USER MOD reduce.3.24.130724 H: found=0, std=0, add=249, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 274 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 4 DT C7 :methyl -30:sc= 0 (180deg=-0.00195) USER MOD Single : A 4 DT O5' : rot -78:sc= 1.19 USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 14 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 19 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 23 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 25 DA O3' : rot -39:sc= 0.00904 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 4 6.065 -9.035 -12.196 1.00 0.78 O ATOM 2 C5' DT A 4 6.457 -10.024 -11.240 1.00 0.63 C ATOM 3 C4' DT A 4 7.958 -10.061 -11.061 1.00 0.48 C ATOM 4 O4' DT A 4 8.267 -10.649 -9.771 1.00 0.71 O ATOM 5 C3' DT A 4 8.708 -10.902 -12.098 1.00 0.39 C ATOM 6 O3' DT A 4 9.955 -10.281 -12.433 1.00 0.60 O ATOM 7 C2' DT A 4 8.942 -12.220 -11.383 1.00 0.61 C ATOM 8 C1' DT A 4 9.103 -11.783 -9.939 1.00 0.65 C ATOM 9 N1 DT A 4 8.700 -12.798 -8.944 1.00 1.04 N ATOM 10 C2 DT A 4 7.368 -13.139 -8.862 1.00 1.59 C ATOM 11 O2 DT A 4 6.507 -12.643 -9.571 1.00 1.76 O ATOM 12 N3 DT A 4 7.077 -14.086 -7.914 1.00 1.96 N ATOM 13 C4 DT A 4 7.964 -14.711 -7.061 1.00 1.84 C ATOM 14 O4 DT A 4 7.555 -15.545 -6.258 1.00 2.22 O ATOM 15 C5 DT A 4 9.345 -14.306 -7.201 1.00 1.28 C ATOM 16 C7 DT A 4 10.377 -14.933 -6.315 1.00 1.21 C ATOM 17 C6 DT A 4 9.645 -13.381 -8.124 1.00 0.91 C ATOM 0 H5' DT A 4 6.104 -11.003 -11.563 1.00 0.63 H new ATOM 0 H5'' DT A 4 5.981 -9.814 -10.282 1.00 0.63 H new ATOM 0 H4' DT A 4 8.281 -9.025 -11.165 1.00 0.48 H new ATOM 0 H3' DT A 4 8.161 -11.019 -13.034 1.00 0.39 H new ATOM 0 H2' DT A 4 8.104 -12.905 -11.509 1.00 0.61 H new ATOM 0 H2'' DT A 4 9.830 -12.731 -11.754 1.00 0.61 H new ATOM 0 HO5' DT A 4 6.089 -8.149 -11.778 1.00 0.78 H new ATOM 0 H1' DT A 4 10.162 -11.591 -9.764 1.00 0.65 H new ATOM 0 H3 DT A 4 6.098 -14.358 -7.830 1.00 1.96 H new ATOM 0 H71 DT A 4 9.922 -15.205 -5.363 1.00 1.21 H new ATOM 0 H72 DT A 4 10.775 -15.827 -6.796 1.00 1.21 H new ATOM 0 H73 DT A 4 11.186 -14.224 -6.141 1.00 1.21 H new ATOM 0 H6 DT A 4 10.676 -13.077 -8.231 1.00 0.91 H new ATOM 31 P DG A 5 10.236 -9.815 -13.946 1.00 0.56 P ATOM 32 OP1 DG A 5 9.040 -9.065 -14.409 1.00 0.61 O ATOM 33 OP2 DG A 5 10.706 -10.994 -14.717 1.00 0.74 O ATOM 34 O5' DG A 5 11.447 -8.788 -13.814 1.00 0.66 O ATOM 35 C5' DG A 5 11.216 -7.380 -13.759 1.00 0.48 C ATOM 36 C4' DG A 5 12.523 -6.644 -13.573 1.00 0.46 C ATOM 37 O4' DG A 5 13.207 -7.179 -12.411 1.00 0.47 O ATOM 38 C3' DG A 5 13.508 -6.779 -14.737 1.00 0.50 C ATOM 39 O3' DG A 5 14.251 -5.565 -14.905 1.00 0.57 O ATOM 40 C2' DG A 5 14.420 -7.905 -14.292 1.00 0.52 C ATOM 41 C1' DG A 5 14.470 -7.709 -12.787 1.00 0.49 C ATOM 42 N9 DG A 5 14.690 -8.937 -12.025 1.00 0.57 N ATOM 43 C8 DG A 5 13.734 -9.811 -11.567 1.00 0.72 C ATOM 44 N7 DG A 5 14.232 -10.824 -10.915 1.00 0.81 N ATOM 45 C5 DG A 5 15.604 -10.607 -10.941 1.00 0.78 C ATOM 46 C6 DG A 5 16.665 -11.373 -10.395 1.00 0.97 C ATOM 47 O6 DG A 5 16.600 -12.432 -9.758 1.00 1.06 O ATOM 48 N1 DG A 5 17.908 -10.796 -10.650 1.00 1.16 N ATOM 49 C2 DG A 5 18.093 -9.625 -11.347 1.00 1.19 C ATOM 50 N2 DG A 5 19.363 -9.221 -11.495 1.00 1.52 N ATOM 51 N3 DG A 5 17.111 -8.901 -11.861 1.00 0.95 N ATOM 52 C4 DG A 5 15.902 -9.447 -11.622 1.00 0.72 C ATOM 0 H5' DG A 5 10.539 -7.147 -12.937 1.00 0.48 H new ATOM 0 H5'' DG A 5 10.730 -7.048 -14.676 1.00 0.48 H new ATOM 0 H4' DG A 5 12.245 -5.594 -13.481 1.00 0.46 H new ATOM 0 H3' DG A 5 13.022 -6.975 -15.693 1.00 0.50 H new ATOM 0 H2' DG A 5 14.020 -8.882 -14.561 1.00 0.52 H new ATOM 0 H2'' DG A 5 15.409 -7.830 -14.745 1.00 0.52 H new ATOM 0 H1' DG A 5 15.314 -7.057 -12.563 1.00 0.49 H new ATOM 0 H8 DG A 5 12.676 -9.673 -11.731 1.00 0.72 H new ATOM 0 H1 DG A 5 18.736 -11.275 -10.296 1.00 1.16 H new ATOM 0 H21 DG A 5 19.569 -8.360 -12.002 1.00 1.52 H new ATOM 0 H22 DG A 5 20.123 -9.775 -11.100 1.00 1.52 H new ATOM 64 P DA A 6 13.795 -4.493 -16.013 1.00 0.49 P ATOM 65 OP1 DA A 6 13.426 -5.246 -17.239 1.00 0.64 O ATOM 66 OP2 DA A 6 14.833 -3.433 -16.090 1.00 0.70 O ATOM 67 O5' DA A 6 12.468 -3.851 -15.408 1.00 0.56 O ATOM 68 C5' DA A 6 12.531 -2.902 -14.342 1.00 0.46 C ATOM 69 C4' DA A 6 11.158 -2.330 -14.073 1.00 0.41 C ATOM 70 O4' DA A 6 10.217 -3.409 -13.891 1.00 0.39 O ATOM 71 C3' DA A 6 11.046 -1.499 -12.803 1.00 0.51 C ATOM 72 O3' DA A 6 11.375 -0.131 -13.072 1.00 0.72 O ATOM 73 C2' DA A 6 9.578 -1.638 -12.436 1.00 0.42 C ATOM 74 C1' DA A 6 9.200 -3.016 -12.977 1.00 0.35 C ATOM 75 N9 DA A 6 9.092 -4.056 -11.951 1.00 0.38 N ATOM 76 C8 DA A 6 10.066 -4.485 -11.082 1.00 0.51 C ATOM 77 N7 DA A 6 9.670 -5.435 -10.272 1.00 0.58 N ATOM 78 C5 DA A 6 8.346 -5.648 -10.629 1.00 0.49 C ATOM 79 C6 DA A 6 7.365 -6.531 -10.144 1.00 0.56 C ATOM 80 N6 DA A 6 7.576 -7.400 -9.152 1.00 0.71 N ATOM 81 N1 DA A 6 6.144 -6.491 -10.719 1.00 0.50 N ATOM 82 C2 DA A 6 5.932 -5.620 -11.713 1.00 0.40 C ATOM 83 N3 DA A 6 6.772 -4.741 -12.256 1.00 0.33 N ATOM 84 C4 DA A 6 7.976 -4.806 -11.662 1.00 0.37 C ATOM 0 H5' DA A 6 13.223 -2.100 -14.599 1.00 0.46 H new ATOM 0 H5'' DA A 6 12.917 -3.380 -13.442 1.00 0.46 H new ATOM 0 H4' DA A 6 10.957 -1.692 -14.934 1.00 0.41 H new ATOM 0 H3' DA A 6 11.720 -1.822 -12.009 1.00 0.51 H new ATOM 0 H2' DA A 6 9.427 -1.575 -11.358 1.00 0.42 H new ATOM 0 H2'' DA A 6 8.975 -0.851 -12.889 1.00 0.42 H new ATOM 0 H1' DA A 6 8.215 -2.923 -13.434 1.00 0.35 H new ATOM 0 H8 DA A 6 11.066 -4.077 -11.068 1.00 0.51 H new ATOM 0 H61 DA A 6 6.823 -8.015 -8.844 1.00 0.71 H new ATOM 0 H62 DA A 6 8.490 -7.448 -8.702 1.00 0.71 H new ATOM 0 H2 DA A 6 4.938 -5.632 -12.135 1.00 0.40 H new ATOM 96 P DG A 7 11.546 0.906 -11.855 1.00 0.77 P ATOM 97 OP1 DG A 7 12.223 2.114 -12.394 1.00 1.15 O ATOM 98 OP2 DG A 7 12.145 0.184 -10.704 1.00 1.13 O ATOM 99 O5' DG A 7 10.050 1.303 -11.474 1.00 0.63 O ATOM 100 C5' DG A 7 9.450 2.494 -11.985 1.00 0.56 C ATOM 101 C4' DG A 7 7.944 2.354 -12.001 1.00 0.40 C ATOM 102 O4' DG A 7 7.588 1.011 -11.585 1.00 0.36 O ATOM 103 C3' DG A 7 7.200 3.292 -11.049 1.00 0.39 C ATOM 104 O3' DG A 7 5.926 3.651 -11.598 1.00 0.40 O ATOM 105 C2' DG A 7 7.026 2.445 -9.804 1.00 0.42 C ATOM 106 C1' DG A 7 6.828 1.056 -10.385 1.00 0.35 C ATOM 107 N9 DG A 7 7.282 -0.032 -9.521 1.00 0.37 N ATOM 108 C8 DG A 7 8.567 -0.278 -9.103 1.00 0.43 C ATOM 109 N7 DG A 7 8.667 -1.324 -8.330 1.00 0.44 N ATOM 110 C5 DG A 7 7.366 -1.800 -8.231 1.00 0.38 C ATOM 111 C6 DG A 7 6.849 -2.915 -7.524 1.00 0.37 C ATOM 112 O6 DG A 7 7.461 -3.726 -6.821 1.00 0.42 O ATOM 113 N1 DG A 7 5.471 -3.043 -7.690 1.00 0.34 N ATOM 114 C2 DG A 7 4.697 -2.194 -8.447 1.00 0.33 C ATOM 115 N2 DG A 7 3.384 -2.470 -8.494 1.00 0.37 N ATOM 116 N3 DG A 7 5.169 -1.151 -9.111 1.00 0.33 N ATOM 117 C4 DG A 7 6.501 -1.015 -8.959 1.00 0.34 C ATOM 0 H5' DG A 7 9.815 2.690 -12.993 1.00 0.56 H new ATOM 0 H5'' DG A 7 9.737 3.347 -11.370 1.00 0.56 H new ATOM 0 H4' DG A 7 7.651 2.598 -13.022 1.00 0.40 H new ATOM 0 H3' DG A 7 7.726 4.228 -10.862 1.00 0.39 H new ATOM 0 H2' DG A 7 7.899 2.493 -9.154 1.00 0.42 H new ATOM 0 H2'' DG A 7 6.169 2.764 -9.211 1.00 0.42 H new ATOM 0 H1' DG A 7 5.758 0.904 -10.527 1.00 0.35 H new ATOM 0 H8 DG A 7 9.411 0.334 -9.386 1.00 0.43 H new ATOM 0 H1 DG A 7 5.005 -3.818 -7.219 1.00 0.34 H new ATOM 0 H21 DG A 7 2.757 -1.877 -9.039 1.00 0.37 H new ATOM 0 H22 DG A 7 3.013 -3.272 -7.985 1.00 0.37 H new ATOM 129 P DG A 8 5.050 4.810 -10.906 1.00 0.42 P ATOM 130 OP1 DG A 8 4.670 5.774 -11.970 1.00 0.62 O ATOM 131 OP2 DG A 8 5.778 5.294 -9.704 1.00 0.65 O ATOM 132 O5' DG A 8 3.729 4.060 -10.423 1.00 0.71 O ATOM 133 C5' DG A 8 2.647 4.782 -9.835 1.00 0.84 C ATOM 134 C4' DG A 8 1.518 3.839 -9.484 1.00 0.63 C ATOM 135 O4' DG A 8 2.072 2.540 -9.147 1.00 0.59 O ATOM 136 C3' DG A 8 0.677 4.262 -8.275 1.00 0.61 C ATOM 137 O3' DG A 8 -0.702 3.939 -8.491 1.00 0.77 O ATOM 138 C2' DG A 8 1.250 3.432 -7.141 1.00 0.57 C ATOM 139 C1' DG A 8 1.644 2.152 -7.851 1.00 0.54 C ATOM 140 N9 DG A 8 2.734 1.417 -7.213 1.00 0.52 N ATOM 141 C8 DG A 8 4.081 1.589 -7.417 1.00 0.55 C ATOM 142 N7 DG A 8 4.817 0.784 -6.704 1.00 0.56 N ATOM 143 C5 DG A 8 3.901 0.031 -5.983 1.00 0.52 C ATOM 144 C6 DG A 8 4.108 -1.006 -5.039 1.00 0.53 C ATOM 145 O6 DG A 8 5.181 -1.472 -4.638 1.00 0.57 O ATOM 146 N1 DG A 8 2.906 -1.505 -4.542 1.00 0.55 N ATOM 147 C2 DG A 8 1.662 -1.049 -4.916 1.00 0.55 C ATOM 148 N2 DG A 8 0.611 -1.639 -4.325 1.00 0.61 N ATOM 149 N3 DG A 8 1.457 -0.082 -5.795 1.00 0.54 N ATOM 150 C4 DG A 8 2.612 0.409 -6.285 1.00 0.51 C ATOM 0 H5' DG A 8 2.291 5.545 -10.527 1.00 0.84 H new ATOM 0 H5'' DG A 8 2.990 5.299 -8.939 1.00 0.84 H new ATOM 0 H4' DG A 8 0.873 3.834 -10.363 1.00 0.63 H new ATOM 0 H3' DG A 8 0.714 5.333 -8.078 1.00 0.61 H new ATOM 0 H2' DG A 8 2.106 3.918 -6.672 1.00 0.57 H new ATOM 0 H2'' DG A 8 0.516 3.253 -6.356 1.00 0.57 H new ATOM 0 H1' DG A 8 0.785 1.481 -7.842 1.00 0.54 H new ATOM 0 H8 DG A 8 4.490 2.319 -8.100 1.00 0.55 H new ATOM 0 H1 DG A 8 2.951 -2.258 -3.856 1.00 0.55 H new ATOM 0 H21 DG A 8 -0.337 -1.345 -4.560 1.00 0.61 H new ATOM 0 H22 DG A 8 0.761 -2.381 -3.641 1.00 0.61 H new ATOM 162 P DG A 9 -1.817 4.430 -7.441 1.00 0.83 P ATOM 163 OP1 DG A 9 -3.104 4.536 -8.176 1.00 1.27 O ATOM 164 OP2 DG A 9 -1.289 5.614 -6.716 1.00 1.08 O ATOM 165 O5' DG A 9 -1.935 3.222 -6.407 1.00 0.84 O ATOM 166 C5' DG A 9 -2.388 1.935 -6.828 1.00 1.05 C ATOM 167 C4' DG A 9 -3.042 1.206 -5.675 1.00 0.57 C ATOM 168 O4' DG A 9 -2.018 0.540 -4.892 1.00 0.54 O ATOM 169 C3' DG A 9 -3.802 2.103 -4.693 1.00 0.58 C ATOM 170 O3' DG A 9 -4.963 1.427 -4.198 1.00 0.67 O ATOM 171 C2' DG A 9 -2.798 2.329 -3.578 1.00 0.63 C ATOM 172 C1' DG A 9 -2.036 1.016 -3.554 1.00 0.35 C ATOM 173 N9 DG A 9 -0.652 1.126 -3.096 1.00 0.31 N ATOM 174 C8 DG A 9 0.318 1.968 -3.584 1.00 0.31 C ATOM 175 N7 DG A 9 1.467 1.835 -2.981 1.00 0.36 N ATOM 176 C5 DG A 9 1.243 0.844 -2.035 1.00 0.34 C ATOM 177 C6 DG A 9 2.123 0.273 -1.082 1.00 0.38 C ATOM 178 O6 DG A 9 3.314 0.537 -0.885 1.00 0.45 O ATOM 179 N1 DG A 9 1.494 -0.705 -0.313 1.00 0.41 N ATOM 180 C2 DG A 9 0.177 -1.077 -0.455 1.00 0.44 C ATOM 181 N2 DG A 9 -0.260 -2.038 0.374 1.00 0.55 N ATOM 182 N3 DG A 9 -0.653 -0.551 -1.341 1.00 0.42 N ATOM 183 C4 DG A 9 -0.058 0.397 -2.092 1.00 0.34 C ATOM 0 H5' DG A 9 -1.548 1.352 -7.206 1.00 1.05 H new ATOM 0 H5'' DG A 9 -3.097 2.042 -7.649 1.00 1.05 H new ATOM 0 H4' DG A 9 -3.757 0.528 -6.141 1.00 0.57 H new ATOM 0 H3' DG A 9 -4.156 3.031 -5.142 1.00 0.58 H new ATOM 0 H2' DG A 9 -2.143 3.175 -3.786 1.00 0.63 H new ATOM 0 H2'' DG A 9 -3.288 2.532 -2.626 1.00 0.63 H new ATOM 0 H1' DG A 9 -2.537 0.354 -2.848 1.00 0.35 H new ATOM 0 H8 DG A 9 0.146 2.670 -4.387 1.00 0.31 H new ATOM 0 H1 DG A 9 2.047 -1.176 0.403 1.00 0.41 H new ATOM 0 H21 DG A 9 -1.227 -2.358 0.319 1.00 0.55 H new ATOM 0 H22 DG A 9 0.375 -2.448 1.059 1.00 0.55 H new ATOM 195 P DT A 10 -6.375 1.612 -4.942 1.00 1.14 P ATOM 196 OP1 DT A 10 -6.109 1.643 -6.403 1.00 1.64 O ATOM 197 OP2 DT A 10 -7.094 2.744 -4.304 1.00 1.62 O ATOM 198 O5' DT A 10 -7.164 0.268 -4.612 1.00 1.23 O ATOM 199 C5' DT A 10 -8.458 0.020 -5.163 1.00 0.55 C ATOM 200 C4' DT A 10 -8.470 -1.305 -5.890 1.00 0.40 C ATOM 201 O4' DT A 10 -9.823 -1.829 -5.901 1.00 0.66 O ATOM 202 C3' DT A 10 -8.035 -1.238 -7.357 1.00 0.81 C ATOM 203 O3' DT A 10 -7.300 -2.414 -7.713 1.00 1.02 O ATOM 204 C2' DT A 10 -9.351 -1.182 -8.110 1.00 1.07 C ATOM 205 C1' DT A 10 -10.261 -2.026 -7.237 1.00 0.94 C ATOM 206 N1 DT A 10 -11.689 -1.660 -7.310 1.00 1.36 N ATOM 207 C2 DT A 10 -12.433 -2.154 -8.359 1.00 1.81 C ATOM 208 O2 DT A 10 -11.967 -2.877 -9.225 1.00 1.91 O ATOM 209 N3 DT A 10 -13.750 -1.770 -8.358 1.00 2.25 N ATOM 210 C4 DT A 10 -14.381 -0.960 -7.435 1.00 2.35 C ATOM 211 O4 DT A 10 -15.574 -0.701 -7.565 1.00 2.83 O ATOM 212 C5 DT A 10 -13.542 -0.477 -6.362 1.00 1.97 C ATOM 213 C7 DT A 10 -14.144 0.408 -5.315 1.00 2.26 C ATOM 214 C6 DT A 10 -12.252 -0.844 -6.349 1.00 1.48 C ATOM 0 H5' DT A 10 -8.729 0.822 -5.849 1.00 0.55 H new ATOM 0 H5'' DT A 10 -9.205 0.014 -4.369 1.00 0.55 H new ATOM 0 H4' DT A 10 -7.757 -1.928 -5.350 1.00 0.40 H new ATOM 0 H3' DT A 10 -7.383 -0.392 -7.574 1.00 0.81 H new ATOM 0 H2' DT A 10 -9.718 -0.161 -8.212 1.00 1.07 H new ATOM 0 H2'' DT A 10 -9.261 -1.590 -9.117 1.00 1.07 H new ATOM 0 H1' DT A 10 -10.196 -3.058 -7.583 1.00 0.94 H new ATOM 0 H3 DT A 10 -14.326 -2.121 -9.123 1.00 2.25 H new ATOM 0 H71 DT A 10 -13.623 0.259 -4.369 1.00 2.26 H new ATOM 0 H72 DT A 10 -14.050 1.450 -5.621 1.00 2.26 H new ATOM 0 H73 DT A 10 -15.198 0.160 -5.191 1.00 2.26 H new ATOM 0 H6 DT A 10 -11.623 -0.484 -5.548 1.00 1.48 H new ATOM 227 P DG A 11 -5.694 -2.370 -7.759 1.00 0.85 P ATOM 228 OP1 DG A 11 -5.221 -1.945 -6.417 1.00 1.23 O ATOM 229 OP2 DG A 11 -5.282 -1.599 -8.960 1.00 1.25 O ATOM 230 O5' DG A 11 -5.273 -3.892 -7.973 1.00 0.65 O ATOM 231 C5' DG A 11 -3.899 -4.269 -8.068 1.00 0.49 C ATOM 232 C4' DG A 11 -3.650 -5.530 -7.273 1.00 0.52 C ATOM 233 O4' DG A 11 -2.283 -5.965 -7.490 1.00 0.51 O ATOM 234 C3' DG A 11 -3.809 -5.377 -5.757 1.00 0.51 C ATOM 235 O3' DG A 11 -4.425 -6.545 -5.202 1.00 0.64 O ATOM 236 C2' DG A 11 -2.380 -5.239 -5.263 1.00 0.50 C ATOM 237 C1' DG A 11 -1.616 -6.103 -6.246 1.00 0.50 C ATOM 238 N9 DG A 11 -0.218 -5.718 -6.435 1.00 0.50 N ATOM 239 C8 DG A 11 0.269 -4.739 -7.265 1.00 0.61 C ATOM 240 N7 DG A 11 1.567 -4.623 -7.221 1.00 0.63 N ATOM 241 C5 DG A 11 1.964 -5.587 -6.303 1.00 0.53 C ATOM 242 C6 DG A 11 3.258 -5.933 -5.841 1.00 0.54 C ATOM 243 O6 DG A 11 4.344 -5.436 -6.162 1.00 0.61 O ATOM 244 N1 DG A 11 3.219 -6.969 -4.909 1.00 0.51 N ATOM 245 C2 DG A 11 2.065 -7.586 -4.483 1.00 0.48 C ATOM 246 N2 DG A 11 2.218 -8.566 -3.578 1.00 0.56 N ATOM 247 N3 DG A 11 0.852 -7.271 -4.907 1.00 0.45 N ATOM 248 C4 DG A 11 0.876 -6.271 -5.809 1.00 0.46 C ATOM 0 H5' DG A 11 -3.266 -3.464 -7.695 1.00 0.49 H new ATOM 0 H5'' DG A 11 -3.629 -4.429 -9.112 1.00 0.49 H new ATOM 0 H4' DG A 11 -4.401 -6.238 -7.623 1.00 0.52 H new ATOM 0 H3' DG A 11 -4.438 -4.533 -5.474 1.00 0.51 H new ATOM 0 H2' DG A 11 -2.041 -4.203 -5.282 1.00 0.50 H new ATOM 0 H2'' DG A 11 -2.268 -5.592 -4.238 1.00 0.50 H new ATOM 0 H1' DG A 11 -1.596 -7.120 -5.855 1.00 0.50 H new ATOM 0 H8 DG A 11 -0.361 -4.126 -7.892 1.00 0.61 H new ATOM 0 H1 DG A 11 4.104 -7.291 -4.517 1.00 0.51 H new ATOM 0 H21 DG A 11 1.402 -9.063 -3.222 1.00 0.56 H new ATOM 0 H22 DG A 11 3.151 -8.813 -3.247 1.00 0.56 H new ATOM 260 P DG A 12 -5.221 -6.445 -3.808 1.00 0.67 P ATOM 261 OP1 DG A 12 -5.575 -7.828 -3.399 1.00 1.03 O ATOM 262 OP2 DG A 12 -6.291 -5.426 -3.954 1.00 0.45 O ATOM 263 O5' DG A 12 -4.135 -5.888 -2.784 1.00 0.92 O ATOM 264 C5' DG A 12 -4.425 -5.779 -1.390 1.00 0.89 C ATOM 265 C4' DG A 12 -3.601 -6.776 -0.608 1.00 0.58 C ATOM 266 O4' DG A 12 -2.279 -6.866 -1.196 1.00 0.48 O ATOM 267 C3' DG A 12 -3.380 -6.413 0.861 1.00 0.56 C ATOM 268 O3' DG A 12 -3.345 -7.596 1.666 1.00 0.59 O ATOM 269 C2' DG A 12 -2.027 -5.727 0.854 1.00 0.48 C ATOM 270 C1' DG A 12 -1.292 -6.448 -0.264 1.00 0.45 C ATOM 271 N9 DG A 12 -0.325 -5.618 -0.977 1.00 0.41 N ATOM 272 C8 DG A 12 -0.596 -4.666 -1.929 1.00 0.45 C ATOM 273 N7 DG A 12 0.474 -4.078 -2.390 1.00 0.42 N ATOM 274 C5 DG A 12 1.517 -4.679 -1.699 1.00 0.38 C ATOM 275 C6 DG A 12 2.915 -4.454 -1.773 1.00 0.44 C ATOM 276 O6 DG A 12 3.523 -3.652 -2.489 1.00 0.51 O ATOM 277 N1 DG A 12 3.623 -5.278 -0.900 1.00 0.47 N ATOM 278 C2 DG A 12 3.042 -6.203 -0.062 1.00 0.44 C ATOM 279 N2 DG A 12 3.882 -6.910 0.710 1.00 0.51 N ATOM 280 N3 DG A 12 1.739 -6.422 0.016 1.00 0.39 N ATOM 281 C4 DG A 12 1.042 -5.631 -0.824 1.00 0.37 C ATOM 0 H5' DG A 12 -5.486 -5.957 -1.216 1.00 0.89 H new ATOM 0 H5'' DG A 12 -4.211 -4.768 -1.044 1.00 0.89 H new ATOM 0 H4' DG A 12 -4.170 -7.705 -0.650 1.00 0.58 H new ATOM 0 H3' DG A 12 -4.171 -5.786 1.274 1.00 0.56 H new ATOM 0 H2' DG A 12 -2.116 -4.659 0.657 1.00 0.48 H new ATOM 0 H2'' DG A 12 -1.514 -5.833 1.810 1.00 0.48 H new ATOM 0 H1' DG A 12 -0.728 -7.266 0.183 1.00 0.45 H new ATOM 0 H8 DG A 12 -1.595 -4.428 -2.263 1.00 0.45 H new ATOM 0 H1 DG A 12 4.639 -5.190 -0.881 1.00 0.47 H new ATOM 0 H21 DG A 12 3.515 -7.612 1.353 1.00 0.51 H new ATOM 0 H22 DG A 12 4.887 -6.746 0.653 1.00 0.51 H new ATOM 293 P DG A 13 -3.593 -7.497 3.253 1.00 0.77 P ATOM 294 OP1 DG A 13 -4.386 -8.687 3.653 1.00 1.05 O ATOM 295 OP2 DG A 13 -4.105 -6.137 3.563 1.00 1.03 O ATOM 296 O5' DG A 13 -2.136 -7.639 3.880 1.00 0.68 O ATOM 297 C5' DG A 13 -1.897 -7.345 5.257 1.00 1.04 C ATOM 298 C4' DG A 13 -0.463 -7.660 5.616 1.00 0.86 C ATOM 299 O4' DG A 13 0.408 -7.168 4.565 1.00 0.68 O ATOM 300 C3' DG A 13 0.032 -7.011 6.912 1.00 0.84 C ATOM 301 O3' DG A 13 0.903 -7.905 7.615 1.00 0.94 O ATOM 302 C2' DG A 13 0.798 -5.794 6.427 1.00 0.77 C ATOM 303 C1' DG A 13 1.369 -6.277 5.107 1.00 0.56 C ATOM 304 N9 DG A 13 1.611 -5.219 4.128 1.00 0.47 N ATOM 305 C8 DG A 13 0.678 -4.581 3.349 1.00 0.49 C ATOM 306 N7 DG A 13 1.193 -3.674 2.565 1.00 0.46 N ATOM 307 C5 DG A 13 2.552 -3.716 2.844 1.00 0.40 C ATOM 308 C6 DG A 13 3.622 -2.959 2.302 1.00 0.40 C ATOM 309 O6 DG A 13 3.573 -2.073 1.442 1.00 0.45 O ATOM 310 N1 DG A 13 4.848 -3.315 2.861 1.00 0.39 N ATOM 311 C2 DG A 13 5.010 -4.285 3.825 1.00 0.40 C ATOM 312 N2 DG A 13 6.266 -4.495 4.248 1.00 0.46 N ATOM 313 N3 DG A 13 4.019 -4.997 4.337 1.00 0.42 N ATOM 314 C4 DG A 13 2.827 -4.663 3.805 1.00 0.41 C ATOM 0 H5' DG A 13 -2.573 -7.927 5.883 1.00 1.04 H new ATOM 0 H5'' DG A 13 -2.106 -6.294 5.454 1.00 1.04 H new ATOM 0 H4' DG A 13 -0.435 -8.742 5.745 1.00 0.86 H new ATOM 0 H3' DG A 13 -0.774 -6.760 7.601 1.00 0.84 H new ATOM 0 H2' DG A 13 0.147 -4.929 6.297 1.00 0.77 H new ATOM 0 H2'' DG A 13 1.581 -5.501 7.126 1.00 0.77 H new ATOM 0 H1' DG A 13 2.340 -6.730 5.306 1.00 0.56 H new ATOM 0 H8 DG A 13 -0.378 -4.807 3.382 1.00 0.49 H new ATOM 0 H1 DG A 13 5.681 -2.825 2.534 1.00 0.39 H new ATOM 0 H21 DG A 13 6.453 -5.200 4.961 1.00 0.46 H new ATOM 0 H22 DG A 13 7.034 -3.949 3.857 1.00 0.46 H new ATOM 326 P DT A 14 0.517 -8.411 9.093 1.00 1.08 P ATOM 327 OP1 DT A 14 -0.549 -7.515 9.610 1.00 2.03 O ATOM 328 OP2 DT A 14 1.772 -8.580 9.869 1.00 1.40 O ATOM 329 O5' DT A 14 -0.121 -9.852 8.853 1.00 0.90 O ATOM 330 C5' DT A 14 -0.015 -10.878 9.841 1.00 0.76 C ATOM 331 C4' DT A 14 1.230 -11.702 9.605 1.00 1.10 C ATOM 332 O4' DT A 14 1.555 -12.431 10.813 1.00 1.22 O ATOM 333 C3' DT A 14 1.103 -12.763 8.516 1.00 1.26 C ATOM 334 O3' DT A 14 1.500 -12.228 7.248 1.00 1.65 O ATOM 335 C2' DT A 14 2.075 -13.832 8.976 1.00 1.53 C ATOM 336 C1' DT A 14 1.959 -13.758 10.493 1.00 1.43 C ATOM 337 N1 DT A 14 0.970 -14.689 11.073 1.00 1.31 N ATOM 338 C2 DT A 14 1.368 -15.981 11.336 1.00 1.53 C ATOM 339 O2 DT A 14 2.496 -16.389 11.112 1.00 1.79 O ATOM 340 N3 DT A 14 0.394 -16.782 11.872 1.00 1.53 N ATOM 341 C4 DT A 14 -0.908 -16.429 12.165 1.00 1.38 C ATOM 342 O4 DT A 14 -1.673 -17.261 12.646 1.00 1.53 O ATOM 343 C5 DT A 14 -1.259 -15.059 11.865 1.00 1.15 C ATOM 344 C7 DT A 14 -2.652 -14.589 12.149 1.00 1.15 C ATOM 345 C6 DT A 14 -0.316 -14.263 11.340 1.00 1.12 C ATOM 0 H5' DT A 14 -0.896 -11.519 9.807 1.00 0.76 H new ATOM 0 H5'' DT A 14 0.017 -10.433 10.836 1.00 0.76 H new ATOM 0 H4' DT A 14 1.985 -10.978 9.299 1.00 1.10 H new ATOM 0 H3' DT A 14 0.086 -13.132 8.382 1.00 1.26 H new ATOM 0 H2' DT A 14 1.803 -14.817 8.596 1.00 1.53 H new ATOM 0 H2'' DT A 14 3.091 -13.629 8.637 1.00 1.53 H new ATOM 0 H1' DT A 14 2.926 -14.037 10.910 1.00 1.43 H new ATOM 0 H3 DT A 14 0.660 -17.745 12.077 1.00 1.53 H new ATOM 0 H71 DT A 14 -2.636 -13.525 12.386 1.00 1.15 H new ATOM 0 H72 DT A 14 -3.278 -14.756 11.272 1.00 1.15 H new ATOM 0 H73 DT A 14 -3.058 -15.144 12.995 1.00 1.15 H new ATOM 0 H6 DT A 14 -0.575 -13.239 11.115 1.00 1.12 H new ATOM 358 P DA A 15 0.854 -12.809 5.895 1.00 1.61 P ATOM 359 OP1 DA A 15 1.340 -11.965 4.774 1.00 1.94 O ATOM 360 OP2 DA A 15 -0.607 -12.977 6.107 1.00 1.57 O ATOM 361 O5' DA A 15 1.509 -14.255 5.745 1.00 1.62 O ATOM 362 C5' DA A 15 0.750 -15.438 5.996 1.00 1.83 C ATOM 363 C4' DA A 15 1.638 -16.657 5.892 1.00 1.32 C ATOM 364 O4' DA A 15 1.058 -17.736 6.662 1.00 1.23 O ATOM 365 C3' DA A 15 1.803 -17.214 4.483 1.00 1.17 C ATOM 366 O3' DA A 15 2.930 -16.613 3.836 1.00 0.94 O ATOM 367 C2' DA A 15 2.050 -18.689 4.732 1.00 1.29 C ATOM 368 C1' DA A 15 1.205 -18.971 5.968 1.00 1.08 C ATOM 369 N9 DA A 15 -0.135 -19.486 5.677 1.00 1.14 N ATOM 370 C8 DA A 15 -1.287 -18.766 5.472 1.00 1.43 C ATOM 371 N7 DA A 15 -2.338 -19.510 5.231 1.00 1.60 N ATOM 372 C5 DA A 15 -1.847 -20.808 5.279 1.00 1.34 C ATOM 373 C6 DA A 15 -2.463 -22.060 5.106 1.00 1.40 C ATOM 374 N6 DA A 15 -3.762 -22.216 4.837 1.00 1.72 N ATOM 375 N1 DA A 15 -1.690 -23.161 5.220 1.00 1.28 N ATOM 376 C2 DA A 15 -0.387 -23.005 5.489 1.00 1.20 C ATOM 377 N3 DA A 15 0.306 -21.884 5.673 1.00 1.12 N ATOM 378 C4 DA A 15 -0.492 -20.808 5.554 1.00 1.11 C ATOM 0 H5' DA A 15 -0.069 -15.513 5.280 1.00 1.83 H new ATOM 0 H5'' DA A 15 0.302 -15.388 6.989 1.00 1.83 H new ATOM 0 H4' DA A 15 2.611 -16.320 6.250 1.00 1.32 H new ATOM 0 H3' DA A 15 0.947 -17.023 3.836 1.00 1.17 H new ATOM 0 H2' DA A 15 1.741 -19.299 3.883 1.00 1.29 H new ATOM 0 H2'' DA A 15 3.105 -18.898 4.908 1.00 1.29 H new ATOM 0 H1' DA A 15 1.716 -19.743 6.544 1.00 1.08 H new ATOM 0 H8 DA A 15 -1.323 -17.687 5.506 1.00 1.43 H new ATOM 0 H61 DA A 15 -4.150 -23.152 4.722 1.00 1.72 H new ATOM 0 H62 DA A 15 -4.366 -21.399 4.746 1.00 1.72 H new ATOM 0 H2 DA A 15 0.182 -23.919 5.568 1.00 1.20 H new ATOM 390 P DG A 16 2.702 -15.639 2.577 1.00 1.31 P ATOM 391 OP1 DG A 16 1.690 -14.627 2.974 1.00 1.90 O ATOM 392 OP2 DG A 16 2.467 -16.478 1.375 1.00 1.94 O ATOM 393 O5' DG A 16 4.102 -14.897 2.404 1.00 0.91 O ATOM 394 C5' DG A 16 4.286 -13.906 1.394 1.00 1.08 C ATOM 395 C4' DG A 16 5.658 -13.284 1.518 1.00 0.91 C ATOM 396 O4' DG A 16 6.003 -12.643 0.262 1.00 0.86 O ATOM 397 C3' DG A 16 5.778 -12.198 2.596 1.00 0.88 C ATOM 398 O3' DG A 16 7.009 -12.344 3.312 1.00 0.89 O ATOM 399 C2' DG A 16 5.771 -10.901 1.803 1.00 0.81 C ATOM 400 C1' DG A 16 6.432 -11.316 0.504 1.00 0.75 C ATOM 401 N9 DG A 16 6.064 -10.499 -0.651 1.00 0.71 N ATOM 402 C8 DG A 16 4.848 -10.460 -1.288 1.00 0.77 C ATOM 403 N7 DG A 16 4.817 -9.629 -2.293 1.00 0.74 N ATOM 404 C5 DG A 16 6.093 -9.084 -2.323 1.00 0.62 C ATOM 405 C6 DG A 16 6.657 -8.121 -3.197 1.00 0.56 C ATOM 406 O6 DG A 16 6.116 -7.538 -4.144 1.00 0.60 O ATOM 407 N1 DG A 16 7.986 -7.845 -2.882 1.00 0.51 N ATOM 408 C2 DG A 16 8.677 -8.432 -1.846 1.00 0.54 C ATOM 409 N2 DG A 16 9.951 -8.041 -1.684 1.00 0.57 N ATOM 410 N3 DG A 16 8.161 -9.332 -1.024 1.00 0.59 N ATOM 411 C4 DG A 16 6.875 -9.609 -1.318 1.00 0.61 C ATOM 0 H5' DG A 16 3.520 -13.136 1.486 1.00 1.08 H new ATOM 0 H5'' DG A 16 4.170 -14.355 0.408 1.00 1.08 H new ATOM 0 H4' DG A 16 6.318 -14.107 1.791 1.00 0.91 H new ATOM 0 H3' DG A 16 4.981 -12.243 3.338 1.00 0.88 H new ATOM 0 H2' DG A 16 4.760 -10.527 1.644 1.00 0.81 H new ATOM 0 H2'' DG A 16 6.327 -10.112 2.309 1.00 0.81 H new ATOM 0 H1' DG A 16 7.510 -11.202 0.617 1.00 0.75 H new ATOM 0 H8 DG A 16 4.001 -11.058 -0.987 1.00 0.77 H new ATOM 0 H1 DG A 16 8.480 -7.163 -3.457 1.00 0.51 H new ATOM 0 H21 DG A 16 10.515 -8.440 -0.934 1.00 0.57 H new ATOM 0 H22 DG A 16 10.355 -7.345 -2.311 1.00 0.57 H new ATOM 423 P DG A 17 7.304 -11.425 4.599 1.00 0.90 P ATOM 424 OP1 DG A 17 7.883 -12.302 5.648 1.00 1.04 O ATOM 425 OP2 DG A 17 6.085 -10.631 4.898 1.00 1.16 O ATOM 426 O5' DG A 17 8.444 -10.425 4.105 1.00 0.68 O ATOM 427 C5' DG A 17 9.684 -10.919 3.599 1.00 0.66 C ATOM 428 C4' DG A 17 10.650 -9.778 3.376 1.00 0.50 C ATOM 429 O4' DG A 17 10.233 -9.025 2.208 1.00 0.57 O ATOM 430 C3' DG A 17 10.730 -8.767 4.526 1.00 0.39 C ATOM 431 O3' DG A 17 12.086 -8.352 4.727 1.00 0.35 O ATOM 432 C2' DG A 17 9.882 -7.606 4.037 1.00 0.39 C ATOM 433 C1' DG A 17 10.111 -7.652 2.539 1.00 0.45 C ATOM 434 N9 DG A 17 9.025 -7.086 1.740 1.00 0.49 N ATOM 435 C8 DG A 17 7.721 -7.512 1.690 1.00 0.57 C ATOM 436 N7 DG A 17 6.979 -6.809 0.879 1.00 0.60 N ATOM 437 C5 DG A 17 7.848 -5.858 0.361 1.00 0.53 C ATOM 438 C6 DG A 17 7.615 -4.816 -0.573 1.00 0.54 C ATOM 439 O6 DG A 17 6.559 -4.521 -1.142 1.00 0.61 O ATOM 440 N1 DG A 17 8.770 -4.078 -0.827 1.00 0.49 N ATOM 441 C2 DG A 17 9.993 -4.324 -0.245 1.00 0.45 C ATOM 442 N2 DG A 17 10.996 -3.508 -0.603 1.00 0.46 N ATOM 443 N3 DG A 17 10.221 -5.292 0.627 1.00 0.44 N ATOM 444 C4 DG A 17 9.113 -6.015 0.881 1.00 0.47 C ATOM 0 H5' DG A 17 9.517 -11.451 2.663 1.00 0.66 H new ATOM 0 H5'' DG A 17 10.112 -11.635 4.301 1.00 0.66 H new ATOM 0 H4' DG A 17 11.627 -10.251 3.273 1.00 0.50 H new ATOM 0 H3' DG A 17 10.386 -9.171 5.478 1.00 0.39 H new ATOM 0 H2' DG A 17 8.830 -7.734 4.292 1.00 0.39 H new ATOM 0 H2'' DG A 17 10.202 -6.658 4.469 1.00 0.39 H new ATOM 0 H1' DG A 17 10.992 -7.051 2.312 1.00 0.45 H new ATOM 0 H8 DG A 17 7.346 -8.346 2.265 1.00 0.57 H new ATOM 0 H1 DG A 17 8.705 -3.304 -1.488 1.00 0.49 H new ATOM 0 H21 DG A 17 11.926 -3.639 -0.206 1.00 0.46 H new ATOM 0 H22 DG A 17 10.828 -2.757 -1.272 1.00 0.46 H new ATOM 456 P DG A 18 12.458 -7.388 5.959 1.00 0.61 P ATOM 457 OP1 DG A 18 13.690 -7.928 6.589 1.00 0.91 O ATOM 458 OP2 DG A 18 11.239 -7.190 6.784 1.00 0.72 O ATOM 459 O5' DG A 18 12.824 -6.000 5.266 1.00 0.94 O ATOM 460 C5' DG A 18 13.843 -5.924 4.269 1.00 0.76 C ATOM 461 C4' DG A 18 14.157 -4.480 3.951 1.00 0.71 C ATOM 462 O4' DG A 18 13.106 -3.942 3.108 1.00 0.68 O ATOM 463 C3' DG A 18 14.239 -3.555 5.171 1.00 0.82 C ATOM 464 O3' DG A 18 15.311 -2.618 5.014 1.00 0.99 O ATOM 465 C2' DG A 18 12.900 -2.840 5.168 1.00 0.75 C ATOM 466 C1' DG A 18 12.577 -2.762 3.688 1.00 0.65 C ATOM 467 N9 DG A 18 11.148 -2.709 3.379 1.00 0.56 N ATOM 468 C8 DG A 18 10.148 -3.458 3.948 1.00 0.58 C ATOM 469 N7 DG A 18 8.966 -3.191 3.467 1.00 0.50 N ATOM 470 C5 DG A 18 9.198 -2.204 2.520 1.00 0.44 C ATOM 471 C6 DG A 18 8.294 -1.519 1.670 1.00 0.43 C ATOM 472 O6 DG A 18 7.068 -1.657 1.587 1.00 0.45 O ATOM 473 N1 DG A 18 8.943 -0.591 0.857 1.00 0.46 N ATOM 474 C2 DG A 18 10.300 -0.361 0.872 1.00 0.45 C ATOM 475 N2 DG A 18 10.752 0.572 0.019 1.00 0.50 N ATOM 476 N3 DG A 18 11.153 -0.993 1.661 1.00 0.46 N ATOM 477 C4 DG A 18 10.538 -1.894 2.453 1.00 0.47 C ATOM 0 H5' DG A 18 13.517 -6.440 3.366 1.00 0.76 H new ATOM 0 H5'' DG A 18 14.742 -6.431 4.619 1.00 0.76 H new ATOM 0 H4' DG A 18 15.138 -4.501 3.476 1.00 0.71 H new ATOM 0 H3' DG A 18 14.431 -4.090 6.101 1.00 0.82 H new ATOM 0 H2' DG A 18 12.142 -3.395 5.721 1.00 0.75 H new ATOM 0 H2'' DG A 18 12.966 -1.851 5.622 1.00 0.75 H new ATOM 0 H1' DG A 18 13.003 -1.837 3.300 1.00 0.65 H new ATOM 0 H8 DG A 18 10.323 -4.195 4.718 1.00 0.58 H new ATOM 0 H1 DG A 18 8.375 -0.046 0.208 1.00 0.46 H new ATOM 0 H21 DG A 18 11.748 0.789 -0.018 1.00 0.50 H new ATOM 0 H22 DG A 18 10.099 1.064 -0.592 1.00 0.50 H new ATOM 489 P DT A 19 16.775 -2.972 5.578 1.00 0.87 P ATOM 490 OP1 DT A 19 16.602 -3.543 6.938 1.00 1.15 O ATOM 491 OP2 DT A 19 17.647 -1.786 5.387 1.00 1.13 O ATOM 492 O5' DT A 19 17.290 -4.132 4.613 1.00 0.85 O ATOM 493 C5' DT A 19 17.868 -5.326 5.140 1.00 0.98 C ATOM 494 C4' DT A 19 18.518 -6.122 4.032 1.00 0.60 C ATOM 495 O4' DT A 19 19.081 -7.337 4.589 1.00 0.71 O ATOM 496 C3' DT A 19 17.565 -6.568 2.916 1.00 0.75 C ATOM 497 O3' DT A 19 18.200 -6.443 1.638 1.00 0.99 O ATOM 498 C2' DT A 19 17.296 -8.028 3.237 1.00 1.11 C ATOM 499 C1' DT A 19 18.597 -8.466 3.881 1.00 1.04 C ATOM 500 N1 DT A 19 18.461 -9.584 4.835 1.00 1.38 N ATOM 501 C2 DT A 19 18.482 -10.868 4.337 1.00 1.89 C ATOM 502 O2 DT A 19 18.607 -11.122 3.150 1.00 2.12 O ATOM 503 N3 DT A 19 18.350 -11.851 5.284 1.00 2.35 N ATOM 504 C4 DT A 19 18.202 -11.682 6.646 1.00 2.54 C ATOM 505 O4 DT A 19 18.095 -12.665 7.376 1.00 3.11 O ATOM 506 C5 DT A 19 18.189 -10.309 7.100 1.00 2.21 C ATOM 507 C7 DT A 19 18.034 -10.031 8.563 1.00 2.76 C ATOM 508 C6 DT A 19 18.317 -9.337 6.186 1.00 1.61 C ATOM 0 H5' DT A 19 17.100 -5.927 5.627 1.00 0.98 H new ATOM 0 H5'' DT A 19 18.608 -5.076 5.901 1.00 0.98 H new ATOM 0 H4' DT A 19 19.258 -5.450 3.597 1.00 0.60 H new ATOM 0 H3' DT A 19 16.655 -5.970 2.868 1.00 0.75 H new ATOM 0 H2' DT A 19 16.449 -8.146 3.913 1.00 1.11 H new ATOM 0 H2'' DT A 19 17.072 -8.606 2.341 1.00 1.11 H new ATOM 0 H1' DT A 19 19.261 -8.824 3.094 1.00 1.04 H new ATOM 0 H3 DT A 19 18.363 -12.813 4.945 1.00 2.35 H new ATOM 0 H71 DT A 19 18.549 -9.103 8.814 1.00 2.76 H new ATOM 0 H72 DT A 19 16.976 -9.936 8.805 1.00 2.76 H new ATOM 0 H73 DT A 19 18.465 -10.851 9.137 1.00 2.76 H new ATOM 0 H6 DT A 19 18.307 -8.311 6.522 1.00 1.61 H new ATOM 521 P DG A 20 18.289 -5.004 0.925 1.00 1.05 P ATOM 522 OP1 DG A 20 19.599 -4.409 1.292 1.00 1.59 O ATOM 523 OP2 DG A 20 17.038 -4.259 1.214 1.00 1.32 O ATOM 524 O5' DG A 20 18.321 -5.347 -0.632 1.00 1.13 O ATOM 525 C5' DG A 20 17.128 -5.698 -1.335 1.00 0.71 C ATOM 526 C4' DG A 20 16.913 -4.757 -2.496 1.00 0.40 C ATOM 527 O4' DG A 20 15.812 -5.248 -3.304 1.00 0.37 O ATOM 528 C3' DG A 20 16.542 -3.321 -2.102 1.00 0.46 C ATOM 529 O3' DG A 20 17.215 -2.381 -2.948 1.00 0.56 O ATOM 530 C2' DG A 20 15.043 -3.264 -2.329 1.00 0.45 C ATOM 531 C1' DG A 20 14.857 -4.218 -3.492 1.00 0.32 C ATOM 532 N9 DG A 20 13.531 -4.830 -3.567 1.00 0.34 N ATOM 533 C8 DG A 20 13.094 -5.950 -2.903 1.00 0.41 C ATOM 534 N7 DG A 20 11.855 -6.260 -3.173 1.00 0.43 N ATOM 535 C5 DG A 20 11.449 -5.283 -4.073 1.00 0.34 C ATOM 536 C6 DG A 20 10.202 -5.096 -4.721 1.00 0.34 C ATOM 537 O6 DG A 20 9.178 -5.779 -4.621 1.00 0.39 O ATOM 538 N1 DG A 20 10.211 -3.980 -5.557 1.00 0.32 N ATOM 539 C2 DG A 20 11.296 -3.153 -5.736 1.00 0.33 C ATOM 540 N2 DG A 20 11.121 -2.117 -6.572 1.00 0.42 N ATOM 541 N3 DG A 20 12.464 -3.318 -5.137 1.00 0.33 N ATOM 542 C4 DG A 20 12.470 -4.394 -4.326 1.00 0.31 C ATOM 0 H5' DG A 20 16.273 -5.656 -0.660 1.00 0.71 H new ATOM 0 H5'' DG A 20 17.198 -6.724 -1.697 1.00 0.71 H new ATOM 0 H4' DG A 20 17.869 -4.728 -3.019 1.00 0.40 H new ATOM 0 H3' DG A 20 16.826 -3.073 -1.079 1.00 0.46 H new ATOM 0 H2' DG A 20 14.486 -3.583 -1.448 1.00 0.45 H new ATOM 0 H2'' DG A 20 14.706 -2.256 -2.572 1.00 0.45 H new ATOM 0 H1' DG A 20 14.977 -3.655 -4.418 1.00 0.32 H new ATOM 0 H8 DG A 20 13.714 -6.518 -2.225 1.00 0.41 H new ATOM 0 H1 DG A 20 9.357 -3.762 -6.070 1.00 0.32 H new ATOM 0 H21 DG A 20 11.888 -1.467 -6.747 1.00 0.42 H new ATOM 0 H22 DG A 20 10.221 -1.980 -7.032 1.00 0.42 H new ATOM 554 P DG A 21 17.165 -0.810 -2.604 1.00 0.90 P ATOM 555 OP1 DG A 21 18.437 -0.211 -3.080 1.00 1.19 O ATOM 556 OP2 DG A 21 16.770 -0.656 -1.180 1.00 1.10 O ATOM 557 O5' DG A 21 15.981 -0.251 -3.515 1.00 0.85 O ATOM 558 C5' DG A 21 16.126 -0.155 -4.932 1.00 1.07 C ATOM 559 C4' DG A 21 15.139 0.843 -5.495 1.00 0.86 C ATOM 560 O4' DG A 21 13.814 0.251 -5.498 1.00 0.83 O ATOM 561 C3' DG A 21 15.017 2.150 -4.702 1.00 0.78 C ATOM 562 O3' DG A 21 14.880 3.261 -5.597 1.00 0.79 O ATOM 563 C2' DG A 21 13.748 1.955 -3.890 1.00 0.65 C ATOM 564 C1' DG A 21 12.905 1.096 -4.813 1.00 0.61 C ATOM 565 N9 DG A 21 11.927 0.250 -4.130 1.00 0.54 N ATOM 566 C8 DG A 21 12.157 -0.598 -3.075 1.00 0.51 C ATOM 567 N7 DG A 21 11.088 -1.232 -2.681 1.00 0.47 N ATOM 568 C5 DG A 21 10.088 -0.775 -3.527 1.00 0.46 C ATOM 569 C6 DG A 21 8.711 -1.107 -3.580 1.00 0.46 C ATOM 570 O6 DG A 21 8.088 -1.901 -2.866 1.00 0.46 O ATOM 571 N1 DG A 21 8.047 -0.414 -4.592 1.00 0.52 N ATOM 572 C2 DG A 21 8.650 0.487 -5.440 1.00 0.59 C ATOM 573 N2 DG A 21 7.855 1.065 -6.353 1.00 0.68 N ATOM 574 N3 DG A 21 9.934 0.803 -5.400 1.00 0.58 N ATOM 575 C4 DG A 21 10.588 0.140 -4.427 1.00 0.52 C ATOM 0 H5' DG A 21 15.965 -1.132 -5.388 1.00 1.07 H new ATOM 0 H5'' DG A 21 17.143 0.149 -5.180 1.00 1.07 H new ATOM 0 H4' DG A 21 15.519 1.084 -6.488 1.00 0.86 H new ATOM 0 H3' DG A 21 15.888 2.360 -4.081 1.00 0.78 H new ATOM 0 H2' DG A 21 13.945 1.459 -2.940 1.00 0.65 H new ATOM 0 H2'' DG A 21 13.262 2.903 -3.660 1.00 0.65 H new ATOM 0 H1' DG A 21 12.329 1.759 -5.459 1.00 0.61 H new ATOM 0 H8 DG A 21 13.127 -0.727 -2.617 1.00 0.51 H new ATOM 0 H1 DG A 21 7.049 -0.586 -4.712 1.00 0.52 H new ATOM 0 H21 DG A 21 8.242 1.742 -7.011 1.00 0.68 H new ATOM 0 H22 DG A 21 6.864 0.828 -6.389 1.00 0.68 H new ATOM 587 P DG A 22 14.753 4.755 -5.015 1.00 0.78 P ATOM 588 OP1 DG A 22 15.627 5.628 -5.840 1.00 1.21 O ATOM 589 OP2 DG A 22 14.947 4.705 -3.543 1.00 1.15 O ATOM 590 O5' DG A 22 13.238 5.153 -5.310 1.00 0.69 O ATOM 591 C5' DG A 22 12.499 5.969 -4.401 1.00 0.50 C ATOM 592 C4' DG A 22 11.067 6.097 -4.865 1.00 0.36 C ATOM 593 O4' DG A 22 10.488 4.781 -4.992 1.00 0.36 O ATOM 594 C3' DG A 22 10.144 6.842 -3.910 1.00 0.37 C ATOM 595 O3' DG A 22 10.159 8.245 -4.196 1.00 0.42 O ATOM 596 C2' DG A 22 8.781 6.246 -4.218 1.00 0.43 C ATOM 597 C1' DG A 22 9.102 4.823 -4.672 1.00 0.32 C ATOM 598 N9 DG A 22 8.843 3.797 -3.663 1.00 0.28 N ATOM 599 C8 DG A 22 9.768 3.151 -2.880 1.00 0.38 C ATOM 600 N7 DG A 22 9.238 2.281 -2.066 1.00 0.45 N ATOM 601 C5 DG A 22 7.877 2.355 -2.327 1.00 0.35 C ATOM 602 C6 DG A 22 6.795 1.644 -1.750 1.00 0.41 C ATOM 603 O6 DG A 22 6.831 0.781 -0.866 1.00 0.54 O ATOM 604 N1 DG A 22 5.571 2.021 -2.301 1.00 0.33 N ATOM 605 C2 DG A 22 5.422 2.970 -3.288 1.00 0.28 C ATOM 606 N2 DG A 22 4.166 3.202 -3.701 1.00 0.35 N ATOM 607 N3 DG A 22 6.425 3.640 -3.833 1.00 0.26 N ATOM 608 C4 DG A 22 7.615 3.285 -3.309 1.00 0.26 C ATOM 0 H5' DG A 22 12.957 6.956 -4.332 1.00 0.50 H new ATOM 0 H5'' DG A 22 12.528 5.533 -3.402 1.00 0.50 H new ATOM 0 H4' DG A 22 11.132 6.656 -5.798 1.00 0.36 H new ATOM 0 H3' DG A 22 10.429 6.742 -2.863 1.00 0.37 H new ATOM 0 H2' DG A 22 8.135 6.250 -3.340 1.00 0.43 H new ATOM 0 H2'' DG A 22 8.265 6.808 -4.997 1.00 0.43 H new ATOM 0 H1' DG A 22 8.451 4.601 -5.518 1.00 0.32 H new ATOM 0 H8 DG A 22 10.829 3.344 -2.933 1.00 0.38 H new ATOM 0 H1 DG A 22 4.730 1.563 -1.950 1.00 0.33 H new ATOM 0 H21 DG A 22 3.988 3.893 -4.430 1.00 0.35 H new ATOM 0 H22 DG A 22 3.389 2.687 -3.286 1.00 0.35 H new ATOM 620 P DT A 23 9.682 9.296 -3.075 1.00 0.62 P ATOM 621 OP1 DT A 23 9.800 10.655 -3.662 1.00 0.72 O ATOM 622 OP2 DT A 23 10.388 8.980 -1.808 1.00 0.71 O ATOM 623 O5' DT A 23 8.133 8.974 -2.879 1.00 0.94 O ATOM 624 C5' DT A 23 7.347 9.695 -1.931 1.00 0.73 C ATOM 625 C4' DT A 23 5.878 9.446 -2.179 1.00 0.64 C ATOM 626 O4' DT A 23 5.621 8.020 -2.106 1.00 0.65 O ATOM 627 C3' DT A 23 4.933 10.098 -1.162 1.00 0.62 C ATOM 628 O3' DT A 23 3.756 10.585 -1.818 1.00 0.71 O ATOM 629 C2' DT A 23 4.590 8.958 -0.221 1.00 0.67 C ATOM 630 C1' DT A 23 4.608 7.758 -1.148 1.00 0.68 C ATOM 631 N1 DT A 23 4.921 6.477 -0.484 1.00 0.73 N ATOM 632 C2 DT A 23 3.875 5.647 -0.149 1.00 0.86 C ATOM 633 O2 DT A 23 2.707 5.918 -0.378 1.00 0.94 O ATOM 634 N3 DT A 23 4.246 4.480 0.467 1.00 0.93 N ATOM 635 C4 DT A 23 5.526 4.070 0.775 1.00 0.87 C ATOM 636 O4 DT A 23 5.701 2.990 1.333 1.00 0.96 O ATOM 637 C5 DT A 23 6.577 4.988 0.396 1.00 0.74 C ATOM 638 C7 DT A 23 7.999 4.626 0.693 1.00 0.72 C ATOM 639 C6 DT A 23 6.230 6.135 -0.208 1.00 0.69 C ATOM 0 H5' DT A 23 7.561 10.761 -2.005 1.00 0.73 H new ATOM 0 H5'' DT A 23 7.610 9.387 -0.919 1.00 0.73 H new ATOM 0 H4' DT A 23 5.678 9.884 -3.157 1.00 0.64 H new ATOM 0 H3' DT A 23 5.374 10.953 -0.650 1.00 0.62 H new ATOM 0 H2' DT A 23 5.319 8.861 0.584 1.00 0.67 H new ATOM 0 H2'' DT A 23 3.615 9.096 0.247 1.00 0.67 H new ATOM 0 H1' DT A 23 3.610 7.640 -1.569 1.00 0.68 H new ATOM 0 H3 DT A 23 3.492 3.844 0.726 1.00 0.93 H new ATOM 0 H71 DT A 23 8.652 5.072 -0.057 1.00 0.72 H new ATOM 0 H72 DT A 23 8.271 5.000 1.680 1.00 0.72 H new ATOM 0 H73 DT A 23 8.110 3.542 0.672 1.00 0.72 H new ATOM 0 H6 DT A 23 7.012 6.824 -0.492 1.00 0.69 H new ATOM 652 P DA A 24 2.607 11.320 -0.966 1.00 0.69 P ATOM 653 OP1 DA A 24 1.954 12.309 -1.861 1.00 0.93 O ATOM 654 OP2 DA A 24 3.195 11.771 0.321 1.00 0.71 O ATOM 655 O5' DA A 24 1.557 10.160 -0.659 1.00 0.71 O ATOM 656 C5' DA A 24 0.672 10.242 0.459 1.00 0.84 C ATOM 657 C4' DA A 24 0.325 8.855 0.949 1.00 0.79 C ATOM 658 O4' DA A 24 1.538 8.195 1.395 1.00 0.82 O ATOM 659 C3' DA A 24 -0.636 8.813 2.141 1.00 0.79 C ATOM 660 O3' DA A 24 -1.507 7.680 2.040 1.00 0.78 O ATOM 661 C2' DA A 24 0.292 8.664 3.331 1.00 0.82 C ATOM 662 C1' DA A 24 1.414 7.816 2.757 1.00 0.79 C ATOM 663 N9 DA A 24 2.714 8.009 3.403 1.00 0.80 N ATOM 664 C8 DA A 24 3.658 8.969 3.128 1.00 0.90 C ATOM 665 N7 DA A 24 4.730 8.885 3.878 1.00 0.93 N ATOM 666 C5 DA A 24 4.476 7.797 4.702 1.00 0.83 C ATOM 667 C6 DA A 24 5.227 7.189 5.723 1.00 0.84 C ATOM 668 N6 DA A 24 6.436 7.608 6.105 1.00 0.93 N ATOM 669 N1 DA A 24 4.686 6.120 6.348 1.00 0.80 N ATOM 670 C2 DA A 24 3.473 5.700 5.966 1.00 0.78 C ATOM 671 N3 DA A 24 2.672 6.188 5.022 1.00 0.76 N ATOM 672 C4 DA A 24 3.239 7.248 4.420 1.00 0.77 C ATOM 0 H5' DA A 24 -0.236 10.774 0.176 1.00 0.84 H new ATOM 0 H5'' DA A 24 1.139 10.813 1.261 1.00 0.84 H new ATOM 0 H4' DA A 24 -0.162 8.371 0.103 1.00 0.79 H new ATOM 0 H3' DA A 24 -1.279 9.691 2.206 1.00 0.79 H new ATOM 0 H2' DA A 24 0.653 9.628 3.690 1.00 0.82 H new ATOM 0 H2'' DA A 24 -0.199 8.175 4.172 1.00 0.82 H new ATOM 0 H1' DA A 24 1.155 6.768 2.911 1.00 0.79 H new ATOM 0 H8 DA A 24 3.529 9.722 2.365 1.00 0.90 H new ATOM 0 H61 DA A 24 6.931 7.123 6.854 1.00 0.93 H new ATOM 0 H62 DA A 24 6.865 8.413 5.648 1.00 0.93 H new ATOM 0 H2 DA A 24 3.090 4.843 6.500 1.00 0.78 H new ATOM 684 P DA A 25 -2.899 7.804 1.244 1.00 0.82 P ATOM 685 OP1 DA A 25 -2.614 8.469 -0.053 1.00 1.52 O ATOM 686 OP2 DA A 25 -3.910 8.387 2.161 1.00 0.87 O ATOM 687 O5' DA A 25 -3.306 6.292 0.946 1.00 1.01 O ATOM 688 C5' DA A 25 -2.340 5.347 0.484 1.00 1.01 C ATOM 689 C4' DA A 25 -2.578 3.999 1.125 1.00 0.88 C ATOM 690 O4' DA A 25 -1.610 3.052 0.629 1.00 0.85 O ATOM 691 C3' DA A 25 -2.404 3.965 2.636 1.00 0.74 C ATOM 692 O3' DA A 25 -3.616 4.336 3.298 1.00 0.87 O ATOM 693 C2' DA A 25 -2.066 2.507 2.900 1.00 0.64 C ATOM 694 C1' DA A 25 -1.353 2.064 1.622 1.00 0.71 C ATOM 695 N9 DA A 25 0.100 1.926 1.759 1.00 0.67 N ATOM 696 C8 DA A 25 1.078 2.658 1.132 1.00 0.79 C ATOM 697 N7 DA A 25 2.296 2.301 1.458 1.00 0.81 N ATOM 698 C5 DA A 25 2.110 1.263 2.360 1.00 0.69 C ATOM 699 C6 DA A 25 3.014 0.456 3.074 1.00 0.73 C ATOM 700 N6 DA A 25 4.342 0.577 2.994 1.00 0.89 N ATOM 701 N1 DA A 25 2.500 -0.489 3.891 1.00 0.66 N ATOM 702 C2 DA A 25 1.169 -0.608 3.978 1.00 0.56 C ATOM 703 N3 DA A 25 0.219 0.090 3.359 1.00 0.52 N ATOM 704 C4 DA A 25 0.762 1.021 2.555 1.00 0.59 C ATOM 0 H5' DA A 25 -1.336 5.698 0.721 1.00 1.01 H new ATOM 0 H5'' DA A 25 -2.399 5.257 -0.601 1.00 1.01 H new ATOM 0 H4' DA A 25 -3.614 3.765 0.878 1.00 0.88 H new ATOM 0 H3' DA A 25 -1.647 4.659 3.001 1.00 0.74 H new ATOM 0 H2' DA A 25 -1.425 2.396 3.775 1.00 0.64 H new ATOM 0 H2'' DA A 25 -2.962 1.915 3.084 1.00 0.64 H new ATOM 0 HO3' DA A 25 -4.044 5.070 2.810 1.00 0.87 H new ATOM 0 H1' DA A 25 -1.735 1.076 1.364 1.00 0.71 H new ATOM 0 H8 DA A 25 0.863 3.454 0.435 1.00 0.79 H new ATOM 0 H61 DA A 25 4.944 -0.040 3.539 1.00 0.89 H new ATOM 0 H62 DA A 25 4.754 1.287 2.388 1.00 0.89 H new ATOM 0 H2 DA A 25 0.816 -1.380 4.645 1.00 0.56 H new TER 717 DA A 25 HETATM 718 C17 BO6 A 101 13.738 -7.095 -6.434 1.00 0.51 C HETATM 719 C18 BO6 A 101 14.727 -6.171 -6.756 1.00 0.51 C HETATM 720 N19 BO6 A 101 14.436 -5.102 -7.603 1.00 0.46 N HETATM 721 C31 BO6 A 101 15.488 -4.118 -7.946 1.00 0.55 C HETATM 722 C20 BO6 A 101 13.151 -4.963 -8.125 1.00 0.42 C HETATM 723 C21 BO6 A 101 12.163 -5.888 -7.802 1.00 0.40 C HETATM 724 C16 BO6 A 101 12.443 -6.963 -6.955 1.00 0.45 C HETATM 725 C15 BO6 A 101 11.481 -7.905 -6.607 1.00 0.52 C HETATM 726 C14 BO6 A 101 11.803 -9.369 -6.286 1.00 0.58 C HETATM 727 C7 BO6 A 101 10.976 -10.184 -5.518 1.00 0.62 C HETATM 728 C6 BO6 A 101 9.644 -10.322 -5.881 1.00 0.59 C HETATM 729 C8 BO6 A 101 11.430 -10.862 -4.409 1.00 0.75 C HETATM 730 C9 BO6 A 101 10.554 -11.657 -3.691 1.00 0.87 C HETATM 731 C2 BO6 A 101 9.275 -11.764 -4.074 1.00 0.84 C HETATM 732 N1 BO6 A 101 8.258 -12.451 -3.560 1.00 0.95 N HETATM 733 C3 BO6 A 101 8.822 -11.103 -5.159 1.00 0.69 C HETATM 734 C4 BO6 A 101 7.530 -11.390 -5.303 1.00 0.71 C HETATM 735 C10 BO6 A 101 6.627 -10.993 -6.215 1.00 0.64 C HETATM 736 C5 BO6 A 101 7.180 -12.230 -4.307 1.00 0.87 C HETATM 737 C13 BO6 A 101 5.925 -12.686 -4.206 1.00 0.95 C HETATM 738 C12 BO6 A 101 4.968 -12.298 -5.127 1.00 0.86 C HETATM 739 C11 BO6 A 101 5.315 -11.443 -6.144 1.00 0.70 C HETATM 740 C22 BO6 A 101 4.394 -11.022 -7.096 1.00 0.64 C HETATM 741 C23 BO6 A 101 4.235 -9.559 -7.528 1.00 0.62 C HETATM 742 C24 BO6 A 101 3.080 -9.050 -8.115 1.00 0.60 C HETATM 743 C25 BO6 A 101 1.835 -9.549 -7.702 1.00 0.66 C HETATM 744 C26 BO6 A 101 0.658 -9.066 -8.264 1.00 0.68 C HETATM 745 N27 BO6 A 101 0.707 -8.078 -9.247 1.00 0.67 N HETATM 746 C30 BO6 A 101 -0.546 -7.563 -9.847 1.00 0.77 C HETATM 747 C28 BO6 A 101 1.939 -7.575 -9.664 1.00 0.62 C HETATM 748 C29 BO6 A 101 3.116 -8.059 -9.101 1.00 0.58 C