USER MOD reduce.3.24.130724 H: found=0, std=0, add=272, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 274 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 8 DT C7 :methyl -30:sc= -1.4 (180deg=-1.48!) USER MOD Set 1.2: A 9 DT C7 :methyl -30:sc= 0 (180deg=-0.0705) USER MOD Single : A 4 A O2' : rot -100:sc= 0.802 USER MOD Single : A 5 A O2' : rot -28:sc= 0.00588 USER MOD Single : A 6 A O2' : rot -143:sc= -1.39! USER MOD Single : A 7 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 12 DG O3' : rot 180:sc= 0 USER MOD Single : B 16 A O2' : rot -152:sc= 0.795 USER MOD Single : B 17 A O2' : rot -22:sc= -0.236 USER MOD Single : B 18 A O2' : rot -146:sc= -1.57! USER MOD Single : B 19 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 20 DT C7 :methyl -30:sc= -0.0375 (180deg=-1.06) USER MOD Single : B 21 DT C7 :methyl -30:sc= 0 (180deg=-0.0242) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 OP3 DC A 1 4.583 9.759 13.601 1.00 0.24 O ATOM 2 P DC A 1 4.597 10.678 12.288 1.00 0.26 P ATOM 3 OP1 DC A 1 4.123 12.034 12.649 1.00 0.30 O ATOM 4 OP2 DC A 1 3.946 9.921 11.197 1.00 0.27 O ATOM 5 O5' DC A 1 6.174 10.739 11.995 1.00 0.28 O ATOM 6 C5' DC A 1 7.125 10.832 13.065 1.00 0.28 C ATOM 7 C4' DC A 1 7.858 9.511 13.254 1.00 0.24 C ATOM 8 O4' DC A 1 6.952 8.404 13.469 1.00 0.21 O ATOM 9 C3' DC A 1 8.690 9.209 12.015 1.00 0.23 C ATOM 10 O3' DC A 1 10.023 8.895 12.430 1.00 0.24 O ATOM 11 C2' DC A 1 7.968 7.885 11.464 1.00 0.19 C ATOM 12 C1' DC A 1 7.455 7.258 12.756 1.00 0.18 C ATOM 13 N1 DC A 1 6.368 6.261 12.575 1.00 0.16 N ATOM 14 C2 DC A 1 6.572 4.924 12.906 1.00 0.14 C ATOM 15 O2 DC A 1 7.652 4.498 13.308 1.00 0.14 O ATOM 16 N3 DC A 1 5.534 4.060 12.756 1.00 0.12 N ATOM 17 C4 DC A 1 4.346 4.475 12.303 1.00 0.13 C ATOM 18 N4 DC A 1 3.360 3.591 12.182 1.00 0.12 N ATOM 19 C5 DC A 1 4.133 5.843 11.959 1.00 0.16 C ATOM 20 C6 DC A 1 5.165 6.679 12.111 1.00 0.17 C ATOM 0 H5' DC A 1 6.614 11.105 13.989 1.00 0.28 H new ATOM 0 H5'' DC A 1 7.843 11.624 12.852 1.00 0.28 H new ATOM 0 H4' DC A 1 8.487 9.618 14.138 1.00 0.24 H new ATOM 0 H3' DC A 1 8.752 10.018 11.287 1.00 0.23 H new ATOM 0 H2' DC A 1 7.159 8.117 10.771 1.00 0.19 H new ATOM 0 H2'' DC A 1 8.661 7.229 10.937 1.00 0.19 H new ATOM 0 H1' DC A 1 8.241 6.692 13.256 1.00 0.18 H new ATOM 0 H41 DC A 1 2.447 3.889 11.838 1.00 0.12 H new ATOM 0 H42 DC A 1 3.517 2.615 12.433 1.00 0.12 H new ATOM 0 H5 DC A 1 3.178 6.189 11.591 1.00 0.16 H new ATOM 0 H6 DC A 1 5.036 7.721 11.856 1.00 0.17 H new ATOM 33 P DG A 2 11.237 8.925 11.370 1.00 0.24 P ATOM 34 OP1 DG A 2 12.507 8.836 12.129 1.00 0.27 O ATOM 35 OP2 DG A 2 11.019 10.055 10.436 1.00 0.29 O ATOM 36 O5' DG A 2 10.993 7.545 10.572 1.00 0.19 O ATOM 37 C5' DG A 2 11.659 6.327 10.931 1.00 0.16 C ATOM 38 C4' DG A 2 11.123 5.104 10.186 1.00 0.12 C ATOM 39 O4' DG A 2 9.803 4.661 10.591 1.00 0.11 O ATOM 40 C3' DG A 2 11.065 5.313 8.660 1.00 0.11 C ATOM 41 O3' DG A 2 12.030 4.472 8.004 1.00 0.13 O ATOM 42 C2' DG A 2 9.611 4.999 8.378 1.00 0.12 C ATOM 43 C1' DG A 2 9.232 4.007 9.444 1.00 0.10 C ATOM 44 N9 DG A 2 7.786 3.752 9.562 1.00 0.12 N ATOM 45 C8 DG A 2 6.747 4.625 9.574 1.00 0.12 C ATOM 46 N7 DG A 2 5.542 4.024 9.703 1.00 0.13 N ATOM 47 C5 DG A 2 5.853 2.702 9.772 1.00 0.10 C ATOM 48 C6 DG A 2 5.007 1.563 9.909 1.00 0.11 C ATOM 49 O6 DG A 2 3.785 1.487 10.002 1.00 0.12 O ATOM 50 N1 DG A 2 5.728 0.392 9.933 1.00 0.09 N ATOM 51 C2 DG A 2 7.092 0.302 9.841 1.00 0.09 C ATOM 52 N2 DG A 2 7.611 -0.913 9.866 1.00 0.08 N ATOM 53 N3 DG A 2 7.898 1.351 9.717 1.00 0.09 N ATOM 54 C4 DG A 2 7.213 2.516 9.687 1.00 0.10 C ATOM 0 H5' DG A 2 11.554 6.166 12.004 1.00 0.16 H new ATOM 0 H5'' DG A 2 12.725 6.430 10.727 1.00 0.16 H new ATOM 0 H4' DG A 2 11.849 4.338 10.458 1.00 0.12 H new ATOM 0 H3' DG A 2 11.334 6.302 8.289 1.00 0.11 H new ATOM 0 H2' DG A 2 8.993 5.895 8.431 1.00 0.12 H new ATOM 0 H2'' DG A 2 9.481 4.580 7.380 1.00 0.12 H new ATOM 0 H1' DG A 2 9.590 2.994 9.262 1.00 0.10 H new ATOM 0 H8 DG A 2 6.870 5.695 9.489 1.00 0.12 H new ATOM 0 H1 DG A 2 5.205 -0.479 10.027 1.00 0.09 H new ATOM 0 H21 DG A 2 8.621 -1.037 9.801 1.00 0.08 H new ATOM 0 H22 DG A 2 7.001 -1.726 9.951 1.00 0.08 H new ATOM 66 P DC A 3 12.048 4.066 6.438 1.00 0.13 P ATOM 67 OP1 DC A 3 13.443 4.147 5.949 1.00 0.18 O ATOM 68 OP2 DC A 3 10.973 4.806 5.737 1.00 0.18 O ATOM 69 O5' DC A 3 11.611 2.513 6.504 1.00 0.09 O ATOM 70 C5' DC A 3 12.396 1.533 7.211 1.00 0.08 C ATOM 71 C4' DC A 3 11.997 0.092 6.883 1.00 0.08 C ATOM 72 O4' DC A 3 10.629 -0.206 7.238 1.00 0.08 O ATOM 73 C3' DC A 3 12.175 -0.197 5.399 1.00 0.09 C ATOM 74 O3' DC A 3 12.559 -1.560 5.162 1.00 0.09 O ATOM 75 C2' DC A 3 10.744 0.123 4.905 1.00 0.09 C ATOM 76 C1' DC A 3 9.837 -0.427 6.056 1.00 0.07 C ATOM 77 N1 DC A 3 8.508 0.218 6.308 1.00 0.07 N ATOM 78 C2 DC A 3 7.387 -0.609 6.419 1.00 0.08 C ATOM 79 O2 DC A 3 7.445 -1.832 6.326 1.00 0.09 O ATOM 80 N3 DC A 3 6.177 -0.043 6.649 1.00 0.08 N ATOM 81 C4 DC A 3 6.043 1.276 6.770 1.00 0.08 C ATOM 82 N4 DC A 3 4.826 1.758 6.999 1.00 0.11 N ATOM 83 C5 DC A 3 7.170 2.149 6.664 1.00 0.08 C ATOM 84 C6 DC A 3 8.372 1.581 6.436 1.00 0.07 C ATOM 0 H5' DC A 3 12.291 1.697 8.283 1.00 0.08 H new ATOM 0 H5'' DC A 3 13.449 1.676 6.968 1.00 0.08 H new ATOM 0 H4' DC A 3 12.656 -0.539 7.479 1.00 0.08 H new ATOM 0 H3' DC A 3 12.964 0.366 4.899 1.00 0.09 H new ATOM 0 H2' DC A 3 10.600 1.193 4.755 1.00 0.09 H new ATOM 0 H2'' DC A 3 10.528 -0.364 3.954 1.00 0.09 H new ATOM 0 H1' DC A 3 9.572 -1.447 5.779 1.00 0.07 H new ATOM 0 H41 DC A 3 4.686 2.764 7.097 1.00 0.11 H new ATOM 0 H42 DC A 3 4.032 1.122 7.076 1.00 0.11 H new ATOM 0 H5 DC A 3 7.063 3.219 6.762 1.00 0.08 H new ATOM 0 H6 DC A 3 9.246 2.210 6.352 1.00 0.07 H new ATOM 96 P A A 4 12.888 -2.121 3.681 1.00 0.10 P ATOM 97 OP1 A A 4 13.731 -3.330 3.824 1.00 0.11 O ATOM 98 OP2 A A 4 13.359 -0.997 2.840 1.00 0.13 O ATOM 99 O5' A A 4 11.427 -2.567 3.158 1.00 0.11 O ATOM 100 C5' A A 4 10.784 -3.738 3.684 1.00 0.10 C ATOM 101 C4' A A 4 9.284 -3.781 3.413 1.00 0.09 C ATOM 102 O4' A A 4 8.577 -2.671 3.981 1.00 0.09 O ATOM 103 C3' A A 4 8.911 -3.700 1.937 1.00 0.09 C ATOM 104 O3' A A 4 9.253 -4.907 1.226 1.00 0.09 O ATOM 105 C2' A A 4 7.415 -3.411 2.057 1.00 0.07 C ATOM 106 O2' A A 4 6.608 -4.563 2.252 1.00 0.08 O ATOM 107 C1' A A 4 7.265 -2.788 3.415 1.00 0.08 C ATOM 108 N9 A A 4 6.403 -1.598 3.463 1.00 0.07 N ATOM 109 C8 A A 4 6.730 -0.284 3.484 1.00 0.07 C ATOM 110 N7 A A 4 5.660 0.540 3.554 1.00 0.08 N ATOM 111 C5 A A 4 4.607 -0.321 3.577 1.00 0.09 C ATOM 112 C6 A A 4 3.219 -0.125 3.644 1.00 0.11 C ATOM 113 N6 A A 4 2.643 1.073 3.711 1.00 0.12 N ATOM 114 N1 A A 4 2.443 -1.218 3.647 1.00 0.12 N ATOM 115 C2 A A 4 2.996 -2.424 3.587 1.00 0.11 C ATOM 116 N3 A A 4 4.279 -2.738 3.522 1.00 0.10 N ATOM 117 C4 A A 4 5.038 -1.621 3.521 1.00 0.08 C ATOM 0 H5' A A 4 10.952 -3.783 4.760 1.00 0.10 H new ATOM 0 H5'' A A 4 11.249 -4.624 3.251 1.00 0.10 H new ATOM 0 H4' A A 4 9.009 -4.739 3.854 1.00 0.09 H new ATOM 0 H3' A A 4 9.441 -2.952 1.347 1.00 0.09 H new ATOM 0 H2' A A 4 7.125 -2.865 1.159 1.00 0.07 H new ATOM 0 HO2' A A 4 6.203 -4.827 1.400 1.00 0.08 H new ATOM 0 H1' A A 4 6.680 -3.438 4.066 1.00 0.08 H new ATOM 0 H8 A A 4 7.749 0.072 3.448 1.00 0.07 H new ATOM 0 H61 A A 4 1.627 1.148 3.758 1.00 0.12 H new ATOM 0 H62 A A 4 3.218 1.916 3.716 1.00 0.12 H new ATOM 0 H2 A A 4 2.308 -3.257 3.592 1.00 0.11 H new ATOM 129 P A A 5 8.953 -5.149 -0.347 1.00 0.08 P ATOM 130 OP1 A A 5 10.024 -6.018 -0.886 1.00 0.08 O ATOM 131 OP2 A A 5 8.696 -3.833 -0.979 1.00 0.10 O ATOM 132 O5' A A 5 7.562 -5.980 -0.362 1.00 0.09 O ATOM 133 C5' A A 5 7.491 -7.374 -0.004 1.00 0.12 C ATOM 134 C4' A A 5 6.067 -7.856 0.304 1.00 0.13 C ATOM 135 O4' A A 5 5.495 -7.099 1.396 1.00 0.12 O ATOM 136 C3' A A 5 5.083 -7.723 -0.868 1.00 0.12 C ATOM 137 O3' A A 5 5.123 -8.806 -1.815 1.00 0.17 O ATOM 138 C2' A A 5 3.792 -7.719 -0.053 1.00 0.11 C ATOM 139 O2' A A 5 3.550 -8.993 0.562 1.00 0.14 O ATOM 140 C1' A A 5 4.151 -6.717 1.044 1.00 0.11 C ATOM 141 N9 A A 5 4.128 -5.289 0.602 1.00 0.08 N ATOM 142 C8 A A 5 5.106 -4.513 0.002 1.00 0.07 C ATOM 143 N7 A A 5 4.715 -3.239 -0.210 1.00 0.07 N ATOM 144 C5 A A 5 3.447 -3.207 0.268 1.00 0.07 C ATOM 145 C6 A A 5 2.497 -2.178 0.341 1.00 0.07 C ATOM 146 N6 A A 5 2.719 -0.938 -0.079 1.00 0.08 N ATOM 147 N1 A A 5 1.307 -2.467 0.877 1.00 0.08 N ATOM 148 C2 A A 5 1.069 -3.696 1.318 1.00 0.09 C ATOM 149 N3 A A 5 1.874 -4.746 1.310 1.00 0.09 N ATOM 150 C4 A A 5 3.068 -4.430 0.762 1.00 0.08 C ATOM 0 H5' A A 5 8.122 -7.550 0.867 1.00 0.12 H new ATOM 0 H5'' A A 5 7.900 -7.971 -0.819 1.00 0.12 H new ATOM 0 H4' A A 5 6.191 -8.912 0.543 1.00 0.13 H new ATOM 0 H3' A A 5 5.264 -6.869 -1.520 1.00 0.12 H new ATOM 0 H2' A A 5 2.907 -7.491 -0.647 1.00 0.11 H new ATOM 0 HO2' A A 5 3.966 -9.700 0.025 1.00 0.14 H new ATOM 0 H1' A A 5 3.428 -6.754 1.859 1.00 0.11 H new ATOM 0 H8 A A 5 6.082 -4.889 -0.268 1.00 0.07 H new ATOM 0 H61 A A 5 1.986 -0.233 0.002 1.00 0.08 H new ATOM 0 H62 A A 5 3.623 -0.690 -0.482 1.00 0.08 H new ATOM 0 H2 A A 5 0.088 -3.861 1.739 1.00 0.09 H new ATOM 162 P A A 6 4.583 -8.651 -3.338 1.00 0.21 P ATOM 163 OP1 A A 6 4.779 -9.946 -4.029 1.00 0.30 O ATOM 164 OP2 A A 6 5.185 -7.423 -3.906 1.00 0.24 O ATOM 165 O5' A A 6 2.995 -8.400 -3.196 1.00 0.17 O ATOM 166 C5' A A 6 2.102 -9.327 -2.550 1.00 0.15 C ATOM 167 C4' A A 6 0.836 -8.618 -2.074 1.00 0.10 C ATOM 168 O4' A A 6 1.269 -7.499 -1.276 1.00 0.10 O ATOM 169 C3' A A 6 0.022 -8.038 -3.233 1.00 0.11 C ATOM 170 O3' A A 6 -0.958 -8.972 -3.735 1.00 0.10 O ATOM 171 C2' A A 6 -0.624 -6.862 -2.511 1.00 0.10 C ATOM 172 O2' A A 6 -1.843 -7.158 -1.850 1.00 0.09 O ATOM 173 C1' A A 6 0.435 -6.372 -1.557 1.00 0.08 C ATOM 174 N9 A A 6 1.156 -5.198 -2.103 1.00 0.09 N ATOM 175 C8 A A 6 2.394 -5.091 -2.679 1.00 0.09 C ATOM 176 N7 A A 6 2.713 -3.825 -3.014 1.00 0.10 N ATOM 177 C5 A A 6 1.626 -3.111 -2.635 1.00 0.09 C ATOM 178 C6 A A 6 1.328 -1.749 -2.707 1.00 0.10 C ATOM 179 N6 A A 6 2.184 -0.864 -3.202 1.00 0.11 N ATOM 180 N1 A A 6 0.140 -1.342 -2.241 1.00 0.10 N ATOM 181 C2 A A 6 -0.701 -2.237 -1.731 1.00 0.09 C ATOM 182 N3 A A 6 -0.533 -3.540 -1.605 1.00 0.09 N ATOM 183 C4 A A 6 0.670 -3.918 -2.084 1.00 0.09 C ATOM 0 H5' A A 6 2.605 -9.792 -1.702 1.00 0.15 H new ATOM 0 H5'' A A 6 1.838 -10.127 -3.242 1.00 0.15 H new ATOM 0 H4' A A 6 0.215 -9.336 -1.539 1.00 0.10 H new ATOM 0 H3' A A 6 0.597 -7.782 -4.123 1.00 0.11 H new ATOM 0 H2' A A 6 -0.932 -6.105 -3.233 1.00 0.10 H new ATOM 0 HO2' A A 6 -2.455 -6.397 -1.936 1.00 0.09 H new ATOM 0 H1' A A 6 0.010 -6.000 -0.625 1.00 0.08 H new ATOM 0 H8 A A 6 3.047 -5.934 -2.847 1.00 0.09 H new ATOM 0 H61 A A 6 1.932 0.124 -3.239 1.00 0.11 H new ATOM 0 H62 A A 6 3.094 -1.172 -3.546 1.00 0.11 H new ATOM 0 H2 A A 6 -1.643 -1.847 -1.374 1.00 0.09 H new ATOM 195 P DT A 7 -1.815 -8.755 -5.093 1.00 0.13 P ATOM 196 OP1 DT A 7 -2.610 -9.981 -5.333 1.00 0.16 O ATOM 197 OP2 DT A 7 -0.884 -8.275 -6.140 1.00 0.19 O ATOM 198 O5' DT A 7 -2.840 -7.550 -4.762 1.00 0.12 O ATOM 199 C5' DT A 7 -3.866 -7.626 -3.754 1.00 0.11 C ATOM 200 C4' DT A 7 -4.443 -6.241 -3.443 1.00 0.12 C ATOM 201 O4' DT A 7 -3.338 -5.350 -3.173 1.00 0.12 O ATOM 202 C3' DT A 7 -5.231 -5.683 -4.633 1.00 0.15 C ATOM 203 O3' DT A 7 -6.610 -5.433 -4.314 1.00 0.17 O ATOM 204 C2' DT A 7 -4.543 -4.319 -4.891 1.00 0.16 C ATOM 205 C1' DT A 7 -3.607 -4.055 -3.734 1.00 0.14 C ATOM 206 N1 DT A 7 -2.387 -3.467 -4.346 1.00 0.14 N ATOM 207 C2 DT A 7 -2.215 -2.100 -4.320 1.00 0.15 C ATOM 208 O2 DT A 7 -3.033 -1.329 -3.837 1.00 0.17 O ATOM 209 N3 DT A 7 -1.052 -1.629 -4.883 1.00 0.17 N ATOM 210 C4 DT A 7 -0.060 -2.389 -5.457 1.00 0.17 C ATOM 211 C5 DT A 7 -0.318 -3.814 -5.445 1.00 0.15 C ATOM 212 C6 DT A 7 -1.457 -4.286 -4.904 1.00 0.15 C ATOM 213 O4 DT A 7 0.934 -1.829 -5.905 1.00 0.18 O ATOM 226 C7 DT A 7 0.717 -4.792 -6.024 1.00 0.15 C ATOM 0 H5' DT A 7 -3.454 -8.063 -2.845 1.00 0.11 H new ATOM 0 H5'' DT A 7 -4.664 -8.287 -4.093 1.00 0.11 H new ATOM 0 H4' DT A 7 -5.117 -6.324 -2.591 1.00 0.12 H new ATOM 0 H3' DT A 7 -5.230 -6.379 -5.472 1.00 0.15 H new ATOM 0 H2' DT A 7 -3.993 -4.339 -5.832 1.00 0.16 H new ATOM 0 H2'' DT A 7 -5.285 -3.525 -4.972 1.00 0.16 H new ATOM 0 H1' DT A 7 -3.989 -3.387 -2.962 1.00 0.14 H new ATOM 0 H3 DT A 7 -0.912 -0.619 -4.874 1.00 0.17 H new ATOM 0 H71 DT A 7 0.653 -5.744 -5.496 1.00 0.15 H new ATOM 0 H72 DT A 7 0.515 -4.950 -7.083 1.00 0.15 H new ATOM 0 H73 DT A 7 1.717 -4.377 -5.903 1.00 0.15 H new ATOM 0 H6 DT A 7 -1.638 -5.351 -4.914 1.00 0.15 H new ATOM 227 P DT A 8 -7.678 -4.923 -5.428 1.00 0.19 P ATOM 228 OP1 DT A 8 -9.035 -5.075 -4.853 1.00 0.24 O ATOM 229 OP2 DT A 8 -7.354 -5.588 -6.711 1.00 0.23 O ATOM 230 O5' DT A 8 -7.372 -3.341 -5.589 1.00 0.16 O ATOM 231 C5' DT A 8 -7.636 -2.407 -4.527 1.00 0.14 C ATOM 232 C4' DT A 8 -7.388 -0.948 -4.934 1.00 0.13 C ATOM 233 O4' DT A 8 -6.012 -0.738 -5.276 1.00 0.13 O ATOM 234 C3' DT A 8 -8.252 -0.467 -6.111 1.00 0.14 C ATOM 235 O3' DT A 8 -8.950 0.736 -5.735 1.00 0.12 O ATOM 236 C2' DT A 8 -7.182 -0.212 -7.177 1.00 0.13 C ATOM 237 C1' DT A 8 -5.961 0.157 -6.388 1.00 0.12 C ATOM 238 N1 DT A 8 -4.660 -0.054 -7.059 1.00 0.12 N ATOM 239 C2 DT A 8 -3.855 1.029 -7.350 1.00 0.12 C ATOM 240 O2 DT A 8 -4.169 2.193 -7.126 1.00 0.14 O ATOM 241 N3 DT A 8 -2.640 0.730 -7.921 1.00 0.12 N ATOM 242 C4 DT A 8 -2.167 -0.526 -8.220 1.00 0.13 C ATOM 243 C5 DT A 8 -3.074 -1.602 -7.890 1.00 0.12 C ATOM 244 C6 DT A 8 -4.264 -1.323 -7.334 1.00 0.13 C ATOM 245 O4 DT A 8 -1.049 -0.642 -8.709 1.00 0.13 O ATOM 258 C7 DT A 8 -2.690 -3.067 -8.164 1.00 0.14 C ATOM 0 H5' DT A 8 -7.007 -2.651 -3.671 1.00 0.14 H new ATOM 0 H5'' DT A 8 -8.671 -2.517 -4.203 1.00 0.14 H new ATOM 0 H4' DT A 8 -7.669 -0.365 -4.057 1.00 0.13 H new ATOM 0 H3' DT A 8 -9.029 -1.156 -6.442 1.00 0.14 H new ATOM 0 H2' DT A 8 -7.009 -1.098 -7.788 1.00 0.13 H new ATOM 0 H2'' DT A 8 -7.477 0.590 -7.854 1.00 0.13 H new ATOM 0 H1' DT A 8 -5.992 1.226 -6.176 1.00 0.12 H new ATOM 0 H3 DT A 8 -2.030 1.517 -8.144 1.00 0.12 H new ATOM 0 H71 DT A 8 -2.026 -3.114 -9.028 1.00 0.14 H new ATOM 0 H72 DT A 8 -2.181 -3.479 -7.293 1.00 0.14 H new ATOM 0 H73 DT A 8 -3.590 -3.647 -8.366 1.00 0.14 H new ATOM 0 H6 DT A 8 -4.931 -2.139 -7.097 1.00 0.13 H new ATOM 259 P DT A 9 -10.225 1.324 -6.541 1.00 0.10 P ATOM 260 OP1 DT A 9 -10.896 2.320 -5.675 1.00 0.12 O ATOM 261 OP2 DT A 9 -11.006 0.180 -7.068 1.00 0.12 O ATOM 262 O5' DT A 9 -9.573 2.104 -7.801 1.00 0.10 O ATOM 263 C5' DT A 9 -8.928 3.386 -7.679 1.00 0.12 C ATOM 264 C4' DT A 9 -7.967 3.674 -8.842 1.00 0.11 C ATOM 265 O4' DT A 9 -6.956 2.664 -8.909 1.00 0.12 O ATOM 266 C3' DT A 9 -8.646 3.682 -10.218 1.00 0.11 C ATOM 267 O3' DT A 9 -8.930 5.023 -10.656 1.00 0.13 O ATOM 268 C2' DT A 9 -7.601 2.955 -11.089 1.00 0.09 C ATOM 269 C1' DT A 9 -6.384 2.826 -10.205 1.00 0.10 C ATOM 270 N1 DT A 9 -5.527 1.650 -10.463 1.00 0.10 N ATOM 271 C2 DT A 9 -4.187 1.857 -10.729 1.00 0.12 C ATOM 272 O2 DT A 9 -3.662 2.964 -10.796 1.00 0.14 O ATOM 273 N3 DT A 9 -3.435 0.731 -10.928 1.00 0.13 N ATOM 274 C4 DT A 9 -3.874 -0.568 -10.888 1.00 0.12 C ATOM 275 C5 DT A 9 -5.290 -0.704 -10.605 1.00 0.11 C ATOM 276 C6 DT A 9 -6.051 0.389 -10.408 1.00 0.10 C ATOM 277 O4 DT A 9 -3.061 -1.468 -11.080 1.00 0.15 O ATOM 290 C7 DT A 9 -5.943 -2.090 -10.506 1.00 0.13 C ATOM 0 H5' DT A 9 -8.377 3.424 -6.739 1.00 0.12 H new ATOM 0 H5'' DT A 9 -9.686 4.168 -7.636 1.00 0.12 H new ATOM 0 H4' DT A 9 -7.564 4.665 -8.634 1.00 0.11 H new ATOM 0 H3' DT A 9 -9.623 3.200 -10.247 1.00 0.11 H new ATOM 0 H2' DT A 9 -7.963 1.978 -11.408 1.00 0.09 H new ATOM 0 H2'' DT A 9 -7.375 3.522 -11.992 1.00 0.09 H new ATOM 0 H1' DT A 9 -5.730 3.684 -10.360 1.00 0.10 H new ATOM 0 H3 DT A 9 -2.445 0.872 -11.127 1.00 0.13 H new ATOM 0 H71 DT A 9 -5.414 -2.789 -11.154 1.00 0.13 H new ATOM 0 H72 DT A 9 -5.894 -2.442 -9.476 1.00 0.13 H new ATOM 0 H73 DT A 9 -6.985 -2.024 -10.818 1.00 0.13 H new ATOM 0 H6 DT A 9 -7.104 0.266 -10.201 1.00 0.10 H new ATOM 291 P DG A 10 -9.506 5.378 -12.126 1.00 0.12 P ATOM 292 OP1 DG A 10 -10.002 6.774 -12.107 1.00 0.14 O ATOM 293 OP2 DG A 10 -10.406 4.283 -12.555 1.00 0.18 O ATOM 294 O5' DG A 10 -8.166 5.316 -13.026 1.00 0.12 O ATOM 295 C5' DG A 10 -7.155 6.336 -12.954 1.00 0.13 C ATOM 296 C4' DG A 10 -5.934 6.025 -13.821 1.00 0.17 C ATOM 297 O4' DG A 10 -5.193 4.863 -13.385 1.00 0.18 O ATOM 298 C3' DG A 10 -6.302 5.794 -15.296 1.00 0.17 C ATOM 299 O3' DG A 10 -5.707 6.789 -16.146 1.00 0.18 O ATOM 300 C2' DG A 10 -5.717 4.407 -15.516 1.00 0.19 C ATOM 301 C1' DG A 10 -4.557 4.335 -14.557 1.00 0.19 C ATOM 302 N9 DG A 10 -4.080 2.951 -14.369 1.00 0.17 N ATOM 303 C8 DG A 10 -4.782 1.872 -13.949 1.00 0.18 C ATOM 304 N7 DG A 10 -4.045 0.740 -13.876 1.00 0.16 N ATOM 305 C5 DG A 10 -2.810 1.145 -14.275 1.00 0.15 C ATOM 306 C6 DG A 10 -1.600 0.402 -14.407 1.00 0.14 C ATOM 307 O6 DG A 10 -1.369 -0.785 -14.188 1.00 0.14 O ATOM 308 N1 DG A 10 -0.564 1.191 -14.845 1.00 0.13 N ATOM 309 C2 DG A 10 -0.654 2.530 -15.129 1.00 0.14 C ATOM 310 N2 DG A 10 0.451 3.127 -15.543 1.00 0.15 N ATOM 311 N3 DG A 10 -1.771 3.241 -15.011 1.00 0.16 N ATOM 312 C4 DG A 10 -2.808 2.487 -14.581 1.00 0.16 C ATOM 0 H5' DG A 10 -6.838 6.454 -11.918 1.00 0.13 H new ATOM 0 H5'' DG A 10 -7.584 7.288 -13.267 1.00 0.13 H new ATOM 0 H4' DG A 10 -5.312 6.914 -13.714 1.00 0.17 H new ATOM 0 H3' DG A 10 -7.365 5.865 -15.525 1.00 0.17 H new ATOM 0 H2' DG A 10 -6.452 3.628 -15.311 1.00 0.19 H new ATOM 0 H2'' DG A 10 -5.390 4.272 -16.547 1.00 0.19 H new ATOM 0 H1' DG A 10 -3.656 4.863 -14.869 1.00 0.19 H new ATOM 0 H8 DG A 10 -5.831 1.911 -13.696 1.00 0.18 H new ATOM 0 H1 DG A 10 0.345 0.745 -14.969 1.00 0.13 H new ATOM 0 H21 DG A 10 0.440 4.122 -15.768 1.00 0.15 H new ATOM 0 H22 DG A 10 1.315 2.593 -15.637 1.00 0.15 H new ATOM 324 P DC A 11 -5.950 6.858 -17.745 1.00 0.21 P ATOM 325 OP1 DC A 11 -5.665 8.241 -18.193 1.00 0.26 O ATOM 326 OP2 DC A 11 -7.266 6.249 -18.044 1.00 0.20 O ATOM 327 O5' DC A 11 -4.803 5.887 -18.333 1.00 0.23 O ATOM 328 C5' DC A 11 -3.414 6.262 -18.340 1.00 0.23 C ATOM 329 C4' DC A 11 -2.510 5.149 -18.878 1.00 0.19 C ATOM 330 O4' DC A 11 -2.589 3.963 -18.065 1.00 0.23 O ATOM 331 C3' DC A 11 -2.835 4.747 -20.326 1.00 0.15 C ATOM 332 O3' DC A 11 -1.653 4.889 -21.138 1.00 0.10 O ATOM 333 C2' DC A 11 -3.209 3.269 -20.127 1.00 0.16 C ATOM 334 C1' DC A 11 -2.356 2.866 -18.946 1.00 0.17 C ATOM 335 N1 DC A 11 -2.700 1.587 -18.270 1.00 0.19 N ATOM 336 C2 DC A 11 -1.707 0.634 -18.098 1.00 0.20 C ATOM 337 O2 DC A 11 -0.565 0.797 -18.514 1.00 0.20 O ATOM 338 N3 DC A 11 -2.015 -0.516 -17.452 1.00 0.22 N ATOM 339 C4 DC A 11 -3.243 -0.742 -16.987 1.00 0.22 C ATOM 340 N4 DC A 11 -3.475 -1.889 -16.358 1.00 0.23 N ATOM 341 C5 DC A 11 -4.285 0.224 -17.152 1.00 0.24 C ATOM 342 C6 DC A 11 -3.964 1.365 -17.800 1.00 0.24 C ATOM 0 H5' DC A 11 -3.105 6.519 -17.327 1.00 0.23 H new ATOM 0 H5'' DC A 11 -3.285 7.157 -18.949 1.00 0.23 H new ATOM 0 H4' DC A 11 -1.505 5.569 -18.848 1.00 0.19 H new ATOM 0 H3' DC A 11 -3.606 5.335 -20.823 1.00 0.15 H new ATOM 0 H2' DC A 11 -4.272 3.145 -19.920 1.00 0.16 H new ATOM 0 H2'' DC A 11 -2.985 2.672 -21.011 1.00 0.16 H new ATOM 0 H1' DC A 11 -1.329 2.678 -19.258 1.00 0.17 H new ATOM 0 H41 DC A 11 -4.405 -2.090 -15.991 1.00 0.23 H new ATOM 0 H42 DC A 11 -2.723 -2.568 -16.242 1.00 0.23 H new ATOM 0 H5 DC A 11 -5.282 0.049 -16.776 1.00 0.24 H new ATOM 0 H6 DC A 11 -4.723 2.119 -17.950 1.00 0.24 H new ATOM 354 P DG A 12 -1.593 4.633 -22.738 1.00 0.09 P ATOM 355 OP1 DG A 12 -1.066 5.857 -23.387 1.00 0.14 O ATOM 356 OP2 DG A 12 -2.885 4.065 -23.184 1.00 0.17 O ATOM 357 O5' DG A 12 -0.471 3.471 -22.857 1.00 0.18 O ATOM 358 C5' DG A 12 0.924 3.733 -22.609 1.00 0.23 C ATOM 359 C4' DG A 12 1.832 2.502 -22.766 1.00 0.30 C ATOM 360 O4' DG A 12 1.478 1.433 -21.833 1.00 0.27 O ATOM 361 C3' DG A 12 1.754 1.843 -24.155 1.00 0.37 C ATOM 362 O3' DG A 12 3.035 1.261 -24.434 1.00 0.46 O ATOM 363 C2' DG A 12 0.802 0.709 -23.852 1.00 0.35 C ATOM 364 C1' DG A 12 1.263 0.172 -22.519 1.00 0.31 C ATOM 365 N9 DG A 12 0.348 -0.742 -21.821 1.00 0.26 N ATOM 366 C8 DG A 12 -0.954 -0.543 -21.509 1.00 0.23 C ATOM 367 N7 DG A 12 -1.519 -1.574 -20.849 1.00 0.22 N ATOM 368 C5 DG A 12 -0.504 -2.470 -20.749 1.00 0.21 C ATOM 369 C6 DG A 12 -0.491 -3.754 -20.155 1.00 0.19 C ATOM 370 O6 DG A 12 -1.397 -4.353 -19.585 1.00 0.20 O ATOM 371 N1 DG A 12 0.737 -4.360 -20.258 1.00 0.21 N ATOM 372 C2 DG A 12 1.839 -3.811 -20.861 1.00 0.26 C ATOM 373 N2 DG A 12 2.934 -4.552 -20.865 1.00 0.31 N ATOM 374 N3 DG A 12 1.851 -2.603 -21.426 1.00 0.29 N ATOM 375 C4 DG A 12 0.645 -1.989 -21.334 1.00 0.25 C ATOM 0 H5' DG A 12 1.035 4.126 -21.598 1.00 0.23 H new ATOM 0 H5'' DG A 12 1.264 4.511 -23.293 1.00 0.23 H new ATOM 0 H4' DG A 12 2.828 2.906 -22.583 1.00 0.30 H new ATOM 0 H3' DG A 12 1.470 2.501 -24.976 1.00 0.37 H new ATOM 0 H2' DG A 12 -0.229 1.059 -23.803 1.00 0.35 H new ATOM 0 H2'' DG A 12 0.842 -0.059 -24.624 1.00 0.35 H new ATOM 0 HO3' DG A 12 3.014 0.831 -25.315 1.00 0.46 H new ATOM 0 H1' DG A 12 2.124 -0.493 -22.590 1.00 0.31 H new ATOM 0 H8 DG A 12 -1.491 0.358 -21.765 1.00 0.23 H new ATOM 0 H1 DG A 12 0.837 -5.291 -19.854 1.00 0.21 H new ATOM 0 H21 DG A 12 3.787 -4.199 -21.299 1.00 0.31 H new ATOM 0 H22 DG A 12 2.926 -5.477 -20.435 1.00 0.31 H new TER 388 DG A 12 ATOM 389 OP3 DC B 13 0.667 -12.527 -17.159 1.00 0.30 O ATOM 390 P DC B 13 1.326 -12.773 -15.719 1.00 0.35 P ATOM 391 OP1 DC B 13 1.126 -14.189 -15.338 1.00 0.41 O ATOM 392 OP2 DC B 13 0.882 -11.683 -14.823 1.00 0.37 O ATOM 393 O5' DC B 13 2.877 -12.544 -16.069 1.00 0.32 O ATOM 394 C5' DC B 13 3.433 -13.004 -17.308 1.00 0.31 C ATOM 395 C4' DC B 13 3.711 -11.838 -18.245 1.00 0.25 C ATOM 396 O4' DC B 13 2.541 -11.020 -18.494 1.00 0.20 O ATOM 397 C3' DC B 13 4.786 -10.944 -17.641 1.00 0.25 C ATOM 398 O3' DC B 13 5.756 -10.685 -18.660 1.00 0.23 O ATOM 399 C2' DC B 13 3.946 -9.609 -17.342 1.00 0.24 C ATOM 400 C1' DC B 13 2.947 -9.637 -18.486 1.00 0.20 C ATOM 401 N1 DC B 13 1.781 -8.743 -18.300 1.00 0.15 N ATOM 402 C2 DC B 13 1.596 -7.641 -19.132 1.00 0.13 C ATOM 403 O2 DC B 13 2.394 -7.340 -20.014 1.00 0.15 O ATOM 404 N3 DC B 13 0.492 -6.872 -18.940 1.00 0.13 N ATOM 405 C4 DC B 13 -0.391 -7.162 -17.978 1.00 0.16 C ATOM 406 N4 DC B 13 -1.455 -6.384 -17.830 1.00 0.19 N ATOM 407 C5 DC B 13 -0.204 -8.288 -17.121 1.00 0.20 C ATOM 408 C6 DC B 13 0.888 -9.032 -17.326 1.00 0.19 C ATOM 0 H5' DC B 13 2.744 -13.702 -17.784 1.00 0.31 H new ATOM 0 H5'' DC B 13 4.357 -13.550 -17.116 1.00 0.31 H new ATOM 0 H4' DC B 13 4.031 -12.272 -19.192 1.00 0.25 H new ATOM 0 H3' DC B 13 5.306 -11.345 -16.771 1.00 0.25 H new ATOM 0 H2' DC B 13 3.459 -9.637 -16.367 1.00 0.24 H new ATOM 0 H2'' DC B 13 4.570 -8.716 -17.360 1.00 0.24 H new ATOM 0 H1' DC B 13 3.386 -9.277 -19.417 1.00 0.20 H new ATOM 0 H41 DC B 13 -2.139 -6.589 -17.102 1.00 0.19 H new ATOM 0 H42 DC B 13 -1.589 -5.581 -18.444 1.00 0.19 H new ATOM 0 H5 DC B 13 -0.913 -8.528 -16.342 1.00 0.20 H new ATOM 0 H6 DC B 13 1.062 -9.890 -16.694 1.00 0.19 H new ATOM 421 P DG B 14 7.134 -9.928 -18.319 1.00 0.24 P ATOM 422 OP1 DG B 14 7.998 -9.996 -19.520 1.00 0.26 O ATOM 423 OP2 DG B 14 7.641 -10.422 -17.019 1.00 0.27 O ATOM 424 O5' DG B 14 6.615 -8.412 -18.127 1.00 0.28 O ATOM 425 C5' DG B 14 6.677 -7.443 -19.184 1.00 0.26 C ATOM 426 C4' DG B 14 6.140 -6.076 -18.762 1.00 0.26 C ATOM 427 O4' DG B 14 4.701 -5.986 -18.615 1.00 0.26 O ATOM 428 C3' DG B 14 6.747 -5.606 -17.425 1.00 0.22 C ATOM 429 O3' DG B 14 7.530 -4.420 -17.631 1.00 0.22 O ATOM 430 C2' DG B 14 5.500 -5.413 -16.595 1.00 0.22 C ATOM 431 C1' DG B 14 4.467 -4.995 -17.600 1.00 0.24 C ATOM 432 N9 DG B 14 3.085 -4.981 -17.101 1.00 0.24 N ATOM 433 C8 DG B 14 2.407 -5.913 -16.390 1.00 0.24 C ATOM 434 N7 DG B 14 1.130 -5.555 -16.118 1.00 0.25 N ATOM 435 C5 DG B 14 1.016 -4.327 -16.693 1.00 0.24 C ATOM 436 C6 DG B 14 -0.093 -3.429 -16.747 1.00 0.24 C ATOM 437 O6 DG B 14 -1.229 -3.535 -16.293 1.00 0.25 O ATOM 438 N1 DG B 14 0.223 -2.275 -17.431 1.00 0.24 N ATOM 439 C2 DG B 14 1.439 -2.000 -17.999 1.00 0.24 C ATOM 440 N2 DG B 14 1.564 -0.833 -18.604 1.00 0.25 N ATOM 441 N3 DG B 14 2.480 -2.823 -17.962 1.00 0.24 N ATOM 442 C4 DG B 14 2.196 -3.963 -17.295 1.00 0.24 C ATOM 0 H5' DG B 14 6.105 -7.806 -20.038 1.00 0.26 H new ATOM 0 H5'' DG B 14 7.710 -7.337 -19.514 1.00 0.26 H new ATOM 0 H4' DG B 14 6.438 -5.441 -19.596 1.00 0.26 H new ATOM 0 H3' DG B 14 7.451 -6.284 -16.943 1.00 0.22 H new ATOM 0 H2' DG B 14 5.213 -6.332 -16.084 1.00 0.22 H new ATOM 0 H2'' DG B 14 5.643 -4.652 -15.827 1.00 0.22 H new ATOM 0 H1' DG B 14 4.564 -3.960 -17.928 1.00 0.24 H new ATOM 0 H8 DG B 14 2.842 -6.849 -16.072 1.00 0.24 H new ATOM 0 H1 DG B 14 -0.507 -1.569 -17.522 1.00 0.24 H new ATOM 0 H21 DG B 14 2.449 -0.578 -19.043 1.00 0.25 H new ATOM 0 H22 DG B 14 0.776 -0.186 -18.632 1.00 0.25 H new ATOM 454 P DC B 15 8.167 -3.502 -16.463 1.00 0.16 P ATOM 455 OP1 DC B 15 9.598 -3.278 -16.772 1.00 0.20 O ATOM 456 OP2 DC B 15 7.770 -4.054 -15.146 1.00 0.20 O ATOM 457 O5' DC B 15 7.363 -2.122 -16.684 1.00 0.13 O ATOM 458 C5' DC B 15 7.506 -1.338 -17.882 1.00 0.11 C ATOM 459 C4' DC B 15 6.908 0.064 -17.746 1.00 0.10 C ATOM 460 O4' DC B 15 5.486 0.042 -17.492 1.00 0.11 O ATOM 461 C3' DC B 15 7.579 0.823 -16.608 1.00 0.13 C ATOM 462 O3' DC B 15 7.655 2.232 -16.866 1.00 0.19 O ATOM 463 C2' DC B 15 6.599 0.479 -15.461 1.00 0.13 C ATOM 464 C1' DC B 15 5.203 0.527 -16.166 1.00 0.10 C ATOM 465 N1 DC B 15 4.080 -0.313 -15.638 1.00 0.10 N ATOM 466 C2 DC B 15 2.843 0.306 -15.446 1.00 0.08 C ATOM 467 O2 DC B 15 2.648 1.495 -15.685 1.00 0.11 O ATOM 468 N3 DC B 15 1.808 -0.434 -14.976 1.00 0.09 N ATOM 469 C4 DC B 15 1.952 -1.728 -14.700 1.00 0.11 C ATOM 470 N4 DC B 15 0.893 -2.390 -14.248 1.00 0.13 N ATOM 471 C5 DC B 15 3.206 -2.392 -14.888 1.00 0.13 C ATOM 472 C6 DC B 15 4.233 -1.650 -15.355 1.00 0.11 C ATOM 0 H5' DC B 15 7.022 -1.856 -18.710 1.00 0.11 H new ATOM 0 H5'' DC B 15 8.564 -1.255 -18.133 1.00 0.11 H new ATOM 0 H4' DC B 15 7.083 0.560 -18.701 1.00 0.10 H new ATOM 0 H3' DC B 15 8.619 0.556 -16.419 1.00 0.13 H new ATOM 0 H2' DC B 15 6.803 -0.504 -15.036 1.00 0.13 H new ATOM 0 H2'' DC B 15 6.664 1.199 -14.645 1.00 0.13 H new ATOM 0 H1' DC B 15 4.831 1.544 -16.037 1.00 0.10 H new ATOM 0 H41 DC B 15 0.968 -3.383 -14.027 1.00 0.13 H new ATOM 0 H42 DC B 15 0.004 -1.906 -14.122 1.00 0.13 H new ATOM 0 H5 DC B 15 3.326 -3.442 -14.666 1.00 0.13 H new ATOM 0 H6 DC B 15 5.195 -2.116 -15.509 1.00 0.11 H new ATOM 484 P A B 16 8.456 3.223 -15.872 1.00 0.26 P ATOM 485 OP1 A B 16 8.796 4.452 -16.624 1.00 0.37 O ATOM 486 OP2 A B 16 9.533 2.453 -15.204 1.00 0.33 O ATOM 487 O5' A B 16 7.335 3.577 -14.766 1.00 0.21 O ATOM 488 C5' A B 16 6.410 4.659 -14.953 1.00 0.19 C ATOM 489 C4' A B 16 5.205 4.587 -14.022 1.00 0.13 C ATOM 490 O4' A B 16 4.390 3.420 -14.215 1.00 0.14 O ATOM 491 C3' A B 16 5.572 4.503 -12.546 1.00 0.12 C ATOM 492 O3' A B 16 6.153 5.720 -12.032 1.00 0.12 O ATOM 493 C2' A B 16 4.209 4.151 -11.971 1.00 0.10 C ATOM 494 O2' A B 16 3.369 5.277 -11.781 1.00 0.14 O ATOM 495 C1' A B 16 3.494 3.435 -13.090 1.00 0.10 C ATOM 496 N9 A B 16 2.927 2.137 -12.686 1.00 0.08 N ATOM 497 C8 A B 16 3.520 0.920 -12.586 1.00 0.09 C ATOM 498 N7 A B 16 2.678 -0.060 -12.187 1.00 0.10 N ATOM 499 C5 A B 16 1.495 0.591 -12.030 1.00 0.09 C ATOM 500 C6 A B 16 0.216 0.161 -11.636 1.00 0.11 C ATOM 501 N6 A B 16 -0.082 -1.098 -11.325 1.00 0.12 N ATOM 502 N1 A B 16 -0.754 1.083 -11.583 1.00 0.13 N ATOM 503 C2 A B 16 -0.489 2.345 -11.897 1.00 0.14 C ATOM 504 N3 A B 16 0.662 2.869 -12.282 1.00 0.13 N ATOM 505 C4 A B 16 1.624 1.923 -12.327 1.00 0.09 C ATOM 0 H5' A B 16 6.063 4.657 -15.986 1.00 0.19 H new ATOM 0 H5'' A B 16 6.929 5.604 -14.792 1.00 0.19 H new ATOM 0 H4' A B 16 4.683 5.510 -14.274 1.00 0.13 H new ATOM 0 H3' A B 16 6.357 3.790 -12.295 1.00 0.12 H new ATOM 0 H2' A B 16 4.371 3.625 -11.030 1.00 0.10 H new ATOM 0 HO2' A B 16 2.747 5.101 -11.044 1.00 0.14 H new ATOM 0 H1' A B 16 2.589 3.965 -13.387 1.00 0.10 H new ATOM 0 H8 A B 16 4.564 0.751 -12.804 1.00 0.09 H new ATOM 0 H61 A B 16 -1.032 -1.343 -11.046 1.00 0.12 H new ATOM 0 H62 A B 16 0.640 -1.818 -11.365 1.00 0.12 H new ATOM 0 H2 A B 16 -1.320 3.032 -11.829 1.00 0.14 H new ATOM 517 P A B 17 6.545 5.940 -10.474 1.00 0.16 P ATOM 518 OP1 A B 17 7.693 6.874 -10.420 1.00 0.21 O ATOM 519 OP2 A B 17 6.657 4.609 -9.834 1.00 0.20 O ATOM 520 O5' A B 17 5.249 6.679 -9.839 1.00 0.14 O ATOM 521 C5' A B 17 4.940 8.060 -10.108 1.00 0.14 C ATOM 522 C4' A B 17 3.494 8.440 -9.772 1.00 0.14 C ATOM 523 O4' A B 17 2.570 7.630 -10.533 1.00 0.13 O ATOM 524 C3' A B 17 3.120 8.261 -8.291 1.00 0.16 C ATOM 525 O3' A B 17 3.431 9.409 -7.476 1.00 0.18 O ATOM 526 C2' A B 17 1.615 8.114 -8.473 1.00 0.15 C ATOM 527 O2' A B 17 1.014 9.362 -8.852 1.00 0.16 O ATOM 528 C1' A B 17 1.526 7.160 -9.659 1.00 0.13 C ATOM 529 N9 A B 17 1.731 5.718 -9.325 1.00 0.13 N ATOM 530 C8 A B 17 2.896 4.997 -9.128 1.00 0.14 C ATOM 531 N7 A B 17 2.671 3.691 -8.876 1.00 0.15 N ATOM 532 C5 A B 17 1.320 3.581 -8.913 1.00 0.14 C ATOM 533 C6 A B 17 0.462 2.487 -8.732 1.00 0.14 C ATOM 534 N6 A B 17 0.894 1.256 -8.480 1.00 0.16 N ATOM 535 N1 A B 17 -0.856 2.702 -8.831 1.00 0.14 N ATOM 536 C2 A B 17 -1.308 3.924 -9.094 1.00 0.13 C ATOM 537 N3 A B 17 -0.601 5.030 -9.285 1.00 0.13 N ATOM 538 C4 A B 17 0.726 4.786 -9.180 1.00 0.13 C ATOM 0 H5' A B 17 5.126 8.267 -11.162 1.00 0.14 H new ATOM 0 H5'' A B 17 5.616 8.694 -9.534 1.00 0.14 H new ATOM 0 H4' A B 17 3.424 9.499 -10.021 1.00 0.14 H new ATOM 0 H3' A B 17 3.644 7.454 -7.779 1.00 0.16 H new ATOM 0 H2' A B 17 1.112 7.780 -7.566 1.00 0.15 H new ATOM 0 HO2' A B 17 1.595 10.102 -8.578 1.00 0.16 H new ATOM 0 H1' A B 17 0.524 7.174 -10.088 1.00 0.13 H new ATOM 0 H8 A B 17 3.882 5.434 -9.172 1.00 0.14 H new ATOM 0 H61 A B 17 0.225 0.496 -8.357 1.00 0.16 H new ATOM 0 H62 A B 17 1.895 1.071 -8.410 1.00 0.16 H new ATOM 0 H2 A B 17 -2.381 4.029 -9.160 1.00 0.13 H new ATOM 550 P A B 18 3.548 9.352 -5.858 1.00 0.19 P ATOM 551 OP1 A B 18 3.684 10.741 -5.360 1.00 0.24 O ATOM 552 OP2 A B 18 4.587 8.353 -5.522 1.00 0.20 O ATOM 553 O5' A B 18 2.122 8.777 -5.353 1.00 0.18 O ATOM 554 C5' A B 18 0.871 9.456 -5.564 1.00 0.18 C ATOM 555 C4' A B 18 -0.318 8.491 -5.494 1.00 0.15 C ATOM 556 O4' A B 18 -0.083 7.397 -6.404 1.00 0.15 O ATOM 557 C3' A B 18 -0.488 7.838 -4.126 1.00 0.14 C ATOM 558 O3' A B 18 -1.192 8.687 -3.194 1.00 0.15 O ATOM 559 C2' A B 18 -1.309 6.627 -4.558 1.00 0.14 C ATOM 560 O2' A B 18 -2.701 6.873 -4.671 1.00 0.15 O ATOM 561 C1' A B 18 -0.719 6.220 -5.888 1.00 0.15 C ATOM 562 N9 A B 18 0.182 5.055 -5.735 1.00 0.15 N ATOM 563 C8 A B 18 1.548 4.976 -5.737 1.00 0.15 C ATOM 564 N7 A B 18 2.008 3.713 -5.612 1.00 0.14 N ATOM 565 C5 A B 18 0.878 2.971 -5.525 1.00 0.15 C ATOM 566 C6 A B 18 0.668 1.596 -5.381 1.00 0.15 C ATOM 567 N6 A B 18 1.669 0.729 -5.324 1.00 0.16 N ATOM 568 N1 A B 18 -0.598 1.158 -5.319 1.00 0.15 N ATOM 569 C2 A B 18 -1.594 2.037 -5.397 1.00 0.16 C ATOM 570 N3 A B 18 -1.523 3.348 -5.537 1.00 0.15 N ATOM 571 C4 A B 18 -0.239 3.757 -5.594 1.00 0.15 C ATOM 0 H5' A B 18 0.884 9.948 -6.537 1.00 0.18 H new ATOM 0 H5'' A B 18 0.750 10.237 -4.814 1.00 0.18 H new ATOM 0 H4' A B 18 -1.201 9.086 -5.729 1.00 0.15 H new ATOM 0 H3' A B 18 0.433 7.614 -3.588 1.00 0.14 H new ATOM 0 H2' A B 18 -1.250 5.846 -3.800 1.00 0.14 H new ATOM 0 HO2' A B 18 -3.198 6.070 -4.407 1.00 0.15 H new ATOM 0 H1' A B 18 -1.471 5.875 -6.597 1.00 0.15 H new ATOM 0 H8 A B 18 2.193 5.837 -5.829 1.00 0.15 H new ATOM 0 H61 A B 18 1.476 -0.267 -5.218 1.00 0.16 H new ATOM 0 H62 A B 18 2.633 1.058 -5.386 1.00 0.16 H new ATOM 0 H2 A B 18 -2.590 1.624 -5.338 1.00 0.16 H new ATOM 583 P DT B 19 -1.390 8.359 -1.619 1.00 0.18 P ATOM 584 OP1 DT B 19 -2.027 9.534 -0.980 1.00 0.23 O ATOM 585 OP2 DT B 19 -0.099 7.854 -1.098 1.00 0.21 O ATOM 586 O5' DT B 19 -2.444 7.139 -1.586 1.00 0.16 O ATOM 587 C5' DT B 19 -3.773 7.253 -2.121 1.00 0.15 C ATOM 588 C4' DT B 19 -4.436 5.880 -2.244 1.00 0.12 C ATOM 589 O4' DT B 19 -3.533 4.997 -2.948 1.00 0.12 O ATOM 590 C3' DT B 19 -4.724 5.288 -0.863 1.00 0.12 C ATOM 591 O3' DT B 19 -6.122 5.016 -0.686 1.00 0.12 O ATOM 592 C2' DT B 19 -3.931 3.954 -0.885 1.00 0.12 C ATOM 593 C1' DT B 19 -3.513 3.705 -2.316 1.00 0.11 C ATOM 594 N1 DT B 19 -2.130 3.160 -2.264 1.00 0.11 N ATOM 595 C2 DT B 19 -1.937 1.800 -2.395 1.00 0.11 C ATOM 596 O2 DT B 19 -2.856 1.002 -2.520 1.00 0.13 O ATOM 597 N3 DT B 19 -0.632 1.370 -2.373 1.00 0.11 N ATOM 598 C4 DT B 19 0.484 2.161 -2.238 1.00 0.10 C ATOM 599 C5 DT B 19 0.199 3.576 -2.103 1.00 0.10 C ATOM 600 C6 DT B 19 -1.077 4.010 -2.115 1.00 0.10 C ATOM 601 O4 DT B 19 1.592 1.635 -2.258 1.00 0.11 O ATOM 614 C7 DT B 19 1.353 4.588 -1.976 1.00 0.11 C ATOM 0 H5' DT B 19 -3.735 7.731 -3.100 1.00 0.15 H new ATOM 0 H5'' DT B 19 -4.374 7.894 -1.477 1.00 0.15 H new ATOM 0 H4' DT B 19 -5.378 5.988 -2.781 1.00 0.12 H new ATOM 0 H3' DT B 19 -4.444 5.963 -0.054 1.00 0.12 H new ATOM 0 H2' DT B 19 -3.058 4.015 -0.235 1.00 0.12 H new ATOM 0 H2'' DT B 19 -4.547 3.134 -0.516 1.00 0.12 H new ATOM 0 H1' DT B 19 -4.152 3.008 -2.858 1.00 0.11 H new ATOM 0 H3 DT B 19 -0.476 0.366 -2.466 1.00 0.11 H new ATOM 0 H71 DT B 19 1.048 5.543 -2.404 1.00 0.11 H new ATOM 0 H72 DT B 19 1.603 4.725 -0.924 1.00 0.11 H new ATOM 0 H73 DT B 19 2.226 4.213 -2.510 1.00 0.11 H new ATOM 0 H6 DT B 19 -1.270 5.067 -2.003 1.00 0.10 H new ATOM 615 P DT B 20 -6.738 4.547 0.740 1.00 0.10 P ATOM 616 OP1 DT B 20 -8.210 4.675 0.661 1.00 0.11 O ATOM 617 OP2 DT B 20 -6.000 5.253 1.814 1.00 0.13 O ATOM 618 O5' DT B 20 -6.367 2.977 0.817 1.00 0.11 O ATOM 619 C5' DT B 20 -6.922 2.024 -0.104 1.00 0.12 C ATOM 620 C4' DT B 20 -6.412 0.608 0.156 1.00 0.09 C ATOM 621 O4' DT B 20 -4.991 0.555 -0.019 1.00 0.11 O ATOM 622 C3' DT B 20 -6.743 0.078 1.560 1.00 0.11 C ATOM 623 O3' DT B 20 -7.492 -1.144 1.433 1.00 0.14 O ATOM 624 C2' DT B 20 -5.338 -0.133 2.144 1.00 0.10 C ATOM 625 C1' DT B 20 -4.457 -0.351 0.946 1.00 0.09 C ATOM 626 N1 DT B 20 -3.026 -0.006 1.081 1.00 0.09 N ATOM 627 C2 DT B 20 -2.082 -0.993 0.884 1.00 0.11 C ATOM 628 O2 DT B 20 -2.361 -2.165 0.656 1.00 0.15 O ATOM 629 N3 DT B 20 -0.771 -0.592 0.956 1.00 0.12 N ATOM 630 C4 DT B 20 -0.318 0.683 1.200 1.00 0.12 C ATOM 631 C5 DT B 20 -1.369 1.659 1.402 1.00 0.09 C ATOM 632 C6 DT B 20 -2.659 1.279 1.339 1.00 0.09 C ATOM 633 O4 DT B 20 0.890 0.893 1.212 1.00 0.14 O ATOM 646 C7 DT B 20 -1.026 3.134 1.673 1.00 0.11 C ATOM 0 H5' DT B 20 -6.671 2.317 -1.123 1.00 0.12 H new ATOM 0 H5'' DT B 20 -8.009 2.037 -0.027 1.00 0.12 H new ATOM 0 H4' DT B 20 -6.926 -0.026 -0.566 1.00 0.09 H new ATOM 0 H3' DT B 20 -7.357 0.725 2.187 1.00 0.11 H new ATOM 0 H2' DT B 20 -5.015 0.733 2.721 1.00 0.10 H new ATOM 0 H2'' DT B 20 -5.313 -0.991 2.816 1.00 0.10 H new ATOM 0 H1' DT B 20 -4.465 -1.418 0.722 1.00 0.09 H new ATOM 0 H3 DT B 20 -0.062 -1.312 0.814 1.00 0.12 H new ATOM 0 H71 DT B 20 -0.069 3.196 2.190 1.00 0.11 H new ATOM 0 H72 DT B 20 -0.963 3.673 0.727 1.00 0.11 H new ATOM 0 H73 DT B 20 -1.803 3.580 2.294 1.00 0.11 H new ATOM 0 H6 DT B 20 -3.429 2.019 1.499 1.00 0.09 H new ATOM 647 P DT B 21 -8.261 -1.876 2.657 1.00 0.15 P ATOM 648 OP1 DT B 21 -9.290 -2.777 2.085 1.00 0.21 O ATOM 649 OP2 DT B 21 -8.664 -0.842 3.638 1.00 0.16 O ATOM 650 O5' DT B 21 -7.113 -2.786 3.338 1.00 0.14 O ATOM 651 C5' DT B 21 -6.551 -3.932 2.672 1.00 0.16 C ATOM 652 C4' DT B 21 -5.189 -4.328 3.247 1.00 0.13 C ATOM 653 O4' DT B 21 -4.275 -3.232 3.153 1.00 0.14 O ATOM 654 C3' DT B 21 -5.218 -4.744 4.721 1.00 0.12 C ATOM 655 O3' DT B 21 -5.100 -6.176 4.803 1.00 0.13 O ATOM 656 C2' DT B 21 -4.018 -3.968 5.290 1.00 0.10 C ATOM 657 C1' DT B 21 -3.237 -3.552 4.076 1.00 0.12 C ATOM 658 N1 DT B 21 -2.404 -2.336 4.213 1.00 0.10 N ATOM 659 C2 DT B 21 -1.057 -2.413 3.924 1.00 0.10 C ATOM 660 O2 DT B 21 -0.491 -3.451 3.599 1.00 0.12 O ATOM 661 N3 DT B 21 -0.348 -1.244 4.021 1.00 0.10 N ATOM 662 C4 DT B 21 -0.845 -0.015 4.373 1.00 0.10 C ATOM 663 C5 DT B 21 -2.266 -0.013 4.663 1.00 0.10 C ATOM 664 C6 DT B 21 -2.978 -1.153 4.578 1.00 0.11 C ATOM 665 O4 DT B 21 -0.078 0.943 4.402 1.00 0.10 O ATOM 678 C7 DT B 21 -2.985 1.285 5.050 1.00 0.09 C ATOM 0 H5' DT B 21 -6.445 -3.716 1.609 1.00 0.16 H new ATOM 0 H5'' DT B 21 -7.238 -4.773 2.759 1.00 0.16 H new ATOM 0 H4' DT B 21 -4.881 -5.188 2.652 1.00 0.13 H new ATOM 0 H3' DT B 21 -6.129 -4.518 5.275 1.00 0.12 H new ATOM 0 H2' DT B 21 -4.342 -3.104 5.870 1.00 0.10 H new ATOM 0 H2'' DT B 21 -3.419 -4.592 5.954 1.00 0.10 H new ATOM 0 H1' DT B 21 -2.533 -4.342 3.816 1.00 0.12 H new ATOM 0 H3 DT B 21 0.649 -1.293 3.810 1.00 0.10 H new ATOM 0 H71 DT B 21 -2.288 1.948 5.564 1.00 0.09 H new ATOM 0 H72 DT B 21 -3.358 1.776 4.151 1.00 0.09 H new ATOM 0 H73 DT B 21 -3.821 1.055 5.711 1.00 0.09 H new ATOM 0 H6 DT B 21 -4.034 -1.130 4.805 1.00 0.11 H new ATOM 679 P DG B 22 -4.724 -7.000 6.141 1.00 0.15 P ATOM 680 OP1 DG B 22 -5.111 -8.416 5.940 1.00 0.22 O ATOM 681 OP2 DG B 22 -5.239 -6.254 7.311 1.00 0.19 O ATOM 682 O5' DG B 22 -3.111 -6.898 6.144 1.00 0.14 O ATOM 683 C5' DG B 22 -2.291 -7.598 5.190 1.00 0.14 C ATOM 684 C4' DG B 22 -0.793 -7.407 5.456 1.00 0.14 C ATOM 685 O4' DG B 22 -0.340 -6.043 5.290 1.00 0.15 O ATOM 686 C3' DG B 22 -0.422 -7.835 6.883 1.00 0.14 C ATOM 687 O3' DG B 22 0.608 -8.843 6.884 1.00 0.17 O ATOM 688 C2' DG B 22 0.053 -6.509 7.441 1.00 0.15 C ATOM 689 C1' DG B 22 0.694 -5.831 6.261 1.00 0.14 C ATOM 690 N9 DG B 22 0.934 -4.401 6.531 1.00 0.12 N ATOM 691 C8 DG B 22 0.017 -3.447 6.818 1.00 0.13 C ATOM 692 N7 DG B 22 0.547 -2.216 6.993 1.00 0.12 N ATOM 693 C5 DG B 22 1.880 -2.422 6.807 1.00 0.11 C ATOM 694 C6 DG B 22 2.965 -1.500 6.867 1.00 0.11 C ATOM 695 O6 DG B 22 2.970 -0.291 7.088 1.00 0.10 O ATOM 696 N1 DG B 22 4.168 -2.114 6.623 1.00 0.09 N ATOM 697 C2 DG B 22 4.335 -3.447 6.351 1.00 0.11 C ATOM 698 N2 DG B 22 5.575 -3.856 6.147 1.00 0.10 N ATOM 699 N3 DG B 22 3.337 -4.324 6.287 1.00 0.11 N ATOM 700 C4 DG B 22 2.138 -3.745 6.526 1.00 0.11 C ATOM 0 H5' DG B 22 -2.527 -7.247 4.185 1.00 0.14 H new ATOM 0 H5'' DG B 22 -2.530 -8.661 5.220 1.00 0.14 H new ATOM 0 H4' DG B 22 -0.303 -8.034 4.711 1.00 0.14 H new ATOM 0 H3' DG B 22 -1.225 -8.299 7.455 1.00 0.14 H new ATOM 0 H2' DG B 22 -0.776 -5.922 7.838 1.00 0.15 H new ATOM 0 H2'' DG B 22 0.763 -6.649 8.256 1.00 0.15 H new ATOM 0 H1' DG B 22 1.677 -6.202 5.971 1.00 0.14 H new ATOM 0 H8 DG B 22 -1.040 -3.651 6.900 1.00 0.13 H new ATOM 0 H1 DG B 22 5.005 -1.532 6.646 1.00 0.09 H new ATOM 0 H21 DG B 22 5.761 -4.837 5.940 1.00 0.10 H new ATOM 0 H22 DG B 22 6.346 -3.190 6.196 1.00 0.10 H new ATOM 712 P DC B 23 1.158 -9.550 8.232 1.00 0.17 P ATOM 713 OP1 DC B 23 1.781 -10.841 7.855 1.00 0.19 O ATOM 714 OP2 DC B 23 0.075 -9.530 9.240 1.00 0.17 O ATOM 715 O5' DC B 23 2.325 -8.544 8.727 1.00 0.18 O ATOM 716 C5' DC B 23 3.635 -8.517 8.128 1.00 0.16 C ATOM 717 C4' DC B 23 4.578 -7.524 8.824 1.00 0.14 C ATOM 718 O4' DC B 23 4.124 -6.164 8.705 1.00 0.14 O ATOM 719 C3' DC B 23 4.753 -7.827 10.318 1.00 0.12 C ATOM 720 O3' DC B 23 6.142 -8.061 10.619 1.00 0.10 O ATOM 721 C2' DC B 23 4.248 -6.514 10.933 1.00 0.12 C ATOM 722 C1' DC B 23 4.575 -5.482 9.876 1.00 0.11 C ATOM 723 N1 DC B 23 3.862 -4.176 9.964 1.00 0.10 N ATOM 724 C2 DC B 23 4.597 -2.996 9.987 1.00 0.08 C ATOM 725 O2 DC B 23 5.825 -2.981 9.977 1.00 0.08 O ATOM 726 N3 DC B 23 3.928 -1.816 10.025 1.00 0.09 N ATOM 727 C4 DC B 23 2.595 -1.775 10.043 1.00 0.11 C ATOM 728 N4 DC B 23 2.000 -0.588 10.072 1.00 0.13 N ATOM 729 C5 DC B 23 1.819 -2.976 10.024 1.00 0.14 C ATOM 730 C6 DC B 23 2.498 -4.139 9.987 1.00 0.13 C ATOM 0 H5' DC B 23 3.544 -8.250 7.075 1.00 0.16 H new ATOM 0 H5'' DC B 23 4.070 -9.516 8.168 1.00 0.16 H new ATOM 0 H4' DC B 23 5.533 -7.643 8.311 1.00 0.14 H new ATOM 0 H3' DC B 23 4.234 -8.714 10.681 1.00 0.12 H new ATOM 0 H2' DC B 23 3.178 -6.552 11.139 1.00 0.12 H new ATOM 0 H2'' DC B 23 4.747 -6.294 11.877 1.00 0.12 H new ATOM 0 H1' DC B 23 5.623 -5.188 9.941 1.00 0.11 H new ATOM 0 H41 DC B 23 0.982 -0.528 10.086 1.00 0.13 H new ATOM 0 H42 DC B 23 2.561 0.264 10.080 1.00 0.13 H new ATOM 0 H5 DC B 23 0.739 -2.952 10.039 1.00 0.14 H new ATOM 0 H6 DC B 23 1.947 -5.068 9.975 1.00 0.13 H new ATOM 742 P DG B 24 6.711 -8.376 12.105 1.00 0.10 P ATOM 743 OP1 DG B 24 7.772 -9.404 11.986 1.00 0.14 O ATOM 744 OP2 DG B 24 5.568 -8.606 13.017 1.00 0.14 O ATOM 745 O5' DG B 24 7.405 -6.971 12.518 1.00 0.07 O ATOM 746 C5' DG B 24 8.673 -6.574 11.965 1.00 0.07 C ATOM 747 C4' DG B 24 9.211 -5.244 12.515 1.00 0.08 C ATOM 748 O4' DG B 24 8.363 -4.120 12.164 1.00 0.08 O ATOM 749 C3' DG B 24 9.361 -5.226 14.048 1.00 0.10 C ATOM 750 O3' DG B 24 10.522 -4.472 14.428 1.00 0.14 O ATOM 751 C2' DG B 24 8.119 -4.448 14.411 1.00 0.10 C ATOM 752 C1' DG B 24 8.105 -3.362 13.355 1.00 0.09 C ATOM 753 N9 DG B 24 6.888 -2.534 13.278 1.00 0.08 N ATOM 754 C8 DG B 24 5.584 -2.908 13.272 1.00 0.07 C ATOM 755 N7 DG B 24 4.720 -1.877 13.181 1.00 0.07 N ATOM 756 C5 DG B 24 5.536 -0.795 13.129 1.00 0.07 C ATOM 757 C6 DG B 24 5.209 0.581 13.030 1.00 0.08 C ATOM 758 O6 DG B 24 4.110 1.120 12.961 1.00 0.08 O ATOM 759 N1 DG B 24 6.330 1.372 13.009 1.00 0.09 N ATOM 760 C2 DG B 24 7.620 0.919 13.072 1.00 0.10 C ATOM 761 N2 DG B 24 8.569 1.841 13.038 1.00 0.13 N ATOM 762 N3 DG B 24 7.952 -0.366 13.163 1.00 0.10 N ATOM 763 C4 DG B 24 6.858 -1.167 13.187 1.00 0.08 C ATOM 0 H5' DG B 24 8.575 -6.494 10.882 1.00 0.07 H new ATOM 0 H5'' DG B 24 9.404 -7.358 12.162 1.00 0.07 H new ATOM 0 H4' DG B 24 10.193 -5.151 12.051 1.00 0.08 H new ATOM 0 H3' DG B 24 9.467 -6.205 14.515 1.00 0.10 H new ATOM 0 H2' DG B 24 7.223 -5.068 14.370 1.00 0.10 H new ATOM 0 H2'' DG B 24 8.176 -4.036 15.419 1.00 0.10 H new ATOM 0 HO3' DG B 24 10.604 -4.468 15.405 1.00 0.14 H new ATOM 0 H1' DG B 24 8.834 -2.580 13.567 1.00 0.09 H new ATOM 0 H8 DG B 24 5.267 -3.938 13.334 1.00 0.07 H new ATOM 0 H1 DG B 24 6.191 2.380 12.941 1.00 0.09 H new ATOM 0 H21 DG B 24 9.550 1.565 13.082 1.00 0.13 H new ATOM 0 H22 DG B 24 8.319 2.827 12.968 1.00 0.13 H new TER 776 DG B 24