USER MOD reduce.3.24.130724 H: found=0, std=0, add=248, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 248 hydrogens (25 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 DG O5' : rot 41:sc= 1.34 USER MOD Single : A 20 DT C7 :methyl -30:sc= -4.62! (180deg=-8.87!) USER MOD Single : A 20 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -7.952 -2.127 -5.901 1.00 0.00 O ATOM 2 C5' DG A 1 -8.604 -3.299 -6.393 1.00 0.00 C ATOM 3 C4' DG A 1 -7.644 -4.483 -6.443 1.00 0.00 C ATOM 4 O4' DG A 1 -6.542 -4.210 -7.306 1.00 0.00 O ATOM 5 C3' DG A 1 -7.053 -4.854 -5.095 1.00 0.00 C ATOM 6 O3' DG A 1 -7.924 -5.795 -4.437 1.00 0.00 O ATOM 7 C2' DG A 1 -5.698 -5.470 -5.441 1.00 0.00 C ATOM 8 C1' DG A 1 -5.425 -4.994 -6.871 1.00 0.00 C ATOM 9 N9 DG A 1 -4.208 -4.168 -7.005 1.00 0.00 N ATOM 10 C8 DG A 1 -2.929 -4.555 -7.300 1.00 0.00 C ATOM 11 N7 DG A 1 -2.035 -3.609 -7.240 1.00 0.00 N ATOM 12 C5 DG A 1 -2.788 -2.488 -6.878 1.00 0.00 C ATOM 13 C6 DG A 1 -2.377 -1.143 -6.658 1.00 0.00 C ATOM 14 O6 DG A 1 -1.248 -0.667 -6.733 1.00 0.00 O ATOM 15 N1 DG A 1 -3.452 -0.333 -6.311 1.00 0.00 N ATOM 16 C2 DG A 1 -4.760 -0.760 -6.192 1.00 0.00 C ATOM 17 N2 DG A 1 -5.658 0.163 -5.856 1.00 0.00 N ATOM 18 N3 DG A 1 -5.146 -2.020 -6.397 1.00 0.00 N ATOM 19 C4 DG A 1 -4.116 -2.826 -6.734 1.00 0.00 C ATOM 0 H5' DG A 1 -9.001 -3.107 -7.390 1.00 0.00 H new ATOM 0 H5'' DG A 1 -9.453 -3.542 -5.754 1.00 0.00 H new ATOM 0 H4' DG A 1 -8.254 -5.311 -6.804 1.00 0.00 H new ATOM 0 H3' DG A 1 -6.942 -4.012 -4.412 1.00 0.00 H new ATOM 0 H2' DG A 1 -4.921 -5.135 -4.754 1.00 0.00 H new ATOM 0 H2'' DG A 1 -5.728 -6.558 -5.382 1.00 0.00 H new ATOM 0 HO5' DG A 1 -7.051 -2.069 -6.283 1.00 0.00 H new ATOM 0 H1' DG A 1 -5.274 -5.888 -7.477 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.678 -5.572 -7.564 1.00 0.00 H new ATOM 0 H1 DG A 1 -3.260 0.652 -6.130 1.00 0.00 H new ATOM 0 H21 DG A 1 -6.640 -0.094 -5.753 1.00 0.00 H new ATOM 0 H22 DG A 1 -5.364 1.127 -5.701 1.00 0.00 H new ATOM 32 P DG A 2 -7.942 -5.919 -2.827 1.00 0.00 P ATOM 33 OP1 DG A 2 -9.062 -6.804 -2.440 1.00 0.00 O ATOM 34 OP2 DG A 2 -7.830 -4.560 -2.251 1.00 0.00 O ATOM 35 O5' DG A 2 -6.567 -6.701 -2.570 1.00 0.00 O ATOM 36 C5' DG A 2 -6.404 -8.025 -3.084 1.00 0.00 C ATOM 37 C4' DG A 2 -4.956 -8.476 -2.995 1.00 0.00 C ATOM 38 O4' DG A 2 -4.142 -7.600 -3.766 1.00 0.00 O ATOM 39 C3' DG A 2 -4.342 -8.539 -1.607 1.00 0.00 C ATOM 40 O3' DG A 2 -4.594 -9.854 -1.063 1.00 0.00 O ATOM 41 C2' DG A 2 -2.870 -8.267 -1.862 1.00 0.00 C ATOM 42 C1' DG A 2 -2.882 -7.400 -3.117 1.00 0.00 C ATOM 43 N9 DG A 2 -2.786 -5.964 -2.825 1.00 0.00 N ATOM 44 C8 DG A 2 -3.784 -5.109 -2.482 1.00 0.00 C ATOM 45 N7 DG A 2 -3.416 -3.899 -2.237 1.00 0.00 N ATOM 46 C5 DG A 2 -2.050 -3.935 -2.424 1.00 0.00 C ATOM 47 C6 DG A 2 -1.109 -2.894 -2.297 1.00 0.00 C ATOM 48 O6 DG A 2 -1.316 -1.720 -1.983 1.00 0.00 O ATOM 49 N1 DG A 2 0.174 -3.339 -2.578 1.00 0.00 N ATOM 50 C2 DG A 2 0.508 -4.628 -2.935 1.00 0.00 C ATOM 51 N2 DG A 2 1.803 -4.858 -3.168 1.00 0.00 N ATOM 52 N3 DG A 2 -0.383 -5.619 -3.054 1.00 0.00 N ATOM 53 C4 DG A 2 -1.642 -5.199 -2.785 1.00 0.00 C ATOM 0 H5' DG A 2 -6.734 -8.058 -4.122 1.00 0.00 H new ATOM 0 H5'' DG A 2 -7.037 -8.715 -2.526 1.00 0.00 H new ATOM 0 H4' DG A 2 -4.983 -9.501 -3.364 1.00 0.00 H new ATOM 0 H3' DG A 2 -4.744 -7.831 -0.882 1.00 0.00 H new ATOM 0 H2' DG A 2 -2.405 -7.751 -1.022 1.00 0.00 H new ATOM 0 H2'' DG A 2 -2.312 -9.190 -2.017 1.00 0.00 H new ATOM 0 H1' DG A 2 -2.022 -7.687 -3.722 1.00 0.00 H new ATOM 0 H8 DG A 2 -4.816 -5.422 -2.419 1.00 0.00 H new ATOM 0 H1 DG A 2 0.931 -2.658 -2.516 1.00 0.00 H new ATOM 0 H21 DG A 2 2.115 -5.791 -3.436 1.00 0.00 H new ATOM 0 H22 DG A 2 2.480 -4.100 -3.078 1.00 0.00 H new ATOM 65 P DG A 3 -4.395 -10.242 0.500 1.00 0.00 P ATOM 66 OP1 DG A 3 -5.012 -11.567 0.733 1.00 0.00 O ATOM 67 OP2 DG A 3 -4.783 -9.078 1.327 1.00 0.00 O ATOM 68 O5' DG A 3 -2.792 -10.406 0.546 1.00 0.00 O ATOM 69 C5' DG A 3 -2.211 -11.360 -0.350 1.00 0.00 C ATOM 70 C4' DG A 3 -0.681 -11.296 -0.422 1.00 0.00 C ATOM 71 O4' DG A 3 -0.314 -9.934 -0.691 1.00 0.00 O ATOM 72 C3' DG A 3 0.141 -11.702 0.804 1.00 0.00 C ATOM 73 O3' DG A 3 1.311 -12.308 0.254 1.00 0.00 O ATOM 74 C2' DG A 3 0.526 -10.409 1.490 1.00 0.00 C ATOM 75 C1' DG A 3 0.547 -9.418 0.350 1.00 0.00 C ATOM 76 N9 DG A 3 0.066 -8.079 0.719 1.00 0.00 N ATOM 77 C8 DG A 3 -1.191 -7.680 1.065 1.00 0.00 C ATOM 78 N7 DG A 3 -1.304 -6.427 1.389 1.00 0.00 N ATOM 79 C5 DG A 3 -0.003 -5.949 1.255 1.00 0.00 C ATOM 80 C6 DG A 3 0.507 -4.646 1.475 1.00 0.00 C ATOM 81 O6 DG A 3 -0.096 -3.643 1.839 1.00 0.00 O ATOM 82 N1 DG A 3 1.866 -4.582 1.228 1.00 0.00 N ATOM 83 C2 DG A 3 2.655 -5.634 0.822 1.00 0.00 C ATOM 84 N2 DG A 3 3.954 -5.361 0.648 1.00 0.00 N ATOM 85 N3 DG A 3 2.182 -6.870 0.608 1.00 0.00 N ATOM 86 C4 DG A 3 0.845 -6.952 0.848 1.00 0.00 C ATOM 0 H5' DG A 3 -2.619 -11.201 -1.348 1.00 0.00 H new ATOM 0 H5'' DG A 3 -2.508 -12.362 -0.041 1.00 0.00 H new ATOM 0 H4' DG A 3 -0.444 -12.037 -1.185 1.00 0.00 H new ATOM 0 H3' DG A 3 -0.371 -12.364 1.502 1.00 0.00 H new ATOM 0 H2' DG A 3 -0.196 -10.128 2.257 1.00 0.00 H new ATOM 0 H2'' DG A 3 1.498 -10.484 1.978 1.00 0.00 H new ATOM 0 H1' DG A 3 1.584 -9.305 0.034 1.00 0.00 H new ATOM 0 H8 DG A 3 -2.032 -8.357 1.069 1.00 0.00 H new ATOM 0 H1 DG A 3 2.322 -3.679 1.358 1.00 0.00 H new ATOM 0 H21 DG A 3 4.594 -6.096 0.348 1.00 0.00 H new ATOM 0 H22 DG A 3 4.304 -4.418 0.816 1.00 0.00 H new ATOM 98 P DG A 4 1.537 -13.894 0.138 1.00 0.00 P ATOM 99 OP1 DG A 4 0.280 -14.517 -0.328 1.00 0.00 O ATOM 100 OP2 DG A 4 2.201 -14.372 1.371 1.00 0.00 O ATOM 101 O5' DG A 4 2.602 -13.918 -1.073 1.00 0.00 O ATOM 102 C5' DG A 4 2.123 -13.481 -2.356 1.00 0.00 C ATOM 103 C4' DG A 4 3.199 -13.290 -3.421 1.00 0.00 C ATOM 104 O4' DG A 4 4.003 -12.169 -3.083 1.00 0.00 O ATOM 105 C3' DG A 4 4.125 -14.474 -3.638 1.00 0.00 C ATOM 106 O3' DG A 4 4.409 -14.570 -5.044 1.00 0.00 O ATOM 107 C2' DG A 4 5.400 -14.107 -2.871 1.00 0.00 C ATOM 108 C1' DG A 4 5.242 -12.612 -2.542 1.00 0.00 C ATOM 109 N9 DG A 4 5.221 -12.270 -1.099 1.00 0.00 N ATOM 110 C8 DG A 4 4.824 -13.021 -0.023 1.00 0.00 C ATOM 111 N7 DG A 4 4.917 -12.430 1.128 1.00 0.00 N ATOM 112 C5 DG A 4 5.412 -11.172 0.805 1.00 0.00 C ATOM 113 C6 DG A 4 5.714 -10.075 1.652 1.00 0.00 C ATOM 114 O6 DG A 4 5.601 -10.002 2.873 1.00 0.00 O ATOM 115 N1 DG A 4 6.186 -8.988 0.929 1.00 0.00 N ATOM 116 C2 DG A 4 6.347 -8.957 -0.442 1.00 0.00 C ATOM 117 N2 DG A 4 6.807 -7.817 -0.956 1.00 0.00 N ATOM 118 N3 DG A 4 6.066 -9.992 -1.244 1.00 0.00 N ATOM 119 C4 DG A 4 5.603 -11.062 -0.555 1.00 0.00 C ATOM 0 H5' DG A 4 1.592 -12.538 -2.226 1.00 0.00 H new ATOM 0 H5'' DG A 4 1.397 -14.208 -2.722 1.00 0.00 H new ATOM 0 H4' DG A 4 2.647 -13.155 -4.351 1.00 0.00 H new ATOM 0 H3' DG A 4 3.706 -15.424 -3.304 1.00 0.00 H new ATOM 0 H2' DG A 4 5.502 -14.703 -1.964 1.00 0.00 H new ATOM 0 H2'' DG A 4 6.290 -14.288 -3.473 1.00 0.00 H new ATOM 0 H1' DG A 4 6.122 -12.129 -2.968 1.00 0.00 H new ATOM 0 H8 DG A 4 4.460 -14.032 -0.126 1.00 0.00 H new ATOM 0 H1 DG A 4 6.433 -8.147 1.451 1.00 0.00 H new ATOM 0 H21 DG A 4 6.947 -7.731 -1.963 1.00 0.00 H new ATOM 0 H22 DG A 4 7.019 -7.030 -0.343 1.00 0.00 H new ATOM 131 P DC A 5 3.524 -15.555 -5.977 1.00 0.00 P ATOM 132 OP1 DC A 5 3.207 -16.770 -5.194 1.00 0.00 O ATOM 133 OP2 DC A 5 4.198 -15.678 -7.289 1.00 0.00 O ATOM 134 O5' DC A 5 2.156 -14.730 -6.195 1.00 0.00 O ATOM 135 C5' DC A 5 2.068 -13.601 -7.073 1.00 0.00 C ATOM 136 C4' DC A 5 0.765 -12.851 -6.844 1.00 0.00 C ATOM 137 O4' DC A 5 0.758 -12.318 -5.526 1.00 0.00 O ATOM 138 C3' DC A 5 0.545 -11.693 -7.800 1.00 0.00 C ATOM 139 O3' DC A 5 -0.308 -12.062 -8.883 1.00 0.00 O ATOM 140 C2' DC A 5 -0.168 -10.637 -6.963 1.00 0.00 C ATOM 141 C1' DC A 5 0.027 -11.094 -5.523 1.00 0.00 C ATOM 142 N1 DC A 5 0.763 -10.132 -4.678 1.00 0.00 N ATOM 143 C2 DC A 5 1.998 -9.686 -5.122 1.00 0.00 C ATOM 144 O2 DC A 5 2.469 -10.121 -6.171 1.00 0.00 O ATOM 145 N3 DC A 5 2.667 -8.769 -4.361 1.00 0.00 N ATOM 146 C4 DC A 5 2.138 -8.310 -3.214 1.00 0.00 C ATOM 147 N4 DC A 5 2.813 -7.420 -2.477 1.00 0.00 N ATOM 148 C5 DC A 5 0.863 -8.765 -2.767 1.00 0.00 C ATOM 149 C6 DC A 5 0.219 -9.673 -3.521 1.00 0.00 C ATOM 0 H5' DC A 5 2.126 -13.933 -8.110 1.00 0.00 H new ATOM 0 H5'' DC A 5 2.913 -12.934 -6.904 1.00 0.00 H new ATOM 0 H4' DC A 5 -0.031 -13.577 -7.009 1.00 0.00 H new ATOM 0 H3' DC A 5 1.488 -11.356 -8.230 1.00 0.00 H new ATOM 0 H2' DC A 5 0.258 -9.647 -7.126 1.00 0.00 H new ATOM 0 H2'' DC A 5 -1.226 -10.575 -7.220 1.00 0.00 H new ATOM 0 H1' DC A 5 -0.972 -11.199 -5.099 1.00 0.00 H new ATOM 0 H41 DC A 5 2.413 -7.071 -1.606 1.00 0.00 H new ATOM 0 H42 DC A 5 3.728 -7.091 -2.786 1.00 0.00 H new ATOM 0 H5 DC A 5 0.428 -8.392 -1.851 1.00 0.00 H new ATOM 0 H6 DC A 5 -0.744 -10.043 -3.202 1.00 0.00 H new ATOM 161 P DG A 6 0.222 -12.000 -10.396 1.00 0.00 P ATOM 162 OP1 DG A 6 -0.927 -12.209 -11.306 1.00 0.00 O ATOM 163 OP2 DG A 6 1.424 -12.856 -10.507 1.00 0.00 O ATOM 164 O5' DG A 6 0.678 -10.461 -10.499 1.00 0.00 O ATOM 165 C5' DG A 6 -0.222 -9.388 -10.233 1.00 0.00 C ATOM 166 C4' DG A 6 0.510 -8.051 -10.361 1.00 0.00 C ATOM 167 O4' DG A 6 0.328 -7.540 -11.688 1.00 0.00 O ATOM 168 C3' DG A 6 0.063 -6.956 -9.402 1.00 0.00 C ATOM 169 O3' DG A 6 1.242 -6.321 -8.935 1.00 0.00 O ATOM 170 C2' DG A 6 -0.749 -5.974 -10.229 1.00 0.00 C ATOM 171 C1' DG A 6 -0.337 -6.260 -11.664 1.00 0.00 C ATOM 172 N9 DG A 6 -1.485 -6.347 -12.582 1.00 0.00 N ATOM 173 C8 DG A 6 -2.320 -7.399 -12.773 1.00 0.00 C ATOM 174 N7 DG A 6 -3.291 -7.198 -13.610 1.00 0.00 N ATOM 175 C5 DG A 6 -3.091 -5.882 -14.016 1.00 0.00 C ATOM 176 C6 DG A 6 -3.840 -5.093 -14.930 1.00 0.00 C ATOM 177 O6 DG A 6 -4.840 -5.411 -15.570 1.00 0.00 O ATOM 178 N1 DG A 6 -3.307 -3.819 -15.059 1.00 0.00 N ATOM 179 C2 DG A 6 -2.191 -3.355 -14.393 1.00 0.00 C ATOM 180 N2 DG A 6 -1.837 -2.095 -14.654 1.00 0.00 N ATOM 181 N3 DG A 6 -1.480 -4.094 -13.529 1.00 0.00 N ATOM 182 C4 DG A 6 -1.987 -5.345 -13.389 1.00 0.00 C ATOM 0 H5' DG A 6 -0.638 -9.490 -9.231 1.00 0.00 H new ATOM 0 H5'' DG A 6 -1.059 -9.423 -10.930 1.00 0.00 H new ATOM 0 H4' DG A 6 1.546 -8.283 -10.116 1.00 0.00 H new ATOM 0 H3' DG A 6 -0.524 -7.329 -8.562 1.00 0.00 H new ATOM 0 H2' DG A 6 -1.819 -6.123 -10.085 1.00 0.00 H new ATOM 0 H2'' DG A 6 -0.530 -4.943 -9.950 1.00 0.00 H new ATOM 0 H1' DG A 6 0.301 -5.440 -11.993 1.00 0.00 H new ATOM 0 H8 DG A 6 -2.186 -8.341 -12.262 1.00 0.00 H new ATOM 0 H1 DG A 6 -3.776 -3.175 -15.696 1.00 0.00 H new ATOM 0 H21 DG A 6 -1.021 -1.689 -14.196 1.00 0.00 H new ATOM 0 H22 DG A 6 -2.382 -1.538 -15.312 1.00 0.00 H new ATOM 194 P DG A 7 1.838 -6.720 -7.499 1.00 0.00 P ATOM 195 OP1 DG A 7 2.004 -8.187 -7.463 1.00 0.00 O ATOM 196 OP2 DG A 7 1.042 -6.037 -6.456 1.00 0.00 O ATOM 197 O5' DG A 7 3.295 -6.065 -7.535 1.00 0.00 O ATOM 198 C5' DG A 7 4.286 -6.596 -8.420 1.00 0.00 C ATOM 199 C4' DG A 7 5.536 -5.752 -8.390 1.00 0.00 C ATOM 200 O4' DG A 7 5.288 -4.460 -8.911 1.00 0.00 O ATOM 201 C3' DG A 7 6.052 -5.578 -6.986 1.00 0.00 C ATOM 202 O3' DG A 7 6.903 -6.677 -6.628 1.00 0.00 O ATOM 203 C2' DG A 7 6.827 -4.269 -7.075 1.00 0.00 C ATOM 204 C1' DG A 7 6.153 -3.538 -8.249 1.00 0.00 C ATOM 205 N9 DG A 7 5.329 -2.380 -7.865 1.00 0.00 N ATOM 206 C8 DG A 7 5.726 -1.114 -7.569 1.00 0.00 C ATOM 207 N7 DG A 7 4.769 -0.288 -7.267 1.00 0.00 N ATOM 208 C5 DG A 7 3.625 -1.076 -7.369 1.00 0.00 C ATOM 209 C6 DG A 7 2.262 -0.734 -7.154 1.00 0.00 C ATOM 210 O6 DG A 7 1.792 0.355 -6.822 1.00 0.00 O ATOM 211 N1 DG A 7 1.424 -1.822 -7.368 1.00 0.00 N ATOM 212 C2 DG A 7 1.837 -3.077 -7.744 1.00 0.00 C ATOM 213 N2 DG A 7 0.868 -3.976 -7.925 1.00 0.00 N ATOM 214 N3 DG A 7 3.120 -3.409 -7.939 1.00 0.00 N ATOM 215 C4 DG A 7 3.956 -2.361 -7.735 1.00 0.00 C ATOM 0 H5' DG A 7 3.891 -6.634 -9.435 1.00 0.00 H new ATOM 0 H5'' DG A 7 4.526 -7.620 -8.133 1.00 0.00 H new ATOM 0 H4' DG A 7 6.274 -6.276 -8.998 1.00 0.00 H new ATOM 0 H3' DG A 7 5.272 -5.555 -6.224 1.00 0.00 H new ATOM 0 H2' DG A 7 6.756 -3.696 -6.150 1.00 0.00 H new ATOM 0 H2'' DG A 7 7.887 -4.441 -7.263 1.00 0.00 H new ATOM 0 H1' DG A 7 6.965 -3.165 -8.874 1.00 0.00 H new ATOM 0 H8 DG A 7 6.764 -0.815 -7.584 1.00 0.00 H new ATOM 0 H1 DG A 7 0.423 -1.677 -7.235 1.00 0.00 H new ATOM 0 H21 DG A 7 1.102 -4.929 -8.205 1.00 0.00 H new ATOM 0 H22 DG A 7 -0.107 -3.711 -7.784 1.00 0.00 H new ATOM 227 P DG A 8 6.824 -7.255 -5.124 1.00 0.00 P ATOM 228 OP1 DG A 8 7.771 -8.386 -5.006 1.00 0.00 O ATOM 229 OP2 DG A 8 5.398 -7.437 -4.769 1.00 0.00 O ATOM 230 O5' DG A 8 7.403 -6.027 -4.285 1.00 0.00 O ATOM 231 C5' DG A 8 8.750 -5.612 -4.461 1.00 0.00 C ATOM 232 C4' DG A 8 8.991 -4.285 -3.775 1.00 0.00 C ATOM 233 O4' DG A 8 8.129 -3.303 -4.354 1.00 0.00 O ATOM 234 C3' DG A 8 8.720 -4.238 -2.284 1.00 0.00 C ATOM 235 O3' DG A 8 9.880 -4.679 -1.555 1.00 0.00 O ATOM 236 C2' DG A 8 8.437 -2.759 -2.057 1.00 0.00 C ATOM 237 C1' DG A 8 7.767 -2.333 -3.357 1.00 0.00 C ATOM 238 N9 DG A 8 6.296 -2.298 -3.264 1.00 0.00 N ATOM 239 C8 DG A 8 5.409 -3.329 -3.375 1.00 0.00 C ATOM 240 N7 DG A 8 4.167 -3.017 -3.168 1.00 0.00 N ATOM 241 C5 DG A 8 4.224 -1.654 -2.891 1.00 0.00 C ATOM 242 C6 DG A 8 3.177 -0.748 -2.591 1.00 0.00 C ATOM 243 O6 DG A 8 1.978 -0.971 -2.506 1.00 0.00 O ATOM 244 N1 DG A 8 3.648 0.531 -2.387 1.00 0.00 N ATOM 245 C2 DG A 8 4.971 0.912 -2.452 1.00 0.00 C ATOM 246 N2 DG A 8 5.224 2.203 -2.214 1.00 0.00 N ATOM 247 N3 DG A 8 5.971 0.063 -2.735 1.00 0.00 N ATOM 248 C4 DG A 8 5.523 -1.202 -2.944 1.00 0.00 C ATOM 0 H5' DG A 8 8.973 -5.524 -5.524 1.00 0.00 H new ATOM 0 H5'' DG A 8 9.425 -6.366 -4.055 1.00 0.00 H new ATOM 0 H4' DG A 8 10.057 -4.105 -3.916 1.00 0.00 H new ATOM 0 H3' DG A 8 7.907 -4.883 -1.950 1.00 0.00 H new ATOM 0 H2' DG A 8 7.786 -2.600 -1.197 1.00 0.00 H new ATOM 0 H2'' DG A 8 9.352 -2.197 -1.872 1.00 0.00 H new ATOM 0 H1' DG A 8 8.099 -1.323 -3.599 1.00 0.00 H new ATOM 0 H8 DG A 8 5.719 -4.334 -3.618 1.00 0.00 H new ATOM 0 H1 DG A 8 2.962 1.254 -2.170 1.00 0.00 H new ATOM 0 H21 DG A 8 6.183 2.549 -2.247 1.00 0.00 H new ATOM 0 H22 DG A 8 4.458 2.842 -2.000 1.00 0.00 H new ATOM 260 P DG A 9 9.796 -5.075 0.016 1.00 0.00 P ATOM 261 OP1 DG A 9 11.066 -5.718 0.419 1.00 0.00 O ATOM 262 OP2 DG A 9 8.501 -5.742 0.274 1.00 0.00 O ATOM 263 O5' DG A 9 9.747 -3.594 0.626 1.00 0.00 O ATOM 264 C5' DG A 9 10.771 -2.707 0.190 1.00 0.00 C ATOM 265 C4' DG A 9 10.344 -1.244 0.235 1.00 0.00 C ATOM 266 O4' DG A 9 8.923 -1.143 0.012 1.00 0.00 O ATOM 267 C3' DG A 9 10.583 -0.495 1.542 1.00 0.00 C ATOM 268 O3' DG A 9 10.625 0.918 1.237 1.00 0.00 O ATOM 269 C2' DG A 9 9.303 -0.779 2.306 1.00 0.00 C ATOM 270 C1' DG A 9 8.305 -0.594 1.186 1.00 0.00 C ATOM 271 N9 DG A 9 6.982 -1.233 1.377 1.00 0.00 N ATOM 272 C8 DG A 9 6.590 -2.528 1.162 1.00 0.00 C ATOM 273 N7 DG A 9 5.310 -2.751 1.306 1.00 0.00 N ATOM 274 C5 DG A 9 4.809 -1.492 1.651 1.00 0.00 C ATOM 275 C6 DG A 9 3.473 -1.081 1.935 1.00 0.00 C ATOM 276 O6 DG A 9 2.449 -1.756 1.937 1.00 0.00 O ATOM 277 N1 DG A 9 3.405 0.272 2.237 1.00 0.00 N ATOM 278 C2 DG A 9 4.480 1.131 2.268 1.00 0.00 C ATOM 279 N2 DG A 9 4.217 2.400 2.585 1.00 0.00 N ATOM 280 N3 DG A 9 5.734 0.752 2.001 1.00 0.00 N ATOM 281 C4 DG A 9 5.824 -0.565 1.701 1.00 0.00 C ATOM 0 H5' DG A 9 11.060 -2.965 -0.829 1.00 0.00 H new ATOM 0 H5'' DG A 9 11.653 -2.843 0.815 1.00 0.00 H new ATOM 0 H4' DG A 9 10.970 -0.789 -0.533 1.00 0.00 H new ATOM 0 H3' DG A 9 11.494 -0.775 2.071 1.00 0.00 H new ATOM 0 H2' DG A 9 9.280 -1.784 2.727 1.00 0.00 H new ATOM 0 H2'' DG A 9 9.143 -0.084 3.130 1.00 0.00 H new ATOM 0 H1' DG A 9 8.080 0.471 1.127 1.00 0.00 H new ATOM 0 H8 DG A 9 7.287 -3.308 0.893 1.00 0.00 H new ATOM 0 H1 DG A 9 2.487 0.660 2.453 1.00 0.00 H new ATOM 0 H21 DG A 9 4.973 3.083 2.624 1.00 0.00 H new ATOM 0 H22 DG A 9 3.260 2.687 2.788 1.00 0.00 H new ATOM 293 P DC A 10 11.620 1.543 0.120 1.00 0.00 P ATOM 294 OP1 DC A 10 12.396 0.431 -0.470 1.00 0.00 O ATOM 295 OP2 DC A 10 12.324 2.700 0.714 1.00 0.00 O ATOM 296 O5' DC A 10 10.576 2.098 -1.010 1.00 0.00 O ATOM 297 C5' DC A 10 9.674 1.215 -1.707 1.00 0.00 C ATOM 298 C4' DC A 10 8.599 1.949 -2.515 1.00 0.00 C ATOM 299 O4' DC A 10 7.763 2.656 -1.600 1.00 0.00 O ATOM 300 C3' DC A 10 9.076 2.960 -3.553 1.00 0.00 C ATOM 301 O3' DC A 10 8.206 2.888 -4.698 1.00 0.00 O ATOM 302 C2' DC A 10 8.941 4.313 -2.887 1.00 0.00 C ATOM 303 C1' DC A 10 7.995 4.062 -1.714 1.00 0.00 C ATOM 304 N1 DC A 10 8.500 4.558 -0.413 1.00 0.00 N ATOM 305 C2 DC A 10 7.611 5.268 0.375 1.00 0.00 C ATOM 306 O2 DC A 10 6.456 5.444 -0.008 1.00 0.00 O ATOM 307 N3 DC A 10 8.051 5.757 1.566 1.00 0.00 N ATOM 308 C4 DC A 10 9.313 5.560 1.968 1.00 0.00 C ATOM 309 N4 DC A 10 9.713 6.061 3.134 1.00 0.00 N ATOM 310 C5 DC A 10 10.234 4.825 1.163 1.00 0.00 C ATOM 311 C6 DC A 10 9.790 4.342 -0.010 1.00 0.00 C ATOM 0 H5' DC A 10 9.189 0.560 -0.983 1.00 0.00 H new ATOM 0 H5'' DC A 10 10.249 0.578 -2.378 1.00 0.00 H new ATOM 0 H4' DC A 10 8.102 1.161 -3.081 1.00 0.00 H new ATOM 0 H3' DC A 10 10.098 2.776 -3.883 1.00 0.00 H new ATOM 0 H2' DC A 10 9.907 4.687 -2.547 1.00 0.00 H new ATOM 0 H2'' DC A 10 8.535 5.056 -3.574 1.00 0.00 H new ATOM 0 H1' DC A 10 7.082 4.616 -1.932 1.00 0.00 H new ATOM 0 H41 DC A 10 10.672 5.916 3.449 1.00 0.00 H new ATOM 0 H42 DC A 10 9.060 6.590 3.713 1.00 0.00 H new ATOM 0 H5 DC A 10 11.252 4.663 1.485 1.00 0.00 H new ATOM 0 H6 DC A 10 10.459 3.777 -0.642 1.00 0.00 H new ATOM 323 P DG A 11 8.475 3.793 -6.004 1.00 0.00 P ATOM 324 OP1 DG A 11 7.832 3.140 -7.168 1.00 0.00 O ATOM 325 OP2 DG A 11 9.911 4.143 -6.045 1.00 0.00 O ATOM 326 O5' DG A 11 7.630 5.121 -5.640 1.00 0.00 O ATOM 327 C5' DG A 11 8.055 6.432 -6.020 1.00 0.00 C ATOM 328 C4' DG A 11 6.993 7.476 -5.667 1.00 0.00 C ATOM 329 O4' DG A 11 5.781 7.205 -6.366 1.00 0.00 O ATOM 330 C3' DG A 11 6.606 7.528 -4.192 1.00 0.00 C ATOM 331 O3' DG A 11 7.467 8.396 -3.433 1.00 0.00 O ATOM 332 C2' DG A 11 5.204 8.117 -4.225 1.00 0.00 C ATOM 333 C1' DG A 11 4.718 7.839 -5.645 1.00 0.00 C ATOM 334 N9 DG A 11 3.520 6.982 -5.695 1.00 0.00 N ATOM 335 C8 DG A 11 2.226 7.334 -5.453 1.00 0.00 C ATOM 336 N7 DG A 11 1.368 6.366 -5.514 1.00 0.00 N ATOM 337 C5 DG A 11 2.150 5.263 -5.825 1.00 0.00 C ATOM 338 C6 DG A 11 1.765 3.914 -6.024 1.00 0.00 C ATOM 339 O6 DG A 11 0.634 3.429 -5.951 1.00 0.00 O ATOM 340 N1 DG A 11 2.860 3.111 -6.326 1.00 0.00 N ATOM 341 C2 DG A 11 4.165 3.558 -6.423 1.00 0.00 C ATOM 342 N2 DG A 11 5.085 2.640 -6.722 1.00 0.00 N ATOM 343 N3 DG A 11 4.532 4.832 -6.234 1.00 0.00 N ATOM 344 C4 DG A 11 3.476 5.626 -5.940 1.00 0.00 C ATOM 0 H5' DG A 11 8.253 6.458 -7.091 1.00 0.00 H new ATOM 0 H5'' DG A 11 8.991 6.675 -5.517 1.00 0.00 H new ATOM 0 H4' DG A 11 7.456 8.423 -5.944 1.00 0.00 H new ATOM 0 H3' DG A 11 6.677 6.548 -3.720 1.00 0.00 H new ATOM 0 H2' DG A 11 4.557 7.649 -3.483 1.00 0.00 H new ATOM 0 H2'' DG A 11 5.215 9.185 -4.009 1.00 0.00 H new ATOM 0 H1' DG A 11 4.437 8.793 -6.090 1.00 0.00 H new ATOM 0 H8 DG A 11 1.936 8.349 -5.226 1.00 0.00 H new ATOM 0 H1 DG A 11 2.688 2.119 -6.488 1.00 0.00 H new ATOM 0 H21 DG A 11 6.065 2.909 -6.807 1.00 0.00 H new ATOM 0 H22 DG A 11 4.808 1.669 -6.865 1.00 0.00 H new ATOM 356 P DG A 12 7.818 8.017 -1.901 1.00 0.00 P ATOM 357 OP1 DG A 12 8.715 9.062 -1.360 1.00 0.00 O ATOM 358 OP2 DG A 12 8.235 6.607 -1.858 1.00 0.00 O ATOM 359 O5' DG A 12 6.390 8.151 -1.157 1.00 0.00 O ATOM 360 C5' DG A 12 5.730 9.414 -1.021 1.00 0.00 C ATOM 361 C4' DG A 12 4.321 9.266 -0.453 1.00 0.00 C ATOM 362 O4' DG A 12 3.532 8.475 -1.334 1.00 0.00 O ATOM 363 C3' DG A 12 4.223 8.591 0.902 1.00 0.00 C ATOM 364 O3' DG A 12 4.439 9.556 1.943 1.00 0.00 O ATOM 365 C2' DG A 12 2.789 8.070 0.910 1.00 0.00 C ATOM 366 C1' DG A 12 2.495 7.828 -0.580 1.00 0.00 C ATOM 367 N9 DG A 12 2.489 6.399 -0.966 1.00 0.00 N ATOM 368 C8 DG A 12 3.539 5.591 -1.310 1.00 0.00 C ATOM 369 N7 DG A 12 3.232 4.344 -1.525 1.00 0.00 N ATOM 370 C5 DG A 12 1.854 4.313 -1.310 1.00 0.00 C ATOM 371 C6 DG A 12 0.940 3.222 -1.401 1.00 0.00 C ATOM 372 O6 DG A 12 1.177 2.053 -1.690 1.00 0.00 O ATOM 373 N1 DG A 12 -0.360 3.618 -1.111 1.00 0.00 N ATOM 374 C2 DG A 12 -0.735 4.906 -0.775 1.00 0.00 C ATOM 375 N2 DG A 12 -2.028 5.104 -0.530 1.00 0.00 N ATOM 376 N3 DG A 12 0.121 5.930 -0.689 1.00 0.00 N ATOM 377 C4 DG A 12 1.392 5.565 -0.967 1.00 0.00 C ATOM 0 H5' DG A 12 5.679 9.903 -1.994 1.00 0.00 H new ATOM 0 H5'' DG A 12 6.317 10.061 -0.370 1.00 0.00 H new ATOM 0 H4' DG A 12 3.975 10.294 -0.341 1.00 0.00 H new ATOM 0 H3' DG A 12 4.959 7.804 1.067 1.00 0.00 H new ATOM 0 H2' DG A 12 2.697 7.153 1.493 1.00 0.00 H new ATOM 0 H2'' DG A 12 2.100 8.794 1.344 1.00 0.00 H new ATOM 0 H1' DG A 12 1.498 8.220 -0.781 1.00 0.00 H new ATOM 0 H8 DG A 12 4.550 5.961 -1.397 1.00 0.00 H new ATOM 0 H1 DG A 12 -1.091 2.907 -1.149 1.00 0.00 H new ATOM 0 H21 DG A 12 -2.363 6.034 -0.277 1.00 0.00 H new ATOM 0 H22 DG A 12 -2.684 4.326 -0.595 1.00 0.00 H new ATOM 389 P DG A 13 4.926 9.078 3.407 1.00 0.00 P ATOM 390 OP1 DG A 13 5.372 10.271 4.159 1.00 0.00 O ATOM 391 OP2 DG A 13 5.839 7.926 3.240 1.00 0.00 O ATOM 392 O5' DG A 13 3.556 8.547 4.066 1.00 0.00 O ATOM 393 C5' DG A 13 2.500 9.485 4.288 1.00 0.00 C ATOM 394 C4' DG A 13 1.212 8.839 4.794 1.00 0.00 C ATOM 395 O4' DG A 13 0.745 7.907 3.837 1.00 0.00 O ATOM 396 C3' DG A 13 1.312 8.076 6.107 1.00 0.00 C ATOM 397 O3' DG A 13 1.171 9.010 7.196 1.00 0.00 O ATOM 398 C2' DG A 13 0.133 7.113 6.017 1.00 0.00 C ATOM 399 C1' DG A 13 -0.044 6.914 4.498 1.00 0.00 C ATOM 400 N9 DG A 13 0.409 5.597 3.994 1.00 0.00 N ATOM 401 C8 DG A 13 1.657 5.214 3.601 1.00 0.00 C ATOM 402 N7 DG A 13 1.769 3.974 3.231 1.00 0.00 N ATOM 403 C5 DG A 13 0.483 3.478 3.392 1.00 0.00 C ATOM 404 C6 DG A 13 -0.021 2.173 3.147 1.00 0.00 C ATOM 405 O6 DG A 13 0.584 1.185 2.731 1.00 0.00 O ATOM 406 N1 DG A 13 -1.372 2.089 3.450 1.00 0.00 N ATOM 407 C2 DG A 13 -2.140 3.130 3.928 1.00 0.00 C ATOM 408 N2 DG A 13 -3.407 2.849 4.192 1.00 0.00 N ATOM 409 N3 DG A 13 -1.674 4.361 4.147 1.00 0.00 N ATOM 410 C4 DG A 13 -0.359 4.464 3.863 1.00 0.00 C ATOM 0 H5' DG A 13 2.292 10.013 3.358 1.00 0.00 H new ATOM 0 H5'' DG A 13 2.832 10.231 5.010 1.00 0.00 H new ATOM 0 H4' DG A 13 0.546 9.686 4.960 1.00 0.00 H new ATOM 0 H3' DG A 13 2.255 7.555 6.274 1.00 0.00 H new ATOM 0 H2' DG A 13 0.342 6.172 6.525 1.00 0.00 H new ATOM 0 H2'' DG A 13 -0.764 7.530 6.476 1.00 0.00 H new ATOM 0 H1' DG A 13 -1.113 6.986 4.297 1.00 0.00 H new ATOM 0 H8 DG A 13 2.495 5.895 3.598 1.00 0.00 H new ATOM 0 H1 DG A 13 -1.832 1.190 3.309 1.00 0.00 H new ATOM 0 H21 DG A 13 -4.027 3.576 4.548 1.00 0.00 H new ATOM 0 H22 DG A 13 -3.763 1.905 4.039 1.00 0.00 H new ATOM 422 P DG A 14 1.786 8.687 8.658 1.00 0.00 P ATOM 423 OP1 DG A 14 1.874 9.963 9.400 1.00 0.00 O ATOM 424 OP2 DG A 14 3.008 7.872 8.466 1.00 0.00 O ATOM 425 O5' DG A 14 0.683 7.763 9.398 1.00 0.00 O ATOM 426 C5' DG A 14 -0.578 8.345 9.764 1.00 0.00 C ATOM 427 C4' DG A 14 -1.451 7.413 10.619 1.00 0.00 C ATOM 428 O4' DG A 14 -0.761 7.045 11.813 1.00 0.00 O ATOM 429 C3' DG A 14 -2.786 8.022 11.065 1.00 0.00 C ATOM 430 O3' DG A 14 -3.820 7.761 10.110 1.00 0.00 O ATOM 431 C2' DG A 14 -3.093 7.281 12.357 1.00 0.00 C ATOM 432 C1' DG A 14 -1.713 6.881 12.880 1.00 0.00 C ATOM 433 N9 DG A 14 -1.250 7.695 14.017 1.00 0.00 N ATOM 434 C8 DG A 14 -0.451 8.799 14.008 1.00 0.00 C ATOM 435 N7 DG A 14 -0.212 9.319 15.175 1.00 0.00 N ATOM 436 C5 DG A 14 -0.914 8.487 16.044 1.00 0.00 C ATOM 437 C6 DG A 14 -1.035 8.546 17.458 1.00 0.00 C ATOM 438 O6 DG A 14 -0.538 9.362 18.233 1.00 0.00 O ATOM 439 N1 DG A 14 -1.834 7.520 17.945 1.00 0.00 N ATOM 440 C2 DG A 14 -2.441 6.553 17.170 1.00 0.00 C ATOM 441 N2 DG A 14 -3.172 5.647 17.823 1.00 0.00 N ATOM 442 N3 DG A 14 -2.329 6.493 15.838 1.00 0.00 N ATOM 443 C4 DG A 14 -1.554 7.487 15.345 1.00 0.00 C ATOM 0 H5' DG A 14 -1.123 8.613 8.859 1.00 0.00 H new ATOM 0 H5'' DG A 14 -0.398 9.269 10.314 1.00 0.00 H new ATOM 0 H4' DG A 14 -1.657 6.563 9.968 1.00 0.00 H new ATOM 0 H3' DG A 14 -2.731 9.105 11.175 1.00 0.00 H new ATOM 0 H2' DG A 14 -3.622 7.916 13.067 1.00 0.00 H new ATOM 0 H2'' DG A 14 -3.722 6.409 12.179 1.00 0.00 H new ATOM 0 H1' DG A 14 -1.794 5.851 13.226 1.00 0.00 H new ATOM 0 H8 DG A 14 -0.045 9.212 13.096 1.00 0.00 H new ATOM 0 H1 DG A 14 -1.984 7.478 18.953 1.00 0.00 H new ATOM 0 H21 DG A 14 -3.646 4.906 17.307 1.00 0.00 H new ATOM 0 H22 DG A 14 -3.256 5.696 18.838 1.00 0.00 H new ATOM 455 P DC A 15 -5.059 8.786 9.895 1.00 0.00 P ATOM 456 OP1 DC A 15 -5.089 9.724 11.041 1.00 0.00 O ATOM 457 OP2 DC A 15 -6.261 7.994 9.555 1.00 0.00 O ATOM 458 O5' DC A 15 -4.605 9.610 8.584 1.00 0.00 O ATOM 459 C5' DC A 15 -3.453 10.444 8.612 1.00 0.00 C ATOM 460 C4' DC A 15 -2.891 10.715 7.215 1.00 0.00 C ATOM 461 O4' DC A 15 -2.438 9.468 6.674 1.00 0.00 O ATOM 462 C3' DC A 15 -3.880 11.311 6.217 1.00 0.00 C ATOM 463 O3' DC A 15 -3.219 12.318 5.428 1.00 0.00 O ATOM 464 C2' DC A 15 -4.288 10.159 5.308 1.00 0.00 C ATOM 465 C1' DC A 15 -3.292 9.045 5.604 1.00 0.00 C ATOM 466 N1 DC A 15 -3.917 7.748 5.980 1.00 0.00 N ATOM 467 C2 DC A 15 -3.435 6.603 5.367 1.00 0.00 C ATOM 468 O2 DC A 15 -2.593 6.691 4.485 1.00 0.00 O ATOM 469 N3 DC A 15 -3.954 5.399 5.735 1.00 0.00 N ATOM 470 C4 DC A 15 -4.916 5.319 6.662 1.00 0.00 C ATOM 471 N4 DC A 15 -5.400 4.124 7.004 1.00 0.00 N ATOM 472 C5 DC A 15 -5.427 6.495 7.290 1.00 0.00 C ATOM 473 C6 DC A 15 -4.902 7.680 6.921 1.00 0.00 C ATOM 0 H5' DC A 15 -2.683 9.974 9.225 1.00 0.00 H new ATOM 0 H5'' DC A 15 -3.706 11.391 9.088 1.00 0.00 H new ATOM 0 H4' DC A 15 -2.103 11.456 7.349 1.00 0.00 H new ATOM 0 H3' DC A 15 -4.735 11.767 6.717 1.00 0.00 H new ATOM 0 H2' DC A 15 -5.310 9.839 5.513 1.00 0.00 H new ATOM 0 H2'' DC A 15 -4.250 10.453 4.259 1.00 0.00 H new ATOM 0 H1' DC A 15 -2.743 8.867 4.679 1.00 0.00 H new ATOM 0 H41 DC A 15 -6.133 4.054 7.710 1.00 0.00 H new ATOM 0 H42 DC A 15 -5.037 3.281 6.560 1.00 0.00 H new ATOM 0 H5 DC A 15 -6.207 6.437 8.035 1.00 0.00 H new ATOM 0 H6 DC A 15 -5.266 8.589 7.377 1.00 0.00 H new ATOM 485 P DG A 16 -4.063 13.211 4.381 1.00 0.00 P ATOM 486 OP1 DG A 16 -3.320 14.466 4.129 1.00 0.00 O ATOM 487 OP2 DG A 16 -5.468 13.261 4.840 1.00 0.00 O ATOM 488 O5' DG A 16 -4.000 12.310 3.045 1.00 0.00 O ATOM 489 C5' DG A 16 -2.731 12.052 2.434 1.00 0.00 C ATOM 490 C4' DG A 16 -2.809 11.022 1.308 1.00 0.00 C ATOM 491 O4' DG A 16 -3.101 9.749 1.887 1.00 0.00 O ATOM 492 C3' DG A 16 -3.869 11.331 0.245 1.00 0.00 C ATOM 493 O3' DG A 16 -3.368 11.054 -1.069 1.00 0.00 O ATOM 494 C2' DG A 16 -4.974 10.324 0.537 1.00 0.00 C ATOM 495 C1' DG A 16 -4.251 9.189 1.272 1.00 0.00 C ATOM 496 N9 DG A 16 -5.049 8.520 2.333 1.00 0.00 N ATOM 497 C8 DG A 16 -5.975 9.052 3.187 1.00 0.00 C ATOM 498 N7 DG A 16 -6.566 8.200 3.967 1.00 0.00 N ATOM 499 C5 DG A 16 -5.990 6.987 3.613 1.00 0.00 C ATOM 500 C6 DG A 16 -6.234 5.686 4.128 1.00 0.00 C ATOM 501 O6 DG A 16 -7.015 5.354 5.017 1.00 0.00 O ATOM 502 N1 DG A 16 -5.445 4.729 3.502 1.00 0.00 N ATOM 503 C2 DG A 16 -4.529 4.996 2.497 1.00 0.00 C ATOM 504 N2 DG A 16 -3.862 3.951 2.006 1.00 0.00 N ATOM 505 N3 DG A 16 -4.297 6.223 2.011 1.00 0.00 N ATOM 506 C4 DG A 16 -5.059 7.167 2.612 1.00 0.00 C ATOM 0 H5' DG A 16 -2.033 11.700 3.194 1.00 0.00 H new ATOM 0 H5'' DG A 16 -2.328 12.984 2.039 1.00 0.00 H new ATOM 0 H4' DG A 16 -1.846 11.040 0.797 1.00 0.00 H new ATOM 0 H3' DG A 16 -4.181 12.375 0.276 1.00 0.00 H new ATOM 0 H2' DG A 16 -5.761 10.761 1.152 1.00 0.00 H new ATOM 0 H2'' DG A 16 -5.445 9.970 -0.380 1.00 0.00 H new ATOM 0 H1' DG A 16 -4.030 8.425 0.527 1.00 0.00 H new ATOM 0 H8 DG A 16 -6.199 10.108 3.211 1.00 0.00 H new ATOM 0 H1 DG A 16 -5.547 3.760 3.804 1.00 0.00 H new ATOM 0 H21 DG A 16 -3.175 4.087 1.265 1.00 0.00 H new ATOM 0 H22 DG A 16 -4.039 3.015 2.372 1.00 0.00 H new ATOM 518 P DG A 17 -4.141 11.628 -2.373 1.00 0.00 P ATOM 519 OP1 DG A 17 -3.194 11.586 -3.512 1.00 0.00 O ATOM 520 OP2 DG A 17 -4.773 12.914 -2.003 1.00 0.00 O ATOM 521 O5' DG A 17 -5.324 10.564 -2.669 1.00 0.00 O ATOM 522 C5' DG A 17 -5.011 9.206 -2.982 1.00 0.00 C ATOM 523 C4' DG A 17 -6.257 8.364 -3.328 1.00 0.00 C ATOM 524 O4' DG A 17 -5.991 7.524 -4.454 1.00 0.00 O ATOM 525 C3' DG A 17 -6.758 7.461 -2.199 1.00 0.00 C ATOM 526 O3' DG A 17 -7.826 8.112 -1.477 1.00 0.00 O ATOM 527 C2' DG A 17 -7.269 6.205 -2.891 1.00 0.00 C ATOM 528 C1' DG A 17 -6.769 6.330 -4.328 1.00 0.00 C ATOM 529 N9 DG A 17 -5.947 5.197 -4.803 1.00 0.00 N ATOM 530 C8 DG A 17 -6.342 3.921 -5.086 1.00 0.00 C ATOM 531 N7 DG A 17 -5.384 3.095 -5.375 1.00 0.00 N ATOM 532 C5 DG A 17 -4.241 3.882 -5.283 1.00 0.00 C ATOM 533 C6 DG A 17 -2.879 3.534 -5.500 1.00 0.00 C ATOM 534 O6 DG A 17 -2.413 2.439 -5.815 1.00 0.00 O ATOM 535 N1 DG A 17 -2.037 4.623 -5.311 1.00 0.00 N ATOM 536 C2 DG A 17 -2.457 5.894 -4.956 1.00 0.00 C ATOM 537 N2 DG A 17 -1.508 6.816 -4.819 1.00 0.00 N ATOM 538 N3 DG A 17 -3.739 6.222 -4.752 1.00 0.00 N ATOM 539 C4 DG A 17 -4.573 5.172 -4.930 1.00 0.00 C ATOM 0 H5' DG A 17 -4.497 8.753 -2.134 1.00 0.00 H new ATOM 0 H5'' DG A 17 -4.319 9.183 -3.824 1.00 0.00 H new ATOM 0 H4' DG A 17 -7.034 9.101 -3.532 1.00 0.00 H new ATOM 0 H3' DG A 17 -5.976 7.235 -1.474 1.00 0.00 H new ATOM 0 H2' DG A 17 -6.884 5.304 -2.414 1.00 0.00 H new ATOM 0 H2'' DG A 17 -8.357 6.145 -2.853 1.00 0.00 H new ATOM 0 H1' DG A 17 -7.667 6.346 -4.946 1.00 0.00 H new ATOM 0 H8 DG A 17 -7.379 3.620 -5.070 1.00 0.00 H new ATOM 0 H1 DG A 17 -1.036 4.476 -5.443 1.00 0.00 H new ATOM 0 H21 DG A 17 -1.758 7.770 -4.559 1.00 0.00 H new ATOM 0 H22 DG A 17 -0.531 6.569 -4.974 1.00 0.00 H new ATOM 551 P DG A 18 -7.915 7.965 0.123 1.00 0.00 P ATOM 552 OP1 DG A 18 -9.075 8.750 0.599 1.00 0.00 O ATOM 553 OP2 DG A 18 -6.581 8.226 0.662 1.00 0.00 O ATOM 554 O5' DG A 18 -8.248 6.404 0.329 1.00 0.00 O ATOM 555 C5' DG A 18 -9.494 5.839 -0.084 1.00 0.00 C ATOM 556 C4' DG A 18 -9.435 4.318 -0.030 1.00 0.00 C ATOM 557 O4' DG A 18 -8.429 3.862 -0.911 1.00 0.00 O ATOM 558 C3' DG A 18 -9.113 3.701 1.322 1.00 0.00 C ATOM 559 O3' DG A 18 -10.317 3.519 2.084 1.00 0.00 O ATOM 560 C2' DG A 18 -8.460 2.370 0.964 1.00 0.00 C ATOM 561 C1' DG A 18 -7.977 2.579 -0.478 1.00 0.00 C ATOM 562 N9 DG A 18 -6.513 2.570 -0.630 1.00 0.00 N ATOM 563 C8 DG A 18 -5.630 3.605 -0.537 1.00 0.00 C ATOM 564 N7 DG A 18 -4.384 3.285 -0.725 1.00 0.00 N ATOM 565 C5 DG A 18 -4.440 1.916 -0.965 1.00 0.00 C ATOM 566 C6 DG A 18 -3.392 0.998 -1.251 1.00 0.00 C ATOM 567 O6 DG A 18 -2.182 1.228 -1.344 1.00 0.00 O ATOM 568 N1 DG A 18 -3.887 -0.294 -1.435 1.00 0.00 N ATOM 569 C2 DG A 18 -5.229 -0.643 -1.349 1.00 0.00 C ATOM 570 N2 DG A 18 -5.533 -1.918 -1.552 1.00 0.00 N ATOM 571 N3 DG A 18 -6.203 0.223 -1.081 1.00 0.00 N ATOM 572 C4 DG A 18 -5.743 1.473 -0.903 1.00 0.00 C ATOM 0 H5' DG A 18 -9.729 6.164 -1.098 1.00 0.00 H new ATOM 0 H5'' DG A 18 -10.295 6.201 0.560 1.00 0.00 H new ATOM 0 H4' DG A 18 -10.447 4.009 -0.293 1.00 0.00 H new ATOM 0 H3' DG A 18 -8.464 4.320 1.941 1.00 0.00 H new ATOM 0 H2' DG A 18 -7.632 2.137 1.634 1.00 0.00 H new ATOM 0 H2'' DG A 18 -9.169 1.545 1.034 1.00 0.00 H new ATOM 0 H1' DG A 18 -8.375 1.750 -1.062 1.00 0.00 H new ATOM 0 H8 DG A 18 -5.943 4.616 -0.323 1.00 0.00 H new ATOM 0 H1 DG A 18 -3.217 -1.033 -1.647 1.00 0.00 H new ATOM 0 H21 DG A 18 -6.504 -2.225 -1.500 1.00 0.00 H new ATOM 0 H22 DG A 18 -4.796 -2.591 -1.760 1.00 0.00 H new ATOM 584 P DG A 19 -10.244 3.355 3.686 1.00 0.00 P ATOM 585 OP1 DG A 19 -11.619 3.436 4.224 1.00 0.00 O ATOM 586 OP2 DG A 19 -9.190 4.259 4.200 1.00 0.00 O ATOM 587 O5' DG A 19 -9.730 1.833 3.835 1.00 0.00 O ATOM 588 C5' DG A 19 -10.562 0.757 3.380 1.00 0.00 C ATOM 589 C4' DG A 19 -9.858 -0.599 3.438 1.00 0.00 C ATOM 590 O4' DG A 19 -8.687 -0.566 2.634 1.00 0.00 O ATOM 591 C3' DG A 19 -9.380 -1.027 4.808 1.00 0.00 C ATOM 592 O3' DG A 19 -10.429 -1.672 5.544 1.00 0.00 O ATOM 593 C2' DG A 19 -8.292 -2.047 4.462 1.00 0.00 C ATOM 594 C1' DG A 19 -7.812 -1.613 3.076 1.00 0.00 C ATOM 595 N9 DG A 19 -6.430 -1.100 3.071 1.00 0.00 N ATOM 596 C8 DG A 19 -5.984 0.165 3.311 1.00 0.00 C ATOM 597 N7 DG A 19 -4.695 0.310 3.283 1.00 0.00 N ATOM 598 C5 DG A 19 -4.234 -0.970 2.995 1.00 0.00 C ATOM 599 C6 DG A 19 -2.906 -1.439 2.826 1.00 0.00 C ATOM 600 O6 DG A 19 -1.857 -0.803 2.911 1.00 0.00 O ATOM 601 N1 DG A 19 -2.878 -2.796 2.535 1.00 0.00 N ATOM 602 C2 DG A 19 -3.988 -3.608 2.424 1.00 0.00 C ATOM 603 N2 DG A 19 -3.757 -4.893 2.138 1.00 0.00 N ATOM 604 N3 DG A 19 -5.242 -3.169 2.585 1.00 0.00 N ATOM 605 C4 DG A 19 -5.290 -1.845 2.866 1.00 0.00 C ATOM 0 H5' DG A 19 -10.877 0.955 2.355 1.00 0.00 H new ATOM 0 H5'' DG A 19 -11.465 0.719 3.989 1.00 0.00 H new ATOM 0 H4' DG A 19 -10.620 -1.302 3.100 1.00 0.00 H new ATOM 0 H3' DG A 19 -9.044 -0.195 5.426 1.00 0.00 H new ATOM 0 H2' DG A 19 -7.481 -2.029 5.190 1.00 0.00 H new ATOM 0 H2'' DG A 19 -8.686 -3.063 4.449 1.00 0.00 H new ATOM 0 H1' DG A 19 -7.827 -2.486 2.423 1.00 0.00 H new ATOM 0 H8 DG A 19 -6.655 0.987 3.510 1.00 0.00 H new ATOM 0 H1 DG A 19 -1.965 -3.227 2.392 1.00 0.00 H new ATOM 0 H21 DG A 19 -4.538 -5.543 2.043 1.00 0.00 H new ATOM 0 H22 DG A 19 -2.800 -5.224 2.015 1.00 0.00 H new ATOM 617 P DT A 20 -10.475 -1.536 7.153 1.00 0.00 P ATOM 618 OP1 DT A 20 -11.684 -2.232 7.644 1.00 0.00 O ATOM 619 OP2 DT A 20 -10.252 -0.114 7.502 1.00 0.00 O ATOM 620 O5' DT A 20 -9.184 -2.380 7.621 1.00 0.00 O ATOM 621 C5' DT A 20 -9.079 -3.780 7.356 1.00 0.00 C ATOM 622 C4' DT A 20 -7.710 -4.318 7.760 1.00 0.00 C ATOM 623 O4' DT A 20 -6.716 -3.666 6.962 1.00 0.00 O ATOM 624 C3' DT A 20 -7.349 -4.087 9.224 1.00 0.00 C ATOM 625 O3' DT A 20 -6.660 -5.219 9.762 1.00 0.00 O ATOM 626 C2' DT A 20 -6.442 -2.860 9.212 1.00 0.00 C ATOM 627 C1' DT A 20 -5.953 -2.761 7.766 1.00 0.00 C ATOM 628 N1 DT A 20 -6.029 -1.406 7.150 1.00 0.00 N ATOM 629 C2 DT A 20 -4.963 -1.029 6.357 1.00 0.00 C ATOM 630 O2 DT A 20 -4.020 -1.780 6.137 1.00 0.00 O ATOM 631 N3 DT A 20 -5.017 0.243 5.817 1.00 0.00 N ATOM 632 C4 DT A 20 -6.032 1.165 5.995 1.00 0.00 C ATOM 633 O4 DT A 20 -5.982 2.269 5.446 1.00 0.00 O ATOM 634 C5 DT A 20 -7.109 0.688 6.833 1.00 0.00 C ATOM 635 C7 DT A 20 -8.299 1.601 7.111 1.00 0.00 C ATOM 636 C6 DT A 20 -7.083 -0.553 7.372 1.00 0.00 C ATOM 0 H5' DT A 20 -9.247 -3.965 6.295 1.00 0.00 H new ATOM 0 H5'' DT A 20 -9.858 -4.315 7.900 1.00 0.00 H new ATOM 0 H4' DT A 20 -7.748 -5.396 7.605 1.00 0.00 H new ATOM 0 H3' DT A 20 -8.232 -3.941 9.846 1.00 0.00 H new ATOM 0 H2' DT A 20 -6.984 -1.963 9.510 1.00 0.00 H new ATOM 0 H2'' DT A 20 -5.609 -2.975 9.906 1.00 0.00 H new ATOM 0 HO3' DT A 20 -6.436 -5.050 10.701 1.00 0.00 H new ATOM 0 H1' DT A 20 -4.892 -3.010 7.801 1.00 0.00 H new ATOM 0 H3 DT A 20 -4.233 0.529 5.231 1.00 0.00 H new ATOM 0 H71 DT A 20 -7.972 2.641 7.091 1.00 0.00 H new ATOM 0 H72 DT A 20 -9.063 1.446 6.349 1.00 0.00 H new ATOM 0 H73 DT A 20 -8.714 1.370 8.092 1.00 0.00 H new ATOM 0 H6 DT A 20 -7.907 -0.879 7.989 1.00 0.00 H new TER 650 DT A 20 HETATM 651 O4 LOC A 101 6.900 5.007 6.940 1.00 0.00 O HETATM 652 C12 LOC A 101 5.722 4.714 6.745 1.00 0.00 C HETATM 653 C13 LOC A 101 4.594 5.664 7.150 1.00 0.00 C HETATM 654 N1 LOC A 101 5.326 3.593 6.125 1.00 0.00 N HETATM 655 C11 LOC A 101 4.082 2.893 6.483 1.00 0.00 C HETATM 656 C14 LOC A 101 4.288 1.525 6.351 1.00 0.00 C HETATM 657 C15 LOC A 101 5.662 1.430 6.537 1.00 0.00 C HETATM 658 C10 LOC A 101 2.984 3.326 5.522 1.00 0.00 C HETATM 659 C9 LOC A 101 1.613 3.080 6.131 1.00 0.00 C HETATM 660 C8 LOC A 101 1.219 1.770 5.883 1.00 0.00 C HETATM 661 C7 LOC A 101 -0.166 1.654 5.943 1.00 0.00 C HETATM 662 C5 LOC A 101 -0.755 0.398 6.001 1.00 0.00 C HETATM 663 C3 LOC A 101 0.041 -0.741 6.026 1.00 0.00 C HETATM 664 C1 LOC A 101 1.421 -0.620 5.924 1.00 0.00 C HETATM 665 O1 LOC A 101 2.171 -1.667 6.364 1.00 0.00 O HETATM 666 C2 LOC A 101 2.087 -1.742 7.790 1.00 0.00 C HETATM 667 O2 LOC A 101 -0.520 -1.918 5.640 1.00 0.00 O HETATM 668 C4 LOC A 101 -1.436 -2.379 6.636 1.00 0.00 C HETATM 669 O3 LOC A 101 -2.101 0.222 6.062 1.00 0.00 O HETATM 670 C6 LOC A 101 -2.612 0.928 7.195 1.00 0.00 C HETATM 671 C22 LOC A 101 2.022 0.634 5.843 1.00 0.00 C HETATM 672 C21 LOC A 101 3.411 0.577 5.836 1.00 0.00 C HETATM 673 C20 LOC A 101 3.710 -0.485 4.991 1.00 0.00 C HETATM 674 C19 LOC A 101 4.953 -1.084 4.817 1.00 0.00 C HETATM 675 C17 LOC A 101 6.191 -0.651 5.281 1.00 0.00 C HETATM 676 C16 LOC A 101 6.531 0.515 5.955 1.00 0.00 C HETATM 677 O5 LOC A 101 7.727 0.746 6.116 1.00 0.00 O HETATM 678 O6 LOC A 101 7.249 -1.485 5.107 1.00 0.00 O HETATM 679 C18 LOC A 101 7.441 -2.225 6.315 1.00 0.00 C HETATM 0 H18B LOC A 101 7.640 -1.536 7.136 1.00 0.00 H new HETATM 0 H18A LOC A 101 6.543 -2.802 6.535 1.00 0.00 H new HETATM 0 H13B LOC A 101 4.635 5.840 8.225 1.00 0.00 H new HETATM 0 H13A LOC A 101 4.709 6.611 6.622 1.00 0.00 H new HETATM 0 H10A LOC A 101 3.098 4.384 5.284 1.00 0.00 H new HETATM 0 HN1 LOC A 101 5.908 3.212 5.379 1.00 0.00 H new HETATM 0 H9A LOC A 101 1.643 3.264 7.205 1.00 0.00 H new HETATM 0 H9 LOC A 101 0.887 3.775 5.709 1.00 0.00 H new HETATM 0 H7 LOC A 101 -0.789 2.549 5.944 1.00 0.00 H new HETATM 0 H6B LOC A 101 -2.150 0.542 8.103 1.00 0.00 H new HETATM 0 H6A LOC A 101 -2.385 1.989 7.095 1.00 0.00 H new HETATM 0 H6 LOC A 101 -3.692 0.792 7.252 1.00 0.00 H new HETATM 0 H4B LOC A 101 -0.906 -2.528 7.577 1.00 0.00 H new HETATM 0 H4A LOC A 101 -2.223 -1.638 6.777 1.00 0.00 H new HETATM 0 H4 LOC A 101 -1.878 -3.322 6.315 1.00 0.00 H new HETATM 0 H2B LOC A 101 2.462 -0.816 8.226 1.00 0.00 H new HETATM 0 H2A LOC A 101 1.048 -1.888 8.086 1.00 0.00 H new HETATM 0 H20 LOC A 101 2.886 -0.890 4.404 1.00 0.00 H new HETATM 0 H2 LOC A 101 2.687 -2.580 8.146 1.00 0.00 H new HETATM 0 H19 LOC A 101 4.958 -2.011 4.244 1.00 0.00 H new HETATM 0 H18 LOC A 101 8.287 -2.902 6.196 1.00 0.00 H new HETATM 0 H15 LOC A 101 6.109 2.156 7.217 1.00 0.00 H new HETATM 0 H13 LOC A 101 3.633 5.219 6.892 1.00 0.00 H new HETATM 0 H11 LOC A 101 3.794 3.130 7.507 1.00 0.00 H new HETATM 0 H10 LOC A 101 3.076 2.777 4.585 1.00 0.00 H new