H new HETATM 0 H1 BGM A 16 -1.124 0.208 0.899 1.00 0.00 H new ATOM 519 P DG A 17 4.076 3.033 8.337 1.00 0.00 P ATOM 520 OP1 DG A 17 4.978 3.050 9.517 1.00 0.00 O ATOM 521 OP2 DG A 17 2.741 3.667 8.484 1.00 0.00 O ATOM 522 O5' DG A 17 4.832 3.695 7.098 1.00 0.00 O ATOM 523 C5' DG A 17 6.140 3.275 6.721 1.00 0.00 C ATOM 524 C4' DG A 17 6.564 3.917 5.417 1.00 0.00 C ATOM 525 O4' DG A 17 5.693 3.456 4.351 1.00 0.00 O ATOM 526 C3' DG A 17 6.485 5.449 5.397 1.00 0.00 C ATOM 527 O3' DG A 17 7.704 6.002 4.860 1.00 0.00 O ATOM 528 C2' DG A 17 5.313 5.744 4.472 1.00 0.00 C ATOM 529 C1' DG A 17 5.323 4.549 3.540 1.00 0.00 C ATOM 530 N9 DG A 17 4.025 4.250 2.911 1.00 0.00 N ATOM 531 C8 DG A 17 2.814 4.093 3.544 1.00 0.00 C ATOM 532 N7 DG A 17 1.826 3.876 2.719 1.00 0.00 N ATOM 533 C5 DG A 17 2.412 3.890 1.467 1.00 0.00 C ATOM 534 C6 DG A 17 1.828 3.715 0.179 1.00 0.00 C ATOM 535 O6 DG A 17 0.643 3.513 -0.099 1.00 0.00 O ATOM 536 N1 DG A 17 2.781 3.805 -0.839 1.00 0.00 N ATOM 537 C2 DG A 17 4.129 4.035 -0.635 1.00 0.00 C ATOM 538 N2 DG A 17 4.897 4.098 -1.730 1.00 0.00 N ATOM 539 N3 DG A 17 4.683 4.199 0.565 1.00 0.00 N ATOM 540 C4 DG A 17 3.773 4.116 1.565 1.00 0.00 C ATOM 0 H5' DG A 17 6.162 2.190 6.620 1.00 0.00 H new ATOM 0 H5'' DG A 17 6.850 3.536 7.506 1.00 0.00 H new ATOM 0 H4' DG A 17 7.608 3.629 5.289 1.00 0.00 H new ATOM 0 H3' DG A 17 6.355 5.881 6.389 1.00 0.00 H new ATOM 0 H2' DG A 17 4.374 5.824 5.019 1.00 0.00 H new ATOM 0 H2'' DG A 17 5.448 6.681 3.932 1.00 0.00 H new ATOM 0 H1' DG A 17 6.002 4.755 2.712 1.00 0.00 H new ATOM 0 H8 DG A 17 2.693 4.144 4.616 1.00 0.00 H new ATOM 0 H1 DG A 17 2.459 3.693 -1.801 1.00 0.00 H new ATOM 0 H21 DG A 17 5.899 4.266 -1.641 1.00 0.00 H new ATOM 0 H22 DG A 17 4.480 3.978 -2.653 1.00 0.00 H new ATOM 552 P DT A 18 8.396 7.295 5.536 1.00 0.00 P ATOM 553 OP1 DT A 18 9.864 7.224 5.316 1.00 0.00 O ATOM 554 OP2 DT A 18 7.921 7.425 6.936 1.00 0.00 O ATOM 555 O5' DT A 18 7.804 8.499 4.672 1.00 0.00 O ATOM 556 C5' DT A 18 8.193 8.695 3.318 1.00 0.00 C ATOM 557 C4' DT A 18 7.612 9.981 2.768 1.00 0.00 C ATOM 558 O4' DT A 18 7.847 10.032 1.339 1.00 0.00 O ATOM 559 C3' DT A 18 6.100 10.123 2.924 1.00 0.00 C ATOM 560 O3' DT A 18 5.719 11.513 2.949 1.00 0.00 O ATOM 561 C2' DT A 18 5.586 9.455 1.667 1.00 0.00 C ATOM 562 C1' DT A 18 6.618 9.883 0.634 1.00 0.00 C ATOM 563 N1 DT A 18 6.821 8.917 -0.461 1.00 0.00 N ATOM 564 C2 DT A 18 6.623 9.350 -1.764 1.00 0.00 C ATOM 565 O2 DT A 18 6.287 10.489 -2.044 1.00 0.00 O ATOM 566 N3 DT A 18 6.833 8.389 -2.732 1.00 0.00 N ATOM 567 C4 DT A 18 7.214 7.071 -2.527 1.00 0.00 C ATOM 568 O4 DT A 18 7.364 6.323 -3.489 1.00 0.00 O ATOM 569 C5 DT A 18 7.405 6.687 -1.136 1.00 0.00 C ATOM 570 C7 DT A 18 7.824 5.284 -0.822 1.00 0.00 C ATOM 571 C6 DT A 18 7.202 7.614 -0.182 1.00 0.00 C ATOM 0 H5' DT A 18 7.857 7.852 2.714 1.00 0.00 H new ATOM 0 H5'' DT A 18 9.280 8.724 3.249 1.00 0.00 H new ATOM 0 H4' DT A 18 8.099 10.771 3.339 1.00 0.00 H new ATOM 0 H3' DT A 18 5.711 9.690 3.846 1.00 0.00 H new ATOM 0 H2' DT A 18 5.539 8.371 1.771 1.00 0.00 H new ATOM 0 H2'' DT A 18 4.583 9.794 1.406 1.00 0.00 H new ATOM 0 H1' DT A 18 6.264 10.798 0.160 1.00 0.00 H new ATOM 0 H3 DT A 18 6.693 8.678 -3.700 1.00 0.00 H new ATOM 0 H71 DT A 18 7.437 4.609 -1.586 1.00 0.00 H new ATOM 0 H72 DT A 18 8.912 5.225 -0.803 1.00 0.00 H new ATOM 0 H73 DT A 18 7.428 4.995 0.152 1.00 0.00 H new ATOM 0 H6 DT A 18 7.343 7.329 0.850 1.00 0.00 H new ATOM 584 P DT A 19 5.739 12.346 4.330 1.00 0.00 P ATOM 585 OP1 DT A 19 6.930 13.233 4.340 1.00 0.00 O ATOM 586 OP2 DT A 19 5.578 11.402 5.464 1.00 0.00 O ATOM 587 O5' DT A 19 4.425 13.250 4.216 1.00 0.00 O ATOM 588 C5' DT A 19 3.423 13.010 3.228 1.00 0.00 C ATOM 589 C4' DT A 19 2.095 12.685 3.880 1.00 0.00 C ATOM 590 O4' DT A 19 1.099 12.455 2.847 1.00 0.00 O ATOM 591 C3' DT A 19 2.094 11.415 4.723 1.00 0.00 C ATOM 592 O3' DT A 19 1.115 11.511 5.774 1.00 0.00 O ATOM 593 C2' DT A 19 1.700 10.358 3.711 1.00 0.00 C ATOM 594 C1' DT A 19 0.675 11.096 2.871 1.00 0.00 C ATOM 595 N1 DT A 19 0.559 10.614 1.479 1.00 0.00 N ATOM 596 C2 DT A 19 -0.558 9.863 1.134 1.00 0.00 C ATOM 597 O2 DT A 19 -1.423 9.543 1.932 1.00 0.00 O ATOM 598 N3 DT A 19 -0.614 9.483 -0.188 1.00 0.00 N ATOM 599 C4 DT A 19 0.313 9.768 -1.178 1.00 0.00 C ATOM 600 O4 DT A 19 0.127 9.366 -2.323 1.00 0.00 O ATOM 601 C5 DT A 19 1.462 10.551 -0.747 1.00 0.00 C ATOM 602 C7 DT A 19 2.518 10.899 -1.750 1.00 0.00 C ATOM 603 C6 DT A 19 1.530 10.932 0.542 1.00 0.00 C ATOM 0 H5' DT A 19 3.730 12.185 2.585 1.00 0.00 H new ATOM 0 H5'' DT A 19 3.316 13.888 2.591 1.00 0.00 H new ATOM 0 H4' DT A 19 1.886 13.538 4.526 1.00 0.00 H new ATOM 0 H3' DT A 19 3.043 11.211 5.219 1.00 0.00 H new ATOM 0 H2' DT A 19 2.551 10.024 3.117 1.00 0.00 H new ATOM 0 H2'' DT A 19 1.277 9.474 4.188 1.00 0.00 H new ATOM 0 H1' DT A 19 -0.308 10.940 3.316 1.00 0.00 H new ATOM 0 H3 DT A 19 -1.425 8.932 -0.469 1.00 0.00 H new ATOM 0 H71 DT A 19 2.979 11.849 -1.479 1.00 0.00 H new ATOM 0 H72 DT A 19 3.278 10.118 -1.764 1.00 0.00 H new ATOM 0 H73 DT A 19 2.067 10.984 -2.739 1.00 0.00 H new ATOM 0 H6 DT A 19 2.382 11.513 0.862 1.00 0.00 H new ATOM 616 P DA A 20 1.235 10.591 7.093 1.00 0.00 P ATOM 617 OP1 DA A 20 0.520 11.256 8.212 1.00 0.00 O ATOM 618 OP2 DA A 20 2.662 10.236 7.305 1.00 0.00 O ATOM 619 O5' DA A 20 0.430 9.279 6.674 1.00 0.00 O ATOM 620 C5' DA A 20 -0.981 9.307 6.481 1.00 0.00 C ATOM 621 C4' DA A 20 -1.450 8.096 5.700 1.00 0.00 C ATOM 622 O4' DA A 20 -0.786 8.066 4.407 1.00 0.00 O ATOM 623 C3' DA A 20 -1.138 6.744 6.348 1.00 0.00 C ATOM 624 O3' DA A 20 -2.210 5.817 6.094 1.00 0.00 O ATOM 625 C2' DA A 20 0.129 6.314 5.628 1.00 0.00 C ATOM 626 C1' DA A 20 -0.155 6.812 4.228 1.00 0.00 C ATOM 627 N9 DA A 20 1.027 7.000 3.374 1.00 0.00 N ATOM 628 C8 DA A 20 2.317 7.281 3.759 1.00 0.00 C ATOM 629 N7 DA A 20 3.156 7.394 2.757 1.00 0.00 N ATOM 630 C5 DA A 20 2.370 7.173 1.635 1.00 0.00 C ATOM 631 C6 DA A 20 2.664 7.153 0.250 1.00 0.00 C ATOM 632 N6 DA A 20 3.879 7.382 -0.255 1.00 0.00 N ATOM 633 N1 DA A 20 1.644 6.897 -0.608 1.00 0.00 N ATOM 634 C2 DA A 20 0.417 6.680 -0.103 1.00 0.00 C ATOM 635 N3 DA A 20 0.019 6.675 1.173 1.00 0.00 N ATOM 636 C4 DA A 20 1.054 6.929 2.003 1.00 0.00 C ATOM 0 H5' DA A 20 -1.260 10.217 5.949 1.00 0.00 H new ATOM 0 H5'' DA A 20 -1.483 9.336 7.448 1.00 0.00 H new ATOM 0 H4' DA A 20 -2.532 8.212 5.645 1.00 0.00 H new ATOM 0 H3' DA A 20 -1.023 6.788 7.431 1.00 0.00 H new ATOM 0 H2' DA A 20 1.022 6.770 6.055 1.00 0.00 H new ATOM 0 H2'' DA A 20 0.276 5.234 5.660 1.00 0.00 H new ATOM 0 H1' DA A 20 -0.753 6.061 3.712 1.00 0.00 H new ATOM 0 H8 DA A 20 2.612 7.398 4.791 1.00 0.00 H new ATOM 0 H61 DA A 20 4.026 7.353 -1.264 1.00 0.00 H new ATOM 0 H62 DA A 20 4.660 7.586 0.368 1.00 0.00 H new ATOM 0 H2 DA A 20 -0.356 6.482 -0.831 1.00 0.00 H new ATOM 648 P DG A 21 -2.361 4.486 6.990 1.00 0.00 P ATOM 649 OP1 DG A 21 -2.420 4.867 8.424 1.00 0.00 O ATOM 650 OP2 DG A 21 -1.318 3.517 6.575 1.00 0.00 O ATOM 651 O5' DG A 21 -3.785 3.927 6.541 1.00 0.00 O ATOM 652 C5' DG A 21 -4.993 4.608 6.868 1.00 0.00 C ATOM 653 C4' DG A 21 -6.171 3.985 6.147 1.00 0.00 C ATOM 654 O4' DG A 21 -6.045 4.236 4.724 1.00 0.00 O ATOM 655 C3' DG A 21 -6.285 2.461 6.294 1.00 0.00 C ATOM 656 O3' DG A 21 -7.654 2.087 6.546 1.00 0.00 O ATOM 657 C2' DG A 21 -5.829 1.949 4.938 1.00 0.00 C ATOM 658 C1' DG A 21 -6.332 3.045 4.031 1.00 0.00 C ATOM 659 N9 DG A 21 -5.702 3.106 2.708 1.00 0.00 N ATOM 660 C8 DG A 21 -6.345 3.037 1.503 1.00 0.00 C ATOM 661 N7 DG A 21 -5.535 3.100 0.481 1.00 0.00 N ATOM 662 C5 DG A 21 -4.276 3.222 1.047 1.00 0.00 C ATOM 663 C6 DG A 21 -2.993 3.335 0.432 1.00 0.00 C ATOM 664 O6 DG A 21 -2.722 3.349 -0.773 1.00 0.00 O ATOM 665 N1 DG A 21 -1.970 3.440 1.380 1.00 0.00 N ATOM 666 C2 DG A 21 -2.163 3.439 2.749 1.00 0.00 C ATOM 667 N2 DG A 21 -1.071 3.556 3.516 1.00 0.00 N ATOM 668 N3 DG A 21 -3.356 3.333 3.328 1.00 0.00 N ATOM 669 C4 DG A 21 -4.361 3.229 2.427 1.00 0.00 C ATOM 0 H5' DG A 21 -4.908 5.660 6.595 1.00 0.00 H new ATOM 0 H5'' DG A 21 -5.158 4.570 7.945 1.00 0.00 H new ATOM 0 H4' DG A 21 -7.051 4.440 6.603 1.00 0.00 H new ATOM 0 H3' DG A 21 -5.700 2.058 7.121 1.00 0.00 H new ATOM 0 H2' DG A 21 -4.746 1.833 4.884 1.00 0.00 H new ATOM 0 H2'' DG A 21 -6.266 0.980 4.695 1.00 0.00 H new ATOM 0 H1' DG A 21 -7.387 2.869 3.822 1.00 0.00 H new ATOM 0 H8 DG A 21 -7.416 2.940 1.406 1.00 0.00 H new ATOM 0 H1 DG A 21 -1.013 3.523 1.037 1.00 0.00 H new ATOM 0 H21 DG A 21 -1.160 3.561 4.532 1.00 0.00 H new ATOM 0 H22 DG A 21 -0.151 3.640 3.084 1.00 0.00 H new ATOM 681 P DG A 22 -8.043 0.551 6.854 1.00 0.00 P ATOM 682 OP1 DG A 22 -9.299 0.522 7.646 1.00 0.00 O ATOM 683 OP2 DG A 22 -6.858 -0.140 7.422 1.00 0.00 O ATOM 684 O5' DG A 22 -8.336 -0.033 5.397 1.00 0.00 O ATOM 685 C5' DG A 22 -9.445 0.424 4.626 1.00 0.00 C ATOM 686 C4' DG A 22 -9.321 -0.005 3.177 1.00 0.00 C ATOM 687 O4' DG A 22 -8.092 0.494 2.628 1.00 0.00 O ATOM 688 C3' DG A 22 -9.266 -1.516 2.944 1.00 0.00 C ATOM 689 O3' DG A 22 -10.561 -1.994 2.527 1.00 0.00 O ATOM 690 C2' DG A 22 -8.230 -1.700 1.829 1.00 0.00 C ATOM 691 C1' DG A 22 -7.772 -0.288 1.503 1.00 0.00 C ATOM 692 N9 DG A 22 -6.333 -0.172 1.243 1.00 0.00 N ATOM 693 C8 DG A 22 -5.324 -0.101 2.170 1.00 0.00 C ATOM 694 N7 DG A 22 -4.136 -0.014 1.631 1.00 0.00 N ATOM 695 C5 DG A 22 -4.379 -0.035 0.265 1.00 0.00 C ATOM 696 C6 DG A 22 -3.474 0.025 -0.836 1.00 0.00 C ATOM 697 O6 DG A 22 -2.242 0.114 -0.806 1.00 0.00 O ATOM 698 N1 DG A 22 -4.146 -0.030 -2.063 1.00 0.00 N ATOM 699 C2 DG A 22 -5.518 -0.129 -2.205 1.00 0.00 C ATOM 700 N2 DG A 22 -6.001 -0.182 -3.457 1.00 0.00 N ATOM 701 N3 DG A 22 -6.364 -0.183 -1.183 1.00 0.00 N ATOM 702 C4 DG A 22 -5.733 -0.132 0.013 1.00 0.00 C ATOM 0 H5' DG A 22 -9.507 1.511 4.682 1.00 0.00 H new ATOM 0 H5'' DG A 22 -10.370 0.030 5.046 1.00 0.00 H new ATOM 0 H4' DG A 22 -10.222 0.392 2.709 1.00 0.00 H new ATOM 0 H3' DG A 22 -8.998 -2.073 3.842 1.00 0.00 H new ATOM 0 H2' DG A 22 -7.398 -2.322 2.159 1.00 0.00 H new ATOM 0 H2'' DG A 22 -8.667 -2.188 0.957 1.00 0.00 H new ATOM 0 H1' DG A 22 -8.267 0.034 0.587 1.00 0.00 H new ATOM 0 H8 DG A 22 -5.494 -0.116 3.236 1.00 0.00 H new ATOM 0 H1 DG A 22 -3.583 0.005 -2.913 1.00 0.00 H new ATOM 0 H21 DG A 22 -7.006 -0.255 -3.613 1.00 0.00 H new ATOM 0 H22 DG A 22 -5.362 -0.149 -4.252 1.00 0.00 H new ATOM 714 P DG A 23 -10.767 -3.522 2.044 1.00 0.00 P ATOM 715 OP1 DG A 23 -12.187 -3.905 2.253 1.00 0.00 O ATOM 716 OP2 DG A 23 -9.728 -4.371 2.681 1.00 0.00 O ATOM 717 O5' DG A 23 -10.481 -3.436 0.473 1.00 0.00 O ATOM 718 C5' DG A 23 -11.317 -2.672 -0.394 1.00 0.00 C ATOM 719 C4' DG A 23 -11.041 -2.988 -1.854 1.00 0.00 C ATOM 720 O4' DG A 23 -9.695 -2.559 -2.198 1.00 0.00 O ATOM 721 C3' DG A 23 -11.112 -4.473 -2.222 1.00 0.00 C ATOM 722 O3' DG A 23 -11.731 -4.648 -3.500 1.00 0.00 O ATOM 723 C2' DG A 23 -9.653 -4.893 -2.270 1.00 0.00 C ATOM 724 C1' DG A 23 -8.980 -3.635 -2.783 1.00 0.00 C ATOM 725 N9 DG A 23 -7.565 -3.511 -2.409 1.00 0.00 N ATOM 726 C8 DG A 23 -7.055 -3.426 -1.138 1.00 0.00 C ATOM 727 N7 DG A 23 -5.757 -3.332 -1.111 1.00 0.00 N ATOM 728 C5 DG A 23 -5.378 -3.356 -2.439 1.00 0.00 C ATOM 729 C6 DG A 23 -4.081 -3.287 -3.023 1.00 0.00 C ATOM 730 O6 DG A 23 -2.991 -3.185 -2.454 1.00 0.00 O ATOM 731 N1 DG A 23 -4.137 -3.349 -4.416 1.00 0.00 N ATOM 732 C2 DG A 23 -5.303 -3.460 -5.154 1.00 0.00 C ATOM 733 N2 DG A 23 -5.167 -3.511 -6.488 1.00 0.00 N ATOM 734 N3 DG A 23 -6.519 -3.522 -4.615 1.00 0.00 N ATOM 735 C4 DG A 23 -6.484 -3.466 -3.261 1.00 0.00 C ATOM 0 H5' DG A 23 -11.155 -1.609 -0.214 1.00 0.00 H new ATOM 0 H5'' DG A 23 -12.363 -2.878 -0.167 1.00 0.00 H new ATOM 0 H4' DG A 23 -11.826 -2.463 -2.399 1.00 0.00 H new ATOM 0 H3' DG A 23 -11.702 -5.060 -1.518 1.00 0.00 H new ATOM 0 H2' DG A 23 -9.280 -5.184 -1.288 1.00 0.00 H new ATOM 0 H2'' DG A 23 -9.494 -5.741 -2.936 1.00 0.00 H new ATOM 0 HO3' DG A 23 -11.766 -5.603 -3.719 1.00 0.00 H new ATOM 0 H1' DG A 23 -8.997 -3.650 -3.873 1.00 0.00 H new ATOM 0 H8 DG A 23 -7.669 -3.436 -0.249 1.00 0.00 H new ATOM 0 H1 DG A 23 -3.255 -3.310 -4.927 1.00 0.00 H new ATOM 0 H21 DG A 23 -5.992 -3.593 -7.082 1.00 0.00 H new ATOM 0 H22 DG A 23 -4.238 -3.468 -6.908 1.00 0.00 H new TER 748 DG A 23