USER MOD reduce.3.24.130724 H: found=0, std=0, add=228, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 228 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 5 DT C7 :methyl 150:sc= -5.58! (180deg=-4.29!) USER MOD Set 1.2: A 6 DT C7 :methyl 150:sc= -2.2! (180deg=-0.527) USER MOD Single : A 1 DC O5' : rot 28:sc= 0.0816 USER MOD Single : A 10 DC O3' : rot 180:sc= 0 USER MOD Single : B 11 DG O5' : rot 32:sc= 0.0938 USER MOD Single : B 14 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 17 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 20 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 -10.607 12.245 -3.748 1.00 2.24 O ATOM 2 C5' DC A 1 -10.668 12.998 -4.955 1.00 2.16 C ATOM 3 C4' DC A 1 -9.251 13.211 -5.513 1.00 1.90 C ATOM 4 O4' DC A 1 -8.346 13.644 -4.438 1.00 1.84 O ATOM 5 C3' DC A 1 -8.685 11.893 -6.032 1.00 1.75 C ATOM 6 O3' DC A 1 -8.162 12.056 -7.366 1.00 1.78 O ATOM 7 C2' DC A 1 -7.573 11.532 -5.048 1.00 1.62 C ATOM 8 C1' DC A 1 -7.143 12.893 -4.515 1.00 1.63 C ATOM 9 N1 DC A 1 -6.543 12.866 -3.146 1.00 1.56 N ATOM 10 C2 DC A 1 -5.231 13.402 -2.951 1.00 1.48 C ATOM 11 O2 DC A 1 -4.562 13.868 -3.889 1.00 1.54 O ATOM 12 N3 DC A 1 -4.698 13.393 -1.685 1.00 1.42 N ATOM 13 C4 DC A 1 -5.383 12.885 -0.644 1.00 1.49 C ATOM 14 N4 DC A 1 -4.831 12.895 0.586 1.00 1.52 N ATOM 15 C5 DC A 1 -6.699 12.344 -0.822 1.00 1.65 C ATOM 16 C6 DC A 1 -7.227 12.354 -2.054 1.00 1.65 C ATOM 0 H5' DC A 1 -11.143 13.961 -4.769 1.00 2.16 H new ATOM 0 H5'' DC A 1 -11.282 12.476 -5.689 1.00 2.16 H new ATOM 0 H4' DC A 1 -9.319 13.956 -6.306 1.00 1.90 H new ATOM 0 H3' DC A 1 -9.443 11.112 -6.094 1.00 1.75 H new ATOM 0 H2' DC A 1 -7.933 10.880 -4.252 1.00 1.62 H new ATOM 0 H2'' DC A 1 -6.751 11.011 -5.539 1.00 1.62 H new ATOM 0 HO5' DC A 1 -9.746 12.403 -3.307 1.00 2.24 H new ATOM 0 H1' DC A 1 -6.373 13.298 -5.171 1.00 1.63 H new ATOM 0 H41 DC A 1 -5.345 12.511 1.379 1.00 1.52 H new ATOM 0 H42 DC A 1 -3.899 13.286 0.724 1.00 1.52 H new ATOM 0 H5 DC A 1 -7.250 11.939 0.014 1.00 1.65 H new ATOM 0 H6 DC A 1 -8.218 11.950 -2.201 1.00 1.65 H new ATOM 29 P DG A 2 -7.963 10.863 -8.427 1.00 1.83 P ATOM 30 OP1 DG A 2 -8.048 11.423 -9.796 1.00 2.15 O ATOM 31 OP2 DG A 2 -8.892 9.765 -8.074 1.00 1.84 O ATOM 32 O5' DG A 2 -6.450 10.428 -8.096 1.00 1.61 O ATOM 33 C5' DG A 2 -5.284 11.184 -8.493 1.00 1.62 C ATOM 34 C4' DG A 2 -3.991 10.689 -7.840 1.00 1.42 C ATOM 35 O4' DG A 2 -4.026 10.966 -6.410 1.00 1.25 O ATOM 36 C3' DG A 2 -3.753 9.174 -7.955 1.00 1.36 C ATOM 37 O3' DG A 2 -2.464 8.922 -8.556 1.00 1.47 O ATOM 38 C2' DG A 2 -3.781 8.694 -6.496 1.00 1.12 C ATOM 39 C1' DG A 2 -3.283 9.945 -5.790 1.00 1.06 C ATOM 40 N9 DG A 2 -3.537 10.016 -4.336 1.00 0.93 N ATOM 41 C8 DG A 2 -4.707 9.874 -3.666 1.00 0.93 C ATOM 42 N7 DG A 2 -4.614 10.008 -2.358 1.00 0.86 N ATOM 43 C5 DG A 2 -3.276 10.265 -2.147 1.00 0.79 C ATOM 44 C6 DG A 2 -2.579 10.495 -0.942 1.00 0.74 C ATOM 45 O6 DG A 2 -3.067 10.513 0.192 1.00 0.75 O ATOM 46 N1 DG A 2 -1.207 10.715 -1.171 1.00 0.69 N ATOM 47 C2 DG A 2 -0.582 10.713 -2.407 1.00 0.70 C ATOM 48 N2 DG A 2 0.735 10.940 -2.363 1.00 0.67 N ATOM 49 N3 DG A 2 -1.266 10.494 -3.536 1.00 0.79 N ATOM 50 C4 DG A 2 -2.585 10.280 -3.356 1.00 0.82 C ATOM 0 H5' DG A 2 -5.434 12.233 -8.236 1.00 1.62 H new ATOM 0 H5'' DG A 2 -5.178 11.133 -9.577 1.00 1.62 H new ATOM 0 H4' DG A 2 -3.198 11.213 -8.373 1.00 1.42 H new ATOM 0 H3' DG A 2 -4.489 8.665 -8.577 1.00 1.36 H new ATOM 0 H2' DG A 2 -4.781 8.405 -6.173 1.00 1.12 H new ATOM 0 H2'' DG A 2 -3.131 7.835 -6.328 1.00 1.12 H new ATOM 0 H1' DG A 2 -2.197 9.997 -5.873 1.00 1.06 H new ATOM 0 H8 DG A 2 -5.642 9.667 -4.165 1.00 0.93 H new ATOM 0 H1 DG A 2 -0.622 10.891 -0.354 1.00 0.69 H new ATOM 0 H21 DG A 2 1.279 10.957 -3.226 1.00 0.67 H new ATOM 0 H22 DG A 2 1.196 11.096 -1.467 1.00 0.67 H new ATOM 62 P DC A 3 -1.683 7.568 -8.942 1.00 1.52 P ATOM 63 OP1 DC A 3 -1.393 7.569 -10.394 1.00 1.88 O ATOM 64 OP2 DC A 3 -2.403 6.404 -8.373 1.00 1.59 O ATOM 65 O5' DC A 3 -0.312 7.750 -8.121 1.00 1.25 O ATOM 66 C5' DC A 3 0.735 8.733 -8.288 1.00 1.18 C ATOM 67 C4' DC A 3 1.893 8.592 -7.276 1.00 0.95 C ATOM 68 O4' DC A 3 1.415 8.811 -5.908 1.00 0.85 O ATOM 69 C3' DC A 3 2.532 7.205 -7.291 1.00 0.96 C ATOM 70 O3' DC A 3 3.960 7.308 -7.094 1.00 0.91 O ATOM 71 C2' DC A 3 1.837 6.508 -6.123 1.00 0.87 C ATOM 72 C1' DC A 3 1.677 7.654 -5.122 1.00 0.74 C ATOM 73 N1 DC A 3 0.546 7.513 -4.158 1.00 0.67 N ATOM 74 C2 DC A 3 0.808 7.654 -2.762 1.00 0.54 C ATOM 75 O2 DC A 3 1.952 7.862 -2.324 1.00 0.50 O ATOM 76 N3 DC A 3 -0.240 7.553 -1.874 1.00 0.47 N ATOM 77 C4 DC A 3 -1.491 7.316 -2.311 1.00 0.56 C ATOM 78 N4 DC A 3 -2.487 7.206 -1.409 1.00 0.51 N ATOM 79 C5 DC A 3 -1.774 7.173 -3.712 1.00 0.72 C ATOM 80 C6 DC A 3 -0.755 7.280 -4.577 1.00 0.77 C ATOM 0 H5' DC A 3 0.303 9.729 -8.194 1.00 1.18 H new ATOM 0 H5'' DC A 3 1.137 8.654 -9.298 1.00 1.18 H new ATOM 0 H4' DC A 3 2.628 9.338 -7.576 1.00 0.95 H new ATOM 0 H3' DC A 3 2.414 6.665 -8.231 1.00 0.96 H new ATOM 0 H2' DC A 3 0.876 6.083 -6.414 1.00 0.87 H new ATOM 0 H2'' DC A 3 2.437 5.693 -5.718 1.00 0.87 H new ATOM 0 H1' DC A 3 2.582 7.687 -4.516 1.00 0.74 H new ATOM 0 H41 DC A 3 -3.441 7.027 -1.722 1.00 0.51 H new ATOM 0 H42 DC A 3 -2.286 7.302 -0.414 1.00 0.51 H new ATOM 0 H5 DC A 3 -2.779 6.985 -4.059 1.00 0.72 H new ATOM 0 H6 DC A 3 -0.954 7.182 -5.634 1.00 0.77 H new ATOM 92 P DA A 4 5.102 6.186 -6.973 1.00 0.94 P ATOM 93 OP1 DA A 4 6.272 6.588 -7.787 1.00 1.01 O ATOM 94 OP2 DA A 4 4.502 4.856 -7.228 1.00 1.02 O ATOM 95 O5' DA A 4 5.475 6.289 -5.406 1.00 0.88 O ATOM 96 C5' DA A 4 6.103 7.384 -4.701 1.00 0.81 C ATOM 97 C4' DA A 4 6.712 7.001 -3.336 1.00 0.77 C ATOM 98 O4' DA A 4 5.686 6.820 -2.304 1.00 0.80 O ATOM 99 C3' DA A 4 7.528 5.723 -3.366 1.00 0.77 C ATOM 100 O3' DA A 4 8.713 5.908 -2.576 1.00 0.73 O ATOM 101 C2' DA A 4 6.578 4.679 -2.785 1.00 0.77 C ATOM 102 C1' DA A 4 5.575 5.454 -1.911 1.00 0.76 C ATOM 103 N9 DA A 4 4.128 5.122 -2.077 1.00 0.73 N ATOM 104 C8 DA A 4 3.485 4.908 -3.259 1.00 0.71 C ATOM 105 N7 DA A 4 2.209 4.630 -3.161 1.00 0.65 N ATOM 106 C5 DA A 4 1.966 4.701 -1.814 1.00 0.64 C ATOM 107 C6 DA A 4 0.769 4.515 -1.099 1.00 0.63 C ATOM 108 N6 DA A 4 -0.393 4.241 -1.729 1.00 0.59 N ATOM 109 N1 DA A 4 0.838 4.628 0.248 1.00 0.64 N ATOM 110 C2 DA A 4 1.992 4.926 0.835 1.00 0.66 C ATOM 111 N3 DA A 4 3.181 5.135 0.255 1.00 0.67 N ATOM 112 C4 DA A 4 3.109 5.002 -1.099 1.00 0.68 C ATOM 0 H5' DA A 4 5.365 8.171 -4.547 1.00 0.81 H new ATOM 0 H5'' DA A 4 6.888 7.802 -5.331 1.00 0.81 H new ATOM 0 H4' DA A 4 7.364 7.842 -3.101 1.00 0.77 H new ATOM 0 H3' DA A 4 7.877 5.424 -4.354 1.00 0.77 H new ATOM 0 H2' DA A 4 6.065 4.135 -3.578 1.00 0.77 H new ATOM 0 H2'' DA A 4 7.122 3.943 -2.194 1.00 0.77 H new ATOM 0 H1' DA A 4 5.833 5.203 -0.882 1.00 0.76 H new ATOM 0 H8 DA A 4 3.992 4.964 -4.211 1.00 0.71 H new ATOM 0 H61 DA A 4 -1.248 4.110 -1.188 1.00 0.59 H new ATOM 0 H62 DA A 4 -0.416 4.165 -2.746 1.00 0.59 H new ATOM 0 H2 DA A 4 1.968 5.010 1.911 1.00 0.66 H new ATOM 124 P DT A 5 10.019 5.033 -2.289 1.00 0.87 P ATOM 125 OP1 DT A 5 11.171 5.952 -2.132 1.00 1.09 O ATOM 126 OP2 DT A 5 10.134 3.966 -3.310 1.00 1.03 O ATOM 127 O5' DT A 5 9.635 4.403 -0.856 1.00 0.77 O ATOM 128 C5' DT A 5 9.372 5.181 0.340 1.00 0.80 C ATOM 129 C4' DT A 5 8.554 4.429 1.401 1.00 0.75 C ATOM 130 O4' DT A 5 7.176 4.208 0.958 1.00 0.74 O ATOM 131 C3' DT A 5 9.137 3.048 1.679 1.00 0.74 C ATOM 132 O3' DT A 5 9.261 2.835 3.095 1.00 0.74 O ATOM 133 C2' DT A 5 8.128 2.105 1.072 1.00 0.76 C ATOM 134 C1' DT A 5 6.815 2.871 1.268 1.00 0.74 C ATOM 135 N1 DT A 5 5.642 2.480 0.417 1.00 0.74 N ATOM 136 C2 DT A 5 4.333 2.566 1.029 1.00 0.70 C ATOM 137 O2 DT A 5 4.114 3.033 2.151 1.00 0.71 O ATOM 138 N3 DT A 5 3.249 2.079 0.239 1.00 0.67 N ATOM 139 C4 DT A 5 3.300 1.507 -1.050 1.00 0.69 C ATOM 140 O4 DT A 5 2.272 1.179 -1.660 1.00 0.69 O ATOM 141 C5 DT A 5 4.683 1.267 -1.661 1.00 0.72 C ATOM 142 C7 DT A 5 4.727 1.804 -3.094 1.00 0.76 C ATOM 143 C6 DT A 5 5.854 1.593 -0.633 1.00 0.73 C ATOM 0 H5' DT A 5 8.839 6.090 0.061 1.00 0.80 H new ATOM 0 H5'' DT A 5 10.321 5.489 0.778 1.00 0.80 H new ATOM 0 H4' DT A 5 8.583 5.054 2.294 1.00 0.75 H new ATOM 0 H3' DT A 5 10.136 2.911 1.265 1.00 0.74 H new ATOM 0 H2' DT A 5 8.333 1.911 0.019 1.00 0.76 H new ATOM 0 H2'' DT A 5 8.116 1.140 1.578 1.00 0.76 H new ATOM 0 H1' DT A 5 6.451 2.670 2.276 1.00 0.74 H new ATOM 0 H3 DT A 5 2.322 2.154 0.658 1.00 0.67 H new ATOM 0 H71 DT A 5 5.741 2.125 -3.331 1.00 0.76 H new ATOM 0 H72 DT A 5 4.424 1.019 -3.786 1.00 0.76 H new ATOM 0 H73 DT A 5 4.047 2.651 -3.186 1.00 0.76 H new ATOM 0 H6 DT A 5 6.819 1.123 -0.752 1.00 0.73 H new ATOM 156 P DT A 6 10.095 1.677 3.825 1.00 0.77 P ATOM 157 OP1 DT A 6 10.437 2.130 5.193 1.00 0.87 O ATOM 158 OP2 DT A 6 11.209 1.268 2.941 1.00 0.81 O ATOM 159 O5' DT A 6 9.019 0.481 3.912 1.00 0.75 O ATOM 160 C5' DT A 6 7.872 0.369 4.782 1.00 0.81 C ATOM 161 C4' DT A 6 6.753 -0.484 4.177 1.00 0.78 C ATOM 162 O4' DT A 6 6.127 0.189 3.033 1.00 0.74 O ATOM 163 C3' DT A 6 7.265 -1.835 3.631 1.00 0.83 C ATOM 164 O3' DT A 6 6.571 -2.951 4.210 1.00 0.95 O ATOM 165 C2' DT A 6 6.887 -1.782 2.152 1.00 0.82 C ATOM 166 C1' DT A 6 5.665 -0.859 2.220 1.00 0.75 C ATOM 167 N1 DT A 6 5.067 -0.454 0.898 1.00 0.74 N ATOM 168 C2 DT A 6 3.739 -0.959 0.720 1.00 0.75 C ATOM 169 O2 DT A 6 2.909 -1.064 1.630 1.00 0.75 O ATOM 170 N3 DT A 6 3.434 -1.423 -0.578 1.00 0.78 N ATOM 171 C4 DT A 6 4.246 -1.352 -1.739 1.00 0.79 C ATOM 172 O4 DT A 6 3.855 -1.775 -2.828 1.00 0.82 O ATOM 173 C5 DT A 6 5.295 -0.262 -1.650 1.00 0.76 C ATOM 174 C7 DT A 6 6.508 -0.293 -2.576 1.00 0.79 C ATOM 175 C6 DT A 6 5.864 0.006 -0.204 1.00 0.75 C ATOM 0 H5' DT A 6 7.487 1.365 4.999 1.00 0.81 H new ATOM 0 H5'' DT A 6 8.182 -0.067 5.732 1.00 0.81 H new ATOM 0 H4' DT A 6 6.049 -0.640 4.994 1.00 0.78 H new ATOM 0 H3' DT A 6 8.326 -1.967 3.842 1.00 0.83 H new ATOM 0 H2' DT A 6 7.685 -1.372 1.533 1.00 0.82 H new ATOM 0 H2'' DT A 6 6.644 -2.765 1.749 1.00 0.82 H new ATOM 0 H1' DT A 6 4.787 -1.356 2.633 1.00 0.75 H new ATOM 0 H3 DT A 6 2.521 -1.862 -0.695 1.00 0.78 H new ATOM 0 H71 DT A 6 6.842 0.726 -2.772 1.00 0.79 H new ATOM 0 H72 DT A 6 7.313 -0.854 -2.102 1.00 0.79 H new ATOM 0 H73 DT A 6 6.236 -0.773 -3.516 1.00 0.79 H new ATOM 0 H6 DT A 6 6.806 0.511 -0.050 1.00 0.75 H new ATOM 188 P DA A 7 6.997 -4.078 5.271 1.00 1.03 P ATOM 189 OP1 DA A 7 7.840 -3.460 6.314 1.00 1.45 O ATOM 190 OP2 DA A 7 7.521 -5.256 4.540 1.00 1.29 O ATOM 191 O5' DA A 7 5.535 -4.404 5.857 1.00 0.85 O ATOM 192 C5' DA A 7 4.640 -3.506 6.564 1.00 0.84 C ATOM 193 C4' DA A 7 3.164 -3.673 6.153 1.00 0.75 C ATOM 194 O4' DA A 7 2.978 -3.254 4.759 1.00 0.69 O ATOM 195 C3' DA A 7 2.723 -5.133 6.214 1.00 0.72 C ATOM 196 O3' DA A 7 1.390 -5.290 6.752 1.00 0.79 O ATOM 197 C2' DA A 7 2.735 -5.568 4.768 1.00 0.62 C ATOM 198 C1' DA A 7 2.295 -4.294 4.077 1.00 0.61 C ATOM 199 N9 DA A 7 2.705 -4.299 2.663 1.00 0.59 N ATOM 200 C8 DA A 7 3.952 -4.116 2.148 1.00 0.62 C ATOM 201 N7 DA A 7 4.019 -4.210 0.838 1.00 0.54 N ATOM 202 C5 DA A 7 2.716 -4.493 0.470 1.00 0.47 C ATOM 203 C6 DA A 7 2.137 -4.711 -0.800 1.00 0.43 C ATOM 204 N6 DA A 7 2.869 -4.665 -1.934 1.00 0.45 N ATOM 205 N1 DA A 7 0.802 -4.969 -0.818 1.00 0.43 N ATOM 206 C2 DA A 7 0.110 -5.006 0.325 1.00 0.44 C ATOM 207 N3 DA A 7 0.556 -4.821 1.564 1.00 0.44 N ATOM 208 C4 DA A 7 1.884 -4.561 1.570 1.00 0.48 C ATOM 0 H5' DA A 7 4.948 -2.477 6.379 1.00 0.84 H new ATOM 0 H5'' DA A 7 4.734 -3.679 7.636 1.00 0.84 H new ATOM 0 H4' DA A 7 2.580 -3.067 6.846 1.00 0.75 H new ATOM 0 H3' DA A 7 3.374 -5.716 6.865 1.00 0.72 H new ATOM 0 H2' DA A 7 3.724 -5.892 4.444 1.00 0.62 H new ATOM 0 H2'' DA A 7 2.051 -6.396 4.581 1.00 0.62 H new ATOM 0 H1' DA A 7 1.211 -4.179 4.101 1.00 0.61 H new ATOM 0 H8 DA A 7 4.815 -3.911 2.764 1.00 0.62 H new ATOM 0 H61 DA A 7 2.422 -4.827 -2.836 1.00 0.45 H new ATOM 0 H62 DA A 7 3.869 -4.468 -1.888 1.00 0.45 H new ATOM 0 H2 DA A 7 -0.946 -5.212 0.230 1.00 0.44 H new ATOM 220 P DC A 8 0.877 -6.632 7.479 1.00 0.82 P ATOM 221 OP1 DC A 8 0.488 -6.297 8.868 1.00 1.00 O ATOM 222 OP2 DC A 8 1.900 -7.685 7.282 1.00 0.93 O ATOM 223 O5' DC A 8 -0.436 -7.043 6.653 1.00 0.68 O ATOM 224 C5' DC A 8 -1.771 -6.485 6.684 1.00 0.58 C ATOM 225 C4' DC A 8 -2.728 -7.101 5.642 1.00 0.45 C ATOM 226 O4' DC A 8 -2.199 -6.883 4.294 1.00 0.44 O ATOM 227 C3' DC A 8 -2.896 -8.617 5.794 1.00 0.41 C ATOM 228 O3' DC A 8 -4.224 -9.046 5.418 1.00 0.44 O ATOM 229 C2' DC A 8 -1.890 -9.152 4.789 1.00 0.42 C ATOM 230 C1' DC A 8 -2.043 -8.139 3.653 1.00 0.36 C ATOM 231 N1 DC A 8 -0.879 -8.065 2.726 1.00 0.38 N ATOM 232 C2 DC A 8 -1.128 -8.096 1.322 1.00 0.36 C ATOM 233 O2 DC A 8 -2.277 -8.177 0.860 1.00 0.41 O ATOM 234 N3 DC A 8 -0.060 -8.036 0.457 1.00 0.39 N ATOM 235 C4 DC A 8 1.201 -7.957 0.927 1.00 0.39 C ATOM 236 N4 DC A 8 2.239 -7.892 0.065 1.00 0.41 N ATOM 237 C5 DC A 8 1.467 -7.925 2.336 1.00 0.44 C ATOM 238 C6 DC A 8 0.425 -7.980 3.178 1.00 0.45 C ATOM 0 H5' DC A 8 -1.709 -5.410 6.516 1.00 0.58 H new ATOM 0 H5'' DC A 8 -2.192 -6.628 7.679 1.00 0.58 H new ATOM 0 H4' DC A 8 -3.690 -6.614 5.803 1.00 0.45 H new ATOM 0 H3' DC A 8 -2.748 -8.958 6.819 1.00 0.41 H new ATOM 0 H2' DC A 8 -0.877 -9.171 5.190 1.00 0.42 H new ATOM 0 H2'' DC A 8 -2.126 -10.167 4.470 1.00 0.42 H new ATOM 0 H1' DC A 8 -2.885 -8.437 3.028 1.00 0.36 H new ATOM 0 H41 DC A 8 3.193 -7.832 0.420 1.00 0.41 H new ATOM 0 H42 DC A 8 2.068 -7.903 -0.941 1.00 0.41 H new ATOM 0 H5 DC A 8 2.479 -7.858 2.708 1.00 0.44 H new ATOM 0 H6 DC A 8 0.610 -7.957 4.242 1.00 0.45 H new ATOM 250 P DG A 9 -5.022 -10.382 5.817 1.00 0.55 P ATOM 251 OP1 DG A 9 -6.154 -10.037 6.708 1.00 0.81 O ATOM 252 OP2 DG A 9 -4.057 -11.404 6.279 1.00 0.76 O ATOM 253 O5' DG A 9 -5.589 -10.836 4.382 1.00 0.42 O ATOM 254 C5' DG A 9 -6.669 -10.214 3.643 1.00 0.44 C ATOM 255 C4' DG A 9 -6.813 -10.728 2.199 1.00 0.51 C ATOM 256 O4' DG A 9 -5.603 -10.435 1.440 1.00 0.52 O ATOM 257 C3' DG A 9 -7.016 -12.238 2.109 1.00 0.50 C ATOM 258 O3' DG A 9 -7.925 -12.560 1.034 1.00 0.56 O ATOM 259 C2' DG A 9 -5.602 -12.747 1.836 1.00 0.45 C ATOM 260 C1' DG A 9 -5.048 -11.641 0.938 1.00 0.44 C ATOM 261 N9 DG A 9 -3.579 -11.493 1.012 1.00 0.41 N ATOM 262 C8 DG A 9 -2.822 -11.352 2.130 1.00 0.53 C ATOM 263 N7 DG A 9 -1.531 -11.247 1.901 1.00 0.54 N ATOM 264 C5 DG A 9 -1.423 -11.292 0.530 1.00 0.43 C ATOM 265 C6 DG A 9 -0.273 -11.209 -0.278 1.00 0.47 C ATOM 266 O6 DG A 9 0.889 -11.069 0.121 1.00 0.56 O ATOM 267 N1 DG A 9 -0.592 -11.321 -1.645 1.00 0.51 N ATOM 268 C2 DG A 9 -1.862 -11.481 -2.174 1.00 0.50 C ATOM 269 N2 DG A 9 -1.883 -11.560 -3.513 1.00 0.66 N ATOM 270 N3 DG A 9 -2.943 -11.554 -1.381 1.00 0.40 N ATOM 271 C4 DG A 9 -2.674 -11.452 -0.057 1.00 0.37 C ATOM 0 H5' DG A 9 -6.507 -9.136 3.620 1.00 0.44 H new ATOM 0 H5'' DG A 9 -7.605 -10.385 4.174 1.00 0.44 H new ATOM 0 H4' DG A 9 -7.692 -10.222 1.800 1.00 0.51 H new ATOM 0 H3' DG A 9 -7.458 -12.684 3.000 1.00 0.50 H new ATOM 0 H2' DG A 9 -5.023 -12.860 2.752 1.00 0.45 H new ATOM 0 H2'' DG A 9 -5.604 -13.717 1.339 1.00 0.45 H new ATOM 0 H1' DG A 9 -5.299 -11.877 -0.096 1.00 0.44 H new ATOM 0 H8 DG A 9 -3.244 -11.328 3.124 1.00 0.53 H new ATOM 0 H1 DG A 9 0.183 -11.281 -2.306 1.00 0.51 H new ATOM 0 H21 DG A 9 -2.770 -11.679 -4.003 1.00 0.66 H new ATOM 0 H22 DG A 9 -1.012 -11.501 -4.041 1.00 0.66 H new ATOM 283 P DC A 10 -8.250 -13.952 0.304 1.00 0.60 P ATOM 284 OP1 DC A 10 -9.605 -13.880 -0.284 1.00 0.80 O ATOM 285 OP2 DC A 10 -7.956 -15.080 1.217 1.00 0.73 O ATOM 286 O5' DC A 10 -7.177 -13.969 -0.901 1.00 0.49 O ATOM 287 C5' DC A 10 -7.205 -13.206 -2.130 1.00 0.55 C ATOM 288 C4' DC A 10 -6.459 -13.886 -3.295 1.00 0.66 C ATOM 289 O4' DC A 10 -5.012 -13.726 -3.147 1.00 0.69 O ATOM 290 C3' DC A 10 -6.715 -15.389 -3.381 1.00 0.75 C ATOM 291 O3' DC A 10 -6.776 -15.837 -4.731 1.00 0.98 O ATOM 292 C2' DC A 10 -5.498 -15.999 -2.694 1.00 0.75 C ATOM 293 C1' DC A 10 -4.380 -14.995 -3.017 1.00 0.73 C ATOM 294 N1 DC A 10 -3.316 -14.850 -1.977 1.00 0.66 N ATOM 295 C2 DC A 10 -1.943 -14.826 -2.384 1.00 0.78 C ATOM 296 O2 DC A 10 -1.605 -14.946 -3.575 1.00 0.97 O ATOM 297 N3 DC A 10 -0.966 -14.667 -1.427 1.00 0.77 N ATOM 298 C4 DC A 10 -1.295 -14.535 -0.128 1.00 0.68 C ATOM 299 N4 DC A 10 -0.319 -14.392 0.793 1.00 0.77 N ATOM 300 C5 DC A 10 -2.665 -14.553 0.298 1.00 0.62 C ATOM 301 C6 DC A 10 -3.617 -14.702 -0.634 1.00 0.56 C ATOM 0 H5' DC A 10 -6.764 -12.226 -1.950 1.00 0.55 H new ATOM 0 H5'' DC A 10 -8.242 -13.040 -2.421 1.00 0.55 H new ATOM 0 H4' DC A 10 -6.838 -13.399 -4.194 1.00 0.66 H new ATOM 0 H3' DC A 10 -7.666 -15.667 -2.926 1.00 0.75 H new ATOM 0 H2' DC A 10 -5.650 -16.102 -1.620 1.00 0.75 H new ATOM 0 H2'' DC A 10 -5.272 -16.993 -3.080 1.00 0.75 H new ATOM 0 HO3' DC A 10 -6.939 -16.803 -4.748 1.00 0.98 H new ATOM 0 H1' DC A 10 -3.876 -15.363 -3.911 1.00 0.73 H new ATOM 0 H41 DC A 10 -0.559 -14.291 1.779 1.00 0.77 H new ATOM 0 H42 DC A 10 0.659 -14.385 0.503 1.00 0.77 H new ATOM 0 H5 DC A 10 -2.922 -14.449 1.342 1.00 0.62 H new ATOM 0 H6 DC A 10 -4.652 -14.707 -0.327 1.00 0.56 H new TER 314 DC A 10 ATOM 315 O5' DG B 11 10.154 -14.296 -4.002 1.00 1.77 O ATOM 316 C5' DG B 11 9.827 -14.715 -5.322 1.00 1.85 C ATOM 317 C4' DG B 11 8.349 -14.414 -5.624 1.00 1.67 C ATOM 318 O4' DG B 11 7.488 -14.835 -4.509 1.00 1.54 O ATOM 319 C3' DG B 11 8.101 -12.907 -5.756 1.00 1.53 C ATOM 320 O3' DG B 11 7.402 -12.625 -6.981 1.00 1.59 O ATOM 321 C2' DG B 11 7.191 -12.571 -4.571 1.00 1.33 C ATOM 322 C1' DG B 11 6.442 -13.884 -4.447 1.00 1.35 C ATOM 323 N9 DG B 11 5.684 -14.059 -3.190 1.00 1.22 N ATOM 324 C8 DG B 11 6.158 -14.202 -1.925 1.00 1.21 C ATOM 325 N7 DG B 11 5.234 -14.346 -1.005 1.00 1.13 N ATOM 326 C5 DG B 11 4.048 -14.298 -1.708 1.00 1.04 C ATOM 327 C6 DG B 11 2.719 -14.399 -1.242 1.00 0.93 C ATOM 328 O6 DG B 11 2.360 -14.560 -0.069 1.00 0.90 O ATOM 329 N1 DG B 11 1.791 -14.298 -2.294 1.00 0.90 N ATOM 330 C2 DG B 11 2.099 -14.124 -3.631 1.00 0.99 C ATOM 331 N2 DG B 11 1.005 -14.062 -4.404 1.00 0.99 N ATOM 332 N3 DG B 11 3.368 -14.025 -4.056 1.00 1.10 N ATOM 333 C4 DG B 11 4.291 -14.119 -3.069 1.00 1.10 C ATOM 0 H5' DG B 11 10.018 -15.783 -5.430 1.00 1.85 H new ATOM 0 H5'' DG B 11 10.465 -14.203 -6.042 1.00 1.85 H new ATOM 0 H4' DG B 11 8.122 -14.947 -6.547 1.00 1.67 H new ATOM 0 H3' DG B 11 9.028 -12.334 -5.764 1.00 1.53 H new ATOM 0 H2' DG B 11 7.752 -12.322 -3.670 1.00 1.33 H new ATOM 0 H2'' DG B 11 6.529 -11.730 -4.777 1.00 1.33 H new ATOM 0 HO5' DG B 11 9.366 -14.385 -3.426 1.00 1.77 H new ATOM 0 H1' DG B 11 5.676 -13.964 -5.218 1.00 1.35 H new ATOM 0 H8 DG B 11 7.213 -14.197 -1.695 1.00 1.21 H new ATOM 0 H1 DG B 11 0.803 -14.358 -2.049 1.00 0.90 H new ATOM 0 H21 DG B 11 1.099 -13.935 -5.412 1.00 0.99 H new ATOM 0 H22 DG B 11 0.079 -14.142 -3.984 1.00 0.99 H new ATOM 346 P DC B 12 7.388 -11.212 -7.740 1.00 1.62 P ATOM 347 OP1 DC B 12 8.190 -11.336 -8.976 1.00 1.90 O ATOM 348 OP2 DC B 12 7.765 -10.163 -6.765 1.00 1.65 O ATOM 349 O5' DC B 12 5.831 -11.057 -8.099 1.00 1.45 O ATOM 350 C5' DC B 12 4.999 -11.832 -8.994 1.00 1.48 C ATOM 351 C4' DC B 12 3.496 -11.509 -8.870 1.00 1.39 C ATOM 352 O4' DC B 12 3.015 -11.842 -7.525 1.00 1.26 O ATOM 353 C3' DC B 12 3.192 -10.024 -9.081 1.00 1.38 C ATOM 354 O3' DC B 12 1.926 -9.841 -9.753 1.00 1.38 O ATOM 355 C2' DC B 12 3.126 -9.502 -7.652 1.00 1.22 C ATOM 356 C1' DC B 12 2.454 -10.677 -6.934 1.00 1.12 C ATOM 357 N1 DC B 12 2.694 -10.726 -5.460 1.00 0.98 N ATOM 358 C2 DC B 12 1.576 -10.877 -4.583 1.00 0.85 C ATOM 359 O2 DC B 12 0.412 -10.983 -5.006 1.00 0.85 O ATOM 360 N3 DC B 12 1.794 -10.930 -3.225 1.00 0.74 N ATOM 361 C4 DC B 12 3.041 -10.828 -2.728 1.00 0.80 C ATOM 362 N4 DC B 12 3.215 -10.880 -1.389 1.00 0.75 N ATOM 363 C5 DC B 12 4.176 -10.672 -3.592 1.00 0.93 C ATOM 364 C6 DC B 12 3.963 -10.630 -4.916 1.00 1.03 C ATOM 0 H5' DC B 12 5.153 -12.892 -8.793 1.00 1.48 H new ATOM 0 H5'' DC B 12 5.318 -11.652 -10.021 1.00 1.48 H new ATOM 0 H4' DC B 12 3.001 -12.099 -9.642 1.00 1.39 H new ATOM 0 H3' DC B 12 3.927 -9.514 -9.704 1.00 1.38 H new ATOM 0 H2' DC B 12 4.115 -9.284 -7.248 1.00 1.22 H new ATOM 0 H2'' DC B 12 2.542 -8.585 -7.576 1.00 1.22 H new ATOM 0 H1' DC B 12 1.374 -10.584 -7.045 1.00 1.12 H new ATOM 0 H41 DC B 12 4.152 -10.805 -0.993 1.00 0.75 H new ATOM 0 H42 DC B 12 2.409 -10.995 -0.774 1.00 0.75 H new ATOM 0 H5 DC B 12 5.174 -10.591 -3.188 1.00 0.93 H new ATOM 0 H6 DC B 12 4.809 -10.518 -5.578 1.00 1.03 H new ATOM 376 P DG B 13 1.311 -8.526 -10.444 1.00 1.42 P ATOM 377 OP1 DG B 13 1.306 -8.680 -11.918 1.00 1.50 O ATOM 378 OP2 DG B 13 1.952 -7.326 -9.861 1.00 1.40 O ATOM 379 O5' DG B 13 -0.189 -8.564 -9.887 1.00 1.43 O ATOM 380 C5' DG B 13 -1.252 -9.485 -10.211 1.00 1.51 C ATOM 381 C4' DG B 13 -2.475 -9.349 -9.287 1.00 1.40 C ATOM 382 O4' DG B 13 -2.071 -9.518 -7.897 1.00 1.17 O ATOM 383 C3' DG B 13 -3.153 -7.987 -9.354 1.00 1.41 C ATOM 384 O3' DG B 13 -4.561 -8.131 -9.091 1.00 1.44 O ATOM 385 C2' DG B 13 -2.494 -7.217 -8.222 1.00 1.20 C ATOM 386 C1' DG B 13 -2.317 -8.316 -7.176 1.00 1.06 C ATOM 387 N9 DG B 13 -1.168 -8.109 -6.273 1.00 0.94 N ATOM 388 C8 DG B 13 0.136 -7.885 -6.588 1.00 0.94 C ATOM 389 N7 DG B 13 0.935 -7.740 -5.556 1.00 0.85 N ATOM 390 C5 DG B 13 0.107 -7.900 -4.474 1.00 0.72 C ATOM 391 C6 DG B 13 0.414 -7.860 -3.109 1.00 0.61 C ATOM 392 O6 DG B 13 1.537 -7.678 -2.623 1.00 0.58 O ATOM 393 N1 DG B 13 -0.733 -8.055 -2.318 1.00 0.58 N ATOM 394 C2 DG B 13 -2.019 -8.271 -2.787 1.00 0.64 C ATOM 395 N2 DG B 13 -2.938 -8.436 -1.831 1.00 0.56 N ATOM 396 N3 DG B 13 -2.282 -8.321 -4.093 1.00 0.74 N ATOM 397 C4 DG B 13 -1.205 -8.126 -4.883 1.00 0.80 C ATOM 0 H5' DG B 13 -0.871 -10.505 -10.151 1.00 1.51 H new ATOM 0 H5'' DG B 13 -1.564 -9.321 -11.242 1.00 1.51 H new ATOM 0 H4' DG B 13 -3.171 -10.115 -9.630 1.00 1.40 H new ATOM 0 H3' DG B 13 -3.054 -7.500 -10.324 1.00 1.41 H new ATOM 0 H2' DG B 13 -1.542 -6.778 -8.523 1.00 1.20 H new ATOM 0 H2'' DG B 13 -3.121 -6.402 -7.860 1.00 1.20 H new ATOM 0 H1' DG B 13 -3.212 -8.332 -6.555 1.00 1.06 H new ATOM 0 H8 DG B 13 0.487 -7.831 -7.608 1.00 0.94 H new ATOM 0 H1 DG B 13 -0.606 -8.036 -1.306 1.00 0.58 H new ATOM 0 H21 DG B 13 -3.913 -8.601 -2.083 1.00 0.56 H new ATOM 0 H22 DG B 13 -2.665 -8.397 -0.849 1.00 0.56 H new ATOM 409 P DT B 14 -5.727 -7.067 -9.343 1.00 1.53 P ATOM 410 OP1 DT B 14 -6.974 -7.814 -9.629 1.00 1.72 O ATOM 411 OP2 DT B 14 -5.273 -6.086 -10.353 1.00 1.62 O ATOM 412 O5' DT B 14 -5.874 -6.337 -7.916 1.00 1.42 O ATOM 413 C5' DT B 14 -6.441 -6.946 -6.732 1.00 1.33 C ATOM 414 C4' DT B 14 -6.067 -6.230 -5.431 1.00 1.09 C ATOM 415 O4' DT B 14 -4.624 -6.285 -5.217 1.00 0.96 O ATOM 416 C3' DT B 14 -6.432 -4.732 -5.421 1.00 1.18 C ATOM 417 O3' DT B 14 -7.263 -4.446 -4.274 1.00 1.10 O ATOM 418 C2' DT B 14 -5.055 -4.044 -5.301 1.00 1.12 C ATOM 419 C1' DT B 14 -4.279 -5.106 -4.534 1.00 0.91 C ATOM 420 N1 DT B 14 -2.791 -4.952 -4.502 1.00 0.85 N ATOM 421 C2 DT B 14 -2.148 -5.046 -3.238 1.00 0.74 C ATOM 422 O2 DT B 14 -2.724 -5.239 -2.166 1.00 0.69 O ATOM 423 N3 DT B 14 -0.756 -4.897 -3.270 1.00 0.71 N ATOM 424 C4 DT B 14 0.043 -4.673 -4.390 1.00 0.79 C ATOM 425 O4 DT B 14 1.262 -4.553 -4.249 1.00 0.77 O ATOM 426 C5 DT B 14 -0.690 -4.591 -5.650 1.00 0.94 C ATOM 427 C7 DT B 14 0.085 -4.348 -6.896 1.00 1.06 C ATOM 428 C6 DT B 14 -2.035 -4.732 -5.647 1.00 0.95 C ATOM 0 H5' DT B 14 -6.110 -7.983 -6.674 1.00 1.33 H new ATOM 0 H5'' DT B 14 -7.527 -6.963 -6.828 1.00 1.33 H new ATOM 0 H4' DT B 14 -6.632 -6.749 -4.656 1.00 1.09 H new ATOM 0 H3' DT B 14 -6.992 -4.400 -6.296 1.00 1.18 H new ATOM 0 H2' DT B 14 -4.613 -3.829 -6.274 1.00 1.12 H new ATOM 0 H2'' DT B 14 -5.110 -3.099 -4.760 1.00 1.12 H new ATOM 0 H1' DT B 14 -4.540 -5.064 -3.477 1.00 0.91 H new ATOM 0 H3 DT B 14 -0.273 -4.959 -2.374 1.00 0.71 H new ATOM 0 H71 DT B 14 -0.424 -4.816 -7.738 1.00 1.06 H new ATOM 0 H72 DT B 14 0.165 -3.275 -7.071 1.00 1.06 H new ATOM 0 H73 DT B 14 1.083 -4.774 -6.793 1.00 1.06 H new ATOM 0 H6 DT B 14 -2.553 -4.670 -6.592 1.00 0.95 H new ATOM 441 P DG B 15 -7.947 -3.146 -3.605 1.00 1.19 P ATOM 442 OP1 DG B 15 -9.339 -2.995 -4.093 1.00 1.36 O ATOM 443 OP2 DG B 15 -7.035 -1.980 -3.709 1.00 1.31 O ATOM 444 O5' DG B 15 -7.954 -3.609 -2.057 1.00 1.05 O ATOM 445 C5' DG B 15 -6.741 -3.936 -1.342 1.00 0.92 C ATOM 446 C4' DG B 15 -6.719 -3.473 0.121 1.00 0.85 C ATOM 447 O4' DG B 15 -5.324 -3.510 0.547 1.00 0.76 O ATOM 448 C3' DG B 15 -7.160 -2.024 0.353 1.00 1.00 C ATOM 449 O3' DG B 15 -7.530 -1.790 1.737 1.00 1.02 O ATOM 450 C2' DG B 15 -5.892 -1.282 -0.036 1.00 0.97 C ATOM 451 C1' DG B 15 -4.806 -2.182 0.563 1.00 0.82 C ATOM 452 N9 DG B 15 -3.523 -2.133 -0.176 1.00 0.80 N ATOM 453 C8 DG B 15 -3.300 -2.168 -1.521 1.00 0.83 C ATOM 454 N7 DG B 15 -2.034 -2.075 -1.866 1.00 0.78 N ATOM 455 C5 DG B 15 -1.369 -1.979 -0.668 1.00 0.73 C ATOM 456 C6 DG B 15 0.006 -1.857 -0.426 1.00 0.69 C ATOM 457 O6 DG B 15 0.884 -1.824 -1.291 1.00 0.67 O ATOM 458 N1 DG B 15 0.294 -1.775 0.953 1.00 0.69 N ATOM 459 C2 DG B 15 -0.645 -1.815 1.971 1.00 0.71 C ATOM 460 N2 DG B 15 -0.084 -1.719 3.187 1.00 0.72 N ATOM 461 N3 DG B 15 -1.956 -1.926 1.715 1.00 0.74 N ATOM 462 C4 DG B 15 -2.260 -2.006 0.400 1.00 0.75 C ATOM 0 H5' DG B 15 -5.895 -3.489 -1.864 1.00 0.92 H new ATOM 0 H5'' DG B 15 -6.598 -5.016 -1.370 1.00 0.92 H new ATOM 0 H4' DG B 15 -7.408 -4.125 0.658 1.00 0.85 H new ATOM 0 H3' DG B 15 -8.046 -1.721 -0.205 1.00 1.00 H new ATOM 0 H2' DG B 15 -5.791 -1.184 -1.117 1.00 0.97 H new ATOM 0 H2'' DG B 15 -5.864 -0.275 0.380 1.00 0.97 H new ATOM 0 H1' DG B 15 -4.576 -1.834 1.570 1.00 0.82 H new ATOM 0 H8 DG B 15 -4.097 -2.264 -2.243 1.00 0.83 H new ATOM 0 H1 DG B 15 1.273 -1.678 1.222 1.00 0.69 H new ATOM 0 H21 DG B 15 -0.670 -1.736 4.022 1.00 0.72 H new ATOM 0 H22 DG B 15 0.928 -1.629 3.276 1.00 0.72 H new ATOM 474 P DA B 16 -7.650 -0.469 2.654 1.00 1.12 P ATOM 475 OP1 DA B 16 -8.636 -0.719 3.731 1.00 1.24 O ATOM 476 OP2 DA B 16 -7.866 0.709 1.782 1.00 1.25 O ATOM 477 O5' DA B 16 -6.176 -0.339 3.316 1.00 1.05 O ATOM 478 C5' DA B 16 -5.575 -1.113 4.386 1.00 0.99 C ATOM 479 C4' DA B 16 -4.599 -0.328 5.295 1.00 1.04 C ATOM 480 O4' DA B 16 -3.310 -0.091 4.636 1.00 1.04 O ATOM 481 C3' DA B 16 -5.130 1.029 5.732 1.00 1.13 C ATOM 482 O3' DA B 16 -4.813 1.280 7.120 1.00 1.25 O ATOM 483 C2' DA B 16 -4.420 2.010 4.797 1.00 1.01 C ATOM 484 C1' DA B 16 -3.146 1.287 4.307 1.00 0.98 C ATOM 485 N9 DA B 16 -2.896 1.294 2.849 1.00 0.96 N ATOM 486 C8 DA B 16 -3.775 1.203 1.806 1.00 0.97 C ATOM 487 N7 DA B 16 -3.214 1.198 0.615 1.00 0.93 N ATOM 488 C5 DA B 16 -1.870 1.267 0.894 1.00 0.91 C ATOM 489 C6 DA B 16 -0.750 1.289 0.042 1.00 0.85 C ATOM 490 N6 DA B 16 -0.830 1.225 -1.300 1.00 0.82 N ATOM 491 N1 DA B 16 0.459 1.369 0.638 1.00 0.83 N ATOM 492 C2 DA B 16 0.553 1.419 1.957 1.00 0.87 C ATOM 493 N3 DA B 16 -0.417 1.413 2.854 1.00 0.89 N ATOM 494 C4 DA B 16 -1.633 1.327 2.253 1.00 0.93 C ATOM 0 H5' DA B 16 -5.041 -1.956 3.948 1.00 0.99 H new ATOM 0 H5'' DA B 16 -6.371 -1.527 5.005 1.00 0.99 H new ATOM 0 H4' DA B 16 -4.481 -0.966 6.171 1.00 1.04 H new ATOM 0 H3' DA B 16 -6.215 1.110 5.667 1.00 1.13 H new ATOM 0 H2' DA B 16 -5.061 2.282 3.958 1.00 1.01 H new ATOM 0 H2'' DA B 16 -4.168 2.933 5.319 1.00 1.01 H new ATOM 0 H1' DA B 16 -2.318 1.817 4.777 1.00 0.98 H new ATOM 0 H8 DA B 16 -4.844 1.140 1.948 1.00 0.97 H new ATOM 0 H61 DA B 16 0.020 1.245 -1.863 1.00 0.82 H new ATOM 0 H62 DA B 16 -1.741 1.156 -1.754 1.00 0.82 H new ATOM 0 H2 DA B 16 1.556 1.472 2.353 1.00 0.87 H new ATOM 506 P DT B 17 -5.463 2.274 8.208 1.00 1.35 P ATOM 507 OP1 DT B 17 -5.361 1.645 9.547 1.00 1.67 O ATOM 508 OP2 DT B 17 -6.813 2.696 7.766 1.00 1.57 O ATOM 509 O5' DT B 17 -4.448 3.526 8.153 1.00 1.00 O ATOM 510 C5' DT B 17 -3.079 3.481 8.627 1.00 0.90 C ATOM 511 C4' DT B 17 -2.128 4.427 7.883 1.00 0.68 C ATOM 512 O4' DT B 17 -2.056 4.083 6.464 1.00 0.58 O ATOM 513 C3' DT B 17 -2.580 5.894 7.941 1.00 0.52 C ATOM 514 O3' DT B 17 -1.522 6.717 8.472 1.00 0.64 O ATOM 515 C2' DT B 17 -2.855 6.230 6.468 1.00 0.45 C ATOM 516 C1' DT B 17 -1.877 5.291 5.761 1.00 0.42 C ATOM 517 N1 DT B 17 -2.105 5.056 4.301 1.00 0.39 N ATOM 518 C2 DT B 17 -0.954 4.936 3.465 1.00 0.38 C ATOM 519 O2 DT B 17 0.221 5.004 3.834 1.00 0.43 O ATOM 520 N3 DT B 17 -1.249 4.709 2.119 1.00 0.41 N ATOM 521 C4 DT B 17 -2.498 4.607 1.518 1.00 0.48 C ATOM 522 O4 DT B 17 -2.566 4.414 0.301 1.00 0.55 O ATOM 523 C5 DT B 17 -3.623 4.747 2.431 1.00 0.54 C ATOM 524 C7 DT B 17 -4.998 4.645 1.862 1.00 0.70 C ATOM 525 C6 DT B 17 -3.382 4.963 3.744 1.00 0.46 C ATOM 0 H5' DT B 17 -2.707 2.461 8.533 1.00 0.90 H new ATOM 0 H5'' DT B 17 -3.065 3.729 9.688 1.00 0.90 H new ATOM 0 H4' DT B 17 -1.165 4.312 8.381 1.00 0.68 H new ATOM 0 H3' DT B 17 -3.445 6.063 8.582 1.00 0.52 H new ATOM 0 H2' DT B 17 -3.890 6.033 6.187 1.00 0.45 H new ATOM 0 H2'' DT B 17 -2.657 7.277 6.241 1.00 0.45 H new ATOM 0 H1' DT B 17 -0.878 5.726 5.777 1.00 0.42 H new ATOM 0 H3 DT B 17 -0.446 4.605 1.498 1.00 0.41 H new ATOM 0 H71 DT B 17 -5.675 4.242 2.616 1.00 0.70 H new ATOM 0 H72 DT B 17 -5.341 5.634 1.559 1.00 0.70 H new ATOM 0 H73 DT B 17 -4.985 3.984 0.995 1.00 0.70 H new ATOM 0 H6 DT B 17 -4.231 5.070 4.403 1.00 0.46 H new ATOM 538 P DG B 18 -1.407 8.276 8.847 1.00 0.70 P ATOM 539 OP1 DG B 18 -1.556 8.491 10.304 1.00 0.90 O ATOM 540 OP2 DG B 18 -2.244 9.072 7.917 1.00 0.73 O ATOM 541 O5' DG B 18 0.107 8.527 8.408 1.00 0.73 O ATOM 542 C5' DG B 18 1.376 8.002 8.849 1.00 0.82 C ATOM 543 C4' DG B 18 2.533 8.394 7.909 1.00 0.77 C ATOM 544 O4' DG B 18 2.265 7.893 6.561 1.00 0.62 O ATOM 545 C3' DG B 18 2.723 9.899 7.760 1.00 0.78 C ATOM 546 O3' DG B 18 4.109 10.213 7.521 1.00 0.88 O ATOM 547 C2' DG B 18 1.879 10.223 6.536 1.00 0.65 C ATOM 548 C1' DG B 18 2.106 8.989 5.665 1.00 0.50 C ATOM 549 N9 DG B 18 0.965 8.678 4.776 1.00 0.39 N ATOM 550 C8 DG B 18 -0.349 8.530 5.102 1.00 0.40 C ATOM 551 N7 DG B 18 -1.139 8.265 4.086 1.00 0.38 N ATOM 552 C5 DG B 18 -0.291 8.216 3.008 1.00 0.32 C ATOM 553 C6 DG B 18 -0.581 7.962 1.660 1.00 0.34 C ATOM 554 O6 DG B 18 -1.697 7.721 1.190 1.00 0.43 O ATOM 555 N1 DG B 18 0.573 8.009 0.861 1.00 0.32 N ATOM 556 C2 DG B 18 1.859 8.275 1.303 1.00 0.29 C ATOM 557 N2 DG B 18 2.778 8.265 0.330 1.00 0.30 N ATOM 558 N3 DG B 18 2.111 8.514 2.598 1.00 0.32 N ATOM 559 C4 DG B 18 1.021 8.472 3.397 1.00 0.32 C ATOM 0 H5' DG B 18 1.315 6.916 8.912 1.00 0.82 H new ATOM 0 H5'' DG B 18 1.588 8.368 9.854 1.00 0.82 H new ATOM 0 H4' DG B 18 3.426 7.963 8.361 1.00 0.77 H new ATOM 0 H3' DG B 18 2.436 10.465 8.647 1.00 0.78 H new ATOM 0 H2' DG B 18 0.827 10.357 6.788 1.00 0.65 H new ATOM 0 H2'' DG B 18 2.208 11.138 6.043 1.00 0.65 H new ATOM 0 H1' DG B 18 2.970 9.172 5.026 1.00 0.50 H new ATOM 0 H8 DG B 18 -0.713 8.623 6.115 1.00 0.40 H new ATOM 0 H1 DG B 18 0.453 7.831 -0.136 1.00 0.32 H new ATOM 0 H21 DG B 18 3.757 8.450 0.551 1.00 0.30 H new ATOM 0 H22 DG B 18 2.500 8.073 -0.632 1.00 0.30 H new ATOM 571 P DC B 19 4.766 11.655 7.271 1.00 0.96 P ATOM 572 OP1 DC B 19 6.149 11.631 7.796 1.00 1.12 O ATOM 573 OP2 DC B 19 3.851 12.689 7.808 1.00 1.16 O ATOM 574 O5' DC B 19 4.824 11.736 5.664 1.00 0.80 O ATOM 575 C5' DC B 19 5.763 10.977 4.861 1.00 0.71 C ATOM 576 C4' DC B 19 5.776 11.383 3.382 1.00 0.72 C ATOM 577 O4' DC B 19 4.530 10.964 2.741 1.00 0.68 O ATOM 578 C3' DC B 19 5.893 12.896 3.201 1.00 0.84 C ATOM 579 O3' DC B 19 6.880 13.223 2.200 1.00 0.98 O ATOM 580 C2' DC B 19 4.482 13.318 2.797 1.00 0.84 C ATOM 581 C1' DC B 19 3.912 12.070 2.105 1.00 0.74 C ATOM 582 N1 DC B 19 2.433 11.860 2.239 1.00 0.69 N ATOM 583 C2 DC B 19 1.681 11.459 1.090 1.00 0.67 C ATOM 584 O2 DC B 19 2.213 11.318 -0.021 1.00 0.73 O ATOM 585 N3 DC B 19 0.328 11.232 1.217 1.00 0.68 N ATOM 586 C4 DC B 19 -0.284 11.387 2.404 1.00 0.70 C ATOM 587 N4 DC B 19 -1.613 11.173 2.483 1.00 0.73 N ATOM 588 C5 DC B 19 0.454 11.778 3.571 1.00 0.72 C ATOM 589 C6 DC B 19 1.772 11.992 3.448 1.00 0.71 C ATOM 0 H5' DC B 19 5.519 9.917 4.936 1.00 0.71 H new ATOM 0 H5'' DC B 19 6.765 11.103 5.272 1.00 0.71 H new ATOM 0 H4' DC B 19 6.642 10.898 2.932 1.00 0.72 H new ATOM 0 H3' DC B 19 6.231 13.416 4.097 1.00 0.84 H new ATOM 0 H2' DC B 19 3.886 13.603 3.664 1.00 0.84 H new ATOM 0 H2'' DC B 19 4.498 14.176 2.125 1.00 0.84 H new ATOM 0 H1' DC B 19 4.105 12.187 1.039 1.00 0.74 H new ATOM 0 H41 DC B 19 -2.096 11.285 3.375 1.00 0.73 H new ATOM 0 H42 DC B 19 -2.136 10.899 1.651 1.00 0.73 H new ATOM 0 H5 DC B 19 -0.040 11.897 4.524 1.00 0.72 H new ATOM 0 H6 DC B 19 2.338 12.277 4.323 1.00 0.71 H new ATOM 601 P DG B 20 7.398 14.636 1.630 1.00 1.11 P ATOM 602 OP1 DG B 20 8.809 14.507 1.198 1.00 1.35 O ATOM 603 OP2 DG B 20 7.065 15.714 2.588 1.00 1.38 O ATOM 604 O5' DG B 20 6.475 14.793 0.323 1.00 0.86 O ATOM 605 C5' DG B 20 6.563 13.919 -0.824 1.00 0.84 C ATOM 606 C4' DG B 20 5.417 14.142 -1.805 1.00 0.87 C ATOM 607 O4' DG B 20 4.148 13.786 -1.182 1.00 0.87 O ATOM 608 C3' DG B 20 5.275 15.618 -2.204 1.00 1.06 C ATOM 609 O3' DG B 20 5.311 15.791 -3.618 1.00 1.19 O ATOM 610 C2' DG B 20 3.896 16.018 -1.673 1.00 1.06 C ATOM 611 C1' DG B 20 3.178 14.675 -1.686 1.00 0.96 C ATOM 612 N9 DG B 20 1.979 14.583 -0.829 1.00 1.02 N ATOM 613 C8 DG B 20 1.879 14.692 0.522 1.00 1.06 C ATOM 614 N7 DG B 20 0.662 14.547 0.996 1.00 1.12 N ATOM 615 C5 DG B 20 -0.105 14.317 -0.124 1.00 1.09 C ATOM 616 C6 DG B 20 -1.488 14.090 -0.230 1.00 1.16 C ATOM 617 O6 DG B 20 -2.298 14.047 0.703 1.00 1.22 O ATOM 618 N1 DG B 20 -1.883 13.904 -1.565 1.00 1.18 N ATOM 619 C2 DG B 20 -1.051 13.928 -2.669 1.00 1.11 C ATOM 620 N2 DG B 20 -1.694 13.723 -3.829 1.00 1.18 N ATOM 621 N3 DG B 20 0.268 14.150 -2.550 1.00 1.05 N ATOM 622 C4 DG B 20 0.683 14.332 -1.272 1.00 1.04 C ATOM 0 H5' DG B 20 6.557 12.881 -0.490 1.00 0.84 H new ATOM 0 H5'' DG B 20 7.513 14.084 -1.333 1.00 0.84 H new ATOM 0 H4' DG B 20 5.644 13.528 -2.677 1.00 0.87 H new ATOM 0 H3' DG B 20 6.090 16.220 -1.803 1.00 1.06 H new ATOM 0 H2' DG B 20 3.948 16.448 -0.673 1.00 1.06 H new ATOM 0 H2'' DG B 20 3.406 16.754 -2.311 1.00 1.06 H new ATOM 0 HO3' DG B 20 5.216 16.742 -3.834 1.00 1.19 H new ATOM 0 H1' DG B 20 2.808 14.475 -2.692 1.00 0.96 H new ATOM 0 H8 DG B 20 2.732 14.883 1.156 1.00 1.06 H new ATOM 0 H1 DG B 20 -2.874 13.736 -1.736 1.00 1.18 H new ATOM 0 H21 DG B 20 -1.174 13.721 -4.707 1.00 1.18 H new ATOM 0 H22 DG B 20 -2.702 13.570 -3.833 1.00 1.18 H new TER 635 DG B 20