USER MOD reduce.3.24.130724 H: found=0, std=0, add=234, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 234 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 DC O5' : rot -25:sc= 1.28 USER MOD Single : A 21 DT C7 :methyl 150:sc= -0.309 (180deg=-0.309) USER MOD Single : A 21 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 10.481 2.517 5.944 1.00 0.00 O ATOM 2 C5' DC A 1 9.382 3.411 5.804 1.00 0.00 C ATOM 3 C4' DC A 1 8.059 2.709 5.456 1.00 0.00 C ATOM 4 O4' DC A 1 7.007 3.654 5.498 1.00 0.00 O ATOM 5 C3' DC A 1 7.997 2.089 4.051 1.00 0.00 C ATOM 6 O3' DC A 1 8.025 0.670 4.062 1.00 0.00 O ATOM 7 C2' DC A 1 6.645 2.563 3.513 1.00 0.00 C ATOM 8 C1' DC A 1 5.933 3.126 4.751 1.00 0.00 C ATOM 9 N1 DC A 1 4.895 4.184 4.568 1.00 0.00 N ATOM 10 C2 DC A 1 4.373 4.815 5.713 1.00 0.00 C ATOM 11 O2 DC A 1 4.533 4.365 6.858 1.00 0.00 O ATOM 12 N3 DC A 1 3.649 5.951 5.602 1.00 0.00 N ATOM 13 C4 DC A 1 3.348 6.383 4.399 1.00 0.00 C ATOM 14 N4 DC A 1 2.685 7.499 4.337 1.00 0.00 N ATOM 15 C5 DC A 1 3.668 5.677 3.214 1.00 0.00 C ATOM 16 C6 DC A 1 4.443 4.572 3.329 1.00 0.00 C ATOM 0 H5' DC A 1 9.613 4.139 5.026 1.00 0.00 H new ATOM 0 H5'' DC A 1 9.256 3.967 6.733 1.00 0.00 H new ATOM 0 H4' DC A 1 7.974 1.906 6.189 1.00 0.00 H new ATOM 0 H3' DC A 1 8.858 2.389 3.454 1.00 0.00 H new ATOM 0 H2' DC A 1 6.766 3.323 2.741 1.00 0.00 H new ATOM 0 H2'' DC A 1 6.083 1.743 3.067 1.00 0.00 H new ATOM 0 HO5' DC A 1 10.150 1.627 6.186 1.00 0.00 H new ATOM 0 H1' DC A 1 5.341 2.327 5.197 1.00 0.00 H new ATOM 0 H41 DC A 1 2.422 7.886 3.431 1.00 0.00 H new ATOM 0 H42 DC A 1 2.428 7.988 5.195 1.00 0.00 H new ATOM 0 H5 DC A 1 3.307 6.008 2.252 1.00 0.00 H new ATOM 0 H6 DC A 1 4.704 3.999 2.452 1.00 0.00 H new ATOM 29 P DG A 2 9.396 -0.113 4.250 1.00 0.00 P ATOM 30 OP1 DG A 2 9.794 0.016 5.673 1.00 0.00 O ATOM 31 OP2 DG A 2 10.310 0.392 3.198 1.00 0.00 O ATOM 32 O5' DG A 2 9.026 -1.639 3.879 1.00 0.00 O ATOM 33 C5' DG A 2 9.243 -2.765 4.743 1.00 0.00 C ATOM 34 C4' DG A 2 8.516 -2.743 6.113 1.00 0.00 C ATOM 35 O4' DG A 2 7.459 -1.803 6.152 1.00 0.00 O ATOM 36 C3' DG A 2 7.841 -4.071 6.515 1.00 0.00 C ATOM 37 O3' DG A 2 7.838 -4.136 7.948 1.00 0.00 O ATOM 38 C2' DG A 2 6.458 -3.936 5.859 1.00 0.00 C ATOM 39 C1' DG A 2 6.265 -2.428 5.740 1.00 0.00 C ATOM 40 N9 DG A 2 5.915 -1.987 4.376 1.00 0.00 N ATOM 41 C8 DG A 2 6.237 -2.532 3.155 1.00 0.00 C ATOM 42 N7 DG A 2 5.665 -1.963 2.124 1.00 0.00 N ATOM 43 C5 DG A 2 4.884 -0.968 2.734 1.00 0.00 C ATOM 44 C6 DG A 2 3.939 -0.038 2.188 1.00 0.00 C ATOM 45 O6 DG A 2 3.566 0.061 1.022 1.00 0.00 O ATOM 46 N1 DG A 2 3.380 0.811 3.125 1.00 0.00 N ATOM 47 C2 DG A 2 3.633 0.727 4.456 1.00 0.00 C ATOM 48 N2 DG A 2 3.025 1.543 5.265 1.00 0.00 N ATOM 49 N3 DG A 2 4.482 -0.123 5.011 1.00 0.00 N ATOM 50 C4 DG A 2 5.074 -0.948 4.096 1.00 0.00 C ATOM 0 H5' DG A 2 10.314 -2.851 4.928 1.00 0.00 H new ATOM 0 H5'' DG A 2 8.938 -3.666 4.211 1.00 0.00 H new ATOM 0 H4' DG A 2 9.333 -2.503 6.793 1.00 0.00 H new ATOM 0 H3' DG A 2 8.318 -4.998 6.195 1.00 0.00 H new ATOM 0 H2' DG A 2 6.427 -4.423 4.884 1.00 0.00 H new ATOM 0 H2'' DG A 2 5.679 -4.393 6.468 1.00 0.00 H new ATOM 0 H1' DG A 2 5.423 -2.146 6.373 1.00 0.00 H new ATOM 0 H8 DG A 2 6.913 -3.369 3.054 1.00 0.00 H new ATOM 0 H1 DG A 2 2.744 1.539 2.799 1.00 0.00 H new ATOM 0 H21 DG A 2 3.203 1.494 6.268 1.00 0.00 H new ATOM 0 H22 DG A 2 2.370 2.232 4.897 1.00 0.00 H new ATOM 62 P DG A 3 6.836 -5.038 8.817 1.00 0.00 P ATOM 63 OP1 DG A 3 7.329 -5.098 10.205 1.00 0.00 O ATOM 64 OP2 DG A 3 6.628 -6.321 8.100 1.00 0.00 O ATOM 65 O5' DG A 3 5.466 -4.224 8.834 1.00 0.00 O ATOM 66 C5' DG A 3 5.384 -2.958 9.483 1.00 0.00 C ATOM 67 C4' DG A 3 4.007 -2.293 9.337 1.00 0.00 C ATOM 68 O4' DG A 3 3.771 -1.899 7.990 1.00 0.00 O ATOM 69 C3' DG A 3 2.850 -3.209 9.768 1.00 0.00 C ATOM 70 O3' DG A 3 2.153 -2.613 10.860 1.00 0.00 O ATOM 71 C2' DG A 3 2.031 -3.332 8.478 1.00 0.00 C ATOM 72 C1' DG A 3 2.396 -2.068 7.713 1.00 0.00 C ATOM 73 N9 DG A 3 2.158 -2.169 6.251 1.00 0.00 N ATOM 74 C8 DG A 3 2.736 -3.013 5.325 1.00 0.00 C ATOM 75 N7 DG A 3 2.344 -2.812 4.089 1.00 0.00 N ATOM 76 C5 DG A 3 1.424 -1.756 4.209 1.00 0.00 C ATOM 77 C6 DG A 3 0.669 -1.025 3.219 1.00 0.00 C ATOM 78 O6 DG A 3 0.648 -1.177 1.997 1.00 0.00 O ATOM 79 N1 DG A 3 -0.103 -0.001 3.732 1.00 0.00 N ATOM 80 C2 DG A 3 -0.152 0.289 5.062 1.00 0.00 C ATOM 81 N2 DG A 3 -0.952 1.237 5.445 1.00 0.00 N ATOM 82 N3 DG A 3 0.540 -0.340 6.008 1.00 0.00 N ATOM 83 C4 DG A 3 1.313 -1.358 5.523 1.00 0.00 C ATOM 0 H5' DG A 3 6.146 -2.296 9.072 1.00 0.00 H new ATOM 0 H5'' DG A 3 5.609 -3.084 10.542 1.00 0.00 H new ATOM 0 H4' DG A 3 4.032 -1.425 9.996 1.00 0.00 H new ATOM 0 H3' DG A 3 3.135 -4.192 10.143 1.00 0.00 H new ATOM 0 H2' DG A 3 2.292 -4.231 7.919 1.00 0.00 H new ATOM 0 H2'' DG A 3 0.962 -3.384 8.683 1.00 0.00 H new ATOM 0 H1' DG A 3 1.777 -1.226 8.022 1.00 0.00 H new ATOM 0 H8 DG A 3 3.452 -3.776 5.595 1.00 0.00 H new ATOM 0 H1 DG A 3 -0.659 0.561 3.088 1.00 0.00 H new ATOM 0 H21 DG A 3 -1.016 1.482 6.433 1.00 0.00 H new ATOM 0 H22 DG A 3 -1.517 1.736 4.758 1.00 0.00 H new ATOM 95 P DG A 4 0.851 -3.264 11.523 1.00 0.00 P ATOM 96 OP1 DG A 4 0.806 -2.842 12.941 1.00 0.00 O ATOM 97 OP2 DG A 4 0.814 -4.710 11.208 1.00 0.00 O ATOM 98 O5' DG A 4 -0.366 -2.563 10.770 1.00 0.00 O ATOM 99 C5' DG A 4 -0.590 -1.167 10.923 1.00 0.00 C ATOM 100 C4' DG A 4 -1.687 -0.600 10.019 1.00 0.00 C ATOM 101 O4' DG A 4 -1.361 -0.822 8.649 1.00 0.00 O ATOM 102 C3' DG A 4 -3.082 -1.202 10.262 1.00 0.00 C ATOM 103 O3' DG A 4 -4.089 -0.195 10.188 1.00 0.00 O ATOM 104 C2' DG A 4 -3.243 -2.112 9.052 1.00 0.00 C ATOM 105 C1' DG A 4 -2.552 -1.247 8.008 1.00 0.00 C ATOM 106 N9 DG A 4 -2.310 -1.942 6.727 1.00 0.00 N ATOM 107 C8 DG A 4 -1.475 -2.996 6.437 1.00 0.00 C ATOM 108 N7 DG A 4 -1.408 -3.295 5.162 1.00 0.00 N ATOM 109 C5 DG A 4 -2.297 -2.388 4.569 1.00 0.00 C ATOM 110 C6 DG A 4 -2.642 -2.145 3.191 1.00 0.00 C ATOM 111 O6 DG A 4 -2.210 -2.693 2.176 1.00 0.00 O ATOM 112 N1 DG A 4 -3.544 -1.112 3.013 1.00 0.00 N ATOM 113 C2 DG A 4 -4.058 -0.387 4.037 1.00 0.00 C ATOM 114 N2 DG A 4 -4.881 0.579 3.757 1.00 0.00 N ATOM 115 N3 DG A 4 -3.775 -0.577 5.321 1.00 0.00 N ATOM 116 C4 DG A 4 -2.873 -1.583 5.525 1.00 0.00 C ATOM 0 H5' DG A 4 0.341 -0.638 10.720 1.00 0.00 H new ATOM 0 H5'' DG A 4 -0.852 -0.965 11.962 1.00 0.00 H new ATOM 0 H4' DG A 4 -1.732 0.461 10.265 1.00 0.00 H new ATOM 0 H3' DG A 4 -3.174 -1.686 11.234 1.00 0.00 H new ATOM 0 H2' DG A 4 -2.758 -3.079 9.185 1.00 0.00 H new ATOM 0 H2'' DG A 4 -4.287 -2.310 8.810 1.00 0.00 H new ATOM 0 H1' DG A 4 -3.176 -0.408 7.700 1.00 0.00 H new ATOM 0 H8 DG A 4 -0.922 -3.531 7.195 1.00 0.00 H new ATOM 0 H1 DG A 4 -3.838 -0.884 2.063 1.00 0.00 H new ATOM 0 H21 DG A 4 -5.283 1.141 4.508 1.00 0.00 H new ATOM 0 H22 DG A 4 -5.125 0.776 2.786 1.00 0.00 H new ATOM 128 P DC A 5 -4.496 0.708 11.437 1.00 0.00 P ATOM 129 OP1 DC A 5 -4.644 -0.210 12.593 1.00 0.00 O ATOM 130 OP2 DC A 5 -5.666 1.515 11.012 1.00 0.00 O ATOM 131 O5' DC A 5 -3.264 1.699 11.708 1.00 0.00 O ATOM 132 C5' DC A 5 -3.025 2.834 10.879 1.00 0.00 C ATOM 133 C4' DC A 5 -1.946 3.803 11.403 1.00 0.00 C ATOM 134 O4' DC A 5 -2.413 4.411 12.607 1.00 0.00 O ATOM 135 C3' DC A 5 -0.595 3.148 11.736 1.00 0.00 C ATOM 136 O3' DC A 5 0.501 4.052 11.605 1.00 0.00 O ATOM 137 C2' DC A 5 -0.750 2.836 13.213 1.00 0.00 C ATOM 138 C1' DC A 5 -1.560 4.041 13.685 1.00 0.00 C ATOM 139 N1 DC A 5 -2.324 3.758 14.931 1.00 0.00 N ATOM 140 C2 DC A 5 -1.946 4.393 16.121 1.00 0.00 C ATOM 141 O2 DC A 5 -1.022 5.211 16.155 1.00 0.00 O ATOM 142 N3 DC A 5 -2.619 4.162 17.278 1.00 0.00 N ATOM 143 C4 DC A 5 -3.590 3.268 17.261 1.00 0.00 C ATOM 144 N4 DC A 5 -4.235 3.124 18.378 1.00 0.00 N ATOM 145 C5 DC A 5 -4.031 2.605 16.089 1.00 0.00 C ATOM 146 C6 DC A 5 -3.373 2.874 14.934 1.00 0.00 C ATOM 0 H5' DC A 5 -3.959 3.383 10.761 1.00 0.00 H new ATOM 0 H5'' DC A 5 -2.731 2.487 9.888 1.00 0.00 H new ATOM 0 H4' DC A 5 -1.779 4.511 10.591 1.00 0.00 H new ATOM 0 H3' DC A 5 -0.385 2.304 11.079 1.00 0.00 H new ATOM 0 H2' DC A 5 -1.274 1.895 13.382 1.00 0.00 H new ATOM 0 H2'' DC A 5 0.211 2.761 13.721 1.00 0.00 H new ATOM 0 H1' DC A 5 -0.895 4.864 13.947 1.00 0.00 H new ATOM 0 H41 DC A 5 -4.999 2.452 18.443 1.00 0.00 H new ATOM 0 H42 DC A 5 -3.978 3.683 19.191 1.00 0.00 H new ATOM 0 H5 DC A 5 -4.859 1.912 16.114 1.00 0.00 H new ATOM 0 H6 DC A 5 -3.675 2.392 14.016 1.00 0.00 H new ATOM 158 P DG A 6 1.378 4.141 10.277 1.00 0.00 P ATOM 159 OP1 DG A 6 1.445 2.807 9.638 1.00 0.00 O ATOM 160 OP2 DG A 6 2.638 4.839 10.609 1.00 0.00 O ATOM 161 O5' DG A 6 0.529 5.084 9.327 1.00 0.00 O ATOM 162 C5' DG A 6 0.321 6.461 9.606 1.00 0.00 C ATOM 163 C4' DG A 6 -0.415 7.140 8.448 1.00 0.00 C ATOM 164 O4' DG A 6 0.362 7.119 7.258 1.00 0.00 O ATOM 165 C3' DG A 6 -1.751 6.466 8.145 1.00 0.00 C ATOM 166 O3' DG A 6 -2.766 7.104 8.900 1.00 0.00 O ATOM 167 C2' DG A 6 -1.885 6.703 6.646 1.00 0.00 C ATOM 168 C1' DG A 6 -0.456 6.836 6.137 1.00 0.00 C ATOM 169 N9 DG A 6 0.020 5.597 5.485 1.00 0.00 N ATOM 170 C8 DG A 6 0.573 4.481 6.064 1.00 0.00 C ATOM 171 N7 DG A 6 1.024 3.601 5.213 1.00 0.00 N ATOM 172 C5 DG A 6 0.706 4.157 3.974 1.00 0.00 C ATOM 173 C6 DG A 6 0.943 3.679 2.643 1.00 0.00 C ATOM 174 O6 DG A 6 1.454 2.623 2.281 1.00 0.00 O ATOM 175 N1 DG A 6 0.545 4.550 1.658 1.00 0.00 N ATOM 176 C2 DG A 6 -0.083 5.726 1.911 1.00 0.00 C ATOM 177 N2 DG A 6 -0.440 6.445 0.888 1.00 0.00 N ATOM 178 N3 DG A 6 -0.358 6.201 3.126 1.00 0.00 N ATOM 179 C4 DG A 6 0.080 5.373 4.126 1.00 0.00 C ATOM 0 H5' DG A 6 1.279 6.953 9.773 1.00 0.00 H new ATOM 0 H5'' DG A 6 -0.257 6.568 10.524 1.00 0.00 H new ATOM 0 H4' DG A 6 -0.589 8.168 8.767 1.00 0.00 H new ATOM 0 H3' DG A 6 -1.822 5.409 8.400 1.00 0.00 H new ATOM 0 H2' DG A 6 -2.401 5.875 6.160 1.00 0.00 H new ATOM 0 H2'' DG A 6 -2.463 7.604 6.439 1.00 0.00 H new ATOM 0 H1' DG A 6 -0.413 7.628 5.389 1.00 0.00 H new ATOM 0 H8 DG A 6 0.630 4.344 7.134 1.00 0.00 H new ATOM 0 H1 DG A 6 0.731 4.300 0.687 1.00 0.00 H new ATOM 0 H21 DG A 6 -0.915 7.336 1.032 1.00 0.00 H new ATOM 0 H22 DG A 6 -0.245 6.118 -0.058 1.00 0.00 H new ATOM 191 P DG A 7 -4.281 6.639 8.837 1.00 0.00 P ATOM 192 OP1 DG A 7 -5.003 7.444 9.846 1.00 0.00 O ATOM 193 OP2 DG A 7 -4.326 5.164 8.916 1.00 0.00 O ATOM 194 O5' DG A 7 -4.721 7.143 7.380 1.00 0.00 O ATOM 195 C5' DG A 7 -5.644 6.422 6.579 1.00 0.00 C ATOM 196 C4' DG A 7 -5.626 6.941 5.135 1.00 0.00 C ATOM 197 O4' DG A 7 -4.418 6.550 4.477 1.00 0.00 O ATOM 198 C3' DG A 7 -6.799 6.373 4.328 1.00 0.00 C ATOM 199 O3' DG A 7 -7.347 7.396 3.504 1.00 0.00 O ATOM 200 C2' DG A 7 -6.142 5.268 3.514 1.00 0.00 C ATOM 201 C1' DG A 7 -4.723 5.786 3.315 1.00 0.00 C ATOM 202 N9 DG A 7 -3.768 4.664 3.139 1.00 0.00 N ATOM 203 C8 DG A 7 -3.230 3.847 4.102 1.00 0.00 C ATOM 204 N7 DG A 7 -2.475 2.885 3.641 1.00 0.00 N ATOM 205 C5 DG A 7 -2.539 3.051 2.256 1.00 0.00 C ATOM 206 C6 DG A 7 -1.948 2.290 1.185 1.00 0.00 C ATOM 207 O6 DG A 7 -1.235 1.282 1.262 1.00 0.00 O ATOM 208 N1 DG A 7 -2.233 2.796 -0.074 1.00 0.00 N ATOM 209 C2 DG A 7 -3.006 3.908 -0.274 1.00 0.00 C ATOM 210 N2 DG A 7 -3.221 4.309 -1.494 1.00 0.00 N ATOM 211 N3 DG A 7 -3.567 4.630 0.692 1.00 0.00 N ATOM 212 C4 DG A 7 -3.306 4.151 1.943 1.00 0.00 C ATOM 0 H5' DG A 7 -6.647 6.519 6.994 1.00 0.00 H new ATOM 0 H5'' DG A 7 -5.395 5.361 6.593 1.00 0.00 H new ATOM 0 H4' DG A 7 -5.701 8.027 5.185 1.00 0.00 H new ATOM 0 H3' DG A 7 -7.629 6.002 4.929 1.00 0.00 H new ATOM 0 H2' DG A 7 -6.153 4.315 4.044 1.00 0.00 H new ATOM 0 H2'' DG A 7 -6.651 5.110 2.563 1.00 0.00 H new ATOM 0 H1' DG A 7 -4.643 6.395 2.414 1.00 0.00 H new ATOM 0 H8 DG A 7 -3.416 3.988 5.157 1.00 0.00 H new ATOM 0 H1 DG A 7 -1.849 2.318 -0.889 1.00 0.00 H new ATOM 0 H21 DG A 7 -3.794 5.135 -1.666 1.00 0.00 H new ATOM 0 H22 DG A 7 -2.816 3.797 -2.278 1.00 0.00 H new ATOM 224 P DG A 8 -8.766 7.244 2.782 1.00 0.00 P ATOM 225 OP1 DG A 8 -9.249 8.621 2.582 1.00 0.00 O ATOM 226 OP2 DG A 8 -9.586 6.300 3.569 1.00 0.00 O ATOM 227 O5' DG A 8 -8.428 6.591 1.380 1.00 0.00 O ATOM 228 C5' DG A 8 -7.762 7.324 0.360 1.00 0.00 C ATOM 229 C4' DG A 8 -7.497 6.450 -0.866 1.00 0.00 C ATOM 230 O4' DG A 8 -6.612 5.396 -0.513 1.00 0.00 O ATOM 231 C3' DG A 8 -8.781 5.820 -1.437 1.00 0.00 C ATOM 232 O3' DG A 8 -8.890 6.034 -2.842 1.00 0.00 O ATOM 233 C2' DG A 8 -8.569 4.334 -1.149 1.00 0.00 C ATOM 234 C1' DG A 8 -7.051 4.230 -1.175 1.00 0.00 C ATOM 235 N9 DG A 8 -6.508 3.021 -0.520 1.00 0.00 N ATOM 236 C8 DG A 8 -6.471 2.714 0.813 1.00 0.00 C ATOM 237 N7 DG A 8 -5.755 1.658 1.118 1.00 0.00 N ATOM 238 C5 DG A 8 -5.337 1.190 -0.137 1.00 0.00 C ATOM 239 C6 DG A 8 -4.516 0.067 -0.516 1.00 0.00 C ATOM 240 O6 DG A 8 -3.933 -0.747 0.204 1.00 0.00 O ATOM 241 N1 DG A 8 -4.358 -0.065 -1.882 1.00 0.00 N ATOM 242 C2 DG A 8 -4.916 0.782 -2.786 1.00 0.00 C ATOM 243 N2 DG A 8 -4.727 0.548 -4.046 1.00 0.00 N ATOM 244 N3 DG A 8 -5.654 1.849 -2.488 1.00 0.00 N ATOM 245 C4 DG A 8 -5.828 2.001 -1.140 1.00 0.00 C ATOM 0 H5' DG A 8 -6.819 7.712 0.744 1.00 0.00 H new ATOM 0 H5'' DG A 8 -8.367 8.184 0.073 1.00 0.00 H new ATOM 0 H4' DG A 8 -7.066 7.099 -1.628 1.00 0.00 H new ATOM 0 H3' DG A 8 -9.690 6.239 -1.004 1.00 0.00 H new ATOM 0 H2' DG A 8 -8.983 4.041 -0.184 1.00 0.00 H new ATOM 0 H2'' DG A 8 -9.036 3.700 -1.903 1.00 0.00 H new ATOM 0 H1' DG A 8 -6.698 4.145 -2.203 1.00 0.00 H new ATOM 0 H8 DG A 8 -6.992 3.297 1.558 1.00 0.00 H new ATOM 0 H1 DG A 8 -3.793 -0.839 -2.230 1.00 0.00 H new ATOM 0 H21 DG A 8 -5.134 1.168 -4.746 1.00 0.00 H new ATOM 0 H22 DG A 8 -4.171 -0.256 -4.338 1.00 0.00 H new ATOM 257 P DC A 9 -9.598 7.340 -3.451 1.00 0.00 P ATOM 258 OP1 DC A 9 -10.916 7.508 -2.803 1.00 0.00 O ATOM 259 OP2 DC A 9 -9.544 7.190 -4.918 1.00 0.00 O ATOM 260 O5' DC A 9 -8.737 8.614 -3.040 1.00 0.00 O ATOM 261 C5' DC A 9 -7.517 8.972 -3.678 1.00 0.00 C ATOM 262 C4' DC A 9 -7.168 10.444 -3.406 1.00 0.00 C ATOM 263 O4' DC A 9 -7.980 11.274 -4.232 1.00 0.00 O ATOM 264 C3' DC A 9 -7.413 10.875 -1.953 1.00 0.00 C ATOM 265 O3' DC A 9 -6.426 11.791 -1.509 1.00 0.00 O ATOM 266 C2' DC A 9 -8.744 11.610 -2.039 1.00 0.00 C ATOM 267 C1' DC A 9 -8.663 12.223 -3.430 1.00 0.00 C ATOM 268 N1 DC A 9 -10.010 12.520 -3.984 1.00 0.00 N ATOM 269 C2 DC A 9 -10.447 13.849 -4.020 1.00 0.00 C ATOM 270 O2 DC A 9 -9.803 14.764 -3.508 1.00 0.00 O ATOM 271 N3 DC A 9 -11.615 14.179 -4.621 1.00 0.00 N ATOM 272 C4 DC A 9 -12.335 13.209 -5.157 1.00 0.00 C ATOM 273 N4 DC A 9 -13.423 13.588 -5.758 1.00 0.00 N ATOM 274 C5 DC A 9 -12.002 11.832 -5.052 1.00 0.00 C ATOM 275 C6 DC A 9 -10.823 11.518 -4.457 1.00 0.00 C ATOM 0 H5' DC A 9 -7.601 8.806 -4.752 1.00 0.00 H new ATOM 0 H5'' DC A 9 -6.712 8.331 -3.319 1.00 0.00 H new ATOM 0 H4' DC A 9 -6.104 10.549 -3.617 1.00 0.00 H new ATOM 0 H3' DC A 9 -7.395 10.030 -1.265 1.00 0.00 H new ATOM 0 H2' DC A 9 -9.593 10.934 -1.937 1.00 0.00 H new ATOM 0 H2'' DC A 9 -8.845 12.368 -1.262 1.00 0.00 H new ATOM 0 H1' DC A 9 -8.140 13.179 -3.403 1.00 0.00 H new ATOM 0 H41 DC A 9 -14.031 12.896 -6.196 1.00 0.00 H new ATOM 0 H42 DC A 9 -13.669 14.577 -5.791 1.00 0.00 H new ATOM 0 H5 DC A 9 -12.661 11.065 -5.431 1.00 0.00 H new ATOM 0 H6 DC A 9 -10.525 10.485 -4.356 1.00 0.00 H new ATOM 287 P DG A 10 -5.709 11.605 -0.099 1.00 0.00 P ATOM 288 OP1 DG A 10 -4.420 10.939 -0.381 1.00 0.00 O ATOM 289 OP2 DG A 10 -6.654 11.006 0.878 1.00 0.00 O ATOM 290 O5' DG A 10 -5.407 13.103 0.332 1.00 0.00 O ATOM 291 C5' DG A 10 -6.454 14.004 0.659 1.00 0.00 C ATOM 292 C4' DG A 10 -5.928 15.432 0.854 1.00 0.00 C ATOM 293 O4' DG A 10 -5.232 15.846 -0.321 1.00 0.00 O ATOM 294 C3' DG A 10 -7.107 16.407 1.072 1.00 0.00 C ATOM 295 O3' DG A 10 -6.902 17.382 2.095 1.00 0.00 O ATOM 296 C2' DG A 10 -7.206 17.083 -0.289 1.00 0.00 C ATOM 297 C1' DG A 10 -5.746 17.104 -0.717 1.00 0.00 C ATOM 298 N9 DG A 10 -5.532 17.351 -2.163 1.00 0.00 N ATOM 299 C8 DG A 10 -6.422 17.309 -3.212 1.00 0.00 C ATOM 300 N7 DG A 10 -5.878 17.503 -4.385 1.00 0.00 N ATOM 301 C5 DG A 10 -4.534 17.761 -4.085 1.00 0.00 C ATOM 302 C6 DG A 10 -3.403 18.046 -4.928 1.00 0.00 C ATOM 303 O6 DG A 10 -3.360 18.153 -6.156 1.00 0.00 O ATOM 304 N1 DG A 10 -2.212 18.183 -4.240 1.00 0.00 N ATOM 305 C2 DG A 10 -2.115 18.083 -2.892 1.00 0.00 C ATOM 306 N2 DG A 10 -0.919 18.119 -2.378 1.00 0.00 N ATOM 307 N3 DG A 10 -3.126 17.809 -2.073 1.00 0.00 N ATOM 308 C4 DG A 10 -4.321 17.680 -2.727 1.00 0.00 C ATOM 0 H5' DG A 10 -6.951 13.671 1.570 1.00 0.00 H new ATOM 0 H5'' DG A 10 -7.203 13.996 -0.133 1.00 0.00 H new ATOM 0 H4' DG A 10 -5.267 15.442 1.720 1.00 0.00 H new ATOM 0 H3' DG A 10 -8.000 15.881 1.410 1.00 0.00 H new ATOM 0 H2' DG A 10 -7.830 16.520 -0.983 1.00 0.00 H new ATOM 0 H2'' DG A 10 -7.629 18.085 -0.221 1.00 0.00 H new ATOM 0 H1' DG A 10 -5.232 17.941 -0.246 1.00 0.00 H new ATOM 0 H8 DG A 10 -7.479 17.131 -3.078 1.00 0.00 H new ATOM 0 H1 DG A 10 -1.363 18.369 -4.774 1.00 0.00 H new ATOM 0 H21 DG A 10 -0.796 18.047 -1.368 1.00 0.00 H new ATOM 0 H22 DG A 10 -0.106 18.219 -2.985 1.00 0.00 H new ATOM 320 P DC A 11 -6.743 16.947 3.633 1.00 0.00 P ATOM 321 OP1 DC A 11 -7.524 15.706 3.808 1.00 0.00 O ATOM 322 OP2 DC A 11 -7.107 18.100 4.486 1.00 0.00 O ATOM 323 O5' DC A 11 -5.202 16.610 3.911 1.00 0.00 O ATOM 324 C5' DC A 11 -4.221 17.612 4.182 1.00 0.00 C ATOM 325 C4' DC A 11 -3.315 17.932 2.985 1.00 0.00 C ATOM 326 O4' DC A 11 -4.061 18.378 1.860 1.00 0.00 O ATOM 327 C3' DC A 11 -2.311 19.054 3.312 1.00 0.00 C ATOM 328 O3' DC A 11 -1.016 18.736 2.813 1.00 0.00 O ATOM 329 C2' DC A 11 -2.850 20.235 2.511 1.00 0.00 C ATOM 330 C1' DC A 11 -3.406 19.502 1.297 1.00 0.00 C ATOM 331 N1 DC A 11 -4.321 20.324 0.461 1.00 0.00 N ATOM 332 C2 DC A 11 -3.804 20.955 -0.678 1.00 0.00 C ATOM 333 O2 DC A 11 -2.594 21.070 -0.881 1.00 0.00 O ATOM 334 N3 DC A 11 -4.624 21.484 -1.613 1.00 0.00 N ATOM 335 C4 DC A 11 -5.922 21.460 -1.386 1.00 0.00 C ATOM 336 N4 DC A 11 -6.657 21.899 -2.361 1.00 0.00 N ATOM 337 C5 DC A 11 -6.506 20.929 -0.203 1.00 0.00 C ATOM 338 C6 DC A 11 -5.671 20.372 0.712 1.00 0.00 C ATOM 0 H5' DC A 11 -3.602 17.284 5.017 1.00 0.00 H new ATOM 0 H5'' DC A 11 -4.726 18.525 4.498 1.00 0.00 H new ATOM 0 H4' DC A 11 -2.797 17.000 2.760 1.00 0.00 H new ATOM 0 H3' DC A 11 -2.217 19.229 4.384 1.00 0.00 H new ATOM 0 H2' DC A 11 -3.618 20.789 3.051 1.00 0.00 H new ATOM 0 H2'' DC A 11 -2.070 20.949 2.245 1.00 0.00 H new ATOM 0 H1' DC A 11 -2.616 19.235 0.596 1.00 0.00 H new ATOM 0 H41 DC A 11 -7.673 21.915 -2.267 1.00 0.00 H new ATOM 0 H42 DC A 11 -6.219 22.229 -3.221 1.00 0.00 H new ATOM 0 H5 DC A 11 -7.573 20.967 -0.038 1.00 0.00 H new ATOM 0 H6 DC A 11 -6.066 19.969 1.633 1.00 0.00 H new ATOM 350 P DG A 12 0.214 18.426 3.786 1.00 0.00 P ATOM 351 OP1 DG A 12 0.167 19.384 4.915 1.00 0.00 O ATOM 352 OP2 DG A 12 1.424 18.378 2.943 1.00 0.00 O ATOM 353 O5' DG A 12 -0.062 16.942 4.323 1.00 0.00 O ATOM 354 C5' DG A 12 -0.220 15.865 3.403 1.00 0.00 C ATOM 355 C4' DG A 12 0.582 14.620 3.774 1.00 0.00 C ATOM 356 O4' DG A 12 0.127 14.055 4.992 1.00 0.00 O ATOM 357 C3' DG A 12 0.432 13.528 2.701 1.00 0.00 C ATOM 358 O3' DG A 12 1.657 13.361 2.002 1.00 0.00 O ATOM 359 C2' DG A 12 0.084 12.289 3.532 1.00 0.00 C ATOM 360 C1' DG A 12 0.468 12.685 4.956 1.00 0.00 C ATOM 361 N9 DG A 12 -0.234 11.898 6.005 1.00 0.00 N ATOM 362 C8 DG A 12 -0.864 10.679 5.891 1.00 0.00 C ATOM 363 N7 DG A 12 -1.324 10.199 7.016 1.00 0.00 N ATOM 364 C5 DG A 12 -0.958 11.167 7.962 1.00 0.00 C ATOM 365 C6 DG A 12 -1.134 11.216 9.393 1.00 0.00 C ATOM 366 O6 DG A 12 -1.628 10.376 10.157 1.00 0.00 O ATOM 367 N1 DG A 12 -0.644 12.376 9.962 1.00 0.00 N ATOM 368 C2 DG A 12 0.020 13.332 9.268 1.00 0.00 C ATOM 369 N2 DG A 12 0.515 14.308 9.973 1.00 0.00 N ATOM 370 N3 DG A 12 0.243 13.316 7.958 1.00 0.00 N ATOM 371 C4 DG A 12 -0.289 12.209 7.350 1.00 0.00 C ATOM 0 H5' DG A 12 0.082 16.199 2.410 1.00 0.00 H new ATOM 0 H5'' DG A 12 -1.276 15.602 3.343 1.00 0.00 H new ATOM 0 H4' DG A 12 1.619 14.942 3.863 1.00 0.00 H new ATOM 0 H3' DG A 12 -0.315 13.749 1.939 1.00 0.00 H new ATOM 0 H2' DG A 12 -0.975 12.042 3.457 1.00 0.00 H new ATOM 0 H2'' DG A 12 0.640 11.413 3.197 1.00 0.00 H new ATOM 0 H1' DG A 12 1.517 12.487 5.175 1.00 0.00 H new ATOM 0 H8 DG A 12 -0.969 10.162 4.949 1.00 0.00 H new ATOM 0 H1 DG A 12 -0.790 12.521 10.961 1.00 0.00 H new ATOM 0 H21 DG A 12 1.027 15.061 9.513 1.00 0.00 H new ATOM 0 H22 DG A 12 0.391 14.320 10.985 1.00 0.00 H new ATOM 383 P DA A 13 1.794 12.564 0.627 1.00 0.00 P ATOM 384 OP1 DA A 13 0.732 11.543 0.515 1.00 0.00 O ATOM 385 OP2 DA A 13 3.201 12.116 0.576 1.00 0.00 O ATOM 386 O5' DA A 13 1.616 13.597 -0.578 1.00 0.00 O ATOM 387 C5' DA A 13 0.336 13.994 -1.051 1.00 0.00 C ATOM 388 C4' DA A 13 0.371 14.422 -2.524 1.00 0.00 C ATOM 389 O4' DA A 13 1.196 15.565 -2.723 1.00 0.00 O ATOM 390 C3' DA A 13 0.903 13.330 -3.477 1.00 0.00 C ATOM 391 O3' DA A 13 -0.048 13.035 -4.491 1.00 0.00 O ATOM 392 C2' DA A 13 2.103 14.004 -4.136 1.00 0.00 C ATOM 393 C1' DA A 13 1.686 15.467 -4.048 1.00 0.00 C ATOM 394 N9 DA A 13 2.756 16.451 -4.343 1.00 0.00 N ATOM 395 C8 DA A 13 4.049 16.239 -4.770 1.00 0.00 C ATOM 396 N7 DA A 13 4.704 17.329 -5.085 1.00 0.00 N ATOM 397 C5 DA A 13 3.745 18.336 -4.877 1.00 0.00 C ATOM 398 C6 DA A 13 3.708 19.742 -5.049 1.00 0.00 C ATOM 399 N6 DA A 13 4.682 20.494 -5.519 1.00 0.00 N ATOM 400 N1 DA A 13 2.616 20.450 -4.757 1.00 0.00 N ATOM 401 C2 DA A 13 1.539 19.794 -4.357 1.00 0.00 C ATOM 402 N3 DA A 13 1.396 18.487 -4.174 1.00 0.00 N ATOM 403 C4 DA A 13 2.557 17.810 -4.438 1.00 0.00 C ATOM 0 H5' DA A 13 -0.034 14.819 -0.443 1.00 0.00 H new ATOM 0 H5'' DA A 13 -0.366 13.169 -0.930 1.00 0.00 H new ATOM 0 H4' DA A 13 -0.672 14.634 -2.759 1.00 0.00 H new ATOM 0 H3' DA A 13 1.128 12.400 -2.955 1.00 0.00 H new ATOM 0 H2' DA A 13 3.033 13.806 -3.604 1.00 0.00 H new ATOM 0 H2'' DA A 13 2.249 13.676 -5.165 1.00 0.00 H new ATOM 0 H1' DA A 13 0.954 15.724 -4.814 1.00 0.00 H new ATOM 0 H8 DA A 13 4.487 15.254 -4.839 1.00 0.00 H new ATOM 0 H61 DA A 13 4.553 21.502 -5.603 1.00 0.00 H new ATOM 0 H62 DA A 13 5.566 20.068 -5.799 1.00 0.00 H new ATOM 0 H2 DA A 13 0.667 20.398 -4.154 1.00 0.00 H new ATOM 415 P DG A 14 -1.037 11.786 -4.415 1.00 0.00 P ATOM 416 OP1 DG A 14 -2.148 12.091 -5.340 1.00 0.00 O ATOM 417 OP2 DG A 14 -1.335 11.457 -3.003 1.00 0.00 O ATOM 418 O5' DG A 14 -0.172 10.589 -5.010 1.00 0.00 O ATOM 419 C5' DG A 14 0.132 10.459 -6.396 1.00 0.00 C ATOM 420 C4' DG A 14 -0.266 9.080 -6.947 1.00 0.00 C ATOM 421 O4' DG A 14 0.310 8.076 -6.114 1.00 0.00 O ATOM 422 C3' DG A 14 -1.784 8.817 -6.956 1.00 0.00 C ATOM 423 O3' DG A 14 -2.071 7.938 -8.043 1.00 0.00 O ATOM 424 C2' DG A 14 -1.977 8.142 -5.602 1.00 0.00 C ATOM 425 C1' DG A 14 -0.728 7.269 -5.582 1.00 0.00 C ATOM 426 N9 DG A 14 -0.379 6.713 -4.256 1.00 0.00 N ATOM 427 C8 DG A 14 -0.881 7.012 -3.007 1.00 0.00 C ATOM 428 N7 DG A 14 -0.458 6.225 -2.052 1.00 0.00 N ATOM 429 C5 DG A 14 0.379 5.327 -2.722 1.00 0.00 C ATOM 430 C6 DG A 14 1.122 4.195 -2.245 1.00 0.00 C ATOM 431 O6 DG A 14 1.204 3.767 -1.091 1.00 0.00 O ATOM 432 N1 DG A 14 1.822 3.531 -3.234 1.00 0.00 N ATOM 433 C2 DG A 14 1.842 3.923 -4.536 1.00 0.00 C ATOM 434 N2 DG A 14 2.526 3.197 -5.375 1.00 0.00 N ATOM 435 N3 DG A 14 1.176 4.971 -5.020 1.00 0.00 N ATOM 436 C4 DG A 14 0.453 5.633 -4.062 1.00 0.00 C ATOM 0 H5' DG A 14 1.200 10.616 -6.549 1.00 0.00 H new ATOM 0 H5'' DG A 14 -0.388 11.237 -6.956 1.00 0.00 H new ATOM 0 H4' DG A 14 0.089 9.056 -7.977 1.00 0.00 H new ATOM 0 H3' DG A 14 -2.428 9.687 -7.085 1.00 0.00 H new ATOM 0 H2' DG A 14 -2.004 8.855 -4.778 1.00 0.00 H new ATOM 0 H2'' DG A 14 -2.897 7.560 -5.551 1.00 0.00 H new ATOM 0 H1' DG A 14 -0.901 6.372 -6.177 1.00 0.00 H new ATOM 0 H8 DG A 14 -1.566 7.828 -2.832 1.00 0.00 H new ATOM 0 H1 DG A 14 2.353 2.700 -2.973 1.00 0.00 H new ATOM 0 H21 DG A 14 2.566 3.458 -6.360 1.00 0.00 H new ATOM 0 H22 DG A 14 3.021 2.368 -5.046 1.00 0.00 H new ATOM 448 P DG A 15 -3.559 7.487 -8.440 1.00 0.00 P ATOM 449 OP1 DG A 15 -3.464 6.879 -9.774 1.00 0.00 O ATOM 450 OP2 DG A 15 -4.479 8.624 -8.250 1.00 0.00 O ATOM 451 O5' DG A 15 -3.911 6.339 -7.364 1.00 0.00 O ATOM 452 C5' DG A 15 -4.104 4.971 -7.719 1.00 0.00 C ATOM 453 C4' DG A 15 -2.867 4.241 -8.276 1.00 0.00 C ATOM 454 O4' DG A 15 -1.675 4.442 -7.516 1.00 0.00 O ATOM 455 C3' DG A 15 -3.112 2.729 -8.334 1.00 0.00 C ATOM 456 O3' DG A 15 -3.741 2.355 -9.545 1.00 0.00 O ATOM 457 C2' DG A 15 -1.690 2.201 -8.240 1.00 0.00 C ATOM 458 C1' DG A 15 -1.055 3.184 -7.255 1.00 0.00 C ATOM 459 N9 DG A 15 -1.291 2.792 -5.842 1.00 0.00 N ATOM 460 C8 DG A 15 -1.979 3.478 -4.870 1.00 0.00 C ATOM 461 N7 DG A 15 -1.872 2.974 -3.668 1.00 0.00 N ATOM 462 C5 DG A 15 -1.071 1.844 -3.861 1.00 0.00 C ATOM 463 C6 DG A 15 -0.556 0.884 -2.923 1.00 0.00 C ATOM 464 O6 DG A 15 -0.714 0.853 -1.698 1.00 0.00 O ATOM 465 N1 DG A 15 0.239 -0.091 -3.498 1.00 0.00 N ATOM 466 C2 DG A 15 0.478 -0.150 -4.843 1.00 0.00 C ATOM 467 N2 DG A 15 1.122 -1.180 -5.309 1.00 0.00 N ATOM 468 N3 DG A 15 0.056 0.740 -5.738 1.00 0.00 N ATOM 469 C4 DG A 15 -0.722 1.719 -5.188 1.00 0.00 C ATOM 0 H5' DG A 15 -4.899 4.917 -8.462 1.00 0.00 H new ATOM 0 H5'' DG A 15 -4.454 4.433 -6.838 1.00 0.00 H new ATOM 0 H4' DG A 15 -2.719 4.671 -9.266 1.00 0.00 H new ATOM 0 H3' DG A 15 -3.778 2.346 -7.561 1.00 0.00 H new ATOM 0 H2' DG A 15 -1.658 1.176 -7.872 1.00 0.00 H new ATOM 0 H2'' DG A 15 -1.186 2.208 -9.207 1.00 0.00 H new ATOM 0 H1' DG A 15 0.026 3.211 -7.388 1.00 0.00 H new ATOM 0 H8 DG A 15 -2.561 4.362 -5.082 1.00 0.00 H new ATOM 0 H1 DG A 15 0.664 -0.795 -2.894 1.00 0.00 H new ATOM 0 H21 DG A 15 1.315 -1.252 -6.308 1.00 0.00 H new ATOM 0 H22 DG A 15 1.434 -1.916 -4.675 1.00 0.00 H new ATOM 481 P DG A 16 -4.676 1.065 -9.662 1.00 0.00 P ATOM 482 OP1 DG A 16 -5.288 1.168 -11.003 1.00 0.00 O ATOM 483 OP2 DG A 16 -5.572 1.023 -8.487 1.00 0.00 O ATOM 484 O5' DG A 16 -3.700 -0.198 -9.597 1.00 0.00 O ATOM 485 C5' DG A 16 -2.681 -0.418 -10.564 1.00 0.00 C ATOM 486 C4' DG A 16 -1.886 -1.719 -10.341 1.00 0.00 C ATOM 487 O4' DG A 16 -1.263 -1.741 -9.059 1.00 0.00 O ATOM 488 C3' DG A 16 -2.752 -2.981 -10.459 1.00 0.00 C ATOM 489 O3' DG A 16 -2.093 -4.049 -11.144 1.00 0.00 O ATOM 490 C2' DG A 16 -2.992 -3.344 -9.003 1.00 0.00 C ATOM 491 C1' DG A 16 -1.722 -2.857 -8.303 1.00 0.00 C ATOM 492 N9 DG A 16 -2.012 -2.430 -6.915 1.00 0.00 N ATOM 493 C8 DG A 16 -2.672 -1.287 -6.541 1.00 0.00 C ATOM 494 N7 DG A 16 -2.777 -1.119 -5.251 1.00 0.00 N ATOM 495 C5 DG A 16 -2.166 -2.257 -4.719 1.00 0.00 C ATOM 496 C6 DG A 16 -1.960 -2.644 -3.351 1.00 0.00 C ATOM 497 O6 DG A 16 -2.283 -2.044 -2.327 1.00 0.00 O ATOM 498 N1 DG A 16 -1.287 -3.836 -3.203 1.00 0.00 N ATOM 499 C2 DG A 16 -0.901 -4.608 -4.254 1.00 0.00 C ATOM 500 N2 DG A 16 -0.335 -5.747 -3.951 1.00 0.00 N ATOM 501 N3 DG A 16 -1.094 -4.297 -5.544 1.00 0.00 N ATOM 502 C4 DG A 16 -1.715 -3.086 -5.724 1.00 0.00 C ATOM 0 H5' DG A 16 -1.991 0.426 -10.550 1.00 0.00 H new ATOM 0 H5'' DG A 16 -3.133 -0.444 -11.556 1.00 0.00 H new ATOM 0 H4' DG A 16 -1.136 -1.727 -11.132 1.00 0.00 H new ATOM 0 H3' DG A 16 -3.658 -2.810 -11.040 1.00 0.00 H new ATOM 0 H2' DG A 16 -3.882 -2.854 -8.608 1.00 0.00 H new ATOM 0 H2'' DG A 16 -3.136 -4.417 -8.875 1.00 0.00 H new ATOM 0 H1' DG A 16 -0.979 -3.653 -8.249 1.00 0.00 H new ATOM 0 H8 DG A 16 -3.072 -0.583 -7.256 1.00 0.00 H new ATOM 0 H1 DG A 16 -1.067 -4.155 -2.260 1.00 0.00 H new ATOM 0 H21 DG A 16 -0.022 -6.374 -4.692 1.00 0.00 H new ATOM 0 H22 DG A 16 -0.207 -6.009 -2.973 1.00 0.00 H new ATOM 514 P DA A 17 -1.879 -4.015 -12.734 1.00 0.00 P ATOM 515 OP1 DA A 17 -2.968 -3.232 -13.341 1.00 0.00 O ATOM 516 OP2 DA A 17 -1.683 -5.404 -13.195 1.00 0.00 O ATOM 517 O5' DA A 17 -0.528 -3.186 -12.960 1.00 0.00 O ATOM 518 C5' DA A 17 0.730 -3.826 -13.150 1.00 0.00 C ATOM 519 C4' DA A 17 1.907 -2.902 -12.805 1.00 0.00 C ATOM 520 O4' DA A 17 1.879 -1.698 -13.569 1.00 0.00 O ATOM 521 C3' DA A 17 1.898 -2.497 -11.317 1.00 0.00 C ATOM 522 O3' DA A 17 3.106 -2.828 -10.643 1.00 0.00 O ATOM 523 C2' DA A 17 1.809 -0.972 -11.393 1.00 0.00 C ATOM 524 C1' DA A 17 2.456 -0.700 -12.748 1.00 0.00 C ATOM 525 N9 DA A 17 2.267 0.677 -13.279 1.00 0.00 N ATOM 526 C8 DA A 17 1.400 1.669 -12.875 1.00 0.00 C ATOM 527 N7 DA A 17 1.635 2.849 -13.398 1.00 0.00 N ATOM 528 C5 DA A 17 2.742 2.605 -14.232 1.00 0.00 C ATOM 529 C6 DA A 17 3.544 3.389 -15.104 1.00 0.00 C ATOM 530 N6 DA A 17 3.403 4.681 -15.325 1.00 0.00 N ATOM 531 N1 DA A 17 4.538 2.851 -15.819 1.00 0.00 N ATOM 532 C2 DA A 17 4.772 1.554 -15.649 1.00 0.00 C ATOM 533 N3 DA A 17 4.128 0.697 -14.866 1.00 0.00 N ATOM 534 C4 DA A 17 3.110 1.287 -14.181 1.00 0.00 C ATOM 0 H5' DA A 17 0.817 -4.152 -14.186 1.00 0.00 H new ATOM 0 H5'' DA A 17 0.778 -4.721 -12.529 1.00 0.00 H new ATOM 0 H4' DA A 17 2.805 -3.475 -13.037 1.00 0.00 H new ATOM 0 H3' DA A 17 1.098 -3.001 -10.774 1.00 0.00 H new ATOM 0 H2' DA A 17 0.779 -0.618 -11.351 1.00 0.00 H new ATOM 0 H2'' DA A 17 2.346 -0.488 -10.577 1.00 0.00 H new ATOM 0 H1' DA A 17 3.544 -0.748 -12.692 1.00 0.00 H new ATOM 0 H8 DA A 17 0.591 1.489 -12.183 1.00 0.00 H new ATOM 0 H61 DA A 17 4.030 5.159 -15.972 1.00 0.00 H new ATOM 0 H62 DA A 17 2.667 5.202 -14.849 1.00 0.00 H new ATOM 0 H2 DA A 17 5.591 1.145 -16.221 1.00 0.00 H new ATOM 546 P DG A 18 3.569 -4.336 -10.341 1.00 0.00 P ATOM 547 OP1 DG A 18 4.309 -4.887 -11.495 1.00 0.00 O ATOM 548 OP2 DG A 18 2.441 -5.096 -9.756 1.00 0.00 O ATOM 549 O5' DG A 18 4.585 -4.022 -9.167 1.00 0.00 O ATOM 550 C5' DG A 18 5.912 -3.601 -9.436 1.00 0.00 C ATOM 551 C4' DG A 18 6.637 -3.178 -8.157 1.00 0.00 C ATOM 552 O4' DG A 18 6.065 -2.000 -7.605 1.00 0.00 O ATOM 553 C3' DG A 18 6.549 -4.266 -7.081 1.00 0.00 C ATOM 554 O3' DG A 18 7.844 -4.552 -6.577 1.00 0.00 O ATOM 555 C2' DG A 18 5.705 -3.591 -6.005 1.00 0.00 C ATOM 556 C1' DG A 18 6.117 -2.139 -6.195 1.00 0.00 C ATOM 557 N9 DG A 18 5.220 -1.194 -5.494 1.00 0.00 N ATOM 558 C8 DG A 18 4.413 -0.226 -6.040 1.00 0.00 C ATOM 559 N7 DG A 18 3.790 0.525 -5.167 1.00 0.00 N ATOM 560 C5 DG A 18 4.190 -0.019 -3.940 1.00 0.00 C ATOM 561 C6 DG A 18 3.828 0.321 -2.592 1.00 0.00 C ATOM 562 O6 DG A 18 3.049 1.188 -2.201 1.00 0.00 O ATOM 563 N1 DG A 18 4.440 -0.455 -1.627 1.00 0.00 N ATOM 564 C2 DG A 18 5.287 -1.474 -1.918 1.00 0.00 C ATOM 565 N2 DG A 18 5.754 -2.185 -0.927 1.00 0.00 N ATOM 566 N3 DG A 18 5.653 -1.824 -3.149 1.00 0.00 N ATOM 567 C4 DG A 18 5.066 -1.065 -4.128 1.00 0.00 C ATOM 0 H5' DG A 18 5.895 -2.768 -10.138 1.00 0.00 H new ATOM 0 H5'' DG A 18 6.461 -4.411 -9.916 1.00 0.00 H new ATOM 0 H4' DG A 18 7.675 -3.003 -8.440 1.00 0.00 H new ATOM 0 H3' DG A 18 6.135 -5.210 -7.437 1.00 0.00 H new ATOM 0 H2' DG A 18 4.637 -3.742 -6.161 1.00 0.00 H new ATOM 0 H2'' DG A 18 5.936 -3.960 -5.006 1.00 0.00 H new ATOM 0 H1' DG A 18 7.094 -1.906 -5.772 1.00 0.00 H new ATOM 0 H8 DG A 18 4.301 -0.095 -7.106 1.00 0.00 H new ATOM 0 H1 DG A 18 4.245 -0.252 -0.647 1.00 0.00 H new ATOM 0 H21 DG A 18 6.393 -2.958 -1.111 1.00 0.00 H new ATOM 0 H22 DG A 18 5.480 -1.967 0.031 1.00 0.00 H new ATOM 579 P DG A 19 8.376 -6.037 -6.396 1.00 0.00 P ATOM 580 OP1 DG A 19 9.802 -5.930 -6.021 1.00 0.00 O ATOM 581 OP2 DG A 19 8.022 -6.830 -7.599 1.00 0.00 O ATOM 582 O5' DG A 19 7.580 -6.633 -5.143 1.00 0.00 O ATOM 583 C5' DG A 19 6.294 -7.212 -5.324 1.00 0.00 C ATOM 584 C4' DG A 19 5.571 -7.495 -4.010 1.00 0.00 C ATOM 585 O4' DG A 19 5.304 -6.262 -3.340 1.00 0.00 O ATOM 586 C3' DG A 19 4.215 -8.152 -4.321 1.00 0.00 C ATOM 587 O3' DG A 19 3.828 -9.029 -3.281 1.00 0.00 O ATOM 588 C2' DG A 19 3.273 -6.967 -4.277 1.00 0.00 C ATOM 589 C1' DG A 19 3.905 -6.216 -3.109 1.00 0.00 C ATOM 590 N9 DG A 19 3.368 -4.854 -2.942 1.00 0.00 N ATOM 591 C8 DG A 19 2.775 -4.038 -3.878 1.00 0.00 C ATOM 592 N7 DG A 19 2.185 -2.989 -3.377 1.00 0.00 N ATOM 593 C5 DG A 19 2.391 -3.125 -2.006 1.00 0.00 C ATOM 594 C6 DG A 19 1.945 -2.309 -0.918 1.00 0.00 C ATOM 595 O6 DG A 19 1.271 -1.277 -0.977 1.00 0.00 O ATOM 596 N1 DG A 19 2.333 -2.780 0.323 1.00 0.00 N ATOM 597 C2 DG A 19 3.049 -3.926 0.500 1.00 0.00 C ATOM 598 N2 DG A 19 3.228 -4.345 1.723 1.00 0.00 N ATOM 599 N3 DG A 19 3.490 -4.711 -0.483 1.00 0.00 N ATOM 600 C4 DG A 19 3.128 -4.252 -1.725 1.00 0.00 C ATOM 0 H5' DG A 19 6.397 -8.143 -5.882 1.00 0.00 H new ATOM 0 H5'' DG A 19 5.684 -6.543 -5.930 1.00 0.00 H new ATOM 0 H4' DG A 19 6.191 -8.143 -3.391 1.00 0.00 H new ATOM 0 H3' DG A 19 4.229 -8.719 -5.252 1.00 0.00 H new ATOM 0 H2' DG A 19 3.276 -6.390 -5.202 1.00 0.00 H new ATOM 0 H2'' DG A 19 2.240 -7.255 -4.085 1.00 0.00 H new ATOM 0 H1' DG A 19 3.662 -6.684 -2.155 1.00 0.00 H new ATOM 0 H8 DG A 19 2.797 -4.249 -4.937 1.00 0.00 H new ATOM 0 H1 DG A 19 2.070 -2.242 1.149 1.00 0.00 H new ATOM 0 H21 DG A 19 3.758 -5.199 1.897 1.00 0.00 H new ATOM 0 H22 DG A 19 2.838 -3.819 2.505 1.00 0.00 H new ATOM 612 P DG A 20 4.143 -10.576 -3.332 1.00 0.00 P ATOM 613 OP1 DG A 20 5.593 -10.785 -3.563 1.00 0.00 O ATOM 614 OP2 DG A 20 3.170 -11.200 -4.242 1.00 0.00 O ATOM 615 O5' DG A 20 3.761 -10.999 -1.841 1.00 0.00 O ATOM 616 C5' DG A 20 4.641 -10.737 -0.755 1.00 0.00 C ATOM 617 C4' DG A 20 3.962 -10.648 0.621 1.00 0.00 C ATOM 618 O4' DG A 20 3.499 -9.316 0.834 1.00 0.00 O ATOM 619 C3' DG A 20 2.766 -11.590 0.805 1.00 0.00 C ATOM 620 O3' DG A 20 2.705 -12.062 2.152 1.00 0.00 O ATOM 621 C2' DG A 20 1.601 -10.667 0.438 1.00 0.00 C ATOM 622 C1' DG A 20 2.088 -9.323 0.976 1.00 0.00 C ATOM 623 N9 DG A 20 1.512 -8.136 0.294 1.00 0.00 N ATOM 624 C8 DG A 20 1.445 -7.835 -1.049 1.00 0.00 C ATOM 625 N7 DG A 20 0.870 -6.691 -1.325 1.00 0.00 N ATOM 626 C5 DG A 20 0.519 -6.191 -0.059 1.00 0.00 C ATOM 627 C6 DG A 20 -0.159 -4.983 0.346 1.00 0.00 C ATOM 628 O6 DG A 20 -0.582 -4.060 -0.351 1.00 0.00 O ATOM 629 N1 DG A 20 -0.349 -4.877 1.715 1.00 0.00 N ATOM 630 C2 DG A 20 0.090 -5.808 2.604 1.00 0.00 C ATOM 631 N2 DG A 20 -0.177 -5.630 3.866 1.00 0.00 N ATOM 632 N3 DG A 20 0.720 -6.934 2.276 1.00 0.00 N ATOM 633 C4 DG A 20 0.909 -7.072 0.929 1.00 0.00 C ATOM 0 H5' DG A 20 5.163 -9.800 -0.948 1.00 0.00 H new ATOM 0 H5'' DG A 20 5.397 -11.522 -0.721 1.00 0.00 H new ATOM 0 H4' DG A 20 4.724 -10.949 1.340 1.00 0.00 H new ATOM 0 H3' DG A 20 2.790 -12.500 0.206 1.00 0.00 H new ATOM 0 H2' DG A 20 1.425 -10.638 -0.637 1.00 0.00 H new ATOM 0 H2'' DG A 20 0.668 -10.981 0.905 1.00 0.00 H new ATOM 0 H1' DG A 20 1.760 -9.237 2.012 1.00 0.00 H new ATOM 0 H8 DG A 20 1.836 -8.490 -1.813 1.00 0.00 H new ATOM 0 H1 DG A 20 -0.843 -4.060 2.074 1.00 0.00 H new ATOM 0 H21 DG A 20 0.140 -6.312 4.555 1.00 0.00 H new ATOM 0 H22 DG A 20 -0.703 -4.809 4.165 1.00 0.00 H new ATOM 645 P DT A 21 1.766 -13.292 2.571 1.00 0.00 P ATOM 646 OP1 DT A 21 2.272 -13.833 3.854 1.00 0.00 O ATOM 647 OP2 DT A 21 1.671 -14.214 1.418 1.00 0.00 O ATOM 648 O5' DT A 21 0.332 -12.610 2.772 1.00 0.00 O ATOM 649 C5' DT A 21 -0.019 -11.977 3.999 1.00 0.00 C ATOM 650 C4' DT A 21 -1.247 -11.052 3.913 1.00 0.00 C ATOM 651 O4' DT A 21 -0.992 -9.810 3.260 1.00 0.00 O ATOM 652 C3' DT A 21 -2.439 -11.594 3.122 1.00 0.00 C ATOM 653 O3' DT A 21 -3.162 -12.660 3.715 1.00 0.00 O ATOM 654 C2' DT A 21 -3.295 -10.339 3.034 1.00 0.00 C ATOM 655 C1' DT A 21 -2.268 -9.194 3.072 1.00 0.00 C ATOM 656 N1 DT A 21 -2.348 -8.371 1.828 1.00 0.00 N ATOM 657 C2 DT A 21 -3.069 -7.166 1.880 1.00 0.00 C ATOM 658 O2 DT A 21 -3.575 -6.717 2.907 1.00 0.00 O ATOM 659 N3 DT A 21 -3.228 -6.474 0.701 1.00 0.00 N ATOM 660 C4 DT A 21 -2.786 -6.892 -0.533 1.00 0.00 C ATOM 661 O4 DT A 21 -2.955 -6.156 -1.500 1.00 0.00 O ATOM 662 C5 DT A 21 -2.122 -8.194 -0.539 1.00 0.00 C ATOM 663 C7 DT A 21 -1.649 -8.799 -1.847 1.00 0.00 C ATOM 664 C6 DT A 21 -1.901 -8.870 0.620 1.00 0.00 C ATOM 0 H5' DT A 21 0.834 -11.396 4.350 1.00 0.00 H new ATOM 0 H5'' DT A 21 -0.211 -12.746 4.748 1.00 0.00 H new ATOM 0 H4' DT A 21 -1.475 -10.955 4.975 1.00 0.00 H new ATOM 0 H3' DT A 21 -2.125 -12.051 2.183 1.00 0.00 H new ATOM 0 H2' DT A 21 -3.883 -10.319 2.117 1.00 0.00 H new ATOM 0 H2'' DT A 21 -3.998 -10.274 3.865 1.00 0.00 H new ATOM 0 HO3' DT A 21 -3.899 -12.923 3.125 1.00 0.00 H new ATOM 0 H1' DT A 21 -2.460 -8.495 3.886 1.00 0.00 H new ATOM 0 H3 DT A 21 -3.713 -5.578 0.746 1.00 0.00 H new ATOM 0 H71 DT A 21 -0.774 -9.423 -1.664 1.00 0.00 H new ATOM 0 H72 DT A 21 -2.445 -9.408 -2.275 1.00 0.00 H new ATOM 0 H73 DT A 21 -1.387 -8.002 -2.543 1.00 0.00 H new ATOM 0 H6 DT A 21 -1.369 -9.810 0.596 1.00 0.00 H new TER 678 DT A 21 HETATM 679 K K A 22 1.498 1.333 -0.041 1.00 0.00 K HETATM 680 K K A 23 -1.273 -1.362 0.015 1.00 0.00 K