USER MOD reduce.3.24.130724 H: found=0, std=0, add=253, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 253 hydrogens (14 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 DC O5' : rot 180:sc= 0 USER MOD Single : A 5 DT C7 :methyl 150:sc= -1.29 (180deg=-1.29) USER MOD Single : A 7 DT C7 :methyl -30:sc= -0.639 (180deg=-1.07) USER MOD Single : A 11 DC O3' : rot 180:sc= 0 USER MOD Single : B 12 DG O5' : rot 27:sc= 0.0144 USER MOD Single : B 15 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 19 DT C7 :methyl 150:sc= -0.385 (180deg=-0.385) USER MOD Single : B 22 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 7.519 -14.136 0.399 1.00 0.00 O ATOM 2 C5' DC A 1 7.824 -15.109 -0.578 1.00 0.00 C ATOM 3 C4' DC A 1 6.933 -14.951 -1.816 1.00 0.00 C ATOM 4 O4' DC A 1 5.591 -15.132 -1.393 1.00 0.00 O ATOM 5 C3' DC A 1 7.041 -13.550 -2.435 1.00 0.00 C ATOM 6 O3' DC A 1 7.135 -13.687 -3.844 1.00 0.00 O ATOM 7 C2' DC A 1 5.726 -12.904 -2.006 1.00 0.00 C ATOM 8 C1' DC A 1 4.804 -14.120 -1.988 1.00 0.00 C ATOM 9 N1 DC A 1 3.591 -13.917 -1.147 1.00 0.00 N ATOM 10 C2 DC A 1 2.332 -13.949 -1.754 1.00 0.00 C ATOM 11 O2 DC A 1 2.213 -14.075 -2.970 1.00 0.00 O ATOM 12 N3 DC A 1 1.224 -13.837 -0.965 1.00 0.00 N ATOM 13 C4 DC A 1 1.330 -13.658 0.360 1.00 0.00 C ATOM 14 N4 DC A 1 0.214 -13.557 1.088 1.00 0.00 N ATOM 15 C5 DC A 1 2.612 -13.599 1.003 1.00 0.00 C ATOM 16 C6 DC A 1 3.702 -13.737 0.212 1.00 0.00 C ATOM 0 H5' DC A 1 7.692 -16.105 -0.156 1.00 0.00 H new ATOM 0 H5'' DC A 1 8.871 -15.022 -0.867 1.00 0.00 H new ATOM 0 H4' DC A 1 7.247 -15.678 -2.565 1.00 0.00 H new ATOM 0 H3' DC A 1 7.907 -12.964 -2.126 1.00 0.00 H new ATOM 0 H2' DC A 1 5.799 -12.426 -1.029 1.00 0.00 H new ATOM 0 H2'' DC A 1 5.391 -12.142 -2.709 1.00 0.00 H new ATOM 0 HO5' DC A 1 8.100 -14.261 1.178 1.00 0.00 H new ATOM 0 H1' DC A 1 4.446 -14.344 -2.993 1.00 0.00 H new ATOM 0 H41 DC A 1 0.274 -13.421 2.097 1.00 0.00 H new ATOM 0 H42 DC A 1 -0.698 -13.616 0.635 1.00 0.00 H new ATOM 0 H5 DC A 1 2.703 -13.451 2.069 1.00 0.00 H new ATOM 0 H6 DC A 1 4.684 -13.705 0.660 1.00 0.00 H new ATOM 29 P DG A 2 7.370 -12.421 -4.822 1.00 0.00 P ATOM 30 OP1 DG A 2 8.146 -12.887 -5.993 1.00 0.00 O ATOM 31 OP2 DG A 2 7.877 -11.291 -4.012 1.00 0.00 O ATOM 32 O5' DG A 2 5.879 -12.047 -5.317 1.00 0.00 O ATOM 33 C5' DG A 2 5.210 -12.815 -6.302 1.00 0.00 C ATOM 34 C4' DG A 2 3.880 -12.161 -6.695 1.00 0.00 C ATOM 35 O4' DG A 2 2.993 -12.254 -5.593 1.00 0.00 O ATOM 36 C3' DG A 2 4.043 -10.671 -7.040 1.00 0.00 C ATOM 37 O3' DG A 2 3.256 -10.437 -8.198 1.00 0.00 O ATOM 38 C2' DG A 2 3.477 -10.021 -5.778 1.00 0.00 C ATOM 39 C1' DG A 2 2.387 -10.989 -5.434 1.00 0.00 C ATOM 40 N9 DG A 2 1.827 -10.888 -4.073 1.00 0.00 N ATOM 41 C8 DG A 2 2.470 -10.624 -2.896 1.00 0.00 C ATOM 42 N7 DG A 2 1.711 -10.719 -1.840 1.00 0.00 N ATOM 43 C5 DG A 2 0.459 -11.037 -2.360 1.00 0.00 C ATOM 44 C6 DG A 2 -0.792 -11.239 -1.700 1.00 0.00 C ATOM 45 O6 DG A 2 -1.009 -11.290 -0.494 1.00 0.00 O ATOM 46 N1 DG A 2 -1.849 -11.390 -2.594 1.00 0.00 N ATOM 47 C2 DG A 2 -1.712 -11.394 -3.971 1.00 0.00 C ATOM 48 N2 DG A 2 -2.822 -11.538 -4.701 1.00 0.00 N ATOM 49 N3 DG A 2 -0.530 -11.264 -4.591 1.00 0.00 N ATOM 50 C4 DG A 2 0.511 -11.084 -3.733 1.00 0.00 C ATOM 0 H5' DG A 2 5.027 -13.821 -5.923 1.00 0.00 H new ATOM 0 H5'' DG A 2 5.844 -12.917 -7.183 1.00 0.00 H new ATOM 0 H4' DG A 2 3.502 -12.680 -7.576 1.00 0.00 H new ATOM 0 H3' DG A 2 5.044 -10.303 -7.267 1.00 0.00 H new ATOM 0 H2' DG A 2 4.221 -9.937 -4.986 1.00 0.00 H new ATOM 0 H2'' DG A 2 3.096 -9.017 -5.965 1.00 0.00 H new ATOM 0 H1' DG A 2 1.528 -10.789 -6.075 1.00 0.00 H new ATOM 0 H8 DG A 2 3.516 -10.360 -2.845 1.00 0.00 H new ATOM 0 H1 DG A 2 -2.786 -11.505 -2.208 1.00 0.00 H new ATOM 0 H21 DG A 2 -2.765 -11.546 -5.719 1.00 0.00 H new ATOM 0 H22 DG A 2 -3.726 -11.640 -4.240 1.00 0.00 H new ATOM 62 P DC A 3 3.020 -8.978 -8.849 1.00 0.00 P ATOM 63 OP1 DC A 3 3.230 -9.086 -10.310 1.00 0.00 O ATOM 64 OP2 DC A 3 3.771 -7.966 -8.072 1.00 0.00 O ATOM 65 O5' DC A 3 1.443 -8.763 -8.578 1.00 0.00 O ATOM 66 C5' DC A 3 0.481 -9.615 -9.176 1.00 0.00 C ATOM 67 C4' DC A 3 -0.953 -9.146 -8.900 1.00 0.00 C ATOM 68 O4' DC A 3 -1.192 -9.247 -7.505 1.00 0.00 O ATOM 69 C3' DC A 3 -1.164 -7.686 -9.309 1.00 0.00 C ATOM 70 O3' DC A 3 -2.448 -7.598 -9.908 1.00 0.00 O ATOM 71 C2' DC A 3 -1.084 -6.962 -7.966 1.00 0.00 C ATOM 72 C1' DC A 3 -1.681 -8.007 -7.022 1.00 0.00 C ATOM 73 N1 DC A 3 -1.219 -7.927 -5.608 1.00 0.00 N ATOM 74 C2 DC A 3 -2.135 -8.169 -4.579 1.00 0.00 C ATOM 75 O2 DC A 3 -3.322 -8.376 -4.817 1.00 0.00 O ATOM 76 N3 DC A 3 -1.689 -8.171 -3.289 1.00 0.00 N ATOM 77 C4 DC A 3 -0.396 -7.960 -3.006 1.00 0.00 C ATOM 78 N4 DC A 3 -0.003 -7.969 -1.729 1.00 0.00 N ATOM 79 C5 DC A 3 0.574 -7.780 -4.047 1.00 0.00 C ATOM 80 C6 DC A 3 0.116 -7.773 -5.320 1.00 0.00 C ATOM 0 H5' DC A 3 0.610 -10.629 -8.798 1.00 0.00 H new ATOM 0 H5'' DC A 3 0.649 -9.653 -10.252 1.00 0.00 H new ATOM 0 H4' DC A 3 -1.633 -9.770 -9.480 1.00 0.00 H new ATOM 0 H3' DC A 3 -0.456 -7.272 -10.027 1.00 0.00 H new ATOM 0 H2' DC A 3 -0.059 -6.705 -7.699 1.00 0.00 H new ATOM 0 H2'' DC A 3 -1.656 -6.034 -7.965 1.00 0.00 H new ATOM 0 H1' DC A 3 -2.762 -7.865 -7.013 1.00 0.00 H new ATOM 0 H41 DC A 3 0.977 -7.810 -1.496 1.00 0.00 H new ATOM 0 H42 DC A 3 -0.683 -8.135 -0.987 1.00 0.00 H new ATOM 0 H5 DC A 3 1.623 -7.656 -3.825 1.00 0.00 H new ATOM 0 H6 DC A 3 0.818 -7.643 -6.131 1.00 0.00 H new ATOM 92 P DA A 4 -3.079 -6.208 -10.438 1.00 0.00 P ATOM 93 OP1 DA A 4 -4.030 -6.518 -11.528 1.00 0.00 O ATOM 94 OP2 DA A 4 -1.977 -5.248 -10.673 1.00 0.00 O ATOM 95 O5' DA A 4 -3.922 -5.708 -9.156 1.00 0.00 O ATOM 96 C5' DA A 4 -5.136 -6.336 -8.788 1.00 0.00 C ATOM 97 C4' DA A 4 -5.696 -5.704 -7.513 1.00 0.00 C ATOM 98 O4' DA A 4 -4.939 -6.070 -6.384 1.00 0.00 O ATOM 99 C3' DA A 4 -5.869 -4.185 -7.567 1.00 0.00 C ATOM 100 O3' DA A 4 -7.239 -3.828 -7.412 1.00 0.00 O ATOM 101 C2' DA A 4 -5.036 -3.862 -6.369 1.00 0.00 C ATOM 102 C1' DA A 4 -5.167 -5.043 -5.450 1.00 0.00 C ATOM 103 N9 DA A 4 -4.067 -5.098 -4.492 1.00 0.00 N ATOM 104 C8 DA A 4 -2.757 -5.033 -4.822 1.00 0.00 C ATOM 105 N7 DA A 4 -1.935 -5.088 -3.812 1.00 0.00 N ATOM 106 C5 DA A 4 -2.795 -5.218 -2.722 1.00 0.00 C ATOM 107 C6 DA A 4 -2.577 -5.348 -1.337 1.00 0.00 C ATOM 108 N6 DA A 4 -1.355 -5.393 -0.798 1.00 0.00 N ATOM 109 N1 DA A 4 -3.649 -5.439 -0.527 1.00 0.00 N ATOM 110 C2 DA A 4 -4.870 -5.414 -1.055 1.00 0.00 C ATOM 111 N3 DA A 4 -5.209 -5.312 -2.336 1.00 0.00 N ATOM 112 C4 DA A 4 -4.108 -5.220 -3.129 1.00 0.00 C ATOM 0 H5' DA A 4 -4.969 -7.402 -8.631 1.00 0.00 H new ATOM 0 H5'' DA A 4 -5.861 -6.243 -9.597 1.00 0.00 H new ATOM 0 H4' DA A 4 -6.703 -6.111 -7.428 1.00 0.00 H new ATOM 0 H3' DA A 4 -5.586 -3.673 -8.487 1.00 0.00 H new ATOM 0 H2' DA A 4 -3.995 -3.698 -6.649 1.00 0.00 H new ATOM 0 H2'' DA A 4 -5.384 -2.949 -5.885 1.00 0.00 H new ATOM 0 H1' DA A 4 -6.094 -5.060 -4.877 1.00 0.00 H new ATOM 0 H8 DA A 4 -2.418 -4.943 -5.843 1.00 0.00 H new ATOM 0 H61 DA A 4 -1.246 -5.488 0.212 1.00 0.00 H new ATOM 0 H62 DA A 4 -0.531 -5.332 -1.396 1.00 0.00 H new ATOM 0 H2 DA A 4 -5.689 -5.486 -0.354 1.00 0.00 H new ATOM 124 P DT A 5 -7.739 -2.294 -7.226 1.00 0.00 P ATOM 125 OP1 DT A 5 -9.122 -2.201 -7.746 1.00 0.00 O ATOM 126 OP2 DT A 5 -6.695 -1.394 -7.762 1.00 0.00 O ATOM 127 O5' DT A 5 -7.793 -2.095 -5.618 1.00 0.00 O ATOM 128 C5' DT A 5 -8.780 -2.743 -4.836 1.00 0.00 C ATOM 129 C4' DT A 5 -8.640 -2.446 -3.336 1.00 0.00 C ATOM 130 O4' DT A 5 -7.417 -2.936 -2.854 1.00 0.00 O ATOM 131 C3' DT A 5 -8.771 -0.971 -2.932 1.00 0.00 C ATOM 132 O3' DT A 5 -9.891 -0.864 -2.062 1.00 0.00 O ATOM 133 C2' DT A 5 -7.454 -0.692 -2.217 1.00 0.00 C ATOM 134 C1' DT A 5 -7.005 -2.087 -1.802 1.00 0.00 C ATOM 135 N1 DT A 5 -5.533 -2.143 -1.840 1.00 0.00 N ATOM 136 C2 DT A 5 -4.827 -2.275 -0.655 1.00 0.00 C ATOM 137 O2 DT A 5 -5.363 -2.541 0.416 1.00 0.00 O ATOM 138 N3 DT A 5 -3.460 -2.081 -0.751 1.00 0.00 N ATOM 139 C4 DT A 5 -2.733 -1.964 -1.926 1.00 0.00 C ATOM 140 O4 DT A 5 -1.504 -1.946 -1.879 1.00 0.00 O ATOM 141 C5 DT A 5 -3.550 -1.870 -3.129 1.00 0.00 C ATOM 142 C7 DT A 5 -2.867 -1.696 -4.473 1.00 0.00 C ATOM 143 C6 DT A 5 -4.907 -1.942 -3.042 1.00 0.00 C ATOM 0 H5' DT A 5 -8.715 -3.819 -4.996 1.00 0.00 H new ATOM 0 H5'' DT A 5 -9.768 -2.429 -5.173 1.00 0.00 H new ATOM 0 H4' DT A 5 -9.490 -2.957 -2.884 1.00 0.00 H new ATOM 0 H3' DT A 5 -8.933 -0.268 -3.749 1.00 0.00 H new ATOM 0 H2' DT A 5 -6.729 -0.211 -2.874 1.00 0.00 H new ATOM 0 H2'' DT A 5 -7.590 -0.036 -1.357 1.00 0.00 H new ATOM 0 H1' DT A 5 -7.394 -2.349 -0.818 1.00 0.00 H new ATOM 0 H3 DT A 5 -2.939 -2.018 0.124 1.00 0.00 H new ATOM 0 H71 DT A 5 -3.475 -2.156 -5.252 1.00 0.00 H new ATOM 0 H72 DT A 5 -2.747 -0.634 -4.685 1.00 0.00 H new ATOM 0 H73 DT A 5 -1.888 -2.174 -4.448 1.00 0.00 H new ATOM 0 H6 DT A 5 -5.501 -1.839 -3.938 1.00 0.00 H new ATOM 156 P DA A 6 -10.334 0.515 -1.340 1.00 0.00 P ATOM 157 OP1 DA A 6 -11.730 0.355 -0.876 1.00 0.00 O ATOM 158 OP2 DA A 6 -9.986 1.640 -2.237 1.00 0.00 O ATOM 159 O5' DA A 6 -9.381 0.601 -0.035 1.00 0.00 O ATOM 160 C5' DA A 6 -9.452 -0.347 1.016 1.00 0.00 C ATOM 161 C4' DA A 6 -8.447 -0.020 2.134 1.00 0.00 C ATOM 162 O4' DA A 6 -7.167 -0.498 1.760 1.00 0.00 O ATOM 163 C3' DA A 6 -8.315 1.482 2.458 1.00 0.00 C ATOM 164 O3' DA A 6 -8.973 1.779 3.679 1.00 0.00 O ATOM 165 C2' DA A 6 -6.814 1.580 2.531 1.00 0.00 C ATOM 166 C1' DA A 6 -6.225 0.213 2.538 1.00 0.00 C ATOM 167 N9 DA A 6 -4.948 0.306 1.796 1.00 0.00 N ATOM 168 C8 DA A 6 -4.826 0.530 0.462 1.00 0.00 C ATOM 169 N7 DA A 6 -3.622 0.671 0.004 1.00 0.00 N ATOM 170 C5 DA A 6 -2.868 0.524 1.151 1.00 0.00 C ATOM 171 C6 DA A 6 -1.484 0.439 1.354 1.00 0.00 C ATOM 172 N6 DA A 6 -0.621 0.391 0.335 1.00 0.00 N ATOM 173 N1 DA A 6 -1.043 0.325 2.617 1.00 0.00 N ATOM 174 C2 DA A 6 -1.931 0.294 3.607 1.00 0.00 C ATOM 175 N3 DA A 6 -3.256 0.327 3.550 1.00 0.00 N ATOM 176 C4 DA A 6 -3.669 0.425 2.265 1.00 0.00 C ATOM 0 H5' DA A 6 -9.251 -1.344 0.623 1.00 0.00 H new ATOM 0 H5'' DA A 6 -10.462 -0.364 1.426 1.00 0.00 H new ATOM 0 H4' DA A 6 -8.833 -0.507 3.030 1.00 0.00 H new ATOM 0 H3' DA A 6 -8.764 2.184 1.756 1.00 0.00 H new ATOM 0 H2' DA A 6 -6.434 2.146 1.680 1.00 0.00 H new ATOM 0 H2'' DA A 6 -6.518 2.119 3.431 1.00 0.00 H new ATOM 0 H1' DA A 6 -6.040 -0.230 3.517 1.00 0.00 H new ATOM 0 H8 DA A 6 -5.689 0.588 -0.185 1.00 0.00 H new ATOM 0 H61 DA A 6 0.381 0.329 0.517 1.00 0.00 H new ATOM 0 H62 DA A 6 -0.964 0.416 -0.625 1.00 0.00 H new ATOM 0 H2 DA A 6 -1.513 0.233 4.601 1.00 0.00 H new ATOM 188 P DT A 7 -8.960 3.252 4.353 1.00 0.00 P ATOM 189 OP1 DT A 7 -9.964 3.263 5.440 1.00 0.00 O ATOM 190 OP2 DT A 7 -9.037 4.262 3.274 1.00 0.00 O ATOM 191 O5' DT A 7 -7.498 3.355 5.028 1.00 0.00 O ATOM 192 C5' DT A 7 -7.051 2.400 5.975 1.00 0.00 C ATOM 193 C4' DT A 7 -5.599 2.667 6.387 1.00 0.00 C ATOM 194 O4' DT A 7 -4.771 2.441 5.257 1.00 0.00 O ATOM 195 C3' DT A 7 -5.398 4.120 6.833 1.00 0.00 C ATOM 196 O3' DT A 7 -4.821 4.131 8.129 1.00 0.00 O ATOM 197 C2' DT A 7 -4.455 4.658 5.759 1.00 0.00 C ATOM 198 C1' DT A 7 -3.738 3.406 5.265 1.00 0.00 C ATOM 199 N1 DT A 7 -3.206 3.567 3.895 1.00 0.00 N ATOM 200 C2 DT A 7 -1.837 3.420 3.666 1.00 0.00 C ATOM 201 O2 DT A 7 -1.009 3.263 4.560 1.00 0.00 O ATOM 202 N3 DT A 7 -1.434 3.459 2.341 1.00 0.00 N ATOM 203 C4 DT A 7 -2.257 3.671 1.245 1.00 0.00 C ATOM 204 O4 DT A 7 -1.771 3.669 0.116 1.00 0.00 O ATOM 205 C5 DT A 7 -3.660 3.876 1.582 1.00 0.00 C ATOM 206 C7 DT A 7 -4.682 4.126 0.498 1.00 0.00 C ATOM 207 C6 DT A 7 -4.074 3.819 2.871 1.00 0.00 C ATOM 0 H5' DT A 7 -7.134 1.399 5.553 1.00 0.00 H new ATOM 0 H5'' DT A 7 -7.693 2.429 6.855 1.00 0.00 H new ATOM 0 H4' DT A 7 -5.349 2.008 7.218 1.00 0.00 H new ATOM 0 H3' DT A 7 -6.306 4.717 6.915 1.00 0.00 H new ATOM 0 H2' DT A 7 -5.001 5.153 4.956 1.00 0.00 H new ATOM 0 H2'' DT A 7 -3.756 5.388 6.166 1.00 0.00 H new ATOM 0 H1' DT A 7 -2.879 3.153 5.886 1.00 0.00 H new ATOM 0 H3 DT A 7 -0.441 3.319 2.154 1.00 0.00 H new ATOM 0 H71 DT A 7 -4.206 4.633 -0.341 1.00 0.00 H new ATOM 0 H72 DT A 7 -5.094 3.175 0.160 1.00 0.00 H new ATOM 0 H73 DT A 7 -5.484 4.750 0.891 1.00 0.00 H new ATOM 0 H6 DT A 7 -5.119 3.977 3.095 1.00 0.00 H new ATOM 220 P DA A 8 -4.572 5.501 8.955 1.00 0.00 P ATOM 221 OP1 DA A 8 -4.579 5.175 10.398 1.00 0.00 O ATOM 222 OP2 DA A 8 -5.485 6.543 8.433 1.00 0.00 O ATOM 223 O5' DA A 8 -3.068 5.899 8.534 1.00 0.00 O ATOM 224 C5' DA A 8 -1.956 5.193 9.048 1.00 0.00 C ATOM 225 C4' DA A 8 -0.654 5.722 8.444 1.00 0.00 C ATOM 226 O4' DA A 8 -0.582 5.368 7.074 1.00 0.00 O ATOM 227 C3' DA A 8 -0.506 7.249 8.539 1.00 0.00 C ATOM 228 O3' DA A 8 0.690 7.556 9.239 1.00 0.00 O ATOM 229 C2' DA A 8 -0.472 7.616 7.081 1.00 0.00 C ATOM 230 C1' DA A 8 0.143 6.406 6.454 1.00 0.00 C ATOM 231 N9 DA A 8 -0.084 6.378 5.002 1.00 0.00 N ATOM 232 C8 DA A 8 -1.261 6.588 4.348 1.00 0.00 C ATOM 233 N7 DA A 8 -1.192 6.466 3.052 1.00 0.00 N ATOM 234 C5 DA A 8 0.151 6.175 2.833 1.00 0.00 C ATOM 235 C6 DA A 8 0.902 5.900 1.672 1.00 0.00 C ATOM 236 N6 DA A 8 0.357 5.790 0.454 1.00 0.00 N ATOM 237 N1 DA A 8 2.231 5.727 1.804 1.00 0.00 N ATOM 238 C2 DA A 8 2.783 5.785 3.014 1.00 0.00 C ATOM 239 N3 DA A 8 2.183 5.984 4.182 1.00 0.00 N ATOM 240 C4 DA A 8 0.847 6.171 4.019 1.00 0.00 C ATOM 0 H5' DA A 8 -2.060 4.131 8.827 1.00 0.00 H new ATOM 0 H5'' DA A 8 -1.926 5.292 10.133 1.00 0.00 H new ATOM 0 H4' DA A 8 0.149 5.269 9.026 1.00 0.00 H new ATOM 0 H3' DA A 8 -1.283 7.787 9.082 1.00 0.00 H new ATOM 0 H2' DA A 8 -1.470 7.813 6.689 1.00 0.00 H new ATOM 0 H2'' DA A 8 0.123 8.512 6.902 1.00 0.00 H new ATOM 0 H1' DA A 8 1.224 6.352 6.583 1.00 0.00 H new ATOM 0 H8 DA A 8 -2.178 6.836 4.862 1.00 0.00 H new ATOM 0 H61 DA A 8 0.948 5.590 -0.353 1.00 0.00 H new ATOM 0 H62 DA A 8 -0.649 5.907 0.333 1.00 0.00 H new ATOM 0 H2 DA A 8 3.854 5.654 3.050 1.00 0.00 H new ATOM 252 P DG A 9 1.149 9.072 9.572 1.00 0.00 P ATOM 253 OP1 DG A 9 1.533 9.134 11.000 1.00 0.00 O ATOM 254 OP2 DG A 9 0.138 10.013 9.042 1.00 0.00 O ATOM 255 O5' DG A 9 2.484 9.227 8.681 1.00 0.00 O ATOM 256 C5' DG A 9 3.637 8.456 8.957 1.00 0.00 C ATOM 257 C4' DG A 9 4.847 8.900 8.126 1.00 0.00 C ATOM 258 O4' DG A 9 4.585 8.654 6.753 1.00 0.00 O ATOM 259 C3' DG A 9 5.157 10.391 8.271 1.00 0.00 C ATOM 260 O3' DG A 9 6.574 10.473 8.197 1.00 0.00 O ATOM 261 C2' DG A 9 4.399 10.991 7.090 1.00 0.00 C ATOM 262 C1' DG A 9 4.493 9.881 6.045 1.00 0.00 C ATOM 263 N9 DG A 9 3.344 9.715 5.127 1.00 0.00 N ATOM 264 C8 DG A 9 2.011 9.977 5.319 1.00 0.00 C ATOM 265 N7 DG A 9 1.272 9.761 4.264 1.00 0.00 N ATOM 266 C5 DG A 9 2.176 9.324 3.300 1.00 0.00 C ATOM 267 C6 DG A 9 1.982 9.001 1.920 1.00 0.00 C ATOM 268 O6 DG A 9 0.929 8.975 1.289 1.00 0.00 O ATOM 269 N1 DG A 9 3.175 8.687 1.269 1.00 0.00 N ATOM 270 C2 DG A 9 4.408 8.632 1.888 1.00 0.00 C ATOM 271 N2 DG A 9 5.464 8.331 1.127 1.00 0.00 N ATOM 272 N3 DG A 9 4.589 8.913 3.187 1.00 0.00 N ATOM 273 C4 DG A 9 3.441 9.261 3.832 1.00 0.00 C ATOM 0 H5' DG A 9 3.426 7.406 8.755 1.00 0.00 H new ATOM 0 H5'' DG A 9 3.879 8.534 10.017 1.00 0.00 H new ATOM 0 H4' DG A 9 5.702 8.332 8.493 1.00 0.00 H new ATOM 0 H3' DG A 9 4.862 10.910 9.183 1.00 0.00 H new ATOM 0 H2' DG A 9 3.365 11.222 7.346 1.00 0.00 H new ATOM 0 H2'' DG A 9 4.856 11.917 6.742 1.00 0.00 H new ATOM 0 H1' DG A 9 5.346 10.156 5.424 1.00 0.00 H new ATOM 0 H8 DG A 9 1.609 10.330 6.257 1.00 0.00 H new ATOM 0 H1 DG A 9 3.134 8.485 0.270 1.00 0.00 H new ATOM 0 H21 DG A 9 6.394 8.279 1.543 1.00 0.00 H new ATOM 0 H22 DG A 9 5.340 8.153 0.130 1.00 0.00 H new ATOM 285 P DC A 10 7.423 11.828 7.959 1.00 0.00 P ATOM 286 OP1 DC A 10 8.677 11.724 8.737 1.00 0.00 O ATOM 287 OP2 DC A 10 6.545 13.005 8.138 1.00 0.00 O ATOM 288 O5' DC A 10 7.791 11.677 6.391 1.00 0.00 O ATOM 289 C5' DC A 10 8.510 10.542 5.932 1.00 0.00 C ATOM 290 C4' DC A 10 8.884 10.630 4.447 1.00 0.00 C ATOM 291 O4' DC A 10 7.671 10.470 3.744 1.00 0.00 O ATOM 292 C3' DC A 10 9.517 11.970 4.041 1.00 0.00 C ATOM 293 O3' DC A 10 10.835 11.761 3.552 1.00 0.00 O ATOM 294 C2' DC A 10 8.580 12.476 2.947 1.00 0.00 C ATOM 295 C1' DC A 10 7.670 11.316 2.617 1.00 0.00 C ATOM 296 N1 DC A 10 6.267 11.750 2.395 1.00 0.00 N ATOM 297 C2 DC A 10 5.742 11.729 1.103 1.00 0.00 C ATOM 298 O2 DC A 10 6.469 11.548 0.129 1.00 0.00 O ATOM 299 N3 DC A 10 4.398 11.913 0.940 1.00 0.00 N ATOM 300 C4 DC A 10 3.599 12.132 1.996 1.00 0.00 C ATOM 301 N4 DC A 10 2.284 12.283 1.803 1.00 0.00 N ATOM 302 C5 DC A 10 4.133 12.202 3.326 1.00 0.00 C ATOM 303 C6 DC A 10 5.461 12.021 3.471 1.00 0.00 C ATOM 0 H5' DC A 10 7.910 9.647 6.097 1.00 0.00 H new ATOM 0 H5'' DC A 10 9.418 10.430 6.524 1.00 0.00 H new ATOM 0 H4' DC A 10 9.633 9.870 4.224 1.00 0.00 H new ATOM 0 H3' DC A 10 9.618 12.679 4.862 1.00 0.00 H new ATOM 0 H2' DC A 10 8.007 13.337 3.290 1.00 0.00 H new ATOM 0 H2'' DC A 10 9.141 12.796 2.069 1.00 0.00 H new ATOM 0 H1' DC A 10 8.028 10.834 1.707 1.00 0.00 H new ATOM 0 H41 DC A 10 1.668 12.450 2.598 1.00 0.00 H new ATOM 0 H42 DC A 10 1.898 12.231 0.860 1.00 0.00 H new ATOM 0 H5 DC A 10 3.496 12.392 4.177 1.00 0.00 H new ATOM 0 H6 DC A 10 5.900 12.091 4.455 1.00 0.00 H new ATOM 315 P DC A 11 11.832 12.981 3.154 1.00 0.00 P ATOM 316 OP1 DC A 11 13.203 12.431 3.070 1.00 0.00 O ATOM 317 OP2 DC A 11 11.557 14.124 4.054 1.00 0.00 O ATOM 318 O5' DC A 11 11.379 13.384 1.653 1.00 0.00 O ATOM 319 C5' DC A 11 10.941 14.691 1.321 1.00 0.00 C ATOM 320 C4' DC A 11 10.384 14.691 -0.109 1.00 0.00 C ATOM 321 O4' DC A 11 9.217 13.895 -0.169 1.00 0.00 O ATOM 322 C3' DC A 11 10.010 16.081 -0.623 1.00 0.00 C ATOM 323 O3' DC A 11 11.110 16.723 -1.230 1.00 0.00 O ATOM 324 C2' DC A 11 8.944 15.726 -1.653 1.00 0.00 C ATOM 325 C1' DC A 11 8.305 14.443 -1.108 1.00 0.00 C ATOM 326 N1 DC A 11 7.036 14.725 -0.378 1.00 0.00 N ATOM 327 C2 DC A 11 5.827 14.614 -1.069 1.00 0.00 C ATOM 328 O2 DC A 11 5.798 14.318 -2.262 1.00 0.00 O ATOM 329 N3 DC A 11 4.666 14.844 -0.391 1.00 0.00 N ATOM 330 C4 DC A 11 4.674 15.176 0.909 1.00 0.00 C ATOM 331 N4 DC A 11 3.508 15.376 1.530 1.00 0.00 N ATOM 332 C5 DC A 11 5.904 15.313 1.635 1.00 0.00 C ATOM 333 C6 DC A 11 7.048 15.082 0.949 1.00 0.00 C ATOM 0 H5' DC A 11 11.769 15.396 1.401 1.00 0.00 H new ATOM 0 H5'' DC A 11 10.174 15.019 2.022 1.00 0.00 H new ATOM 0 H4' DC A 11 11.185 14.299 -0.736 1.00 0.00 H new ATOM 0 H3' DC A 11 9.683 16.773 0.152 1.00 0.00 H new ATOM 0 H2' DC A 11 8.209 16.524 -1.756 1.00 0.00 H new ATOM 0 H2'' DC A 11 9.381 15.566 -2.639 1.00 0.00 H new ATOM 0 HO3' DC A 11 10.837 17.608 -1.549 1.00 0.00 H new ATOM 0 H1' DC A 11 8.087 13.774 -1.940 1.00 0.00 H new ATOM 0 H41 DC A 11 3.493 15.629 2.518 1.00 0.00 H new ATOM 0 H42 DC A 11 2.633 15.276 1.016 1.00 0.00 H new ATOM 0 H5 DC A 11 5.917 15.587 2.679 1.00 0.00 H new ATOM 0 H6 DC A 11 7.995 15.181 1.458 1.00 0.00 H new TER 346 DC A 11 ATOM 347 O5' DG B 12 -5.173 14.826 -5.364 1.00 0.00 O ATOM 348 C5' DG B 12 -4.621 15.456 -6.501 1.00 0.00 C ATOM 349 C4' DG B 12 -3.217 14.914 -6.793 1.00 0.00 C ATOM 350 O4' DG B 12 -2.418 15.178 -5.653 1.00 0.00 O ATOM 351 C3' DG B 12 -3.212 13.396 -7.024 1.00 0.00 C ATOM 352 O3' DG B 12 -2.572 13.132 -8.261 1.00 0.00 O ATOM 353 C2' DG B 12 -2.412 12.880 -5.829 1.00 0.00 C ATOM 354 C1' DG B 12 -1.552 14.079 -5.477 1.00 0.00 C ATOM 355 N9 DG B 12 -1.110 14.075 -4.064 1.00 0.00 N ATOM 356 C8 DG B 12 -1.883 14.103 -2.931 1.00 0.00 C ATOM 357 N7 DG B 12 -1.205 14.187 -1.821 1.00 0.00 N ATOM 358 C5 DG B 12 0.118 14.212 -2.243 1.00 0.00 C ATOM 359 C6 DG B 12 1.319 14.309 -1.478 1.00 0.00 C ATOM 360 O6 DG B 12 1.433 14.391 -0.258 1.00 0.00 O ATOM 361 N1 DG B 12 2.459 14.301 -2.276 1.00 0.00 N ATOM 362 C2 DG B 12 2.448 14.193 -3.655 1.00 0.00 C ATOM 363 N2 DG B 12 3.633 14.161 -4.273 1.00 0.00 N ATOM 364 N3 DG B 12 1.318 14.105 -4.377 1.00 0.00 N ATOM 365 C4 DG B 12 0.190 14.124 -3.614 1.00 0.00 C ATOM 0 H5' DG B 12 -4.574 16.533 -6.339 1.00 0.00 H new ATOM 0 H5'' DG B 12 -5.267 15.291 -7.364 1.00 0.00 H new ATOM 0 H4' DG B 12 -2.844 15.395 -7.697 1.00 0.00 H new ATOM 0 H3' DG B 12 -4.194 12.927 -7.085 1.00 0.00 H new ATOM 0 H2' DG B 12 -3.059 12.586 -5.002 1.00 0.00 H new ATOM 0 H2'' DG B 12 -1.810 12.009 -6.088 1.00 0.00 H new ATOM 0 HO5' DG B 12 -4.451 14.533 -4.770 1.00 0.00 H new ATOM 0 H1' DG B 12 -0.650 14.093 -6.088 1.00 0.00 H new ATOM 0 H8 DG B 12 -2.962 14.059 -2.957 1.00 0.00 H new ATOM 0 H1 DG B 12 3.364 14.380 -1.813 1.00 0.00 H new ATOM 0 H21 DG B 12 3.676 14.082 -5.289 1.00 0.00 H new ATOM 0 H22 DG B 12 4.494 14.215 -3.728 1.00 0.00 H new ATOM 378 P DG B 13 -2.408 11.637 -8.856 1.00 0.00 P ATOM 379 OP1 DG B 13 -2.397 11.730 -10.333 1.00 0.00 O ATOM 380 OP2 DG B 13 -3.387 10.753 -8.184 1.00 0.00 O ATOM 381 O5' DG B 13 -0.931 11.212 -8.365 1.00 0.00 O ATOM 382 C5' DG B 13 0.223 11.852 -8.875 1.00 0.00 C ATOM 383 C4' DG B 13 1.511 11.221 -8.333 1.00 0.00 C ATOM 384 O4' DG B 13 1.576 11.453 -6.935 1.00 0.00 O ATOM 385 C3' DG B 13 1.561 9.705 -8.546 1.00 0.00 C ATOM 386 O3' DG B 13 2.927 9.406 -8.788 1.00 0.00 O ATOM 387 C2' DG B 13 1.066 9.180 -7.197 1.00 0.00 C ATOM 388 C1' DG B 13 1.665 10.210 -6.259 1.00 0.00 C ATOM 389 N9 DG B 13 1.051 10.405 -4.928 1.00 0.00 N ATOM 390 C8 DG B 13 -0.253 10.304 -4.516 1.00 0.00 C ATOM 391 N7 DG B 13 -0.431 10.558 -3.247 1.00 0.00 N ATOM 392 C5 DG B 13 0.848 10.840 -2.777 1.00 0.00 C ATOM 393 C6 DG B 13 1.310 11.140 -1.458 1.00 0.00 C ATOM 394 O6 DG B 13 0.647 11.291 -0.436 1.00 0.00 O ATOM 395 N1 DG B 13 2.698 11.266 -1.394 1.00 0.00 N ATOM 396 C2 DG B 13 3.540 11.172 -2.485 1.00 0.00 C ATOM 397 N2 DG B 13 4.847 11.330 -2.271 1.00 0.00 N ATOM 398 N3 DG B 13 3.105 10.925 -3.727 1.00 0.00 N ATOM 399 C4 DG B 13 1.757 10.759 -3.803 1.00 0.00 C ATOM 0 H5' DG B 13 0.198 12.910 -8.612 1.00 0.00 H new ATOM 0 H5'' DG B 13 0.220 11.794 -9.963 1.00 0.00 H new ATOM 0 H4' DG B 13 2.343 11.674 -8.872 1.00 0.00 H new ATOM 0 H3' DG B 13 0.977 9.285 -9.365 1.00 0.00 H new ATOM 0 H2' DG B 13 -0.022 9.150 -7.138 1.00 0.00 H new ATOM 0 H2'' DG B 13 1.424 8.172 -6.988 1.00 0.00 H new ATOM 0 H1' DG B 13 2.663 9.833 -6.036 1.00 0.00 H new ATOM 0 H8 DG B 13 -1.061 10.038 -5.181 1.00 0.00 H new ATOM 0 H1 DG B 13 3.119 11.439 -0.481 1.00 0.00 H new ATOM 0 H21 DG B 13 5.502 11.268 -3.050 1.00 0.00 H new ATOM 0 H22 DG B 13 5.191 11.513 -1.328 1.00 0.00 H new ATOM 411 P DC B 14 3.494 7.924 -9.093 1.00 0.00 P ATOM 412 OP1 DC B 14 4.213 7.961 -10.386 1.00 0.00 O ATOM 413 OP2 DC B 14 2.424 6.927 -8.872 1.00 0.00 O ATOM 414 O5' DC B 14 4.581 7.777 -7.909 1.00 0.00 O ATOM 415 C5' DC B 14 5.736 8.598 -7.879 1.00 0.00 C ATOM 416 C4' DC B 14 6.598 8.323 -6.642 1.00 0.00 C ATOM 417 O4' DC B 14 5.838 8.678 -5.497 1.00 0.00 O ATOM 418 C3' DC B 14 6.974 6.842 -6.518 1.00 0.00 C ATOM 419 O3' DC B 14 8.346 6.776 -6.170 1.00 0.00 O ATOM 420 C2' DC B 14 6.048 6.371 -5.398 1.00 0.00 C ATOM 421 C1' DC B 14 5.938 7.634 -4.546 1.00 0.00 C ATOM 422 N1 DC B 14 4.696 7.677 -3.721 1.00 0.00 N ATOM 423 C2 DC B 14 4.793 7.832 -2.333 1.00 0.00 C ATOM 424 O2 DC B 14 5.882 7.892 -1.769 1.00 0.00 O ATOM 425 N3 DC B 14 3.644 7.919 -1.598 1.00 0.00 N ATOM 426 C4 DC B 14 2.442 7.862 -2.190 1.00 0.00 C ATOM 427 N4 DC B 14 1.338 7.960 -1.443 1.00 0.00 N ATOM 428 C5 DC B 14 2.321 7.744 -3.612 1.00 0.00 C ATOM 429 C6 DC B 14 3.462 7.663 -4.330 1.00 0.00 C ATOM 0 H5' DC B 14 5.437 9.646 -7.888 1.00 0.00 H new ATOM 0 H5'' DC B 14 6.327 8.427 -8.779 1.00 0.00 H new ATOM 0 H4' DC B 14 7.518 8.902 -6.729 1.00 0.00 H new ATOM 0 H3' DC B 14 6.857 6.232 -7.414 1.00 0.00 H new ATOM 0 H2' DC B 14 5.079 6.045 -5.776 1.00 0.00 H new ATOM 0 H2'' DC B 14 6.470 5.535 -4.840 1.00 0.00 H new ATOM 0 H1' DC B 14 6.782 7.696 -3.859 1.00 0.00 H new ATOM 0 H41 DC B 14 0.419 7.918 -1.883 1.00 0.00 H new ATOM 0 H42 DC B 14 1.415 8.077 -0.433 1.00 0.00 H new ATOM 0 H5 DC B 14 1.354 7.721 -4.092 1.00 0.00 H new ATOM 0 H6 DC B 14 3.405 7.586 -5.406 1.00 0.00 H new ATOM 441 P DT B 15 9.137 5.379 -6.005 1.00 0.00 P ATOM 442 OP1 DT B 15 10.583 5.645 -6.174 1.00 0.00 O ATOM 443 OP2 DT B 15 8.474 4.357 -6.846 1.00 0.00 O ATOM 444 O5' DT B 15 8.867 5.013 -4.461 1.00 0.00 O ATOM 445 C5' DT B 15 9.449 5.765 -3.413 1.00 0.00 C ATOM 446 C4' DT B 15 9.002 5.229 -2.048 1.00 0.00 C ATOM 447 O4' DT B 15 7.633 5.519 -1.911 1.00 0.00 O ATOM 448 C3' DT B 15 9.136 3.708 -1.889 1.00 0.00 C ATOM 449 O3' DT B 15 10.279 3.451 -1.084 1.00 0.00 O ATOM 450 C2' DT B 15 7.813 3.290 -1.251 1.00 0.00 C ATOM 451 C1' DT B 15 7.115 4.611 -0.967 1.00 0.00 C ATOM 452 N1 DT B 15 5.670 4.538 -1.260 1.00 0.00 N ATOM 453 C2 DT B 15 4.771 4.960 -0.290 1.00 0.00 C ATOM 454 O2 DT B 15 5.111 5.302 0.839 1.00 0.00 O ATOM 455 N3 DT B 15 3.441 4.974 -0.667 1.00 0.00 N ATOM 456 C4 DT B 15 2.935 4.605 -1.902 1.00 0.00 C ATOM 457 O4 DT B 15 1.725 4.679 -2.103 1.00 0.00 O ATOM 458 C5 DT B 15 3.940 4.154 -2.852 1.00 0.00 C ATOM 459 C7 DT B 15 3.511 3.718 -4.239 1.00 0.00 C ATOM 460 C6 DT B 15 5.253 4.133 -2.503 1.00 0.00 C ATOM 0 H5' DT B 15 9.164 6.813 -3.509 1.00 0.00 H new ATOM 0 H5'' DT B 15 10.536 5.722 -3.488 1.00 0.00 H new ATOM 0 H4' DT B 15 9.645 5.699 -1.303 1.00 0.00 H new ATOM 0 H3' DT B 15 9.292 3.147 -2.810 1.00 0.00 H new ATOM 0 H2' DT B 15 7.226 2.663 -1.922 1.00 0.00 H new ATOM 0 H2'' DT B 15 7.973 2.717 -0.338 1.00 0.00 H new ATOM 0 H1' DT B 15 7.266 4.882 0.078 1.00 0.00 H new ATOM 0 H3 DT B 15 2.767 5.286 0.032 1.00 0.00 H new ATOM 0 H71 DT B 15 4.312 3.923 -4.949 1.00 0.00 H new ATOM 0 H72 DT B 15 3.295 2.650 -4.234 1.00 0.00 H new ATOM 0 H73 DT B 15 2.617 4.268 -4.533 1.00 0.00 H new ATOM 0 H6 DT B 15 5.985 3.790 -3.220 1.00 0.00 H new ATOM 473 P DA B 16 10.723 1.970 -0.612 1.00 0.00 P ATOM 474 OP1 DA B 16 12.126 2.038 -0.147 1.00 0.00 O ATOM 475 OP2 DA B 16 10.347 1.010 -1.673 1.00 0.00 O ATOM 476 O5' DA B 16 9.784 1.693 0.672 1.00 0.00 O ATOM 477 C5' DA B 16 9.943 2.394 1.896 1.00 0.00 C ATOM 478 C4' DA B 16 8.766 2.124 2.851 1.00 0.00 C ATOM 479 O4' DA B 16 7.577 2.598 2.265 1.00 0.00 O ATOM 480 C3' DA B 16 8.489 0.659 3.129 1.00 0.00 C ATOM 481 O3' DA B 16 9.043 0.210 4.357 1.00 0.00 O ATOM 482 C2' DA B 16 7.020 0.406 2.904 1.00 0.00 C ATOM 483 C1' DA B 16 6.550 1.821 2.843 1.00 0.00 C ATOM 484 N9 DA B 16 5.351 1.928 2.008 1.00 0.00 N ATOM 485 C8 DA B 16 5.321 1.616 0.689 1.00 0.00 C ATOM 486 N7 DA B 16 4.167 1.813 0.112 1.00 0.00 N ATOM 487 C5 DA B 16 3.352 2.224 1.168 1.00 0.00 C ATOM 488 C6 DA B 16 1.983 2.561 1.258 1.00 0.00 C ATOM 489 N6 DA B 16 1.188 2.690 0.189 1.00 0.00 N ATOM 490 N1 DA B 16 1.453 2.762 2.481 1.00 0.00 N ATOM 491 C2 DA B 16 2.244 2.683 3.551 1.00 0.00 C ATOM 492 N3 DA B 16 3.552 2.443 3.595 1.00 0.00 N ATOM 493 C4 DA B 16 4.054 2.219 2.351 1.00 0.00 C ATOM 0 H5' DA B 16 10.016 3.463 1.698 1.00 0.00 H new ATOM 0 H5'' DA B 16 10.877 2.093 2.371 1.00 0.00 H new ATOM 0 H4' DA B 16 9.052 2.618 3.780 1.00 0.00 H new ATOM 0 H3' DA B 16 9.021 0.021 2.424 1.00 0.00 H new ATOM 0 H2' DA B 16 6.823 -0.144 1.984 1.00 0.00 H new ATOM 0 H2'' DA B 16 6.560 -0.157 3.716 1.00 0.00 H new ATOM 0 H1' DA B 16 6.310 2.169 3.848 1.00 0.00 H new ATOM 0 H8 DA B 16 6.182 1.236 0.159 1.00 0.00 H new ATOM 0 H61 DA B 16 0.205 2.935 0.311 1.00 0.00 H new ATOM 0 H62 DA B 16 1.565 2.543 -0.747 1.00 0.00 H new ATOM 0 H2 DA B 16 1.761 2.833 4.505 1.00 0.00 H new HETATM 505 N1 T41 B 17 3.334 -0.995 4.109 1.00 0.00 N HETATM 506 C2 T41 B 17 2.033 -0.582 3.829 1.00 0.00 C HETATM 507 N3 T41 B 17 1.670 -0.571 2.491 1.00 0.00 N HETATM 508 C4 T41 B 17 2.467 -0.930 1.418 1.00 0.00 C HETATM 509 C5 T41 B 17 3.793 -1.371 1.797 1.00 0.00 C HETATM 510 C5M T41 B 17 4.770 -1.843 0.749 1.00 0.00 C HETATM 511 C6 T41 B 17 4.169 -1.383 3.093 1.00 0.00 C HETATM 512 O2 T41 B 17 1.228 -0.242 4.693 1.00 0.00 O HETATM 513 O4 T41 B 17 2.033 -0.859 0.271 1.00 0.00 O HETATM 514 C1' T41 B 17 3.798 -0.967 5.522 1.00 0.00 C HETATM 515 C2' T41 B 17 4.261 -2.252 6.133 1.00 0.00 C HETATM 516 O2' T41 B 17 5.121 -2.975 5.303 1.00 0.00 O HETATM 517 C3' T41 B 17 5.050 -1.786 7.347 1.00 0.00 C HETATM 518 C4' T41 B 17 5.554 -0.408 6.891 1.00 0.00 C HETATM 519 O3' T41 B 17 4.244 -1.584 8.500 1.00 0.00 O HETATM 520 O4' T41 B 17 4.858 -0.051 5.704 1.00 0.00 O HETATM 521 C5' T41 B 17 7.055 -0.374 6.579 1.00 0.00 C HETATM 522 O5' T41 B 17 7.410 -1.309 5.577 1.00 0.00 O HETATM 523 C6' T41 B 17 4.707 -4.298 5.368 1.00 0.00 C HETATM 524 P T41 B 17 8.880 -1.306 4.906 1.00 0.00 P HETATM 525 O1P T41 B 17 9.872 -1.510 5.985 1.00 0.00 O HETATM 526 O2P T41 B 17 8.856 -2.225 3.746 1.00 0.00 O HETATM 0 H5M3 T41 B 17 4.353 -2.701 0.223 1.00 0.00 H new HETATM 0 H5M2 T41 B 17 4.958 -1.038 0.038 1.00 0.00 H new HETATM 0 H5M1 T41 B 17 5.706 -2.131 1.228 1.00 0.00 H new HETATM 0 H5'2 T41 B 17 7.335 0.628 6.255 1.00 0.00 H new HETATM 0 H5'1 T41 B 17 7.619 -0.585 7.488 1.00 0.00 H new HETATM 0 H2'1 T41 B 17 3.419 -2.913 6.341 1.00 0.00 H new HETATM 0 H6 T41 B 17 5.177 -1.714 3.342 1.00 0.00 H new HETATM 0 H4' T41 B 17 5.375 0.284 7.714 1.00 0.00 H new HETATM 0 H3' T41 B 17 5.807 -2.518 7.630 1.00 0.00 H new HETATM 0 H3 T41 B 17 0.720 -0.268 2.276 1.00 0.00 H new HETATM 0 H13 T41 B 17 4.772 -4.649 6.398 1.00 0.00 H new HETATM 0 H12 T41 B 17 3.676 -4.374 5.023 1.00 0.00 H new HETATM 0 H11 T41 B 17 5.348 -4.911 4.735 1.00 0.00 H new HETATM 0 H1' T41 B 17 2.876 -0.684 6.031 1.00 0.00 H new ATOM 541 P DA B 18 3.573 -2.793 9.336 1.00 0.00 P ATOM 542 OP1 DA B 18 3.521 -2.389 10.758 1.00 0.00 O ATOM 543 OP2 DA B 18 4.244 -4.057 8.960 1.00 0.00 O ATOM 544 O5' DA B 18 2.063 -2.839 8.769 1.00 0.00 O ATOM 545 C5' DA B 18 1.086 -1.889 9.166 1.00 0.00 C ATOM 546 C4' DA B 18 -0.267 -2.252 8.544 1.00 0.00 C ATOM 547 O4' DA B 18 -0.135 -2.146 7.147 1.00 0.00 O ATOM 548 C3' DA B 18 -0.691 -3.689 8.874 1.00 0.00 C ATOM 549 O3' DA B 18 -1.914 -3.632 9.591 1.00 0.00 O ATOM 550 C2' DA B 18 -0.822 -4.305 7.482 1.00 0.00 C ATOM 551 C1' DA B 18 -1.008 -3.100 6.596 1.00 0.00 C ATOM 552 N9 DA B 18 -0.552 -3.302 5.206 1.00 0.00 N ATOM 553 C8 DA B 18 0.725 -3.601 4.804 1.00 0.00 C ATOM 554 N7 DA B 18 0.904 -3.588 3.515 1.00 0.00 N ATOM 555 C5 DA B 18 -0.349 -3.245 3.024 1.00 0.00 C ATOM 556 C6 DA B 18 -0.823 -3.017 1.720 1.00 0.00 C ATOM 557 N6 DA B 18 -0.055 -3.059 0.626 1.00 0.00 N ATOM 558 N1 DA B 18 -2.108 -2.672 1.572 1.00 0.00 N ATOM 559 C2 DA B 18 -2.906 -2.553 2.624 1.00 0.00 C ATOM 560 N3 DA B 18 -2.576 -2.732 3.906 1.00 0.00 N ATOM 561 C4 DA B 18 -1.260 -3.083 4.043 1.00 0.00 C ATOM 0 H5' DA B 18 1.386 -0.890 8.850 1.00 0.00 H new ATOM 0 H5'' DA B 18 1.004 -1.869 10.253 1.00 0.00 H new ATOM 0 H4' DA B 18 -1.023 -1.577 8.946 1.00 0.00 H new ATOM 0 H3' DA B 18 -0.013 -4.268 9.501 1.00 0.00 H new ATOM 0 H2' DA B 18 0.066 -4.875 7.207 1.00 0.00 H new ATOM 0 H2'' DA B 18 -1.670 -4.987 7.420 1.00 0.00 H new ATOM 0 H1' DA B 18 -2.066 -2.841 6.557 1.00 0.00 H new ATOM 0 H8 DA B 18 1.518 -3.829 5.501 1.00 0.00 H new ATOM 0 H61 DA B 18 -0.464 -2.883 -0.292 1.00 0.00 H new ATOM 0 H62 DA B 18 0.940 -3.267 0.709 1.00 0.00 H new ATOM 0 H2 DA B 18 -3.932 -2.283 2.423 1.00 0.00 H new ATOM 573 P DT B 19 -2.755 -4.948 10.005 1.00 0.00 P ATOM 574 OP1 DT B 19 -3.552 -4.629 11.210 1.00 0.00 O ATOM 575 OP2 DT B 19 -1.844 -6.114 10.009 1.00 0.00 O ATOM 576 O5' DT B 19 -3.765 -5.097 8.756 1.00 0.00 O ATOM 577 C5' DT B 19 -4.719 -4.093 8.464 1.00 0.00 C ATOM 578 C4' DT B 19 -5.541 -4.465 7.227 1.00 0.00 C ATOM 579 O4' DT B 19 -4.668 -4.407 6.112 1.00 0.00 O ATOM 580 C3' DT B 19 -6.112 -5.891 7.308 1.00 0.00 C ATOM 581 O3' DT B 19 -7.505 -5.848 7.038 1.00 0.00 O ATOM 582 C2' DT B 19 -5.336 -6.625 6.215 1.00 0.00 C ATOM 583 C1' DT B 19 -4.979 -5.499 5.275 1.00 0.00 C ATOM 584 N1 DT B 19 -3.864 -5.771 4.347 1.00 0.00 N ATOM 585 C2 DT B 19 -4.022 -5.641 2.970 1.00 0.00 C ATOM 586 O2 DT B 19 -5.082 -5.331 2.432 1.00 0.00 O ATOM 587 N3 DT B 19 -2.884 -5.888 2.214 1.00 0.00 N ATOM 588 C4 DT B 19 -1.638 -6.260 2.700 1.00 0.00 C ATOM 589 O4 DT B 19 -0.701 -6.429 1.923 1.00 0.00 O ATOM 590 C5 DT B 19 -1.582 -6.411 4.143 1.00 0.00 C ATOM 591 C7 DT B 19 -0.301 -6.880 4.802 1.00 0.00 C ATOM 592 C6 DT B 19 -2.684 -6.150 4.890 1.00 0.00 C ATOM 0 H5' DT B 19 -4.213 -3.142 8.297 1.00 0.00 H new ATOM 0 H5'' DT B 19 -5.382 -3.956 9.318 1.00 0.00 H new ATOM 0 H4' DT B 19 -6.380 -3.774 7.148 1.00 0.00 H new ATOM 0 H3' DT B 19 -6.008 -6.375 8.279 1.00 0.00 H new ATOM 0 H2' DT B 19 -4.451 -7.125 6.608 1.00 0.00 H new ATOM 0 H2'' DT B 19 -5.942 -7.388 5.726 1.00 0.00 H new ATOM 0 H1' DT B 19 -5.821 -5.321 4.606 1.00 0.00 H new ATOM 0 H3 DT B 19 -2.972 -5.786 1.203 1.00 0.00 H new ATOM 0 H71 DT B 19 -0.229 -6.454 5.803 1.00 0.00 H new ATOM 0 H72 DT B 19 -0.304 -7.968 4.870 1.00 0.00 H new ATOM 0 H73 DT B 19 0.554 -6.556 4.208 1.00 0.00 H new ATOM 0 H6 DT B 19 -2.617 -6.249 5.963 1.00 0.00 H new ATOM 605 P DG B 20 -8.434 -7.173 7.057 1.00 0.00 P ATOM 606 OP1 DG B 20 -9.792 -6.775 7.492 1.00 0.00 O ATOM 607 OP2 DG B 20 -7.717 -8.244 7.785 1.00 0.00 O ATOM 608 O5' DG B 20 -8.505 -7.591 5.498 1.00 0.00 O ATOM 609 C5' DG B 20 -9.232 -6.816 4.563 1.00 0.00 C ATOM 610 C4' DG B 20 -9.272 -7.481 3.182 1.00 0.00 C ATOM 611 O4' DG B 20 -7.980 -7.423 2.600 1.00 0.00 O ATOM 612 C3' DG B 20 -9.668 -8.962 3.250 1.00 0.00 C ATOM 613 O3' DG B 20 -10.592 -9.162 2.192 1.00 0.00 O ATOM 614 C2' DG B 20 -8.322 -9.660 3.050 1.00 0.00 C ATOM 615 C1' DG B 20 -7.675 -8.699 2.068 1.00 0.00 C ATOM 616 N9 DG B 20 -6.206 -8.779 1.967 1.00 0.00 N ATOM 617 C8 DG B 20 -5.300 -8.967 2.970 1.00 0.00 C ATOM 618 N7 DG B 20 -4.055 -8.938 2.585 1.00 0.00 N ATOM 619 C5 DG B 20 -4.142 -8.733 1.210 1.00 0.00 C ATOM 620 C6 DG B 20 -3.114 -8.666 0.220 1.00 0.00 C ATOM 621 O6 DG B 20 -1.900 -8.667 0.394 1.00 0.00 O ATOM 622 N1 DG B 20 -3.622 -8.595 -1.076 1.00 0.00 N ATOM 623 C2 DG B 20 -4.970 -8.547 -1.381 1.00 0.00 C ATOM 624 N2 DG B 20 -5.310 -8.502 -2.672 1.00 0.00 N ATOM 625 N3 DG B 20 -5.935 -8.555 -0.450 1.00 0.00 N ATOM 626 C4 DG B 20 -5.458 -8.659 0.820 1.00 0.00 C ATOM 0 H5' DG B 20 -8.778 -5.829 4.478 1.00 0.00 H new ATOM 0 H5'' DG B 20 -10.249 -6.669 4.925 1.00 0.00 H new ATOM 0 H4' DG B 20 -10.017 -6.943 2.596 1.00 0.00 H new ATOM 0 H3' DG B 20 -10.149 -9.325 4.159 1.00 0.00 H new ATOM 0 H2' DG B 20 -7.757 -9.752 3.978 1.00 0.00 H new ATOM 0 H2'' DG B 20 -8.429 -10.665 2.642 1.00 0.00 H new ATOM 0 H1' DG B 20 -8.047 -8.924 1.068 1.00 0.00 H new ATOM 0 H8 DG B 20 -5.591 -9.127 3.998 1.00 0.00 H new ATOM 0 H1 DG B 20 -2.957 -8.577 -1.849 1.00 0.00 H new ATOM 0 H21 DG B 20 -6.294 -8.466 -2.939 1.00 0.00 H new ATOM 0 H22 DG B 20 -4.586 -8.504 -3.390 1.00 0.00 H new ATOM 638 P DC B 21 -11.172 -10.603 1.748 1.00 0.00 P ATOM 639 OP1 DC B 21 -12.612 -10.447 1.447 1.00 0.00 O ATOM 640 OP2 DC B 21 -10.729 -11.633 2.714 1.00 0.00 O ATOM 641 O5' DC B 21 -10.385 -10.825 0.357 1.00 0.00 O ATOM 642 C5' DC B 21 -10.542 -9.911 -0.715 1.00 0.00 C ATOM 643 C4' DC B 21 -9.838 -10.386 -1.992 1.00 0.00 C ATOM 644 O4' DC B 21 -8.443 -10.311 -1.752 1.00 0.00 O ATOM 645 C3' DC B 21 -10.181 -11.840 -2.341 1.00 0.00 C ATOM 646 O3' DC B 21 -10.360 -11.931 -3.745 1.00 0.00 O ATOM 647 C2' DC B 21 -8.935 -12.578 -1.857 1.00 0.00 C ATOM 648 C1' DC B 21 -7.850 -11.538 -2.128 1.00 0.00 C ATOM 649 N1 DC B 21 -6.658 -11.717 -1.257 1.00 0.00 N ATOM 650 C2 DC B 21 -5.385 -11.764 -1.831 1.00 0.00 C ATOM 651 O2 DC B 21 -5.229 -11.740 -3.049 1.00 0.00 O ATOM 652 N3 DC B 21 -4.300 -11.839 -1.006 1.00 0.00 N ATOM 653 C4 DC B 21 -4.444 -11.873 0.326 1.00 0.00 C ATOM 654 N4 DC B 21 -3.350 -11.919 1.091 1.00 0.00 N ATOM 655 C5 DC B 21 -5.740 -11.791 0.936 1.00 0.00 C ATOM 656 C6 DC B 21 -6.805 -11.715 0.108 1.00 0.00 C ATOM 0 H5' DC B 21 -10.143 -8.940 -0.423 1.00 0.00 H new ATOM 0 H5'' DC B 21 -11.604 -9.772 -0.918 1.00 0.00 H new ATOM 0 H4' DC B 21 -10.161 -9.759 -2.823 1.00 0.00 H new ATOM 0 H3' DC B 21 -11.093 -12.239 -1.896 1.00 0.00 H new ATOM 0 H2' DC B 21 -8.997 -12.842 -0.801 1.00 0.00 H new ATOM 0 H2'' DC B 21 -8.765 -13.503 -2.408 1.00 0.00 H new ATOM 0 H1' DC B 21 -7.519 -11.605 -3.164 1.00 0.00 H new ATOM 0 H41 DC B 21 -3.439 -11.945 2.107 1.00 0.00 H new ATOM 0 H42 DC B 21 -2.426 -11.928 0.659 1.00 0.00 H new ATOM 0 H5 DC B 21 -5.859 -11.790 2.009 1.00 0.00 H new ATOM 0 H6 DC B 21 -7.797 -11.651 0.531 1.00 0.00 H new ATOM 668 P DG B 22 -10.726 -13.319 -4.489 1.00 0.00 P ATOM 669 OP1 DG B 22 -11.518 -13.001 -5.698 1.00 0.00 O ATOM 670 OP2 DG B 22 -11.261 -14.270 -3.489 1.00 0.00 O ATOM 671 O5' DG B 22 -9.278 -13.851 -4.962 1.00 0.00 O ATOM 672 C5' DG B 22 -8.581 -13.223 -6.021 1.00 0.00 C ATOM 673 C4' DG B 22 -7.225 -13.896 -6.251 1.00 0.00 C ATOM 674 O4' DG B 22 -6.446 -13.717 -5.082 1.00 0.00 O ATOM 675 C3' DG B 22 -7.343 -15.410 -6.484 1.00 0.00 C ATOM 676 O3' DG B 22 -6.730 -15.764 -7.707 1.00 0.00 O ATOM 677 C2' DG B 22 -6.564 -16.008 -5.320 1.00 0.00 C ATOM 678 C1' DG B 22 -5.637 -14.865 -4.954 1.00 0.00 C ATOM 679 N9 DG B 22 -5.108 -14.925 -3.574 1.00 0.00 N ATOM 680 C8 DG B 22 -5.787 -15.045 -2.387 1.00 0.00 C ATOM 681 N7 DG B 22 -5.026 -14.991 -1.329 1.00 0.00 N ATOM 682 C5 DG B 22 -3.745 -14.829 -1.846 1.00 0.00 C ATOM 683 C6 DG B 22 -2.492 -14.674 -1.177 1.00 0.00 C ATOM 684 O6 DG B 22 -2.277 -14.637 0.031 1.00 0.00 O ATOM 685 N1 DG B 22 -1.425 -14.555 -2.065 1.00 0.00 N ATOM 686 C2 DG B 22 -1.550 -14.578 -3.442 1.00 0.00 C ATOM 687 N2 DG B 22 -0.434 -14.445 -4.164 1.00 0.00 N ATOM 688 N3 DG B 22 -2.730 -14.692 -4.071 1.00 0.00 N ATOM 689 C4 DG B 22 -3.784 -14.810 -3.220 1.00 0.00 C ATOM 0 H5' DG B 22 -8.434 -12.168 -5.791 1.00 0.00 H new ATOM 0 H5'' DG B 22 -9.176 -13.271 -6.933 1.00 0.00 H new ATOM 0 H4' DG B 22 -6.781 -13.444 -7.138 1.00 0.00 H new ATOM 0 H3' DG B 22 -8.375 -15.756 -6.535 1.00 0.00 H new ATOM 0 H2' DG B 22 -7.215 -16.288 -4.492 1.00 0.00 H new ATOM 0 H2'' DG B 22 -6.015 -16.904 -5.611 1.00 0.00 H new ATOM 0 HO3' DG B 22 -6.809 -16.731 -7.845 1.00 0.00 H new ATOM 0 H1' DG B 22 -4.755 -14.886 -5.594 1.00 0.00 H new ATOM 0 H8 DG B 22 -6.858 -15.173 -2.334 1.00 0.00 H new ATOM 0 H1 DG B 22 -0.490 -14.444 -1.673 1.00 0.00 H new ATOM 0 H21 DG B 22 -0.481 -14.456 -5.183 1.00 0.00 H new ATOM 0 H22 DG B 22 0.465 -14.332 -3.696 1.00 0.00 H new TER 702 DG B 22