USER MOD reduce.3.24.130724 H: found=0, std=0, add=308, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 308 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 Set 1.1: A 8 DT C7 :methyl -30:sc= 0 (180deg=-0.0172) USER MOD Set 1.2: A 26 DT C7 :methyl 150:sc= -0.0408 (180deg=-0.0408) USER MOD Single : A 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 1 DT O5' : rot 33:sc= 0.614 USER MOD Single : A 2 DT C7 :methyl -30:sc= -0.374 (180deg=-0.768) USER MOD Single : A 7 DT C7 :methyl -30:sc= 0 (180deg=-0.31) USER MOD Single : A 13 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 14 DT C7 :methyl 150:sc= -4.2! (180deg=-4.2!) USER MOD Single : A 19 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 20 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 25 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 27 DA O3' : rot -159:sc= -3.63! 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4.420 1.00 0.47 C ATOM 78 C6 DA A 3 7.949 -2.317 3.035 1.00 0.52 C ATOM 79 N6 DA A 3 8.403 -3.241 2.189 1.00 0.61 N ATOM 80 N1 DA A 3 7.571 -1.116 2.563 1.00 0.50 N ATOM 81 C2 DA A 3 7.120 -0.199 3.411 1.00 0.43 C ATOM 82 N3 DA A 3 6.971 -0.278 4.724 1.00 0.38 N ATOM 83 C4 DA A 3 7.359 -1.493 5.168 1.00 0.40 C ATOM 0 H5' DA A 3 7.753 -1.334 11.902 1.00 0.39 H new ATOM 0 H5'' DA A 3 8.009 -2.641 10.763 1.00 0.39 H new ATOM 0 H4' DA A 3 7.542 0.263 10.127 1.00 0.36 H new ATOM 0 H3' DA A 3 5.571 -1.726 10.583 1.00 0.37 H new ATOM 0 H2' DA A 3 5.792 -2.826 8.449 1.00 0.39 H new ATOM 0 H2'' DA A 3 4.776 -1.489 7.951 1.00 0.39 H new ATOM 0 H1' DA A 3 6.586 -0.176 7.236 1.00 0.35 H new ATOM 0 H8 DA A 3 7.931 -3.826 7.310 1.00 0.45 H new ATOM 0 H61 DA A 3 8.461 -3.035 1.192 1.00 0.61 H new ATOM 0 H62 DA A 3 8.692 -4.154 2.539 1.00 0.61 H new ATOM 0 H2 DA A 3 6.835 0.743 2.967 1.00 0.43 H new ATOM 95 P DG A 4 3.580 0.145 9.731 1.00 0.41 P ATOM 96 OP1 DG A 4 3.037 0.213 11.106 1.00 0.48 O ATOM 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4.708 2.859 9.719 1.00 0.28 H new ATOM 0 H5'' DG A 4 3.225 2.798 10.650 1.00 0.28 H new ATOM 0 H4' DG A 4 3.340 4.855 9.466 1.00 0.23 H new ATOM 0 H3' DG A 4 1.080 3.148 9.191 1.00 0.26 H new ATOM 0 H2' DG A 4 1.278 2.823 6.813 1.00 0.27 H new ATOM 0 H2'' DG A 4 0.515 4.401 6.791 1.00 0.27 H new ATOM 0 H1' DG A 4 2.558 5.556 6.615 1.00 0.22 H new ATOM 0 H8 DG A 4 3.112 5.932 4.201 1.00 0.24 H new ATOM 0 H1 DG A 4 4.023 -0.335 3.156 1.00 0.26 H new ATOM 0 H21 DG A 4 3.314 -0.687 6.541 1.00 0.28 H new ATOM 0 H22 DG A 4 3.736 -1.466 5.013 1.00 0.28 H new ATOM 128 P DG A 5 -0.527 5.565 8.771 1.00 0.32 P ATOM 129 OP1 DG A 5 -0.967 6.629 9.701 1.00 0.36 O ATOM 130 OP2 DG A 5 -1.298 4.307 8.673 1.00 0.38 O ATOM 131 O5' DG A 5 -0.412 6.202 7.295 1.00 0.30 O ATOM 132 C5' DG A 5 0.112 7.521 7.112 1.00 0.28 C ATOM 133 C4' DG A 5 -0.383 8.148 5.811 1.00 0.29 C ATOM 134 O4' DG A 5 0.202 7.486 4.690 1.00 0.28 O ATOM 135 C3' DG A 5 -1.905 8.070 5.626 1.00 0.33 C ATOM 136 O3' DG A 5 -2.448 9.394 5.548 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DT A 8 -10.448 5.428 2.755 1.00 0.49 H new ATOM 0 H1' DT A 8 -12.081 3.785 2.614 1.00 0.60 H new ATOM 0 H3 DT A 8 -10.847 0.766 -0.374 1.00 0.90 H new ATOM 0 H71 DT A 8 -10.328 4.050 -3.675 1.00 0.80 H new ATOM 0 H72 DT A 8 -12.057 4.464 -3.591 1.00 0.80 H new ATOM 0 H73 DT A 8 -10.846 5.545 -2.860 1.00 0.80 H new ATOM 0 H6 DT A 8 -11.840 5.457 -0.693 1.00 0.64 H new ATOM 258 P DA A 9 -11.348 6.724 5.307 1.00 0.64 P ATOM 259 OP1 DA A 9 -11.922 6.497 6.652 1.00 0.78 O ATOM 260 OP2 DA A 9 -10.925 8.084 4.906 1.00 0.65 O ATOM 261 O5' DA A 9 -10.094 5.731 5.122 1.00 0.52 O ATOM 262 C5' DA A 9 -10.114 4.420 5.692 1.00 0.49 C ATOM 263 C4' DA A 9 -8.829 3.654 5.386 1.00 0.41 C ATOM 264 O4' DA A 9 -8.641 3.587 3.967 1.00 0.40 O ATOM 265 C3' DA A 9 -7.567 4.291 5.979 1.00 0.38 C ATOM 266 O3' DA A 9 -6.722 3.265 6.512 1.00 0.38 O ATOM 267 C2' DA A 9 -6.895 4.943 4.781 1.00 0.36 C ATOM 268 C1' DA A 9 -7.304 3.989 3.672 1.00 0.33 C ATOM 269 N9 DA A 9 -7.293 4.577 2.318 1.00 0.32 N ATOM 270 C8 DA A 9 -7.575 5.864 1.933 1.00 0.33 C ATOM 271 N7 DA A 9 -7.475 6.063 0.647 1.00 0.34 N ATOM 272 C5 DA A 9 -7.102 4.821 0.146 1.00 0.34 C ATOM 273 C6 DA A 9 -6.836 4.363 -1.155 1.00 0.36 C ATOM 274 N6 DA A 9 -6.907 5.146 -2.233 1.00 0.39 N ATOM 275 N1 DA A 9 -6.492 3.072 -1.297 1.00 0.38 N ATOM 276 C2 DA A 9 -6.422 2.299 -0.220 1.00 0.37 C ATOM 277 N3 DA A 9 -6.648 2.609 1.047 1.00 0.35 N ATOM 278 C4 DA A 9 -6.990 3.910 1.157 1.00 0.33 C ATOM 0 H5' DA A 9 -10.969 3.867 5.304 1.00 0.49 H new ATOM 0 H5'' DA A 9 -10.246 4.494 6.771 1.00 0.49 H new ATOM 0 H4' DA A 9 -8.956 2.672 5.841 1.00 0.41 H new ATOM 0 H3' DA A 9 -7.776 4.996 6.784 1.00 0.38 H new ATOM 0 H2' DA A 9 -7.254 5.957 4.607 1.00 0.36 H new ATOM 0 H2'' DA A 9 -5.813 5.003 4.896 1.00 0.36 H new ATOM 0 H1' DA A 9 -6.581 3.174 3.651 1.00 0.33 H new ATOM 0 H8 DA A 9 -7.854 6.640 2.630 1.00 0.33 H new ATOM 0 H61 DA A 9 -6.704 4.763 -3.156 1.00 0.39 H new ATOM 0 H62 DA A 9 -7.165 6.128 -2.134 1.00 0.39 H new ATOM 0 H2 DA A 9 -6.141 1.272 -0.403 1.00 0.37 H new ATOM 290 P DG A 10 -5.284 3.623 7.147 1.00 0.40 P ATOM 291 OP1 DG A 10 -5.499 4.387 8.396 1.00 0.49 O ATOM 292 OP2 DG A 10 -4.431 4.185 6.077 1.00 0.45 O ATOM 293 O5' DG A 10 -4.707 2.174 7.537 1.00 0.32 O ATOM 294 C5' DG A 10 -5.338 1.389 8.550 1.00 0.30 C ATOM 295 C4' DG A 10 -4.744 -0.015 8.620 1.00 0.23 C ATOM 296 O4' DG A 10 -4.953 -0.684 7.373 1.00 0.22 O ATOM 297 C3' DG A 10 -3.235 -0.033 8.897 1.00 0.21 C ATOM 298 O3' DG A 10 -2.962 -0.915 9.991 1.00 0.22 O ATOM 299 C2' DG A 10 -2.619 -0.587 7.618 1.00 0.21 C ATOM 300 C1' DG A 10 -3.767 -1.404 7.056 1.00 0.20 C ATOM 301 N9 DG A 10 -3.721 -1.589 5.593 1.00 0.21 N ATOM 302 C8 DG A 10 -3.588 -2.752 4.883 1.00 0.24 C ATOM 303 N7 DG A 10 -3.558 -2.584 3.591 1.00 0.26 N ATOM 304 C5 DG A 10 -3.681 -1.208 3.429 1.00 0.24 C ATOM 305 C6 DG A 10 -3.711 -0.430 2.240 1.00 0.27 C ATOM 306 O6 DG A 10 -3.632 -0.815 1.075 1.00 0.32 O ATOM 307 N1 DG A 10 -3.848 0.923 2.519 1.00 0.26 N ATOM 308 C2 DG A 10 -3.943 1.464 3.784 1.00 0.24 C ATOM 309 N2 DG A 10 -4.072 2.790 3.851 1.00 0.26 N ATOM 310 N3 DG A 10 -3.914 0.735 4.904 1.00 0.21 N ATOM 311 C4 DG A 10 -3.782 -0.589 4.651 1.00 0.22 C ATOM 0 H5' DG A 10 -6.407 1.323 8.348 1.00 0.30 H new ATOM 0 H5'' DG A 10 -5.226 1.881 9.516 1.00 0.30 H new ATOM 0 H4' DG A 10 -5.248 -0.511 9.449 1.00 0.23 H new ATOM 0 H3' DG A 10 -2.841 0.949 9.156 1.00 0.21 H new ATOM 0 H2' DG A 10 -2.308 0.205 6.937 1.00 0.21 H new ATOM 0 H2'' DG A 10 -1.740 -1.199 7.818 1.00 0.21 H new ATOM 0 H1' DG A 10 -3.718 -2.403 7.489 1.00 0.20 H new ATOM 0 H8 DG A 10 -3.514 -3.722 5.352 1.00 0.24 H new ATOM 0 H1 DG A 10 -3.881 1.566 1.728 1.00 0.26 H new ATOM 0 H21 DG A 10 -4.147 3.250 4.758 1.00 0.26 H new ATOM 0 H22 DG A 10 -4.096 3.344 2.995 1.00 0.26 H new ATOM 323 P DG A 11 -1.455 -1.109 10.526 1.00 0.25 P ATOM 324 OP1 DG A 11 -1.504 -1.860 11.800 1.00 0.32 O ATOM 325 OP2 DG A 11 -0.772 0.203 10.469 1.00 0.28 O ATOM 326 O5' DG A 11 -0.805 -2.063 9.404 1.00 0.24 O ATOM 327 C5' DG A 11 -1.261 -3.409 9.243 1.00 0.23 C ATOM 328 C4' DG A 11 -0.598 -4.084 8.047 1.00 0.21 C ATOM 329 O4' DG A 11 -0.929 -3.379 6.854 1.00 0.20 O ATOM 330 C3' DG A 11 0.932 -4.126 8.130 1.00 0.22 C ATOM 331 O3' DG A 11 1.364 -5.486 8.248 1.00 0.23 O ATOM 332 C2' DG A 11 1.421 -3.540 6.804 1.00 0.29 C ATOM 333 C1' DG A 11 0.160 -3.522 5.954 1.00 0.22 C ATOM 334 N9 DG A 11 0.098 -2.408 4.990 1.00 0.23 N ATOM 335 C8 DG A 11 -0.075 -1.071 5.237 1.00 0.24 C ATOM 336 N7 DG A 11 -0.069 -0.329 4.166 1.00 0.26 N ATOM 337 C5 DG A 11 0.120 -1.238 3.131 1.00 0.25 C ATOM 338 C6 DG A 11 0.212 -1.014 1.730 1.00 0.27 C ATOM 339 O6 DG A 11 0.147 0.052 1.122 1.00 0.32 O ATOM 340 N1 DG A 11 0.404 -2.202 1.037 1.00 0.26 N ATOM 341 C2 DG A 11 0.495 -3.451 1.616 1.00 0.24 C ATOM 342 N2 DG A 11 0.679 -4.476 0.784 1.00 0.26 N ATOM 343 N3 DG A 11 0.409 -3.663 2.933 1.00 0.23 N ATOM 344 C4 DG A 11 0.222 -2.514 3.626 1.00 0.23 C ATOM 0 H5' DG A 11 -2.343 -3.414 9.112 1.00 0.23 H new ATOM 0 H5'' DG A 11 -1.047 -3.978 10.148 1.00 0.23 H new ATOM 0 H4' DG A 11 -0.971 -5.108 8.046 1.00 0.21 H new ATOM 0 H3' DG A 11 1.317 -3.574 8.987 1.00 0.22 H new ATOM 0 H2' DG A 11 1.836 -2.540 6.933 1.00 0.29 H new ATOM 0 H2'' DG A 11 2.202 -4.153 6.355 1.00 0.29 H new ATOM 0 H1' DG A 11 0.138 -4.441 5.368 1.00 0.22 H new ATOM 0 H8 DG A 11 -0.205 -0.668 6.231 1.00 0.24 H new ATOM 0 H1 DG A 11 0.484 -2.147 0.022 1.00 0.26 H new ATOM 0 H21 DG A 11 0.754 -5.424 1.152 1.00 0.26 H new ATOM 0 H22 DG A 11 0.745 -4.312 -0.221 1.00 0.26 H new ATOM 356 P DG A 12 2.935 -5.839 8.302 1.00 0.28 P ATOM 357 OP1 DG A 12 3.114 -7.036 9.153 1.00 0.37 O ATOM 358 OP2 DG A 12 3.676 -4.595 8.613 1.00 0.33 O ATOM 359 O5' DG A 12 3.256 -6.249 6.780 1.00 0.25 O ATOM 360 C5' DG A 12 2.691 -7.434 6.214 1.00 0.24 C ATOM 361 C4' DG A 12 3.266 -7.727 4.832 1.00 0.26 C ATOM 362 O4' DG A 12 3.007 -6.621 3.959 1.00 0.26 O ATOM 363 C3' DG A 12 4.777 -7.965 4.829 1.00 0.32 C ATOM 364 O3' DG A 12 5.083 -9.061 3.962 1.00 0.36 O ATOM 365 C2' DG A 12 5.349 -6.679 4.252 1.00 0.35 C ATOM 366 C1' DG A 12 4.229 -6.248 3.321 1.00 0.30 C ATOM 367 N9 DG A 12 4.178 -4.798 3.062 1.00 0.28 N ATOM 368 C8 DG A 12 4.010 -3.772 3.955 1.00 0.30 C ATOM 369 N7 DG A 12 4.002 -2.589 3.408 1.00 0.30 N ATOM 370 C5 DG A 12 4.176 -2.846 2.053 1.00 0.27 C ATOM 371 C6 DG A 12 4.249 -1.942 0.958 1.00 0.26 C ATOM 372 O6 DG A 12 4.172 -0.715 0.974 1.00 0.28 O ATOM 373 N1 DG A 12 4.432 -2.612 -0.245 1.00 0.25 N ATOM 374 C2 DG A 12 4.531 -3.982 -0.379 1.00 0.25 C ATOM 375 N2 DG A 12 4.706 -4.443 -1.619 1.00 0.26 N ATOM 376 N3 DG A 12 4.463 -4.833 0.649 1.00 0.26 N ATOM 377 C4 DG A 12 4.285 -4.196 1.830 1.00 0.26 C ATOM 0 H5' DG A 12 1.609 -7.323 6.142 1.00 0.24 H new ATOM 0 H5'' DG A 12 2.882 -8.280 6.875 1.00 0.24 H new ATOM 0 H4' DG A 12 2.779 -8.643 4.498 1.00 0.26 H new ATOM 0 H3' DG A 12 5.176 -8.201 5.816 1.00 0.32 H new ATOM 0 H2' DG A 12 5.551 -5.936 5.024 1.00 0.35 H new ATOM 0 H2'' DG A 12 6.285 -6.848 3.719 1.00 0.35 H new ATOM 0 H1' DG A 12 4.396 -6.727 2.356 1.00 0.30 H new ATOM 0 H8 DG A 12 3.895 -3.930 5.017 1.00 0.30 H new ATOM 0 H1 DG A 12 4.498 -2.049 -1.093 1.00 0.25 H new ATOM 0 H21 DG A 12 4.786 -5.446 -1.783 1.00 0.26 H new ATOM 0 H22 DG A 12 4.759 -3.792 -2.402 1.00 0.26 H new ATOM 389 P DT A 13 6.408 -9.944 4.195 1.00 0.45 P ATOM 390 OP1 DT A 13 7.499 -9.040 4.622 1.00 0.54 O ATOM 391 OP2 DT A 13 6.595 -10.821 3.017 1.00 0.55 O ATOM 392 O5' DT A 13 5.997 -10.867 5.450 1.00 0.39 O ATOM 393 C5' DT A 13 4.996 -11.878 5.310 1.00 0.36 C ATOM 394 C4' DT A 13 4.799 -12.655 6.608 1.00 0.34 C ATOM 395 O4' DT A 13 6.039 -13.260 6.994 1.00 0.36 O ATOM 396 C3' DT A 13 4.342 -11.793 7.780 1.00 0.38 C ATOM 397 O3' DT A 13 3.471 -12.552 8.628 1.00 0.43 O ATOM 398 C2' DT A 13 5.631 -11.480 8.516 1.00 0.45 C ATOM 399 C1' DT A 13 6.432 -12.751 8.273 1.00 0.44 C ATOM 400 N1 DT A 13 7.892 -12.546 8.243 1.00 0.53 N ATOM 401 C2 DT A 13 8.660 -13.294 9.115 1.00 0.62 C ATOM 402 O2 DT A 13 8.162 -14.103 9.896 1.00 0.66 O ATOM 403 N3 DT A 13 10.024 -13.079 9.060 1.00 0.73 N ATOM 404 C4 DT A 13 10.676 -12.193 8.219 1.00 0.77 C ATOM 405 O4 DT A 13 11.900 -12.081 8.253 1.00 0.90 O ATOM 406 C5 DT A 13 9.792 -11.456 7.344 1.00 0.70 C ATOM 407 C7 DT A 13 10.378 -10.445 6.364 1.00 0.81 C ATOM 408 C6 DT A 13 8.458 -11.648 7.379 1.00 0.57 C ATOM 0 H5' DT A 13 5.281 -12.565 4.513 1.00 0.36 H new ATOM 0 H5'' DT A 13 4.053 -11.419 5.013 1.00 0.36 H new ATOM 0 H4' DT A 13 4.019 -13.387 6.398 1.00 0.34 H new ATOM 0 H3' DT A 13 3.798 -10.901 7.470 1.00 0.38 H new ATOM 0 H2' DT A 13 6.129 -10.598 8.115 1.00 0.45 H new ATOM 0 H2'' DT A 13 5.464 -11.297 9.577 1.00 0.45 H new ATOM 0 H1' DT A 13 6.224 -13.430 9.100 1.00 0.44 H new ATOM 0 H3 DT A 13 10.604 -13.623 9.698 1.00 0.73 H new ATOM 0 H71 DT A 13 9.743 -10.385 5.480 1.00 0.81 H new ATOM 0 H72 DT A 13 10.431 -9.466 6.840 1.00 0.81 H new ATOM 0 H73 DT A 13 11.379 -10.761 6.071 1.00 0.81 H new ATOM 0 H6 DT A 13 7.824 -11.082 6.712 1.00 0.57 H new ATOM 421 P DT A 14 2.110 -13.192 8.053 1.00 0.42 P ATOM 422 OP1 DT A 14 1.713 -14.310 8.937 1.00 0.55 O ATOM 423 OP2 DT A 14 2.286 -13.426 6.602 1.00 0.41 O ATOM 424 O5' DT A 14 1.044 -11.998 8.242 1.00 0.38 O ATOM 425 C5' DT A 14 1.131 -10.813 7.448 1.00 0.34 C ATOM 426 C4' DT A 14 -0.204 -10.081 7.371 1.00 0.26 C ATOM 427 O4' DT A 14 -0.085 -8.976 6.469 1.00 0.26 O ATOM 428 C3' DT A 14 -1.361 -10.950 6.875 1.00 0.27 C ATOM 429 O3' DT A 14 -2.540 -10.654 7.630 1.00 0.28 O ATOM 430 C2' DT A 14 -1.552 -10.516 5.431 1.00 0.25 C ATOM 431 C1' DT A 14 -1.127 -9.058 5.497 1.00 0.22 C ATOM 432 N1 DT A 14 -0.603 -8.521 4.226 1.00 0.20 N ATOM 433 C2 DT A 14 -1.201 -7.383 3.721 1.00 0.21 C ATOM 434 O2 DT A 14 -2.133 -6.824 4.295 1.00 0.24 O ATOM 435 N3 DT A 14 -0.689 -6.908 2.527 1.00 0.23 N ATOM 436 C4 DT A 14 0.353 -7.465 1.808 1.00 0.24 C ATOM 437 O4 DT A 14 0.729 -6.958 0.753 1.00 0.29 O ATOM 438 C5 DT A 14 0.916 -8.651 2.412 1.00 0.23 C ATOM 439 C7 DT A 14 2.069 -9.372 1.721 1.00 0.28 C ATOM 440 C6 DT A 14 0.436 -9.133 3.576 1.00 0.22 C ATOM 0 H5' DT A 14 1.461 -11.073 6.442 1.00 0.34 H new ATOM 0 H5'' DT A 14 1.886 -10.149 7.869 1.00 0.34 H new ATOM 0 H4' DT A 14 -0.432 -9.769 8.390 1.00 0.26 H new ATOM 0 H3' DT A 14 -1.166 -12.018 6.974 1.00 0.27 H new ATOM 0 H2' DT A 14 -0.934 -11.093 4.743 1.00 0.25 H new ATOM 0 H2'' DT A 14 -2.585 -10.628 5.102 1.00 0.25 H new ATOM 0 H1' DT A 14 -2.010 -8.468 5.742 1.00 0.22 H new ATOM 0 H3 DT A 14 -1.120 -6.068 2.141 1.00 0.23 H new ATOM 0 H71 DT A 14 2.697 -9.854 2.470 1.00 0.28 H new ATOM 0 H72 DT A 14 1.672 -10.125 1.041 1.00 0.28 H new ATOM 0 H73 DT A 14 2.663 -8.652 1.158 1.00 0.28 H new ATOM 0 H6 DT A 14 0.880 -10.020 4.005 1.00 0.22 H new ATOM 453 P DA A 15 -3.913 -11.450 7.350 1.00 0.34 P ATOM 454 OP1 DA A 15 -4.842 -11.180 8.471 1.00 0.40 O ATOM 455 OP2 DA A 15 -3.573 -12.846 6.995 1.00 0.39 O ATOM 456 O5' DA A 15 -4.485 -10.720 6.033 1.00 0.30 O ATOM 457 C5' DA A 15 -5.278 -9.535 6.146 1.00 0.29 C ATOM 458 C4' DA A 15 -5.743 -9.038 4.780 1.00 0.24 C ATOM 459 O4' DA A 15 -6.676 -7.974 4.955 1.00 0.27 O ATOM 460 C3' DA A 15 -4.611 -8.511 3.892 1.00 0.20 C ATOM 461 O3' DA A 15 -4.586 -9.247 2.665 1.00 0.20 O ATOM 462 C2' DA A 15 -4.976 -7.053 3.609 1.00 0.22 C ATOM 463 C1' DA A 15 -6.462 -7.020 3.924 1.00 0.22 C ATOM 464 N9 DA A 15 -6.944 -5.719 4.421 1.00 0.27 N ATOM 465 C8 DA A 15 -7.314 -5.374 5.694 1.00 0.34 C ATOM 466 N7 DA A 15 -7.693 -4.132 5.816 1.00 0.39 N ATOM 467 C5 DA A 15 -7.564 -3.618 4.528 1.00 0.37 C ATOM 468 C6 DA A 15 -7.808 -2.346 3.985 1.00 0.43 C ATOM 469 N6 DA A 15 -8.254 -1.317 4.707 1.00 0.49 N ATOM 470 N1 DA A 15 -7.574 -2.181 2.672 1.00 0.44 N ATOM 471 C2 DA A 15 -7.131 -3.210 1.959 1.00 0.42 C ATOM 472 N3 DA A 15 -6.864 -4.446 2.353 1.00 0.34 N ATOM 473 C4 DA A 15 -7.107 -4.580 3.673 1.00 0.31 C ATOM 0 H5' DA A 15 -4.699 -8.755 6.640 1.00 0.29 H new ATOM 0 H5'' DA A 15 -6.145 -9.735 6.775 1.00 0.29 H new ATOM 0 H4' DA A 15 -6.183 -9.903 4.284 1.00 0.24 H new ATOM 0 H3' DA A 15 -3.633 -8.608 4.364 1.00 0.20 H new ATOM 0 H2' DA A 15 -4.412 -6.364 4.238 1.00 0.22 H new ATOM 0 H2'' DA A 15 -4.774 -6.778 2.574 1.00 0.22 H new ATOM 0 H1' DA A 15 -7.002 -7.225 3.000 1.00 0.22 H new ATOM 0 H8 DA A 15 -7.294 -6.068 6.522 1.00 0.34 H new ATOM 0 H61 DA A 15 -8.415 -0.413 4.262 1.00 0.49 H new ATOM 0 H62 DA A 15 -8.434 -1.434 5.704 1.00 0.49 H new ATOM 0 H2 DA A 15 -6.965 -3.011 0.911 1.00 0.42 H new ATOM 485 P DG A 16 -3.434 -8.973 1.574 1.00 0.20 P ATOM 486 OP1 DG A 16 -2.544 -10.153 1.532 1.00 0.28 O ATOM 487 OP2 DG A 16 -2.868 -7.629 1.827 1.00 0.26 O ATOM 488 O5' DG A 16 -4.264 -8.918 0.196 1.00 0.23 O ATOM 489 C5' DG A 16 -4.168 -9.980 -0.756 1.00 0.21 C ATOM 490 C4' DG A 16 -3.164 -9.654 -1.858 1.00 0.25 C ATOM 491 O4' DG A 16 -3.468 -8.374 -2.410 1.00 0.28 O ATOM 492 C3' DG A 16 -1.705 -9.609 -1.386 1.00 0.27 C ATOM 493 O3' DG A 16 -0.934 -10.555 -2.135 1.00 0.32 O ATOM 494 C2' DG A 16 -1.233 -8.191 -1.702 1.00 0.29 C ATOM 495 C1' DG A 16 -2.241 -7.746 -2.748 1.00 0.31 C ATOM 496 N9 DG A 16 -2.473 -6.289 -2.792 1.00 0.32 N ATOM 497 C8 DG A 16 -2.481 -5.462 -3.882 1.00 0.37 C ATOM 498 N7 DG A 16 -2.700 -4.210 -3.595 1.00 0.38 N ATOM 499 C5 DG A 16 -2.849 -4.203 -2.213 1.00 0.35 C ATOM 500 C6 DG A 16 -3.105 -3.118 -1.330 1.00 0.36 C ATOM 501 O6 DG A 16 -3.252 -1.929 -1.607 1.00 0.40 O ATOM 502 N1 DG A 16 -3.182 -3.543 -0.011 1.00 0.34 N ATOM 503 C2 DG A 16 -3.032 -4.847 0.410 1.00 0.30 C ATOM 504 N2 DG A 16 -3.140 -5.059 1.722 1.00 0.30 N ATOM 505 N3 DG A 16 -2.791 -5.867 -0.417 1.00 0.28 N ATOM 506 C4 DG A 16 -2.712 -5.473 -1.710 1.00 0.31 C ATOM 0 H5' DG A 16 -5.147 -10.164 -1.197 1.00 0.21 H new ATOM 0 H5'' DG A 16 -3.869 -10.898 -0.250 1.00 0.21 H new ATOM 0 H4' DG A 16 -3.255 -10.461 -2.585 1.00 0.25 H new ATOM 0 H3' DG A 16 -1.599 -9.852 -0.329 1.00 0.27 H new ATOM 0 H2' DG A 16 -1.250 -7.550 -0.821 1.00 0.29 H new ATOM 0 H2'' DG A 16 -0.213 -8.177 -2.087 1.00 0.29 H new ATOM 0 H1' DG A 16 -1.850 -8.021 -3.727 1.00 0.31 H new ATOM 0 H8 DG A 16 -2.320 -5.815 -4.890 1.00 0.37 H new ATOM 0 H1 DG A 16 -3.364 -2.836 0.702 1.00 0.34 H new ATOM 0 H21 DG A 16 -3.039 -6.002 2.096 1.00 0.30 H new ATOM 0 H22 DG A 16 -3.324 -4.278 2.351 1.00 0.30 H new ATOM 518 P DG A 17 0.676 -10.544 -2.066 1.00 0.39 P ATOM 519 OP1 DG A 17 1.171 -11.857 -2.535 1.00 0.48 O ATOM 520 OP2 DG A 17 1.079 -10.037 -0.735 1.00 0.44 O ATOM 521 O5' DG A 17 1.067 -9.435 -3.166 1.00 0.37 O ATOM 522 C5' DG A 17 0.717 -9.621 -4.541 1.00 0.35 C ATOM 523 C4' DG A 17 1.266 -8.497 -5.415 1.00 0.33 C ATOM 524 O4' DG A 17 0.743 -7.243 -4.965 1.00 0.32 O ATOM 525 C3' DG A 17 2.795 -8.388 -5.391 1.00 0.32 C ATOM 526 O3' DG A 17 3.292 -8.353 -6.733 1.00 0.37 O ATOM 527 C2' DG A 17 3.074 -7.058 -4.701 1.00 0.32 C ATOM 528 C1' DG A 17 1.798 -6.286 -4.986 1.00 0.30 C ATOM 529 N9 DG A 17 1.489 -5.245 -3.989 1.00 0.29 N ATOM 530 C8 DG A 17 1.290 -5.385 -2.641 1.00 0.28 C ATOM 531 N7 DG A 17 1.047 -4.265 -2.023 1.00 0.29 N ATOM 532 C5 DG A 17 1.088 -3.309 -3.032 1.00 0.29 C ATOM 533 C6 DG A 17 0.899 -1.903 -2.962 1.00 0.32 C ATOM 534 O6 DG A 17 0.654 -1.215 -1.973 1.00 0.34 O ATOM 535 N1 DG A 17 1.024 -1.309 -4.210 1.00 0.34 N ATOM 536 C2 DG A 17 1.298 -1.983 -5.383 1.00 0.34 C ATOM 537 N2 DG A 17 1.381 -1.240 -6.487 1.00 0.38 N ATOM 538 N3 DG A 17 1.476 -3.306 -5.451 1.00 0.32 N ATOM 539 C4 DG A 17 1.358 -3.901 -4.242 1.00 0.29 C ATOM 0 H5' DG A 17 -0.368 -9.663 -4.639 1.00 0.35 H new ATOM 0 H5'' DG A 17 1.106 -10.578 -4.890 1.00 0.35 H new ATOM 0 H4' DG A 17 0.959 -8.735 -6.433 1.00 0.33 H new ATOM 0 H3' DG A 17 3.270 -9.227 -4.883 1.00 0.32 H new ATOM 0 H2' DG A 17 3.247 -7.181 -3.632 1.00 0.32 H new ATOM 0 H2'' DG A 17 3.953 -6.561 -5.112 1.00 0.32 H new ATOM 0 H1' DG A 17 1.917 -5.772 -5.940 1.00 0.30 H new ATOM 0 H8 DG A 17 1.331 -6.339 -2.136 1.00 0.28 H new ATOM 0 H1 DG A 17 0.904 -0.298 -4.265 1.00 0.34 H new ATOM 0 H21 DG A 17 1.581 -1.681 -7.385 1.00 0.38 H new ATOM 0 H22 DG A 17 1.244 -0.231 -6.434 1.00 0.38 H new ATOM 551 P DG A 18 4.845 -8.036 -7.020 1.00 0.33 P ATOM 552 OP1 DG A 18 5.291 -8.877 -8.154 1.00 0.38 O ATOM 553 OP2 DG A 18 5.573 -8.091 -5.732 1.00 0.37 O ATOM 554 O5' DG A 18 4.808 -6.504 -7.511 1.00 0.31 O ATOM 555 C5' DG A 18 4.216 -6.158 -8.766 1.00 0.34 C ATOM 556 C4' DG A 18 4.693 -4.791 -9.248 1.00 0.36 C ATOM 557 O4' DG A 18 4.321 -3.788 -8.294 1.00 0.35 O ATOM 558 C3' DG A 18 6.206 -4.700 -9.429 1.00 0.36 C ATOM 559 O3' DG A 18 6.503 -3.916 -10.588 1.00 0.44 O ATOM 560 C2' DG A 18 6.677 -3.978 -8.178 1.00 0.30 C ATOM 561 C1' DG A 18 5.492 -3.072 -7.892 1.00 0.30 C ATOM 562 N9 DG A 18 5.334 -2.721 -6.469 1.00 0.25 N ATOM 563 C8 DG A 18 5.322 -3.554 -5.384 1.00 0.24 C ATOM 564 N7 DG A 18 5.146 -2.942 -4.246 1.00 0.24 N ATOM 565 C5 DG A 18 5.034 -1.602 -4.602 1.00 0.23 C ATOM 566 C6 DG A 18 4.833 -0.459 -3.783 1.00 0.25 C ATOM 567 O6 DG A 18 4.707 -0.409 -2.561 1.00 0.28 O ATOM 568 N1 DG A 18 4.782 0.705 -4.539 1.00 0.26 N ATOM 569 C2 DG A 18 4.908 0.764 -5.911 1.00 0.27 C ATOM 570 N2 DG A 18 4.834 1.977 -6.460 1.00 0.31 N ATOM 571 N3 DG A 18 5.096 -0.312 -6.683 1.00 0.28 N ATOM 572 C4 DG A 18 5.150 -1.456 -5.962 1.00 0.25 C ATOM 0 H5' DG A 18 3.130 -6.153 -8.669 1.00 0.34 H new ATOM 0 H5'' DG A 18 4.466 -6.915 -9.509 1.00 0.34 H new ATOM 0 H4' DG A 18 4.222 -4.637 -10.219 1.00 0.36 H new ATOM 0 H3' DG A 18 6.683 -5.671 -9.562 1.00 0.36 H new ATOM 0 H2' DG A 18 6.876 -4.666 -7.357 1.00 0.30 H new ATOM 0 H2'' DG A 18 7.594 -3.414 -8.350 1.00 0.30 H new ATOM 0 H1' DG A 18 5.650 -2.138 -8.431 1.00 0.30 H new ATOM 0 H8 DG A 18 5.447 -4.624 -5.463 1.00 0.24 H new ATOM 0 H1 DG A 18 4.640 1.584 -4.041 1.00 0.26 H new ATOM 0 H21 DG A 18 4.920 2.086 -7.471 1.00 0.31 H new ATOM 0 H22 DG A 18 4.691 2.796 -5.869 1.00 0.31 H new ATOM 584 P DT A 19 8.016 -3.467 -10.904 1.00 0.50 P ATOM 585 OP1 DT A 19 8.091 -3.054 -12.323 1.00 0.62 O ATOM 586 OP2 DT A 19 8.928 -4.513 -10.389 1.00 0.47 O ATOM 587 O5' DT A 19 8.186 -2.154 -9.988 1.00 0.51 O ATOM 588 C5' DT A 19 9.474 -1.764 -9.507 1.00 0.54 C ATOM 589 C4' DT A 19 9.502 -0.288 -9.128 1.00 0.57 C ATOM 590 O4' DT A 19 9.151 0.498 -10.265 1.00 0.67 O ATOM 591 C3' DT A 19 8.527 0.085 -8.004 1.00 0.50 C ATOM 592 O3' DT A 19 9.258 0.569 -6.868 1.00 0.50 O ATOM 593 C2' DT A 19 7.659 1.205 -8.580 1.00 0.56 C ATOM 594 C1' DT A 19 8.445 1.643 -9.807 1.00 0.67 C ATOM 595 N1 DT A 19 7.609 2.132 -10.919 1.00 0.77 N ATOM 596 C2 DT A 19 7.879 3.395 -11.412 1.00 0.89 C ATOM 597 O2 DT A 19 8.778 4.096 -10.954 1.00 0.92 O ATOM 598 N3 DT A 19 7.079 3.823 -12.455 1.00 1.01 N ATOM 599 C4 DT A 19 6.046 3.108 -13.037 1.00 1.02 C ATOM 600 O4 DT A 19 5.395 3.587 -13.963 1.00 1.15 O ATOM 601 C5 DT A 19 5.837 1.800 -12.457 1.00 0.90 C ATOM 602 C7 DT A 19 4.731 0.904 -13.004 1.00 0.94 C ATOM 603 C6 DT A 19 6.605 1.360 -11.440 1.00 0.78 C ATOM 0 H5' DT A 19 10.225 -1.959 -10.273 1.00 0.54 H new ATOM 0 H5'' DT A 19 9.739 -2.369 -8.640 1.00 0.54 H new ATOM 0 H4' DT A 19 10.515 -0.092 -8.776 1.00 0.57 H new ATOM 0 H3' DT A 19 7.931 -0.767 -7.676 1.00 0.50 H new ATOM 0 H2' DT A 19 6.663 0.850 -8.843 1.00 0.56 H new ATOM 0 H2'' DT A 19 7.529 2.022 -7.870 1.00 0.56 H new ATOM 0 H1' DT A 19 9.085 2.475 -9.512 1.00 0.67 H new ATOM 0 H3 DT A 19 7.267 4.752 -12.831 1.00 1.01 H new ATOM 0 H71 DT A 19 5.015 -0.141 -12.881 1.00 0.94 H new ATOM 0 H72 DT A 19 3.806 1.095 -12.460 1.00 0.94 H new ATOM 0 H73 DT A 19 4.580 1.117 -14.062 1.00 0.94 H new ATOM 0 H6 DT A 19 6.425 0.378 -11.028 1.00 0.78 H new ATOM 616 P DT A 20 10.382 1.714 -7.019 1.00 0.61 P ATOM 617 OP1 DT A 20 9.967 2.647 -8.087 1.00 0.72 O ATOM 618 OP2 DT A 20 11.706 1.056 -7.087 1.00 0.70 O ATOM 619 O5' DT A 20 10.278 2.489 -5.612 1.00 0.55 O ATOM 620 C5' DT A 20 9.249 3.458 -5.400 1.00 0.57 C ATOM 621 C4' DT A 20 8.580 3.278 -4.041 1.00 0.45 C ATOM 622 O4' DT A 20 7.980 1.984 -3.968 1.00 0.38 O ATOM 623 C3' DT A 20 9.544 3.398 -2.855 1.00 0.38 C ATOM 624 O3' DT A 20 9.069 4.407 -1.959 1.00 0.32 O ATOM 625 C2' DT A 20 9.491 2.034 -2.171 1.00 0.38 C ATOM 626 C1' DT A 20 8.150 1.500 -2.642 1.00 0.32 C ATOM 627 N1 DT A 20 8.059 0.029 -2.679 1.00 0.31 N ATOM 628 C2 DT A 20 7.330 -0.588 -1.679 1.00 0.34 C ATOM 629 O2 DT A 20 6.780 0.049 -0.784 1.00 0.38 O ATOM 630 N3 DT A 20 7.257 -1.967 -1.744 1.00 0.36 N ATOM 631 C4 DT A 20 7.840 -2.770 -2.710 1.00 0.34 C ATOM 632 O4 DT A 20 7.709 -3.991 -2.672 1.00 0.39 O ATOM 633 C5 DT A 20 8.581 -2.038 -3.712 1.00 0.31 C ATOM 634 C7 DT A 20 9.271 -2.800 -4.839 1.00 0.35 C ATOM 635 C6 DT A 20 8.667 -0.693 -3.671 1.00 0.31 C ATOM 0 H5' DT A 20 8.501 3.374 -6.188 1.00 0.57 H new ATOM 0 H5'' DT A 20 9.672 4.460 -5.468 1.00 0.57 H new ATOM 0 H4' DT A 20 7.847 4.081 -3.966 1.00 0.45 H new ATOM 0 H3' DT A 20 10.555 3.668 -3.160 1.00 0.38 H new ATOM 0 H2' DT A 20 10.317 1.391 -2.477 1.00 0.38 H new ATOM 0 H2'' DT A 20 9.538 2.119 -1.085 1.00 0.38 H new ATOM 0 H1' DT A 20 7.387 1.832 -1.938 1.00 0.32 H new ATOM 0 H3 DT A 20 6.724 -2.437 -1.012 1.00 0.36 H new ATOM 0 H71 DT A 20 9.307 -2.175 -5.732 1.00 0.35 H new ATOM 0 H72 DT A 20 10.285 -3.059 -4.535 1.00 0.35 H new ATOM 0 H73 DT A 20 8.714 -3.711 -5.056 1.00 0.35 H new ATOM 0 H6 DT A 20 9.227 -0.175 -4.436 1.00 0.31 H new ATOM 648 P DA A 21 9.284 5.966 -2.294 1.00 0.34 P ATOM 649 OP1 DA A 21 8.716 6.235 -3.635 1.00 0.52 O ATOM 650 OP2 DA A 21 10.694 6.312 -2.007 1.00 0.57 O ATOM 651 O5' DA A 21 8.354 6.690 -1.198 1.00 0.26 O ATOM 652 C5' DA A 21 6.953 6.854 -1.431 1.00 0.21 C ATOM 653 C4' DA A 21 6.209 7.206 -0.146 1.00 0.18 C ATOM 654 O4' DA A 21 6.303 6.112 0.773 1.00 0.24 O ATOM 655 C3' DA A 21 6.774 8.429 0.574 1.00 0.18 C ATOM 656 O3' DA A 21 5.743 9.090 1.324 1.00 0.23 O ATOM 657 C2' DA A 21 7.780 7.814 1.529 1.00 0.22 C ATOM 658 C1' DA A 21 7.056 6.532 1.918 1.00 0.24 C ATOM 659 N9 DA A 21 7.946 5.421 2.299 1.00 0.26 N ATOM 660 C8 DA A 21 8.966 4.849 1.584 1.00 0.27 C ATOM 661 N7 DA A 21 9.555 3.862 2.200 1.00 0.30 N ATOM 662 C5 DA A 21 8.875 3.775 3.412 1.00 0.31 C ATOM 663 C6 DA A 21 9.016 2.924 4.521 1.00 0.36 C ATOM 664 N6 DA A 21 9.930 1.957 4.589 1.00 0.39 N ATOM 665 N1 DA A 21 8.176 3.113 5.553 1.00 0.42 N ATOM 666 C2 DA A 21 7.266 4.077 5.478 1.00 0.42 C ATOM 667 N3 DA A 21 7.037 4.936 4.497 1.00 0.36 N ATOM 668 C4 DA A 21 7.894 4.721 3.478 1.00 0.30 C ATOM 0 H5' DA A 21 6.543 5.935 -1.850 1.00 0.21 H new ATOM 0 H5'' DA A 21 6.796 7.639 -2.170 1.00 0.21 H new ATOM 0 H4' DA A 21 5.184 7.422 -0.447 1.00 0.18 H new ATOM 0 H3' DA A 21 7.197 9.171 -0.103 1.00 0.18 H new ATOM 0 H2' DA A 21 8.739 7.618 1.049 1.00 0.22 H new ATOM 0 H2'' DA A 21 7.979 8.454 2.389 1.00 0.22 H new ATOM 0 H1' DA A 21 6.447 6.758 2.793 1.00 0.24 H new ATOM 0 H8 DA A 21 9.256 5.185 0.599 1.00 0.27 H new ATOM 0 H61 DA A 21 9.988 1.368 5.420 1.00 0.39 H new ATOM 0 H62 DA A 21 10.572 1.806 3.811 1.00 0.39 H new ATOM 0 H2 DA A 21 6.621 4.174 6.339 1.00 0.42 H new HETATM 680 P BGM A 22 4.321 9.459 0.659 1.00 0.31 P HETATM 681 OP1 BGM A 22 4.153 10.929 0.701 1.00 0.43 O HETATM 682 OP2 BGM A 22 3.291 8.584 1.262 1.00 0.43 O HETATM 683 O5' BGM A 22 4.517 9.017 -0.876 1.00 0.22 O HETATM 684 C5' BGM A 22 5.030 9.939 -1.842 1.00 0.23 C HETATM 685 C4' BGM A 22 4.603 9.554 -3.254 1.00 0.20 C HETATM 686 O4' BGM A 22 5.081 8.239 -3.557 1.00 0.20 O HETATM 687 C1' BGM A 22 4.031 7.518 -4.196 1.00 0.18 C HETATM 688 N9 BGM A 22 4.236 6.082 -3.932 1.00 0.17 N HETATM 689 C8 BGM A 22 4.498 5.093 -4.851 1.00 0.20 C HETATM 690 N7 BGM A 22 4.600 3.901 -4.295 1.00 0.21 N HETATM 691 C5 BGM A 22 4.391 4.134 -2.937 1.00 0.17 C HETATM 692 C4 BGM A 22 4.168 5.468 -2.707 1.00 0.15 C HETATM 693 N3 BGM A 22 3.926 6.081 -1.525 1.00 0.16 N HETATM 694 C2 BGM A 22 3.920 5.222 -0.501 1.00 0.17 C HETATM 695 N2 BGM A 22 3.699 5.660 0.738 1.00 0.22 N HETATM 696 N1 BGM A 22 4.133 3.867 -0.643 1.00 0.19 N HETATM 697 C6 BGM A 22 4.381 3.220 -1.847 1.00 0.20 C HETATM 698 O6 BGM A 22 4.556 2.004 -1.870 1.00 0.25 O HETATM 699 C2' BGM A 22 2.734 8.071 -3.636 1.00 0.19 C HETATM 700 C3' BGM A 22 3.083 9.544 -3.454 1.00 0.22 C HETATM 701 O3' BGM A 22 2.750 10.271 -4.640 1.00 0.26 O HETATM 702 BR BGM A 22 4.700 5.368 -6.700 1.00 0.27 BR HETATM 0 H5'' BGM A 22 4.675 10.944 -1.613 1.00 0.23 H new HETATM 0 H2'' BGM A 22 1.898 7.929 -4.321 1.00 0.19 H new HETATM 0 H5' BGM A 22 6.118 9.964 -1.783 1.00 0.23 H new HETATM 0 H4' BGM A 22 5.028 10.312 -3.912 1.00 0.20 H new HETATM 0 H3' BGM A 22 2.545 10.002 -2.624 1.00 0.22 H new HETATM 0 H22 BGM A 22 3.695 5.003 1.518 1.00 0.22 H new HETATM 0 H21 BGM A 22 3.534 6.652 0.906 1.00 0.22 H new HETATM 0 H2' BGM A 22 2.458 7.596 -2.695 1.00 0.19 H new HETATM 0 H1' BGM A 22 4.008 7.631 -5.280 1.00 0.18 H new HETATM 0 H1 BGM A 22 4.106 3.296 0.201 1.00 0.19 H new ATOM 713 P DG A 23 1.247 10.242 -5.216 1.00 0.30 P ATOM 714 OP1 DG A 23 1.076 11.390 -6.135 1.00 0.40 O ATOM 715 OP2 DG A 23 0.319 10.063 -4.078 1.00 0.34 O ATOM 716 O5' DG A 23 1.236 8.892 -6.091 1.00 0.29 O ATOM 717 C5' DG A 23 0.003 8.354 -6.573 1.00 0.27 C ATOM 718 C4' DG A 23 0.231 7.182 -7.523 1.00 0.27 C ATOM 719 O4' DG A 23 0.909 6.131 -6.840 1.00 0.27 O ATOM 720 C3' DG A 23 -1.061 6.582 -8.084 1.00 0.31 C ATOM 721 O3' DG A 23 -1.152 6.861 -9.485 1.00 0.37 O ATOM 722 C2' DG A 23 -0.926 5.072 -7.866 1.00 0.32 C ATOM 723 C1' DG A 23 0.537 4.915 -7.475 1.00 0.28 C ATOM 724 N9 DG A 23 0.786 3.806 -6.535 1.00 0.28 N ATOM 725 C8 DG A 23 1.072 2.496 -6.817 1.00 0.30 C ATOM 726 N7 DG A 23 1.183 1.739 -5.762 1.00 0.32 N ATOM 727 C5 DG A 23 0.957 2.609 -4.701 1.00 0.30 C ATOM 728 C6 DG A 23 0.949 2.354 -3.303 1.00 0.32 C ATOM 729 O6 DG A 23 1.134 1.287 -2.721 1.00 0.37 O ATOM 730 N1 DG A 23 0.682 3.507 -2.577 1.00 0.31 N ATOM 731 C2 DG A 23 0.451 4.751 -3.125 1.00 0.28 C ATOM 732 N2 DG A 23 0.216 5.742 -2.264 1.00 0.29 N ATOM 733 N3 DG A 23 0.457 4.993 -4.440 1.00 0.26 N ATOM 734 C4 DG A 23 0.717 3.878 -5.164 1.00 0.27 C ATOM 0 H5' DG A 23 -0.558 9.135 -7.086 1.00 0.27 H new ATOM 0 H5'' DG A 23 -0.605 8.026 -5.730 1.00 0.27 H new ATOM 0 H4' DG A 23 0.813 7.588 -8.350 1.00 0.27 H new ATOM 0 H3' DG A 23 -1.950 6.990 -7.603 1.00 0.31 H new ATOM 0 H2' DG A 23 -1.594 4.716 -7.082 1.00 0.32 H new ATOM 0 H2'' DG A 23 -1.166 4.510 -8.769 1.00 0.32 H new ATOM 0 H1' DG A 23 1.113 4.691 -8.373 1.00 0.28 H new ATOM 0 H8 DG A 23 1.194 2.124 -7.824 1.00 0.30 H new ATOM 0 H1 DG A 23 0.655 3.428 -1.560 1.00 0.31 H new ATOM 0 H21 DG A 23 0.038 6.685 -2.608 1.00 0.29 H new ATOM 0 H22 DG A 23 0.214 5.556 -1.261 1.00 0.29 H new ATOM 746 P DG A 24 -2.566 6.730 -10.247 1.00 0.42 P ATOM 747 OP1 DG A 24 -2.372 7.108 -11.664 1.00 0.52 O ATOM 748 OP2 DG A 24 -3.593 7.419 -9.435 1.00 0.49 O ATOM 749 O5' DG A 24 -2.852 5.147 -10.183 1.00 0.35 O ATOM 750 C5' DG A 24 -2.145 4.243 -11.036 1.00 0.32 C ATOM 751 C4' DG A 24 -2.545 2.796 -10.765 1.00 0.27 C ATOM 752 O4' DG A 24 -2.221 2.455 -9.412 1.00 0.26 O ATOM 753 C3' DG A 24 -4.042 2.527 -10.956 1.00 0.26 C ATOM 754 O3' DG A 24 -4.222 1.393 -11.814 1.00 0.28 O ATOM 755 C2' DG A 24 -4.553 2.205 -9.557 1.00 0.24 C ATOM 756 C1' DG A 24 -3.296 1.689 -8.882 1.00 0.22 C ATOM 757 N9 DG A 24 -3.292 1.842 -7.416 1.00 0.23 N ATOM 758 C8 DG A 24 -3.448 2.980 -6.669 1.00 0.26 C ATOM 759 N7 DG A 24 -3.414 2.778 -5.382 1.00 0.28 N ATOM 760 C5 DG A 24 -3.222 1.405 -5.264 1.00 0.25 C ATOM 761 C6 DG A 24 -3.107 0.598 -4.100 1.00 0.28 C ATOM 762 O6 DG A 24 -3.154 0.948 -2.922 1.00 0.32 O ATOM 763 N1 DG A 24 -2.921 -0.739 -4.425 1.00 0.27 N ATOM 764 C2 DG A 24 -2.855 -1.240 -5.708 1.00 0.24 C ATOM 765 N2 DG A 24 -2.673 -2.555 -5.821 1.00 0.26 N ATOM 766 N3 DG A 24 -2.964 -0.483 -6.802 1.00 0.22 N ATOM 767 C4 DG A 24 -3.145 0.825 -6.505 1.00 0.22 C ATOM 0 H5' DG A 24 -1.072 4.360 -10.884 1.00 0.32 H new ATOM 0 H5'' DG A 24 -2.348 4.489 -12.078 1.00 0.32 H new ATOM 0 H4' DG A 24 -1.995 2.194 -11.488 1.00 0.27 H new ATOM 0 H3' DG A 24 -4.567 3.369 -11.408 1.00 0.26 H new ATOM 0 H2' DG A 24 -4.955 3.085 -9.055 1.00 0.24 H new ATOM 0 H2'' DG A 24 -5.346 1.457 -9.573 1.00 0.24 H new ATOM 0 H1' DG A 24 -3.220 0.619 -9.075 1.00 0.22 H new ATOM 0 H8 DG A 24 -3.587 3.957 -7.108 1.00 0.26 H new ATOM 0 H1 DG A 24 -2.826 -1.402 -3.655 1.00 0.27 H new ATOM 0 H21 DG A 24 -2.616 -2.984 -6.744 1.00 0.26 H new ATOM 0 H22 DG A 24 -2.591 -3.132 -4.984 1.00 0.26 H new ATOM 779 P DT A 25 -3.413 0.024 -11.559 1.00 0.28 P ATOM 780 OP1 DT A 25 -1.997 0.366 -11.300 1.00 0.32 O ATOM 781 OP2 DT A 25 -3.758 -0.925 -12.639 1.00 0.36 O ATOM 782 O5' DT A 25 -4.058 -0.518 -10.186 1.00 0.23 O ATOM 783 C5' DT A 25 -5.405 -1.003 -10.154 1.00 0.21 C ATOM 784 C4' DT A 25 -5.835 -1.365 -8.734 1.00 0.20 C ATOM 785 O4' DT A 25 -5.625 -0.260 -7.873 1.00 0.29 O ATOM 786 C3' DT A 25 -7.309 -1.723 -8.603 1.00 0.25 C ATOM 787 O3' DT A 25 -7.469 -3.142 -8.694 1.00 0.22 O ATOM 788 C2' DT A 25 -7.692 -1.251 -7.198 1.00 0.39 C ATOM 789 C1' DT A 25 -6.490 -0.414 -6.750 1.00 0.40 C ATOM 790 N1 DT A 25 -6.844 0.937 -6.276 1.00 0.52 N ATOM 791 C2 DT A 25 -6.708 1.194 -4.926 1.00 0.67 C ATOM 792 O2 DT A 25 -6.311 0.342 -4.134 1.00 0.73 O ATOM 793 N3 DT A 25 -7.048 2.469 -4.514 1.00 0.80 N ATOM 794 C4 DT A 25 -7.505 3.494 -5.327 1.00 0.82 C ATOM 795 O4 DT A 25 -7.779 4.594 -4.854 1.00 0.96 O ATOM 796 C5 DT A 25 -7.614 3.131 -6.722 1.00 0.70 C ATOM 797 C7 DT A 25 -8.106 4.165 -7.729 1.00 0.78 C ATOM 798 C6 DT A 25 -7.288 1.894 -7.148 1.00 0.55 C ATOM 0 H5' DT A 25 -5.493 -1.879 -10.797 1.00 0.21 H new ATOM 0 H5'' DT A 25 -6.076 -0.244 -10.556 1.00 0.21 H new ATOM 0 H4' DT A 25 -5.235 -2.236 -8.471 1.00 0.20 H new ATOM 0 H3' DT A 25 -7.923 -1.269 -9.381 1.00 0.25 H new ATOM 0 H2' DT A 25 -8.608 -0.660 -7.211 1.00 0.39 H new ATOM 0 H2'' DT A 25 -7.865 -2.093 -6.527 1.00 0.39 H new ATOM 0 H1' DT A 25 -6.029 -0.940 -5.914 1.00 0.40 H new ATOM 0 H3 DT A 25 -6.954 2.674 -3.519 1.00 0.80 H new ATOM 0 H71 DT A 25 -7.655 3.969 -8.702 1.00 0.78 H new ATOM 0 H72 DT A 25 -9.191 4.103 -7.813 1.00 0.78 H new ATOM 0 H73 DT A 25 -7.824 5.163 -7.393 1.00 0.78 H new ATOM 0 H6 DT A 25 -7.379 1.654 -8.197 1.00 0.55 H new ATOM 811 P DT A 26 -8.938 -3.797 -8.780 1.00 0.28 P ATOM 812 OP1 DT A 26 -8.784 -5.237 -9.084 1.00 0.36 O ATOM 813 OP2 DT A 26 -9.774 -2.944 -9.654 1.00 0.36 O ATOM 814 O5' DT A 26 -9.484 -3.657 -7.270 1.00 0.26 O ATOM 815 C5' DT A 26 -9.004 -4.526 -6.240 1.00 0.26 C ATOM 816 C4' DT A 26 -10.001 -4.638 -5.088 1.00 0.28 C ATOM 817 O4' DT A 26 -10.237 -3.347 -4.525 1.00 0.31 O ATOM 818 C3' DT A 26 -11.367 -5.203 -5.499 1.00 0.33 C ATOM 819 O3' DT A 26 -11.638 -6.396 -4.757 1.00 0.37 O ATOM 820 C2' DT A 26 -12.374 -4.118 -5.116 1.00 0.40 C ATOM 821 C1' DT A 26 -11.592 -3.305 -4.100 1.00 0.36 C ATOM 822 N1 DT A 26 -11.996 -1.889 -4.014 1.00 0.42 N ATOM 823 C2 DT A 26 -12.986 -1.563 -3.108 1.00 0.56 C ATOM 824 O2 DT A 26 -13.526 -2.406 -2.396 1.00 0.64 O ATOM 825 N3 DT A 26 -13.336 -0.226 -3.048 1.00 0.63 N ATOM 826 C4 DT A 26 -12.788 0.795 -3.806 1.00 0.58 C ATOM 827 O4 DT A 26 -13.175 1.953 -3.671 1.00 0.66 O ATOM 828 C5 DT A 26 -11.761 0.357 -4.724 1.00 0.45 C ATOM 829 C7 DT A 26 -11.068 1.381 -5.619 1.00 0.46 C ATOM 830 C6 DT A 26 -11.403 -0.940 -4.801 1.00 0.38 C ATOM 0 H5' DT A 26 -8.052 -4.153 -5.863 1.00 0.26 H new ATOM 0 H5'' DT A 26 -8.816 -5.516 -6.657 1.00 0.26 H new ATOM 0 H4' DT A 26 -9.545 -5.327 -4.377 1.00 0.28 H new ATOM 0 H3' DT A 26 -11.410 -5.453 -6.559 1.00 0.33 H new ATOM 0 H2' DT A 26 -12.673 -3.518 -5.975 1.00 0.40 H new ATOM 0 H2'' DT A 26 -13.284 -4.539 -4.688 1.00 0.40 H new ATOM 0 H1' DT A 26 -11.771 -3.733 -3.114 1.00 0.36 H new ATOM 0 H3 DT A 26 -14.066 0.032 -2.384 1.00 0.63 H new ATOM 0 H71 DT A 26 -10.049 1.054 -5.824 1.00 0.46 H new ATOM 0 H72 DT A 26 -11.615 1.474 -6.557 1.00 0.46 H new ATOM 0 H73 DT A 26 -11.045 2.347 -5.116 1.00 0.46 H new ATOM 0 H6 DT A 26 -10.633 -1.236 -5.498 1.00 0.38 H new ATOM 843 P DA A 27 -11.290 -7.841 -5.378 1.00 0.44 P ATOM 844 OP1 DA A 27 -11.307 -7.727 -6.853 1.00 0.51 O ATOM 845 OP2 DA A 27 -12.139 -8.851 -4.708 1.00 0.55 O ATOM 846 O5' DA A 27 -9.768 -8.072 -4.909 1.00 0.36 O ATOM 847 C5' DA A 27 -9.478 -8.451 -3.562 1.00 0.32 C ATOM 848 C4' DA A 27 -7.978 -8.448 -3.286 1.00 0.27 C ATOM 849 O4' DA A 27 -7.442 -7.157 -3.590 1.00 0.23 O ATOM 850 C3' DA A 27 -7.621 -8.778 -1.835 1.00 0.28 C ATOM 851 O3' DA A 27 -6.951 -10.040 -1.741 1.00 0.37 O ATOM 852 C2' DA A 27 -6.707 -7.637 -1.393 1.00 0.28 C ATOM 853 C1' DA A 27 -7.036 -6.527 -2.380 1.00 0.23 C ATOM 854 N9 DA A 27 -8.119 -5.617 -1.951 1.00 0.21 N ATOM 855 C8 DA A 27 -9.269 -5.901 -1.255 1.00 0.24 C ATOM 856 N7 DA A 27 -10.022 -4.860 -1.032 1.00 0.30 N ATOM 857 C5 DA A 27 -9.325 -3.811 -1.621 1.00 0.30 C ATOM 858 C6 DA A 27 -9.595 -2.437 -1.732 1.00 0.38 C ATOM 859 N6 DA A 27 -10.689 -1.864 -1.231 1.00 0.47 N ATOM 860 N1 DA A 27 -8.691 -1.682 -2.379 1.00 0.39 N ATOM 861 C2 DA A 27 -7.603 -2.259 -2.876 1.00 0.34 C ATOM 862 N3 DA A 27 -7.240 -3.532 -2.838 1.00 0.28 N ATOM 863 C4 DA A 27 -8.165 -4.262 -2.183 1.00 0.25 C ATOM 0 H5' DA A 27 -9.882 -9.445 -3.369 1.00 0.32 H new ATOM 0 H5'' DA A 27 -9.976 -7.766 -2.876 1.00 0.32 H new ATOM 0 H4' DA A 27 -7.551 -9.227 -3.917 1.00 0.27 H new ATOM 0 H3' DA A 27 -8.506 -8.864 -1.205 1.00 0.28 H new ATOM 0 H2' DA A 27 -6.908 -7.335 -0.365 1.00 0.28 H new ATOM 0 H2'' DA A 27 -5.656 -7.921 -1.442 1.00 0.28 H new ATOM 0 HO3' DA A 27 -7.029 -10.384 -0.827 1.00 0.37 H new ATOM 0 H1' DA A 27 -6.144 -5.908 -2.479 1.00 0.23 H new ATOM 0 H8 DA A 27 -9.526 -6.896 -0.923 1.00 0.24 H new ATOM 0 H61 DA A 27 -10.835 -0.860 -1.341 1.00 0.47 H new ATOM 0 H62 DA A 27 -11.380 -2.429 -0.738 1.00 0.47 H new ATOM 0 H2 DA A 27 -6.917 -1.596 -3.383 1.00 0.34 H new TER 876 DA A 27