USER MOD reduce.3.24.130724 H: found=0, std=0, add=232, rem=0, adj=0 USER MOD reduce.3.24.130724 removed 232 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 9 DT C7 :methyl 150:sc= -0.0883 (180deg=0) USER MOD Set 1.2: B 9 DT C7 :methyl 150:sc= -0.121 (180deg=-0.0327) USER MOD Single : A 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 4 DT C7 :methyl 150:sc= -0.436 (180deg=-0.436) USER MOD Single : A 5 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 4 DT C7 :methyl 150:sc= -0.633 (180deg=-0.633) USER MOD Single : B 5 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 P DT A 1 7.597 -4.494 10.158 1.00 0.00 P ATOM 2 OP1 DT A 1 8.986 -4.889 9.837 1.00 0.00 O ATOM 3 OP2 DT A 1 7.327 -3.416 11.131 1.00 0.00 O ATOM 4 O5' DT A 1 6.869 -4.138 8.768 1.00 0.00 O ATOM 5 C5' DT A 1 6.361 -2.841 8.536 1.00 0.00 C ATOM 6 C4' DT A 1 5.605 -2.798 7.205 1.00 0.00 C ATOM 7 O4' DT A 1 4.333 -3.408 7.334 1.00 0.00 O ATOM 8 C3' DT A 1 5.368 -1.340 6.768 1.00 0.00 C ATOM 9 O3' DT A 1 5.702 -1.091 5.421 1.00 0.00 O ATOM 10 C2' DT A 1 3.871 -1.168 6.959 1.00 0.00 C ATOM 11 C1' DT A 1 3.403 -2.590 6.664 1.00 0.00 C ATOM 12 N1 DT A 1 2.044 -2.924 7.159 1.00 0.00 N ATOM 13 C2 DT A 1 1.158 -3.542 6.272 1.00 0.00 C ATOM 14 O2 DT A 1 1.368 -3.676 5.067 1.00 0.00 O ATOM 15 N3 DT A 1 -0.018 -4.022 6.802 1.00 0.00 N ATOM 16 C4 DT A 1 -0.414 -3.919 8.117 1.00 0.00 C ATOM 17 O4 DT A 1 -1.477 -4.433 8.443 1.00 0.00 O ATOM 18 C5 DT A 1 0.527 -3.203 8.978 1.00 0.00 C ATOM 19 C7 DT A 1 0.214 -2.951 10.439 1.00 0.00 C ATOM 20 C6 DT A 1 1.704 -2.742 8.484 1.00 0.00 C ATOM 0 H5' DT A 1 7.178 -2.120 8.522 1.00 0.00 H new ATOM 0 H5'' DT A 1 5.696 -2.552 9.350 1.00 0.00 H new ATOM 0 H4' DT A 1 6.211 -3.328 6.470 1.00 0.00 H new ATOM 0 H3' DT A 1 5.991 -0.652 7.340 1.00 0.00 H new ATOM 0 H2' DT A 1 3.614 -0.845 7.968 1.00 0.00 H new ATOM 0 H2'' DT A 1 3.444 -0.437 6.272 1.00 0.00 H new ATOM 0 H1' DT A 1 3.347 -2.726 5.584 1.00 0.00 H new ATOM 0 H3 DT A 1 -0.654 -4.498 6.162 1.00 0.00 H new ATOM 0 H71 DT A 1 1.142 -2.916 11.009 1.00 0.00 H new ATOM 0 H72 DT A 1 -0.310 -2.001 10.540 1.00 0.00 H new ATOM 0 H73 DT A 1 -0.416 -3.755 10.820 1.00 0.00 H new ATOM 0 H6 DT A 1 2.387 -2.223 9.140 1.00 0.00 H new ATOM 33 P DC A 2 7.245 -0.946 4.969 1.00 0.00 P ATOM 34 OP1 DC A 2 7.294 -0.748 3.516 1.00 0.00 O ATOM 35 OP2 DC A 2 8.008 -2.058 5.596 1.00 0.00 O ATOM 36 O5' DC A 2 7.661 0.427 5.695 1.00 0.00 O ATOM 37 C5' DC A 2 6.949 1.636 5.533 1.00 0.00 C ATOM 38 C4' DC A 2 7.196 2.253 4.142 1.00 0.00 C ATOM 39 O4' DC A 2 6.098 1.928 3.300 1.00 0.00 O ATOM 40 C3' DC A 2 7.305 3.784 4.208 1.00 0.00 C ATOM 41 O3' DC A 2 8.495 4.328 3.628 1.00 0.00 O ATOM 42 C2' DC A 2 5.974 4.271 3.645 1.00 0.00 C ATOM 43 C1' DC A 2 5.455 3.088 2.824 1.00 0.00 C ATOM 44 N1 DC A 2 3.987 2.848 2.932 1.00 0.00 N ATOM 45 C2 DC A 2 3.244 2.680 1.755 1.00 0.00 C ATOM 46 O2 DC A 2 3.735 2.807 0.627 1.00 0.00 O ATOM 47 N3 DC A 2 1.936 2.362 1.858 1.00 0.00 N ATOM 48 C4 DC A 2 1.373 2.165 3.028 1.00 0.00 C ATOM 49 N4 DC A 2 0.105 1.853 2.998 1.00 0.00 N ATOM 50 C5 DC A 2 2.088 2.301 4.255 1.00 0.00 C ATOM 51 C6 DC A 2 3.393 2.648 4.157 1.00 0.00 C ATOM 0 H5' DC A 2 7.251 2.344 6.305 1.00 0.00 H new ATOM 0 H5'' DC A 2 5.883 1.453 5.667 1.00 0.00 H new ATOM 0 H4' DC A 2 8.134 1.853 3.758 1.00 0.00 H new ATOM 0 H3' DC A 2 7.445 4.153 5.224 1.00 0.00 H new ATOM 0 H2' DC A 2 5.279 4.538 4.441 1.00 0.00 H new ATOM 0 H2'' DC A 2 6.105 5.158 3.025 1.00 0.00 H new ATOM 0 H1' DC A 2 5.663 3.321 1.780 1.00 0.00 H new ATOM 0 H41 DC A 2 -0.400 1.685 3.868 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.380 1.777 2.104 1.00 0.00 H new ATOM 0 H5 DC A 2 1.614 2.136 5.211 1.00 0.00 H new ATOM 0 H6 DC A 2 3.978 2.770 5.056 1.00 0.00 H new ATOM 63 P DG A 3 8.962 4.266 2.071 1.00 0.00 P ATOM 64 OP1 DG A 3 8.890 2.882 1.553 1.00 0.00 O ATOM 65 OP2 DG A 3 10.230 5.012 1.946 1.00 0.00 O ATOM 66 O5' DG A 3 7.842 5.151 1.351 1.00 0.00 O ATOM 67 C5' DG A 3 7.274 4.818 0.102 1.00 0.00 C ATOM 68 C4' DG A 3 6.086 5.752 -0.164 1.00 0.00 C ATOM 69 O4' DG A 3 5.000 5.449 0.690 1.00 0.00 O ATOM 70 C3' DG A 3 6.373 7.247 0.034 1.00 0.00 C ATOM 71 O3' DG A 3 7.080 7.731 -1.117 1.00 0.00 O ATOM 72 C2' DG A 3 4.950 7.775 0.301 1.00 0.00 C ATOM 73 C1' DG A 3 4.128 6.557 0.754 1.00 0.00 C ATOM 74 N9 DG A 3 3.523 6.601 2.114 1.00 0.00 N ATOM 75 C8 DG A 3 4.069 7.016 3.303 1.00 0.00 C ATOM 76 N7 DG A 3 3.319 6.784 4.347 1.00 0.00 N ATOM 77 C5 DG A 3 2.165 6.207 3.816 1.00 0.00 C ATOM 78 C6 DG A 3 0.940 5.765 4.434 1.00 0.00 C ATOM 79 O6 DG A 3 0.600 5.785 5.612 1.00 0.00 O ATOM 80 N1 DG A 3 0.020 5.268 3.535 1.00 0.00 N ATOM 81 C2 DG A 3 0.210 5.223 2.194 1.00 0.00 C ATOM 82 N2 DG A 3 -0.816 4.834 1.482 1.00 0.00 N ATOM 83 N3 DG A 3 1.318 5.655 1.581 1.00 0.00 N ATOM 84 C4 DG A 3 2.270 6.117 2.443 1.00 0.00 C ATOM 0 H5' DG A 3 6.945 3.779 0.102 1.00 0.00 H new ATOM 0 H5'' DG A 3 8.017 4.917 -0.689 1.00 0.00 H new ATOM 0 H4' DG A 3 5.861 5.577 -1.216 1.00 0.00 H new ATOM 0 H3' DG A 3 7.032 7.561 0.843 1.00 0.00 H new ATOM 0 H2' DG A 3 4.958 8.549 1.069 1.00 0.00 H new ATOM 0 H2'' DG A 3 4.524 8.222 -0.597 1.00 0.00 H new ATOM 0 H1' DG A 3 3.264 6.515 0.090 1.00 0.00 H new ATOM 0 H8 DG A 3 5.036 7.493 3.370 1.00 0.00 H new ATOM 0 H1 DG A 3 -0.861 4.911 3.904 1.00 0.00 H new ATOM 0 H21 DG A 3 -0.740 4.778 0.466 1.00 0.00 H new ATOM 0 H22 DG A 3 -1.692 4.587 1.942 1.00 0.00 H new ATOM 96 P DT A 4 7.046 9.269 -1.631 1.00 0.00 P ATOM 97 OP1 DT A 4 8.268 9.516 -2.444 1.00 0.00 O ATOM 98 OP2 DT A 4 6.703 10.157 -0.505 1.00 0.00 O ATOM 99 O5' DT A 4 5.814 9.217 -2.658 1.00 0.00 O ATOM 100 C5' DT A 4 5.835 8.321 -3.763 1.00 0.00 C ATOM 101 C4' DT A 4 4.592 8.453 -4.648 1.00 0.00 C ATOM 102 O4' DT A 4 3.453 7.954 -3.963 1.00 0.00 O ATOM 103 C3' DT A 4 4.301 9.913 -5.051 1.00 0.00 C ATOM 104 O3' DT A 4 4.566 10.268 -6.410 1.00 0.00 O ATOM 105 C2' DT A 4 2.844 10.109 -4.639 1.00 0.00 C ATOM 106 C1' DT A 4 2.329 8.685 -4.416 1.00 0.00 C ATOM 107 N1 DT A 4 1.239 8.666 -3.408 1.00 0.00 N ATOM 108 C2 DT A 4 -0.086 8.622 -3.860 1.00 0.00 C ATOM 109 O2 DT A 4 -0.413 8.444 -5.026 1.00 0.00 O ATOM 110 N3 DT A 4 -1.069 8.787 -2.909 1.00 0.00 N ATOM 111 C4 DT A 4 -0.859 8.972 -1.559 1.00 0.00 C ATOM 112 O4 DT A 4 -1.831 9.132 -0.831 1.00 0.00 O ATOM 113 C5 DT A 4 0.540 8.954 -1.147 1.00 0.00 C ATOM 114 C7 DT A 4 0.898 9.107 0.316 1.00 0.00 C ATOM 115 C6 DT A 4 1.528 8.809 -2.066 1.00 0.00 C ATOM 0 H5' DT A 4 5.908 7.297 -3.395 1.00 0.00 H new ATOM 0 H5'' DT A 4 6.726 8.509 -4.362 1.00 0.00 H new ATOM 0 H4' DT A 4 4.795 7.878 -5.551 1.00 0.00 H new ATOM 0 H3' DT A 4 4.992 10.592 -4.551 1.00 0.00 H new ATOM 0 H2' DT A 4 2.762 10.710 -3.733 1.00 0.00 H new ATOM 0 H2'' DT A 4 2.275 10.623 -5.414 1.00 0.00 H new ATOM 0 H1' DT A 4 1.906 8.258 -5.325 1.00 0.00 H new ATOM 0 H3 DT A 4 -2.036 8.771 -3.232 1.00 0.00 H new ATOM 0 H71 DT A 4 1.824 8.570 0.522 1.00 0.00 H new ATOM 0 H72 DT A 4 1.032 10.163 0.549 1.00 0.00 H new ATOM 0 H73 DT A 4 0.096 8.698 0.931 1.00 0.00 H new ATOM 0 H6 DT A 4 2.558 8.805 -1.742 1.00 0.00 H new ATOM 128 P DT A 5 3.994 9.492 -7.723 1.00 0.00 P ATOM 129 OP1 DT A 5 4.154 10.384 -8.890 1.00 0.00 O ATOM 130 OP2 DT A 5 2.681 8.895 -7.414 1.00 0.00 O ATOM 131 O5' DT A 5 5.064 8.305 -7.852 1.00 0.00 O ATOM 132 C5' DT A 5 6.348 8.561 -8.374 1.00 0.00 C ATOM 133 C4' DT A 5 7.263 7.358 -8.164 1.00 0.00 C ATOM 134 O4' DT A 5 6.896 6.281 -9.024 1.00 0.00 O ATOM 135 C3' DT A 5 8.708 7.779 -8.511 1.00 0.00 C ATOM 136 O3' DT A 5 9.684 7.437 -7.537 1.00 0.00 O ATOM 137 C2' DT A 5 8.942 7.006 -9.808 1.00 0.00 C ATOM 138 C1' DT A 5 8.077 5.761 -9.592 1.00 0.00 C ATOM 139 N1 DT A 5 7.775 4.920 -10.792 1.00 0.00 N ATOM 140 C2 DT A 5 7.718 3.531 -10.597 1.00 0.00 C ATOM 141 O2 DT A 5 7.817 2.992 -9.498 1.00 0.00 O ATOM 142 N3 DT A 5 7.548 2.747 -11.720 1.00 0.00 N ATOM 143 C4 DT A 5 7.422 3.206 -13.015 1.00 0.00 C ATOM 144 O4 DT A 5 7.302 2.383 -13.915 1.00 0.00 O ATOM 145 C5 DT A 5 7.445 4.661 -13.152 1.00 0.00 C ATOM 146 C7 DT A 5 7.300 5.318 -14.515 1.00 0.00 C ATOM 147 C6 DT A 5 7.611 5.455 -12.059 1.00 0.00 C ATOM 0 H5' DT A 5 6.775 9.439 -7.889 1.00 0.00 H new ATOM 0 H5'' DT A 5 6.275 8.788 -9.438 1.00 0.00 H new ATOM 0 H4' DT A 5 7.179 7.030 -7.128 1.00 0.00 H new ATOM 0 H3' DT A 5 8.809 8.862 -8.576 1.00 0.00 H new ATOM 0 H2' DT A 5 8.629 7.574 -10.684 1.00 0.00 H new ATOM 0 H2'' DT A 5 9.993 6.754 -9.950 1.00 0.00 H new ATOM 0 H1' DT A 5 8.622 5.049 -8.972 1.00 0.00 H new ATOM 0 H3 DT A 5 7.512 1.737 -11.580 1.00 0.00 H new ATOM 0 H71 DT A 5 6.822 6.291 -14.401 1.00 0.00 H new ATOM 0 H72 DT A 5 8.285 5.448 -14.963 1.00 0.00 H new ATOM 0 H73 DT A 5 6.688 4.687 -15.160 1.00 0.00 H new ATOM 0 H6 DT A 5 7.615 6.528 -12.183 1.00 0.00 H new ATOM 160 P DT A 6 9.758 8.102 -6.048 1.00 0.00 P ATOM 161 OP1 DT A 6 9.227 9.487 -6.042 1.00 0.00 O ATOM 162 OP2 DT A 6 11.077 7.803 -5.461 1.00 0.00 O ATOM 163 O5' DT A 6 8.716 7.191 -5.259 1.00 0.00 O ATOM 164 C5' DT A 6 8.869 5.792 -5.298 1.00 0.00 C ATOM 165 C4' DT A 6 7.741 5.092 -4.550 1.00 0.00 C ATOM 166 O4' DT A 6 6.474 5.326 -5.165 1.00 0.00 O ATOM 167 C3' DT A 6 8.004 3.590 -4.607 1.00 0.00 C ATOM 168 O3' DT A 6 8.276 3.176 -3.271 1.00 0.00 O ATOM 169 C2' DT A 6 6.745 3.053 -5.302 1.00 0.00 C ATOM 170 C1' DT A 6 5.706 4.146 -5.053 1.00 0.00 C ATOM 171 N1 DT A 6 4.555 4.203 -6.010 1.00 0.00 N ATOM 172 C2 DT A 6 3.255 4.272 -5.475 1.00 0.00 C ATOM 173 O2 DT A 6 3.013 4.282 -4.268 1.00 0.00 O ATOM 174 N3 DT A 6 2.200 4.275 -6.369 1.00 0.00 N ATOM 175 C4 DT A 6 2.305 4.132 -7.736 1.00 0.00 C ATOM 176 O4 DT A 6 1.277 4.037 -8.401 1.00 0.00 O ATOM 177 C5 DT A 6 3.681 4.083 -8.236 1.00 0.00 C ATOM 178 C7 DT A 6 3.944 3.906 -9.721 1.00 0.00 C ATOM 179 C6 DT A 6 4.739 4.149 -7.380 1.00 0.00 C ATOM 0 H5' DT A 6 9.827 5.516 -4.857 1.00 0.00 H new ATOM 0 H5'' DT A 6 8.886 5.454 -6.334 1.00 0.00 H new ATOM 0 H4' DT A 6 7.714 5.476 -3.530 1.00 0.00 H new ATOM 0 H3' DT A 6 8.863 3.221 -5.167 1.00 0.00 H new ATOM 0 H2' DT A 6 6.912 2.893 -6.367 1.00 0.00 H new ATOM 0 H2'' DT A 6 6.431 2.098 -4.882 1.00 0.00 H new ATOM 0 H1' DT A 6 5.212 3.974 -4.097 1.00 0.00 H new ATOM 0 H3 DT A 6 1.263 4.393 -5.984 1.00 0.00 H new ATOM 0 H71 DT A 6 4.879 4.399 -9.986 1.00 0.00 H new ATOM 0 H72 DT A 6 4.015 2.844 -9.954 1.00 0.00 H new ATOM 0 H73 DT A 6 3.126 4.348 -10.291 1.00 0.00 H new ATOM 0 H6 DT A 6 5.742 4.159 -7.779 1.00 0.00 H new ATOM 192 P DC A 7 8.645 1.722 -2.806 1.00 0.00 P ATOM 193 OP1 DC A 7 9.913 1.719 -2.054 1.00 0.00 O ATOM 194 OP2 DC A 7 8.434 0.745 -3.892 1.00 0.00 O ATOM 195 O5' DC A 7 7.574 1.386 -1.735 1.00 0.00 O ATOM 196 C5' DC A 7 6.242 1.099 -2.076 1.00 0.00 C ATOM 197 C4' DC A 7 5.833 0.213 -0.933 1.00 0.00 C ATOM 198 O4' DC A 7 4.457 -0.072 -1.030 1.00 0.00 O ATOM 199 C3' DC A 7 6.556 -1.143 -1.084 1.00 0.00 C ATOM 200 O3' DC A 7 7.432 -1.294 -0.010 1.00 0.00 O ATOM 201 C2' DC A 7 5.422 -2.157 -1.200 1.00 0.00 C ATOM 202 C1' DC A 7 4.213 -1.418 -0.665 1.00 0.00 C ATOM 203 N1 DC A 7 2.878 -1.632 -1.277 1.00 0.00 N ATOM 204 C2 DC A 7 1.813 -1.772 -0.383 1.00 0.00 C ATOM 205 O2 DC A 7 1.986 -1.958 0.825 1.00 0.00 O ATOM 206 N3 DC A 7 0.548 -1.739 -0.879 1.00 0.00 N ATOM 207 C4 DC A 7 0.328 -1.589 -2.163 1.00 0.00 C ATOM 208 N4 DC A 7 -0.930 -1.713 -2.528 1.00 0.00 N ATOM 209 C5 DC A 7 1.385 -1.469 -3.125 1.00 0.00 C ATOM 210 C6 DC A 7 2.652 -1.481 -2.618 1.00 0.00 C ATOM 0 H5' DC A 7 6.163 0.592 -3.038 1.00 0.00 H new ATOM 0 H5'' DC A 7 5.630 1.999 -2.139 1.00 0.00 H new ATOM 0 H4' DC A 7 6.073 0.711 0.007 1.00 0.00 H new ATOM 0 H3' DC A 7 7.199 -1.259 -1.957 1.00 0.00 H new ATOM 0 H2' DC A 7 5.272 -2.472 -2.233 1.00 0.00 H new ATOM 0 H2'' DC A 7 5.629 -3.056 -0.619 1.00 0.00 H new ATOM 0 H1' DC A 7 4.141 -1.741 0.373 1.00 0.00 H new ATOM 0 H41 DC A 7 -1.189 -1.611 -3.509 1.00 0.00 H new ATOM 0 H42 DC A 7 -1.646 -1.911 -1.830 1.00 0.00 H new ATOM 0 H5 DC A 7 1.191 -1.375 -4.183 1.00 0.00 H new ATOM 0 H6 DC A 7 3.492 -1.369 -3.288 1.00 0.00 H new ATOM 222 P DG A 8 8.464 -2.492 0.141 1.00 0.00 P ATOM 223 OP1 DG A 8 9.472 -1.966 1.081 1.00 0.00 O ATOM 224 OP2 DG A 8 8.903 -2.987 -1.194 1.00 0.00 O ATOM 225 O5' DG A 8 7.569 -3.654 0.767 1.00 0.00 O ATOM 226 C5' DG A 8 6.732 -3.484 1.900 1.00 0.00 C ATOM 227 C4' DG A 8 5.753 -4.674 2.001 1.00 0.00 C ATOM 228 O4' DG A 8 4.638 -4.463 1.133 1.00 0.00 O ATOM 229 C3' DG A 8 6.385 -6.037 1.641 1.00 0.00 C ATOM 230 O3' DG A 8 6.746 -6.886 2.726 1.00 0.00 O ATOM 231 C2' DG A 8 5.298 -6.725 0.811 1.00 0.00 C ATOM 232 C1' DG A 8 4.250 -5.655 0.469 1.00 0.00 C ATOM 233 N9 DG A 8 4.082 -5.394 -0.995 1.00 0.00 N ATOM 234 C8 DG A 8 5.038 -5.383 -1.982 1.00 0.00 C ATOM 235 N7 DG A 8 4.583 -5.139 -3.181 1.00 0.00 N ATOM 236 C5 DG A 8 3.211 -4.974 -2.993 1.00 0.00 C ATOM 237 C6 DG A 8 2.153 -4.657 -3.918 1.00 0.00 C ATOM 238 O6 DG A 8 2.206 -4.407 -5.117 1.00 0.00 O ATOM 239 N1 DG A 8 0.904 -4.612 -3.339 1.00 0.00 N ATOM 240 C2 DG A 8 0.683 -4.803 -2.016 1.00 0.00 C ATOM 241 N2 DG A 8 -0.549 -4.619 -1.619 1.00 0.00 N ATOM 242 N3 DG A 8 1.640 -5.065 -1.118 1.00 0.00 N ATOM 243 C4 DG A 8 2.891 -5.143 -1.659 1.00 0.00 C ATOM 0 H5' DG A 8 6.177 -2.549 1.819 1.00 0.00 H new ATOM 0 H5'' DG A 8 7.336 -3.419 2.805 1.00 0.00 H new ATOM 0 H4' DG A 8 5.450 -4.716 3.047 1.00 0.00 H new ATOM 0 H3' DG A 8 7.338 -5.857 1.143 1.00 0.00 H new ATOM 0 H2' DG A 8 5.720 -7.155 -0.097 1.00 0.00 H new ATOM 0 H2'' DG A 8 4.845 -7.543 1.371 1.00 0.00 H new ATOM 0 H1' DG A 8 3.278 -6.022 0.800 1.00 0.00 H new ATOM 0 H8 DG A 8 6.084 -5.562 -1.781 1.00 0.00 H new ATOM 0 H1 DG A 8 0.101 -4.425 -3.939 1.00 0.00 H new ATOM 0 H21 DG A 8 -0.792 -4.744 -0.636 1.00 0.00 H new ATOM 0 H22 DG A 8 -1.267 -4.350 -2.292 1.00 0.00 H new ATOM 255 P DT A 9 7.690 -6.461 3.979 1.00 0.00 P ATOM 256 OP1 DT A 9 8.687 -5.448 3.580 1.00 0.00 O ATOM 257 OP2 DT A 9 8.238 -7.690 4.600 1.00 0.00 O ATOM 258 O5' DT A 9 6.710 -5.686 5.026 1.00 0.00 O ATOM 259 C5' DT A 9 5.697 -6.362 5.768 1.00 0.00 C ATOM 260 C4' DT A 9 4.237 -6.175 5.274 1.00 0.00 C ATOM 261 O4' DT A 9 4.034 -6.465 3.895 1.00 0.00 O ATOM 262 C3' DT A 9 3.267 -7.160 5.933 1.00 0.00 C ATOM 263 O3' DT A 9 2.891 -6.891 7.267 1.00 0.00 O ATOM 264 C2' DT A 9 2.064 -7.124 5.027 1.00 0.00 C ATOM 265 C1' DT A 9 2.787 -7.117 3.684 1.00 0.00 C ATOM 266 N1 DT A 9 2.883 -8.520 3.149 1.00 0.00 N ATOM 267 C2 DT A 9 4.006 -9.355 3.410 1.00 0.00 C ATOM 268 O2 DT A 9 5.021 -9.057 4.008 1.00 0.00 O ATOM 269 N3 DT A 9 3.930 -10.654 2.960 1.00 0.00 N ATOM 270 C4 DT A 9 2.873 -11.232 2.309 1.00 0.00 C ATOM 271 O4 DT A 9 2.973 -12.402 1.969 1.00 0.00 O ATOM 272 C5 DT A 9 1.727 -10.347 2.112 1.00 0.00 C ATOM 273 C7 DT A 9 0.455 -10.891 1.493 1.00 0.00 C ATOM 274 C6 DT A 9 1.773 -9.054 2.527 1.00 0.00 C ATOM 0 H5' DT A 9 5.752 -6.028 6.804 1.00 0.00 H new ATOM 0 H5'' DT A 9 5.925 -7.428 5.764 1.00 0.00 H new ATOM 0 H4' DT A 9 4.059 -5.126 5.513 1.00 0.00 H new ATOM 0 H3' DT A 9 3.755 -8.130 6.031 1.00 0.00 H new ATOM 0 H2' DT A 9 1.415 -7.990 5.153 1.00 0.00 H new ATOM 0 H2'' DT A 9 1.447 -6.238 5.179 1.00 0.00 H new ATOM 0 H1' DT A 9 2.251 -6.567 2.910 1.00 0.00 H new ATOM 0 H3 DT A 9 4.743 -11.246 3.129 1.00 0.00 H new ATOM 0 H71 DT A 9 -0.402 -10.341 1.881 1.00 0.00 H new ATOM 0 H72 DT A 9 0.500 -10.777 0.410 1.00 0.00 H new ATOM 0 H73 DT A 9 0.352 -11.947 1.742 1.00 0.00 H new ATOM 0 H6 DT A 9 0.912 -8.423 2.365 1.00 0.00 H new ATOM 287 P DT A 10 3.044 -8.066 8.323 1.00 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7.573 1.00 0.00 C ATOM 0 H5' DT B 6 -6.934 3.330 7.667 1.00 0.00 H new ATOM 0 H5'' DT B 6 -7.585 4.943 7.448 1.00 0.00 H new ATOM 0 H4' DT B 6 -7.921 4.444 5.010 1.00 0.00 H new ATOM 0 H3' DT B 6 -7.727 1.730 5.562 1.00 0.00 H new ATOM 0 H2' DT B 6 -5.460 1.631 6.245 1.00 0.00 H new ATOM 0 H2'' DT B 6 -5.238 1.479 4.513 1.00 0.00 H new ATOM 0 H1' DT B 6 -4.460 3.597 4.278 1.00 0.00 H new ATOM 0 H3 DT B 6 -0.736 4.903 6.305 1.00 0.00 H new ATOM 0 H71 DT B 6 -4.112 3.248 10.178 1.00 0.00 H new ATOM 0 H72 DT B 6 -2.728 2.136 10.055 1.00 0.00 H new ATOM 0 H73 DT B 6 -2.469 3.828 10.541 1.00 0.00 H new ATOM 0 H6 DT B 6 -4.809 2.891 7.931 1.00 0.00 H new ATOM 511 P DC B 7 -8.880 1.787 3.258 1.00 0.00 P ATOM 512 OP1 DC B 7 -9.570 2.694 2.308 1.00 0.00 O ATOM 513 OP2 DC B 7 -9.596 1.273 4.461 1.00 0.00 O ATOM 514 O5' DC B 7 -8.344 0.555 2.357 1.00 0.00 O ATOM 515 C5' DC B 7 -7.864 -0.641 2.918 1.00 0.00 C ATOM 516 C4' DC B 7 -7.095 -1.504 1.913 1.00 0.00 C ATOM 517 O4' DC B 7 -5.730 -1.150 1.855 1.00 0.00 O ATOM 518 C3' DC B 7 -7.101 -2.940 2.433 1.00 0.00 C ATOM 519 O3' DC B 7 -8.196 -3.784 2.051 1.00 0.00 O ATOM 520 C2' DC B 7 -5.729 -3.496 2.079 1.00 0.00 C ATOM 521 C1' DC B 7 -5.001 -2.298 1.456 1.00 0.00 C ATOM 522 N1 DC B 7 -3.596 -2.141 1.920 1.00 0.00 N ATOM 523 C2 DC B 7 -2.562 -2.124 0.974 1.00 0.00 C ATOM 524 O2 DC B 7 -2.766 -2.280 -0.236 1.00 0.00 O ATOM 525 N3 DC B 7 -1.299 -1.940 1.403 1.00 0.00 N ATOM 526 C4 DC B 7 -1.034 -1.751 2.676 1.00 0.00 C ATOM 527 N4 DC B 7 0.232 -1.608 2.953 1.00 0.00 N ATOM 528 C5 DC B 7 -2.050 -1.749 3.679 1.00 0.00 C ATOM 529 C6 DC B 7 -3.318 -1.940 3.254 1.00 0.00 C ATOM 0 H5' DC B 7 -8.703 -1.213 3.314 1.00 0.00 H new ATOM 0 H5'' DC B 7 -7.213 -0.406 3.760 1.00 0.00 H new ATOM 0 H4' DC B 7 -7.565 -1.375 0.938 1.00 0.00 H new ATOM 0 H3' DC B 7 -7.283 -2.923 3.508 1.00 0.00 H new ATOM 0 H2' DC B 7 -5.207 -3.867 2.961 1.00 0.00 H new ATOM 0 H2'' DC B 7 -5.803 -4.328 1.379 1.00 0.00 H new ATOM 0 H1' DC B 7 -4.953 -2.443 0.377 1.00 0.00 H new ATOM 0 H41 DC B 7 0.529 -1.457 3.917 1.00 0.00 H new ATOM 0 H42 DC B 7 0.925 -1.647 2.206 1.00 0.00 H new ATOM 0 H5 DC B 7 -1.817 -1.602 4.723 1.00 0.00 H new ATOM 0 H6 DC B 7 -4.126 -1.935 3.971 1.00 0.00 H new ATOM 541 P DG B 8 -8.748 -4.058 0.542 1.00 0.00 P ATOM 542 OP1 DG B 8 -9.075 -2.747 -0.058 1.00 0.00 O ATOM 543 OP2 DG B 8 -9.847 -5.035 0.734 1.00 0.00 O ATOM 544 O5' DG B 8 -7.575 -4.803 -0.290 1.00 0.00 O ATOM 545 C5' DG B 8 -6.795 -4.146 -1.272 1.00 0.00 C ATOM 546 C4' DG B 8 -5.485 -4.906 -1.560 1.00 0.00 C ATOM 547 O4' DG B 8 -4.508 -4.693 -0.561 1.00 0.00 O ATOM 548 C3' DG B 8 -5.615 -6.420 -1.746 1.00 0.00 C ATOM 549 O3' DG B 8 -5.813 -6.631 -3.127 1.00 0.00 O ATOM 550 C2' DG B 8 -4.291 -6.968 -1.197 1.00 0.00 C ATOM 551 C1' DG B 8 -3.634 -5.799 -0.455 1.00 0.00 C ATOM 552 N9 DG B 8 -3.363 -6.042 0.989 1.00 0.00 N ATOM 553 C8 DG B 8 -4.216 -6.504 1.960 1.00 0.00 C ATOM 554 N7 DG B 8 -3.727 -6.464 3.171 1.00 0.00 N ATOM 555 C5 DG B 8 -2.445 -5.945 3.001 1.00 0.00 C ATOM 556 C6 DG B 8 -1.399 -5.631 3.946 1.00 0.00 C ATOM 557 O6 DG B 8 -1.348 -5.803 5.164 1.00 0.00 O ATOM 558 N1 DG B 8 -0.294 -5.055 3.358 1.00 0.00 N ATOM 559 C2 DG B 8 -0.118 -4.937 2.020 1.00 0.00 C ATOM 560 N2 DG B 8 1.081 -4.605 1.626 1.00 0.00 N ATOM 561 N3 DG B 8 -1.040 -5.264 1.111 1.00 0.00 N ATOM 562 C4 DG B 8 -2.200 -5.718 1.660 1.00 0.00 C ATOM 0 H5' DG B 8 -6.563 -3.135 -0.937 1.00 0.00 H new ATOM 0 H5'' DG B 8 -7.372 -4.052 -2.192 1.00 0.00 H new ATOM 0 H4' DG B 8 -5.183 -4.478 -2.516 1.00 0.00 H new ATOM 0 H3' DG B 8 -6.441 -6.914 -1.235 1.00 0.00 H new ATOM 0 H2' DG B 8 -4.464 -7.810 -0.526 1.00 0.00 H new ATOM 0 H2'' DG B 8 -3.652 -7.329 -2.003 1.00 0.00 H new ATOM 0 H1' DG B 8 -2.660 -5.637 -0.917 1.00 0.00 H new ATOM 0 H8 DG B 8 -5.208 -6.870 1.741 1.00 0.00 H new ATOM 0 H1 DG B 8 0.438 -4.694 3.969 1.00 0.00 H new ATOM 0 H21 DG B 8 1.280 -4.500 0.631 1.00 0.00 H new ATOM 0 H22 DG B 8 1.819 -4.451 2.313 1.00 0.00 H new ATOM 574 P DT B 9 -5.794 -8.073 -3.816 1.00 0.00 P ATOM 575 OP1 DT B 9 -6.880 -7.933 -4.813 1.00 0.00 O ATOM 576 OP2 DT B 9 -5.830 -9.138 -2.796 1.00 0.00 O ATOM 577 O5' DT B 9 -4.349 -8.110 -4.537 1.00 0.00 O ATOM 578 C5' DT B 9 -4.010 -7.135 -5.512 1.00 0.00 C ATOM 579 C4' DT B 9 -2.744 -7.450 -6.328 1.00 0.00 C ATOM 580 O4' DT B 9 -1.584 -7.033 -5.629 1.00 0.00 O ATOM 581 C3' DT B 9 -2.565 -8.941 -6.598 1.00 0.00 C ATOM 582 O3' DT B 9 -2.361 -9.182 -7.964 1.00 0.00 O ATOM 583 C2' DT B 9 -1.365 -9.387 -5.777 1.00 0.00 C ATOM 584 C1' DT B 9 -0.608 -8.067 -5.684 1.00 0.00 C ATOM 585 N1 DT B 9 0.230 -8.032 -4.461 1.00 0.00 N ATOM 586 C2 DT B 9 1.617 -8.176 -4.587 1.00 0.00 C ATOM 587 O2 DT B 9 2.196 -8.275 -5.662 1.00 0.00 O ATOM 588 N3 DT B 9 2.336 -8.245 -3.409 1.00 0.00 N ATOM 589 C4 DT B 9 1.802 -8.268 -2.134 1.00 0.00 C ATOM 590 O4 DT B 9 2.567 -8.398 -1.182 1.00 0.00 O ATOM 591 C5 DT B 9 0.345 -8.125 -2.081 1.00 0.00 C ATOM 592 C7 DT B 9 -0.394 -8.066 -0.760 1.00 0.00 C ATOM 593 C6 DT B 9 -0.375 -7.997 -3.224 1.00 0.00 C ATOM 0 H5' DT B 9 -3.874 -6.175 -5.013 1.00 0.00 H new ATOM 0 H5'' DT B 9 -4.849 -7.022 -6.199 1.00 0.00 H new ATOM 0 H4' DT B 9 -2.870 -6.917 -7.271 1.00 0.00 H new ATOM 0 H3' DT B 9 -3.457 -9.500 -6.317 1.00 0.00 H new ATOM 0 H2' DT B 9 -1.649 -9.775 -4.799 1.00 0.00 H new ATOM 0 H2'' DT B 9 -0.786 -10.166 -6.273 1.00 0.00 H new ATOM 0 H1' DT B 9 0.052 -7.943 -6.542 1.00 0.00 H new ATOM 0 H3 DT B 9 3.352 -8.282 -3.487 1.00 0.00 H new ATOM 0 H71 DT B 9 -1.293 -7.460 -0.873 1.00 0.00 H new ATOM 0 H72 DT B 9 -0.672 -9.074 -0.453 1.00 0.00 H new ATOM 0 H73 DT B 9 0.251 -7.621 -0.002 1.00 0.00 H new ATOM 0 H6 DT B 9 -1.445 -7.865 -3.163 1.00 0.00 H new ATOM 606 P DT B 10 -3.077 -10.445 -8.593 1.00 0.00 P ATOM 607 OP1 DT B 10 -2.915 -11.580 -7.653 1.00 0.00 O ATOM 608 OP2 DT B 10 -2.640 -10.459 -10.003 1.00 0.00 O ATOM 609 O5' DT B 10 -4.594 -9.925 -8.435 1.00 0.00 O ATOM 610 C5' DT B 10 -5.684 -10.184 -9.316 1.00 0.00 C ATOM 611 C4' DT B 10 -5.508 -9.566 -10.698 1.00 0.00 C ATOM 612 O4' DT B 10 -5.899 -10.485 -11.696 1.00 0.00 O ATOM 613 C3' DT B 10 -6.199 -8.231 -10.997 1.00 0.00 C ATOM 614 O3' DT B 10 -5.302 -7.143 -10.951 1.00 0.00 O ATOM 615 C2' DT B 10 -6.606 -8.394 -12.457 1.00 0.00 C ATOM 616 C1' DT B 10 -5.991 -9.741 -12.883 1.00 0.00 C ATOM 617 N1 DT B 10 -6.682 -10.575 -13.910 1.00 0.00 N ATOM 618 C2 DT B 10 -5.875 -11.475 -14.625 1.00 0.00 C ATOM 619 O2 DT B 10 -4.663 -11.583 -14.465 1.00 0.00 O ATOM 620 N3 DT B 10 -6.499 -12.228 -15.599 1.00 0.00 N ATOM 621 C4 DT B 10 -7.819 -12.128 -15.975 1.00 0.00 C ATOM 622 O4 DT B 10 -8.223 -12.839 -16.885 1.00 0.00 O ATOM 623 C5 DT B 10 -8.606 -11.161 -15.215 1.00 0.00 C ATOM 624 C7 DT B 10 -10.082 -10.970 -15.536 1.00 0.00 C ATOM 625 C6 DT B 10 -8.029 -10.445 -14.211 1.00 0.00 C ATOM 0 H5' DT B 10 -6.601 -9.800 -8.869 1.00 0.00 H new ATOM 0 H5'' DT B 10 -5.807 -11.262 -9.422 1.00 0.00 H new ATOM 0 H4' DT B 10 -4.443 -9.332 -10.704 1.00 0.00 H new ATOM 0 H3' DT B 10 -6.999 -8.029 -10.285 1.00 0.00 H new ATOM 0 H2' DT B 10 -7.690 -8.400 -12.568 1.00 0.00 H new ATOM 0 H2'' DT B 10 -6.228 -7.574 -13.068 1.00 0.00 H new ATOM 0 H1' DT B 10 -5.059 -9.490 -13.390 1.00 0.00 H new ATOM 0 H3 DT B 10 -5.930 -12.922 -16.084 1.00 0.00 H new ATOM 0 H71 DT B 10 -10.616 -10.675 -14.632 1.00 0.00 H new ATOM 0 H72 DT B 10 -10.192 -10.193 -16.292 1.00 0.00 H new ATOM 0 H73 DT B 10 -10.496 -11.905 -15.913 1.00 0.00 H new ATOM 0 H6 DT B 10 -8.634 -9.760 -13.636 1.00 0.00 H new TER 638 DT B 10