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= -1.3 (180deg=-1.3) USER MOD Single : A 7 DT C7 :methyl -30:sc= -0.602 (180deg=-0.999) USER MOD Single : A 11 DC O3' : rot 180:sc= 0 USER MOD Single : B 12 DG O5' : rot 180:sc= 0 USER MOD Single : B 15 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 19 DT C7 :methyl 150:sc= -0.308 (180deg=-0.308) USER MOD Single : B 22 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 9.273 -14.987 -1.317 1.00 0.00 O ATOM 2 C5' DC A 1 7.922 -14.994 -0.908 1.00 0.00 C ATOM 3 C4' DC A 1 6.997 -14.812 -2.116 1.00 0.00 C ATOM 4 O4' DC A 1 5.671 -14.994 -1.646 1.00 0.00 O ATOM 5 C3' DC A 1 7.084 -13.391 -2.694 1.00 0.00 C ATOM 6 O3' DC A 1 7.176 -13.482 -4.106 1.00 0.00 O ATOM 7 C2' DC A 1 5.767 -12.769 -2.236 1.00 0.00 C ATOM 8 C1' DC A 1 4.859 -13.994 -2.229 1.00 0.00 C ATOM 9 N1 DC A 1 3.648 -13.817 -1.379 1.00 0.00 N ATOM 10 C2 DC A 1 2.388 -13.843 -1.982 1.00 0.00 C ATOM 11 O2 DC A 1 2.266 -13.942 -3.201 1.00 0.00 O ATOM 12 N3 DC A 1 1.281 -13.756 -1.188 1.00 0.00 N ATOM 13 C4 DC A 1 1.391 -13.604 0.140 1.00 0.00 C ATOM 14 N4 DC A 1 0.277 -13.526 0.874 1.00 0.00 N ATOM 15 C5 DC A 1 2.675 -13.548 0.780 1.00 0.00 C ATOM 16 C6 DC A 1 3.764 -13.662 -0.017 1.00 0.00 C ATOM 0 H5' DC A 1 7.750 -14.195 -0.187 1.00 0.00 H new ATOM 0 H5'' DC A 1 7.693 -15.933 -0.405 1.00 0.00 H new ATOM 0 H4' DC A 1 7.284 -15.520 -2.893 1.00 0.00 H new ATOM 0 H3' DC A 1 7.945 -12.805 -2.372 1.00 0.00 H new ATOM 0 H2' DC A 1 5.848 -12.309 -1.251 1.00 0.00 H new ATOM 0 H2'' DC A 1 5.414 -11.997 -2.920 1.00 0.00 H new ATOM 0 HO5' DC A 1 9.852 -15.102 -0.535 1.00 0.00 H new ATOM 0 H1' DC A 1 4.493 -14.214 -3.232 1.00 0.00 H new ATOM 0 H41 DC A 1 0.340 -13.410 1.885 1.00 0.00 H new ATOM 0 H42 DC A 1 -0.636 -13.582 0.423 1.00 0.00 H new ATOM 0 H5 DC A 1 2.768 -13.421 1.848 1.00 0.00 H new ATOM 0 H6 DC A 1 4.748 -13.630 0.428 1.00 0.00 H new ATOM 29 P DG A 2 7.401 -12.185 -5.043 1.00 0.00 P ATOM 30 OP1 DG A 2 8.173 -12.609 -6.231 1.00 0.00 O ATOM 31 OP2 DG A 2 7.908 -11.081 -4.197 1.00 0.00 O ATOM 32 O5' DG A 2 5.907 -11.801 -5.517 1.00 0.00 O ATOM 33 C5' DG A 2 5.237 -12.539 -6.523 1.00 0.00 C ATOM 34 C4' DG A 2 3.902 -11.878 -6.888 1.00 0.00 C ATOM 35 O4' DG A 2 3.018 -12.017 -5.787 1.00 0.00 O ATOM 36 C3' DG A 2 4.057 -10.376 -7.176 1.00 0.00 C ATOM 37 O3' DG A 2 3.273 -10.103 -8.327 1.00 0.00 O ATOM 38 C2' DG A 2 3.485 -9.775 -5.893 1.00 0.00 C ATOM 39 C1' DG A 2 2.403 -10.763 -5.582 1.00 0.00 C ATOM 40 N9 DG A 2 1.843 -10.716 -4.218 1.00 0.00 N ATOM 41 C8 DG A 2 2.485 -10.482 -3.032 1.00 0.00 C ATOM 42 N7 DG A 2 1.728 -10.616 -1.980 1.00 0.00 N ATOM 43 C5 DG A 2 0.479 -10.931 -2.508 1.00 0.00 C ATOM 44 C6 DG A 2 -0.769 -11.163 -1.854 1.00 0.00 C ATOM 45 O6 DG A 2 -0.985 -11.247 -0.649 1.00 0.00 O ATOM 46 N1 DG A 2 -1.825 -11.303 -2.751 1.00 0.00 N ATOM 47 C2 DG A 2 -1.689 -11.268 -4.127 1.00 0.00 C ATOM 48 N2 DG A 2 -2.798 -11.407 -4.860 1.00 0.00 N ATOM 49 N3 DG A 2 -0.509 -11.106 -4.744 1.00 0.00 N ATOM 50 C4 DG A 2 0.530 -10.938 -3.882 1.00 0.00 C ATOM 0 H5' DG A 2 5.061 -13.557 -6.176 1.00 0.00 H new ATOM 0 H5'' DG A 2 5.867 -12.609 -7.409 1.00 0.00 H new ATOM 0 H4' DG A 2 3.523 -12.365 -7.787 1.00 0.00 H new ATOM 0 H3' DG A 2 5.057 -9.995 -7.386 1.00 0.00 H new ATOM 0 H2' DG A 2 4.228 -9.712 -5.098 1.00 0.00 H new ATOM 0 H2'' DG A 2 3.095 -8.769 -6.045 1.00 0.00 H new ATOM 0 H1' DG A 2 1.542 -10.545 -6.214 1.00 0.00 H new ATOM 0 H8 DG A 2 3.529 -10.210 -2.973 1.00 0.00 H new ATOM 0 H1 DG A 2 -2.760 -11.440 -2.368 1.00 0.00 H new ATOM 0 H21 DG A 2 -2.742 -11.387 -5.878 1.00 0.00 H new ATOM 0 H22 DG A 2 -3.700 -11.533 -4.401 1.00 0.00 H new ATOM 62 P DC A 3 3.032 -8.622 -8.925 1.00 0.00 P ATOM 63 OP1 DC A 3 3.251 -8.675 -10.388 1.00 0.00 O ATOM 64 OP2 DC A 3 3.770 -7.635 -8.106 1.00 0.00 O ATOM 65 O5' DC A 3 1.451 -8.431 -8.656 1.00 0.00 O ATOM 66 C5' DC A 3 0.501 -9.272 -9.287 1.00 0.00 C ATOM 67 C4' DC A 3 -0.939 -8.835 -8.993 1.00 0.00 C ATOM 68 O4' DC A 3 -1.175 -8.990 -7.603 1.00 0.00 O ATOM 69 C3' DC A 3 -1.173 -7.365 -9.348 1.00 0.00 C ATOM 70 O3' DC A 3 -2.462 -7.275 -9.938 1.00 0.00 O ATOM 71 C2' DC A 3 -1.099 -6.689 -7.981 1.00 0.00 C ATOM 72 C1' DC A 3 -1.682 -7.775 -7.075 1.00 0.00 C ATOM 73 N1 DC A 3 -1.221 -7.739 -5.658 1.00 0.00 N ATOM 74 C2 DC A 3 -2.136 -8.028 -4.640 1.00 0.00 C ATOM 75 O2 DC A 3 -3.319 -8.245 -4.888 1.00 0.00 O ATOM 76 N3 DC A 3 -1.692 -8.067 -3.349 1.00 0.00 N ATOM 77 C4 DC A 3 -0.402 -7.846 -3.058 1.00 0.00 C ATOM 78 N4 DC A 3 -0.011 -7.890 -1.781 1.00 0.00 N ATOM 79 C5 DC A 3 0.567 -7.619 -4.090 1.00 0.00 C ATOM 80 C6 DC A 3 0.111 -7.576 -5.363 1.00 0.00 C ATOM 0 H5' DC A 3 0.644 -10.298 -8.949 1.00 0.00 H new ATOM 0 H5'' DC A 3 0.669 -9.265 -10.364 1.00 0.00 H new ATOM 0 H4' DC A 3 -1.610 -9.448 -9.595 1.00 0.00 H new ATOM 0 H3' DC A 3 -0.474 -6.915 -10.053 1.00 0.00 H new ATOM 0 H2' DC A 3 -0.077 -6.430 -7.706 1.00 0.00 H new ATOM 0 H2'' DC A 3 -1.682 -5.768 -7.946 1.00 0.00 H new ATOM 0 H1' DC A 3 -2.765 -7.648 -7.061 1.00 0.00 H new ATOM 0 H41 DC A 3 0.966 -7.724 -1.541 1.00 0.00 H new ATOM 0 H42 DC A 3 -0.690 -8.089 -1.046 1.00 0.00 H new ATOM 0 H5 DC A 3 1.614 -7.488 -3.861 1.00 0.00 H new ATOM 0 H6 DC A 3 0.812 -7.409 -6.168 1.00 0.00 H new ATOM 92 P DA A 4 -3.115 -5.877 -10.415 1.00 0.00 P ATOM 93 OP1 DA A 4 -4.071 -6.163 -11.509 1.00 0.00 O ATOM 94 OP2 DA A 4 -2.029 -4.894 -10.626 1.00 0.00 O ATOM 95 O5' DA A 4 -3.956 -5.432 -9.111 1.00 0.00 O ATOM 96 C5' DA A 4 -5.161 -6.083 -8.759 1.00 0.00 C ATOM 97 C4' DA A 4 -5.724 -5.496 -7.464 1.00 0.00 C ATOM 98 O4' DA A 4 -4.964 -5.892 -6.347 1.00 0.00 O ATOM 99 C3' DA A 4 -5.903 -3.977 -7.471 1.00 0.00 C ATOM 100 O3' DA A 4 -7.274 -3.629 -7.307 1.00 0.00 O ATOM 101 C2' DA A 4 -5.072 -3.687 -6.264 1.00 0.00 C ATOM 102 C1' DA A 4 -5.197 -4.896 -5.382 1.00 0.00 C ATOM 103 N9 DA A 4 -4.095 -4.975 -4.427 1.00 0.00 N ATOM 104 C8 DA A 4 -2.785 -4.895 -4.758 1.00 0.00 C ATOM 105 N7 DA A 4 -1.962 -4.974 -3.751 1.00 0.00 N ATOM 106 C5 DA A 4 -2.818 -5.138 -2.664 1.00 0.00 C ATOM 107 C6 DA A 4 -2.597 -5.303 -1.282 1.00 0.00 C ATOM 108 N6 DA A 4 -1.373 -5.355 -0.747 1.00 0.00 N ATOM 109 N1 DA A 4 -3.666 -5.418 -0.473 1.00 0.00 N ATOM 110 C2 DA A 4 -4.889 -5.383 -0.997 1.00 0.00 C ATOM 111 N3 DA A 4 -5.231 -5.250 -2.275 1.00 0.00 N ATOM 112 C4 DA A 4 -4.132 -5.134 -3.067 1.00 0.00 C ATOM 0 H5' DA A 4 -4.982 -7.151 -8.634 1.00 0.00 H new ATOM 0 H5'' DA A 4 -5.889 -5.974 -9.562 1.00 0.00 H new ATOM 0 H4' DA A 4 -6.729 -5.913 -7.390 1.00 0.00 H new ATOM 0 H3' DA A 4 -5.621 -3.437 -8.375 1.00 0.00 H new ATOM 0 H2' DA A 4 -4.032 -3.509 -6.539 1.00 0.00 H new ATOM 0 H2'' DA A 4 -5.424 -2.791 -5.752 1.00 0.00 H new ATOM 0 H1' DA A 4 -6.124 -4.935 -4.810 1.00 0.00 H new ATOM 0 H8 DA A 4 -2.448 -4.775 -5.777 1.00 0.00 H new ATOM 0 H61 DA A 4 -1.261 -5.476 0.260 1.00 0.00 H new ATOM 0 H62 DA A 4 -0.551 -5.274 -1.345 1.00 0.00 H new ATOM 0 H2 DA A 4 -5.706 -5.474 -0.296 1.00 0.00 H new ATOM 124 P DT A 5 -7.780 -2.102 -7.080 1.00 0.00 P ATOM 125 OP1 DT A 5 -9.161 -1.998 -7.600 1.00 0.00 O ATOM 126 OP2 DT A 5 -6.736 -1.184 -7.589 1.00 0.00 O ATOM 127 O5' DT A 5 -7.837 -1.947 -5.467 1.00 0.00 O ATOM 128 C5' DT A 5 -8.824 -2.619 -4.705 1.00 0.00 C ATOM 129 C4' DT A 5 -8.691 -2.358 -3.198 1.00 0.00 C ATOM 130 O4' DT A 5 -7.472 -2.862 -2.722 1.00 0.00 O ATOM 131 C3' DT A 5 -8.822 -0.893 -2.760 1.00 0.00 C ATOM 132 O3' DT A 5 -9.945 -0.804 -1.892 1.00 0.00 O ATOM 133 C2' DT A 5 -7.508 -0.634 -2.032 1.00 0.00 C ATOM 134 C1' DT A 5 -7.062 -2.039 -1.650 1.00 0.00 C ATOM 135 N1 DT A 5 -5.590 -2.099 -1.685 1.00 0.00 N ATOM 136 C2 DT A 5 -4.888 -2.261 -0.501 1.00 0.00 C ATOM 137 O2 DT A 5 -5.426 -2.553 0.562 1.00 0.00 O ATOM 138 N3 DT A 5 -3.520 -2.066 -0.588 1.00 0.00 N ATOM 139 C4 DT A 5 -2.789 -1.920 -1.757 1.00 0.00 C ATOM 140 O4 DT A 5 -1.560 -1.906 -1.706 1.00 0.00 O ATOM 141 C5 DT A 5 -3.602 -1.793 -2.960 1.00 0.00 C ATOM 142 C7 DT A 5 -2.915 -1.576 -4.296 1.00 0.00 C ATOM 143 C6 DT A 5 -4.959 -1.866 -2.879 1.00 0.00 C ATOM 0 H5' DT A 5 -8.753 -3.691 -4.891 1.00 0.00 H new ATOM 0 H5'' DT A 5 -9.812 -2.302 -5.038 1.00 0.00 H new ATOM 0 H4' DT A 5 -9.544 -2.878 -2.762 1.00 0.00 H new ATOM 0 H3' DT A 5 -8.980 -0.172 -3.562 1.00 0.00 H new ATOM 0 H2' DT A 5 -6.780 -0.137 -2.673 1.00 0.00 H new ATOM 0 H2'' DT A 5 -7.647 0.000 -1.156 1.00 0.00 H new ATOM 0 H1' DT A 5 -7.455 -2.322 -0.673 1.00 0.00 H new ATOM 0 H3 DT A 5 -3.002 -2.026 0.290 1.00 0.00 H new ATOM 0 H71 DT A 5 -3.518 -2.014 -5.091 1.00 0.00 H new ATOM 0 H72 DT A 5 -2.799 -0.507 -4.476 1.00 0.00 H new ATOM 0 H73 DT A 5 -1.934 -2.050 -4.282 1.00 0.00 H new ATOM 0 H6 DT A 5 -5.550 -1.738 -3.774 1.00 0.00 H new ATOM 156 P DA A 6 -10.397 0.563 -1.150 1.00 0.00 P ATOM 157 OP1 DA A 6 -11.790 0.386 -0.685 1.00 0.00 O ATOM 158 OP2 DA A 6 -10.059 1.701 -2.033 1.00 0.00 O ATOM 159 O5' DA A 6 -9.440 0.639 0.154 1.00 0.00 O ATOM 160 C5' DA A 6 -9.500 -0.324 1.191 1.00 0.00 C ATOM 161 C4' DA A 6 -8.490 -0.009 2.308 1.00 0.00 C ATOM 162 O4' DA A 6 -7.214 -0.495 1.927 1.00 0.00 O ATOM 163 C3' DA A 6 -8.342 1.489 2.640 1.00 0.00 C ATOM 164 O3' DA A 6 -9.002 1.789 3.859 1.00 0.00 O ATOM 165 C2' DA A 6 -6.841 1.572 2.724 1.00 0.00 C ATOM 166 C1' DA A 6 -6.266 0.199 2.712 1.00 0.00 C ATOM 167 N9 DA A 6 -4.988 0.289 1.971 1.00 0.00 N ATOM 168 C8 DA A 6 -4.866 0.528 0.640 1.00 0.00 C ATOM 169 N7 DA A 6 -3.661 0.671 0.183 1.00 0.00 N ATOM 170 C5 DA A 6 -2.908 0.507 1.328 1.00 0.00 C ATOM 171 C6 DA A 6 -1.525 0.416 1.531 1.00 0.00 C ATOM 172 N6 DA A 6 -0.661 0.370 0.513 1.00 0.00 N ATOM 173 N1 DA A 6 -1.084 0.295 2.794 1.00 0.00 N ATOM 174 C2 DA A 6 -1.974 0.261 3.784 1.00 0.00 C ATOM 175 N3 DA A 6 -3.298 0.295 3.726 1.00 0.00 N ATOM 176 C4 DA A 6 -3.710 0.402 2.442 1.00 0.00 C ATOM 0 H5' DA A 6 -9.296 -1.314 0.783 1.00 0.00 H new ATOM 0 H5'' DA A 6 -10.507 -0.352 1.606 1.00 0.00 H new ATOM 0 H4' DA A 6 -8.880 -0.496 3.202 1.00 0.00 H new ATOM 0 H3' DA A 6 -8.780 2.198 1.937 1.00 0.00 H new ATOM 0 H2' DA A 6 -6.451 2.148 1.885 1.00 0.00 H new ATOM 0 H2'' DA A 6 -6.545 2.094 3.634 1.00 0.00 H new ATOM 0 H1' DA A 6 -6.086 -0.258 3.685 1.00 0.00 H new ATOM 0 H8 DA A 6 -5.729 0.596 -0.006 1.00 0.00 H new ATOM 0 H61 DA A 6 0.340 0.304 0.696 1.00 0.00 H new ATOM 0 H62 DA A 6 -1.003 0.401 -0.448 1.00 0.00 H new ATOM 0 H2 DA A 6 -1.557 0.196 4.778 1.00 0.00 H new ATOM 188 P DT A 7 -8.983 3.261 4.536 1.00 0.00 P ATOM 189 OP1 DT A 7 -9.987 3.274 5.623 1.00 0.00 O ATOM 190 OP2 DT A 7 -9.056 4.272 3.458 1.00 0.00 O ATOM 191 O5' DT A 7 -7.520 3.359 5.213 1.00 0.00 O ATOM 192 C5' DT A 7 -7.079 2.406 6.164 1.00 0.00 C ATOM 193 C4' DT A 7 -5.624 2.664 6.574 1.00 0.00 C ATOM 194 O4' DT A 7 -4.800 2.422 5.443 1.00 0.00 O ATOM 195 C3' DT A 7 -5.411 4.119 7.008 1.00 0.00 C ATOM 196 O3' DT A 7 -4.816 4.140 8.295 1.00 0.00 O ATOM 197 C2' DT A 7 -4.479 4.644 5.919 1.00 0.00 C ATOM 198 C1' DT A 7 -3.765 3.385 5.436 1.00 0.00 C ATOM 199 N1 DT A 7 -3.234 3.533 4.064 1.00 0.00 N ATOM 200 C2 DT A 7 -1.865 3.387 3.838 1.00 0.00 C ATOM 201 O2 DT A 7 -1.038 3.231 4.733 1.00 0.00 O ATOM 202 N3 DT A 7 -1.460 3.425 2.513 1.00 0.00 N ATOM 203 C4 DT A 7 -2.281 3.640 1.417 1.00 0.00 C ATOM 204 O4 DT A 7 -1.793 3.638 0.289 1.00 0.00 O ATOM 205 C5 DT A 7 -3.683 3.850 1.752 1.00 0.00 C ATOM 206 C7 DT A 7 -4.701 4.119 0.667 1.00 0.00 C ATOM 207 C6 DT A 7 -4.101 3.788 3.039 1.00 0.00 C ATOM 0 H5' DT A 7 -7.170 1.403 5.747 1.00 0.00 H new ATOM 0 H5'' DT A 7 -7.720 2.444 7.045 1.00 0.00 H new ATOM 0 H4' DT A 7 -5.378 2.010 7.411 1.00 0.00 H new ATOM 0 H3' DT A 7 -6.317 4.719 7.098 1.00 0.00 H new ATOM 0 H2' DT A 7 -5.032 5.127 5.114 1.00 0.00 H new ATOM 0 H2'' DT A 7 -3.777 5.380 6.310 1.00 0.00 H new ATOM 0 H1' DT A 7 -2.904 3.135 6.057 1.00 0.00 H new ATOM 0 H3 DT A 7 -0.467 3.282 2.327 1.00 0.00 H new ATOM 0 H71 DT A 7 -4.219 4.633 -0.165 1.00 0.00 H new ATOM 0 H72 DT A 7 -5.118 3.175 0.317 1.00 0.00 H new ATOM 0 H73 DT A 7 -5.501 4.744 1.065 1.00 0.00 H new ATOM 0 H6 DT A 7 -5.146 3.944 3.261 1.00 0.00 H new ATOM 220 P DA A 8 -4.563 5.516 9.110 1.00 0.00 P ATOM 221 OP1 DA A 8 -4.543 5.197 10.555 1.00 0.00 O ATOM 222 OP2 DA A 8 -5.494 6.548 8.600 1.00 0.00 O ATOM 223 O5' DA A 8 -3.069 5.927 8.663 1.00 0.00 O ATOM 224 C5' DA A 8 -1.941 5.248 9.177 1.00 0.00 C ATOM 225 C4' DA A 8 -0.652 5.787 8.553 1.00 0.00 C ATOM 226 O4' DA A 8 -0.581 5.405 7.191 1.00 0.00 O ATOM 227 C3' DA A 8 -0.527 7.317 8.614 1.00 0.00 C ATOM 228 O3' DA A 8 0.669 7.657 9.299 1.00 0.00 O ATOM 229 C2' DA A 8 -0.507 7.654 7.149 1.00 0.00 C ATOM 230 C1' DA A 8 0.124 6.442 6.546 1.00 0.00 C ATOM 231 N9 DA A 8 -0.107 6.381 5.097 1.00 0.00 N ATOM 232 C8 DA A 8 -1.288 6.559 4.442 1.00 0.00 C ATOM 233 N7 DA A 8 -1.219 6.420 3.148 1.00 0.00 N ATOM 234 C5 DA A 8 0.129 6.147 2.931 1.00 0.00 C ATOM 235 C6 DA A 8 0.882 5.861 1.774 1.00 0.00 C ATOM 236 N6 DA A 8 0.337 5.713 0.560 1.00 0.00 N ATOM 237 N1 DA A 8 2.213 5.710 1.908 1.00 0.00 N ATOM 238 C2 DA A 8 2.766 5.798 3.116 1.00 0.00 C ATOM 239 N3 DA A 8 2.165 6.009 4.281 1.00 0.00 N ATOM 240 C4 DA A 8 0.826 6.174 4.115 1.00 0.00 C ATOM 0 H5' DA A 8 -2.030 4.181 8.975 1.00 0.00 H new ATOM 0 H5'' DA A 8 -1.903 5.365 10.260 1.00 0.00 H new ATOM 0 H4' DA A 8 0.161 5.360 9.141 1.00 0.00 H new ATOM 0 H3' DA A 8 -1.309 7.854 9.151 1.00 0.00 H new ATOM 0 H2' DA A 8 -1.510 7.826 6.759 1.00 0.00 H new ATOM 0 H2'' DA A 8 0.072 8.555 6.948 1.00 0.00 H new ATOM 0 H1' DA A 8 1.206 6.407 6.672 1.00 0.00 H new ATOM 0 H8 DA A 8 -2.209 6.796 4.954 1.00 0.00 H new ATOM 0 H61 DA A 8 0.930 5.506 -0.244 1.00 0.00 H new ATOM 0 H62 DA A 8 -0.671 5.807 0.439 1.00 0.00 H new ATOM 0 H2 DA A 8 3.839 5.683 3.153 1.00 0.00 H new ATOM 252 P DG A 9 1.111 9.186 9.593 1.00 0.00 P ATOM 253 OP1 DG A 9 1.514 9.285 11.013 1.00 0.00 O ATOM 254 OP2 DG A 9 0.077 10.100 9.058 1.00 0.00 O ATOM 255 O5' DG A 9 2.430 9.344 8.679 1.00 0.00 O ATOM 256 C5' DG A 9 3.600 8.598 8.951 1.00 0.00 C ATOM 257 C4' DG A 9 4.802 9.077 8.126 1.00 0.00 C ATOM 258 O4' DG A 9 4.564 8.813 6.752 1.00 0.00 O ATOM 259 C3' DG A 9 5.056 10.579 8.262 1.00 0.00 C ATOM 260 O3' DG A 9 6.468 10.718 8.190 1.00 0.00 O ATOM 261 C2' DG A 9 4.285 11.145 7.071 1.00 0.00 C ATOM 262 C1' DG A 9 4.421 10.030 6.036 1.00 0.00 C ATOM 263 N9 DG A 9 3.276 9.807 5.124 1.00 0.00 N ATOM 264 C8 DG A 9 1.934 10.027 5.315 1.00 0.00 C ATOM 265 N7 DG A 9 1.201 9.765 4.267 1.00 0.00 N ATOM 266 C5 DG A 9 2.117 9.339 3.309 1.00 0.00 C ATOM 267 C6 DG A 9 1.929 8.985 1.937 1.00 0.00 C ATOM 268 O6 DG A 9 0.877 8.923 1.308 1.00 0.00 O ATOM 269 N1 DG A 9 3.129 8.685 1.291 1.00 0.00 N ATOM 270 C2 DG A 9 4.365 8.681 1.907 1.00 0.00 C ATOM 271 N2 DG A 9 5.426 8.391 1.149 1.00 0.00 N ATOM 272 N3 DG A 9 4.541 9.000 3.198 1.00 0.00 N ATOM 273 C4 DG A 9 3.384 9.327 3.839 1.00 0.00 C ATOM 0 H5' DG A 9 3.414 7.545 8.740 1.00 0.00 H new ATOM 0 H5'' DG A 9 3.838 8.673 10.012 1.00 0.00 H new ATOM 0 H4' DG A 9 5.672 8.541 8.505 1.00 0.00 H new ATOM 0 H3' DG A 9 4.736 11.087 9.172 1.00 0.00 H new ATOM 0 H2' DG A 9 3.243 11.345 7.319 1.00 0.00 H new ATOM 0 H2'' DG A 9 4.714 12.083 6.717 1.00 0.00 H new ATOM 0 H1' DG A 9 5.260 10.337 5.412 1.00 0.00 H new ATOM 0 H8 DG A 9 1.522 10.384 6.247 1.00 0.00 H new ATOM 0 H1 DG A 9 3.091 8.453 0.298 1.00 0.00 H new ATOM 0 H21 DG A 9 6.359 8.376 1.561 1.00 0.00 H new ATOM 0 H22 DG A 9 5.303 8.184 0.158 1.00 0.00 H new ATOM 285 P DC A 10 7.249 12.117 7.994 1.00 0.00 P ATOM 286 OP1 DC A 10 8.516 12.046 8.755 1.00 0.00 O ATOM 287 OP2 DC A 10 6.314 13.240 8.226 1.00 0.00 O ATOM 288 O5' DC A 10 7.600 12.043 6.418 1.00 0.00 O ATOM 289 C5' DC A 10 8.404 10.991 5.908 1.00 0.00 C ATOM 290 C4' DC A 10 8.728 11.145 4.415 1.00 0.00 C ATOM 291 O4' DC A 10 7.545 10.779 3.740 1.00 0.00 O ATOM 292 C3' DC A 10 9.088 12.573 3.977 1.00 0.00 C ATOM 293 O3' DC A 10 10.486 12.751 3.803 1.00 0.00 O ATOM 294 C2' DC A 10 8.359 12.696 2.647 1.00 0.00 C ATOM 295 C1' DC A 10 7.457 11.488 2.525 1.00 0.00 C ATOM 296 N1 DC A 10 6.040 11.879 2.334 1.00 0.00 N ATOM 297 C2 DC A 10 5.499 11.822 1.051 1.00 0.00 C ATOM 298 O2 DC A 10 6.221 11.637 0.074 1.00 0.00 O ATOM 299 N3 DC A 10 4.150 11.977 0.901 1.00 0.00 N ATOM 300 C4 DC A 10 3.361 12.196 1.965 1.00 0.00 C ATOM 301 N4 DC A 10 2.040 12.297 1.783 1.00 0.00 N ATOM 302 C5 DC A 10 3.912 12.298 3.288 1.00 0.00 C ATOM 303 C6 DC A 10 5.245 12.152 3.417 1.00 0.00 C ATOM 0 H5' DC A 10 7.892 10.042 6.066 1.00 0.00 H new ATOM 0 H5'' DC A 10 9.335 10.948 6.473 1.00 0.00 H new ATOM 0 H4' DC A 10 9.603 10.534 4.191 1.00 0.00 H new ATOM 0 H3' DC A 10 8.807 13.324 4.715 1.00 0.00 H new ATOM 0 H2' DC A 10 7.777 13.617 2.610 1.00 0.00 H new ATOM 0 H2'' DC A 10 9.068 12.733 1.820 1.00 0.00 H new ATOM 0 H1' DC A 10 7.771 10.897 1.665 1.00 0.00 H new ATOM 0 H41 DC A 10 1.427 12.463 2.581 1.00 0.00 H new ATOM 0 H42 DC A 10 1.646 12.208 0.846 1.00 0.00 H new ATOM 0 H5 DC A 10 3.282 12.484 4.145 1.00 0.00 H new ATOM 0 H6 DC A 10 5.696 12.252 4.393 1.00 0.00 H new ATOM 315 P DC A 11 11.128 14.179 3.362 1.00 0.00 P ATOM 316 OP1 DC A 11 12.598 14.078 3.504 1.00 0.00 O ATOM 317 OP2 DC A 11 10.400 15.251 4.075 1.00 0.00 O ATOM 318 O5' DC A 11 10.794 14.327 1.783 1.00 0.00 O ATOM 319 C5' DC A 11 11.472 13.559 0.805 1.00 0.00 C ATOM 320 C4' DC A 11 10.856 13.743 -0.591 1.00 0.00 C ATOM 321 O4' DC A 11 9.516 13.309 -0.600 1.00 0.00 O ATOM 322 C3' DC A 11 10.890 15.166 -1.142 1.00 0.00 C ATOM 323 O3' DC A 11 12.098 15.415 -1.829 1.00 0.00 O ATOM 324 C2' DC A 11 9.706 15.138 -2.109 1.00 0.00 C ATOM 325 C1' DC A 11 8.823 13.966 -1.650 1.00 0.00 C ATOM 326 N1 DC A 11 7.554 14.436 -1.034 1.00 0.00 N ATOM 327 C2 DC A 11 6.339 14.250 -1.698 1.00 0.00 C ATOM 328 O2 DC A 11 6.294 13.785 -2.835 1.00 0.00 O ATOM 329 N3 DC A 11 5.189 14.600 -1.050 1.00 0.00 N ATOM 330 C4 DC A 11 5.218 15.127 0.185 1.00 0.00 C ATOM 331 N4 DC A 11 4.063 15.415 0.793 1.00 0.00 N ATOM 332 C5 DC A 11 6.460 15.366 0.864 1.00 0.00 C ATOM 333 C6 DC A 11 7.589 15.003 0.212 1.00 0.00 C ATOM 0 H5' DC A 11 11.438 12.505 1.082 1.00 0.00 H new ATOM 0 H5'' DC A 11 12.523 13.848 0.780 1.00 0.00 H new ATOM 0 H4' DC A 11 11.489 13.138 -1.240 1.00 0.00 H new ATOM 0 H3' DC A 11 10.831 15.944 -0.381 1.00 0.00 H new ATOM 0 H2' DC A 11 9.155 16.078 -2.081 1.00 0.00 H new ATOM 0 H2'' DC A 11 10.042 14.996 -3.136 1.00 0.00 H new ATOM 0 HO3' DC A 11 12.095 16.332 -2.174 1.00 0.00 H new ATOM 0 H1' DC A 11 8.611 13.342 -2.518 1.00 0.00 H new ATOM 0 H41 DC A 11 4.066 15.816 1.731 1.00 0.00 H new ATOM 0 H42 DC A 11 3.178 15.234 0.319 1.00 0.00 H new ATOM 0 H5 DC A 11 6.492 15.813 1.846 1.00 0.00 H new ATOM 0 H6 DC A 11 8.545 15.165 0.688 1.00 0.00 H new TER 346 DC A 11 ATOM 347 O5' DG B 12 -4.554 16.444 -6.722 1.00 0.00 O ATOM 348 C5' DG B 12 -4.557 15.034 -6.775 1.00 0.00 C ATOM 349 C4' DG B 12 -3.129 14.510 -6.960 1.00 0.00 C ATOM 350 O4' DG B 12 -2.383 14.851 -5.808 1.00 0.00 O ATOM 351 C3' DG B 12 -3.099 12.979 -7.069 1.00 0.00 C ATOM 352 O3' DG B 12 -2.658 12.628 -8.370 1.00 0.00 O ATOM 353 C2' DG B 12 -2.119 12.571 -5.966 1.00 0.00 C ATOM 354 C1' DG B 12 -1.388 13.863 -5.653 1.00 0.00 C ATOM 355 N9 DG B 12 -0.910 13.915 -4.253 1.00 0.00 N ATOM 356 C8 DG B 12 -1.658 13.988 -3.103 1.00 0.00 C ATOM 357 N7 DG B 12 -0.954 14.089 -2.012 1.00 0.00 N ATOM 358 C5 DG B 12 0.360 14.076 -2.463 1.00 0.00 C ATOM 359 C6 DG B 12 1.578 14.160 -1.726 1.00 0.00 C ATOM 360 O6 DG B 12 1.720 14.270 -0.511 1.00 0.00 O ATOM 361 N1 DG B 12 2.701 14.101 -2.546 1.00 0.00 N ATOM 362 C2 DG B 12 2.658 13.953 -3.920 1.00 0.00 C ATOM 363 N2 DG B 12 3.831 13.861 -4.556 1.00 0.00 N ATOM 364 N3 DG B 12 1.512 13.875 -4.617 1.00 0.00 N ATOM 365 C4 DG B 12 0.400 13.946 -3.832 1.00 0.00 C ATOM 0 H5' DG B 12 -5.186 14.695 -7.598 1.00 0.00 H new ATOM 0 H5'' DG B 12 -4.985 14.629 -5.858 1.00 0.00 H new ATOM 0 H4' DG B 12 -2.723 14.947 -7.872 1.00 0.00 H new ATOM 0 H3' DG B 12 -4.060 12.481 -6.939 1.00 0.00 H new ATOM 0 H2' DG B 12 -2.638 12.180 -5.091 1.00 0.00 H new ATOM 0 H2'' DG B 12 -1.434 11.793 -6.304 1.00 0.00 H new ATOM 0 HO5' DG B 12 -5.471 16.769 -6.605 1.00 0.00 H new ATOM 0 H1' DG B 12 -0.512 13.981 -6.291 1.00 0.00 H new ATOM 0 H8 DG B 12 -2.738 13.964 -3.104 1.00 0.00 H new ATOM 0 H1 DG B 12 3.617 14.172 -2.104 1.00 0.00 H new ATOM 0 H21 DG B 12 3.854 13.751 -5.570 1.00 0.00 H new ATOM 0 H22 DG B 12 4.702 13.901 -4.027 1.00 0.00 H new ATOM 378 P DG B 13 -2.547 11.095 -8.872 1.00 0.00 P ATOM 379 OP1 DG B 13 -2.602 11.092 -10.350 1.00 0.00 O ATOM 380 OP2 DG B 13 -3.507 10.276 -8.099 1.00 0.00 O ATOM 381 O5' DG B 13 -1.056 10.675 -8.425 1.00 0.00 O ATOM 382 C5' DG B 13 0.079 11.341 -8.943 1.00 0.00 C ATOM 383 C4' DG B 13 1.382 10.753 -8.389 1.00 0.00 C ATOM 384 O4' DG B 13 1.450 11.044 -7.001 1.00 0.00 O ATOM 385 C3' DG B 13 1.457 9.231 -8.539 1.00 0.00 C ATOM 386 O3' DG B 13 2.827 8.945 -8.772 1.00 0.00 O ATOM 387 C2' DG B 13 0.976 8.753 -7.167 1.00 0.00 C ATOM 388 C1' DG B 13 1.556 9.833 -6.272 1.00 0.00 C ATOM 389 N9 DG B 13 0.935 10.077 -4.952 1.00 0.00 N ATOM 390 C8 DG B 13 -0.372 9.989 -4.541 1.00 0.00 C ATOM 391 N7 DG B 13 -0.556 10.305 -3.287 1.00 0.00 N ATOM 392 C5 DG B 13 0.719 10.616 -2.824 1.00 0.00 C ATOM 393 C6 DG B 13 1.175 10.989 -1.520 1.00 0.00 C ATOM 394 O6 DG B 13 0.508 11.190 -0.509 1.00 0.00 O ATOM 395 N1 DG B 13 2.561 11.125 -1.459 1.00 0.00 N ATOM 396 C2 DG B 13 3.407 10.980 -2.542 1.00 0.00 C ATOM 397 N2 DG B 13 4.711 11.175 -2.341 1.00 0.00 N ATOM 398 N3 DG B 13 2.978 10.670 -3.772 1.00 0.00 N ATOM 399 C4 DG B 13 1.632 10.490 -3.843 1.00 0.00 C ATOM 0 H5' DG B 13 0.024 12.401 -8.695 1.00 0.00 H new ATOM 0 H5'' DG B 13 0.080 11.267 -10.031 1.00 0.00 H new ATOM 0 H4' DG B 13 2.203 11.195 -8.954 1.00 0.00 H new ATOM 0 H3' DG B 13 0.877 8.769 -9.338 1.00 0.00 H new ATOM 0 H2' DG B 13 -0.111 8.703 -7.104 1.00 0.00 H new ATOM 0 H2'' DG B 13 1.355 7.762 -6.918 1.00 0.00 H new ATOM 0 H1' DG B 13 2.559 9.481 -6.030 1.00 0.00 H new ATOM 0 H8 DG B 13 -1.176 9.686 -5.196 1.00 0.00 H new ATOM 0 H1 DG B 13 2.978 11.346 -0.555 1.00 0.00 H new ATOM 0 H21 DG B 13 5.367 11.077 -3.116 1.00 0.00 H new ATOM 0 H22 DG B 13 5.052 11.422 -1.412 1.00 0.00 H new ATOM 411 P DC B 14 3.417 7.462 -9.025 1.00 0.00 P ATOM 412 OP1 DC B 14 4.124 7.459 -10.325 1.00 0.00 O ATOM 413 OP2 DC B 14 2.365 6.457 -8.756 1.00 0.00 O ATOM 414 O5' DC B 14 4.515 7.380 -7.845 1.00 0.00 O ATOM 415 C5' DC B 14 5.658 8.218 -7.859 1.00 0.00 C ATOM 416 C4' DC B 14 6.531 8.008 -6.617 1.00 0.00 C ATOM 417 O4' DC B 14 5.775 8.402 -5.483 1.00 0.00 O ATOM 418 C3' DC B 14 6.927 6.538 -6.433 1.00 0.00 C ATOM 419 O3' DC B 14 8.303 6.505 -6.090 1.00 0.00 O ATOM 420 C2' DC B 14 6.013 6.103 -5.288 1.00 0.00 C ATOM 421 C1' DC B 14 5.892 7.400 -4.489 1.00 0.00 C ATOM 422 N1 DC B 14 4.653 7.466 -3.660 1.00 0.00 N ATOM 423 C2 DC B 14 4.755 7.701 -2.283 1.00 0.00 C ATOM 424 O2 DC B 14 5.846 7.812 -1.730 1.00 0.00 O ATOM 425 N3 DC B 14 3.609 7.810 -1.546 1.00 0.00 N ATOM 426 C4 DC B 14 2.406 7.698 -2.126 1.00 0.00 C ATOM 427 N4 DC B 14 1.304 7.817 -1.380 1.00 0.00 N ATOM 428 C5 DC B 14 2.278 7.498 -3.538 1.00 0.00 C ATOM 429 C6 DC B 14 3.417 7.397 -4.258 1.00 0.00 C ATOM 0 H5' DC B 14 5.344 9.261 -7.911 1.00 0.00 H new ATOM 0 H5'' DC B 14 6.246 8.017 -8.755 1.00 0.00 H new ATOM 0 H4' DC B 14 7.442 8.595 -6.735 1.00 0.00 H new ATOM 0 H3' DC B 14 6.814 5.889 -7.301 1.00 0.00 H new ATOM 0 H2' DC B 14 5.046 5.750 -5.646 1.00 0.00 H new ATOM 0 H2'' DC B 14 6.449 5.297 -4.698 1.00 0.00 H new ATOM 0 H1' DC B 14 6.739 7.498 -3.810 1.00 0.00 H new ATOM 0 H41 DC B 14 0.384 7.733 -1.812 1.00 0.00 H new ATOM 0 H42 DC B 14 1.383 7.992 -0.378 1.00 0.00 H new ATOM 0 H5 DC B 14 1.309 7.430 -4.009 1.00 0.00 H new ATOM 0 H6 DC B 14 3.355 7.259 -5.327 1.00 0.00 H new ATOM 441 P DT B 15 9.114 5.126 -5.873 1.00 0.00 P ATOM 442 OP1 DT B 15 10.555 5.405 -6.061 1.00 0.00 O ATOM 443 OP2 DT B 15 8.460 4.062 -6.666 1.00 0.00 O ATOM 444 O5' DT B 15 8.857 4.822 -4.313 1.00 0.00 O ATOM 445 C5' DT B 15 9.434 5.625 -3.301 1.00 0.00 C ATOM 446 C4' DT B 15 8.991 5.149 -1.914 1.00 0.00 C ATOM 447 O4' DT B 15 7.620 5.432 -1.794 1.00 0.00 O ATOM 448 C3' DT B 15 9.139 3.638 -1.685 1.00 0.00 C ATOM 449 O3' DT B 15 10.280 3.424 -0.865 1.00 0.00 O ATOM 450 C2' DT B 15 7.820 3.238 -1.029 1.00 0.00 C ATOM 451 C1' DT B 15 7.107 4.564 -0.811 1.00 0.00 C ATOM 452 N1 DT B 15 5.664 4.464 -1.103 1.00 0.00 N ATOM 453 C2 DT B 15 4.760 4.934 -0.161 1.00 0.00 C ATOM 454 O2 DT B 15 5.095 5.348 0.945 1.00 0.00 O ATOM 455 N3 DT B 15 3.430 4.910 -0.538 1.00 0.00 N ATOM 456 C4 DT B 15 2.929 4.466 -1.749 1.00 0.00 C ATOM 457 O4 DT B 15 1.717 4.514 -1.952 1.00 0.00 O ATOM 458 C5 DT B 15 3.939 3.975 -2.673 1.00 0.00 C ATOM 459 C7 DT B 15 3.518 3.460 -4.034 1.00 0.00 C ATOM 460 C6 DT B 15 5.252 3.987 -2.323 1.00 0.00 C ATOM 0 H5' DT B 15 9.142 6.665 -3.444 1.00 0.00 H new ATOM 0 H5'' DT B 15 10.521 5.586 -3.374 1.00 0.00 H new ATOM 0 H4' DT B 15 9.628 5.658 -1.190 1.00 0.00 H new ATOM 0 H3' DT B 15 9.304 3.040 -2.582 1.00 0.00 H new ATOM 0 H2' DT B 15 7.240 2.573 -1.669 1.00 0.00 H new ATOM 0 H2'' DT B 15 7.984 2.713 -0.088 1.00 0.00 H new ATOM 0 H1' DT B 15 7.251 4.885 0.221 1.00 0.00 H new ATOM 0 H3 DT B 15 2.752 5.253 0.143 1.00 0.00 H new ATOM 0 H71 DT B 15 4.319 3.635 -4.753 1.00 0.00 H new ATOM 0 H72 DT B 15 3.314 2.391 -3.971 1.00 0.00 H new ATOM 0 H73 DT B 15 2.618 3.983 -4.359 1.00 0.00 H new ATOM 0 H6 DT B 15 5.988 3.613 -3.020 1.00 0.00 H new ATOM 473 P DA B 16 10.748 1.962 -0.353 1.00 0.00 P ATOM 474 OP1 DA B 16 12.140 2.072 0.135 1.00 0.00 O ATOM 475 OP2 DA B 16 10.413 0.973 -1.402 1.00 0.00 O ATOM 476 O5' DA B 16 9.792 1.685 0.920 1.00 0.00 O ATOM 477 C5' DA B 16 9.930 2.393 2.141 1.00 0.00 C ATOM 478 C4' DA B 16 8.742 2.122 3.084 1.00 0.00 C ATOM 479 O4' DA B 16 7.558 2.598 2.489 1.00 0.00 O ATOM 480 C3' DA B 16 8.460 0.657 3.357 1.00 0.00 C ATOM 481 O3' DA B 16 9.005 0.207 4.589 1.00 0.00 O ATOM 482 C2' DA B 16 6.992 0.407 3.124 1.00 0.00 C ATOM 483 C1' DA B 16 6.526 1.824 3.060 1.00 0.00 C ATOM 484 N9 DA B 16 5.331 1.933 2.219 1.00 0.00 N ATOM 485 C8 DA B 16 5.307 1.617 0.901 1.00 0.00 C ATOM 486 N7 DA B 16 4.152 1.803 0.322 1.00 0.00 N ATOM 487 C5 DA B 16 3.332 2.214 1.375 1.00 0.00 C ATOM 488 C6 DA B 16 1.961 2.542 1.462 1.00 0.00 C ATOM 489 N6 DA B 16 1.164 2.653 0.391 1.00 0.00 N ATOM 490 N1 DA B 16 1.428 2.749 2.682 1.00 0.00 N ATOM 491 C2 DA B 16 2.219 2.682 3.754 1.00 0.00 C ATOM 492 N3 DA B 16 3.529 2.449 3.801 1.00 0.00 N ATOM 493 C4 DA B 16 4.033 2.221 2.559 1.00 0.00 C ATOM 0 H5' DA B 16 9.999 3.462 1.938 1.00 0.00 H new ATOM 0 H5'' DA B 16 10.859 2.101 2.630 1.00 0.00 H new ATOM 0 H4' DA B 16 9.021 2.615 4.015 1.00 0.00 H new ATOM 0 H3' DA B 16 8.994 0.019 2.653 1.00 0.00 H new ATOM 0 H2' DA B 16 6.799 -0.143 2.203 1.00 0.00 H new ATOM 0 H2'' DA B 16 6.526 -0.154 3.934 1.00 0.00 H new ATOM 0 H1' DA B 16 6.281 2.173 4.063 1.00 0.00 H new ATOM 0 H8 DA B 16 6.172 1.242 0.374 1.00 0.00 H new ATOM 0 H61 DA B 16 0.180 2.892 0.510 1.00 0.00 H new ATOM 0 H62 DA B 16 1.541 2.498 -0.544 1.00 0.00 H new ATOM 0 H2 DA B 16 1.734 2.837 4.707 1.00 0.00 H new HETATM 505 N1 T41 B 17 3.296 -0.999 4.292 1.00 0.00 N HETATM 506 C2 T41 B 17 1.994 -0.590 4.007 1.00 0.00 C HETATM 507 N3 T41 B 17 1.636 -0.579 2.668 1.00 0.00 N HETATM 508 C4 T41 B 17 2.440 -0.933 1.597 1.00 0.00 C HETATM 509 C5 T41 B 17 3.766 -1.368 1.981 1.00 0.00 C HETATM 510 C5M T41 B 17 4.751 -1.834 0.937 1.00 0.00 C HETATM 511 C6 T41 B 17 4.138 -1.380 3.279 1.00 0.00 C HETATM 512 O2 T41 B 17 1.184 -0.254 4.868 1.00 0.00 O HETATM 513 O4 T41 B 17 2.010 -0.862 0.449 1.00 0.00 O HETATM 514 C1' T41 B 17 3.750 -0.980 5.708 1.00 0.00 C HETATM 515 C2' T41 B 17 4.214 -2.268 6.312 1.00 0.00 C HETATM 516 O2' T41 B 17 5.085 -2.979 5.484 1.00 0.00 O HETATM 517 C3' T41 B 17 4.990 -1.808 7.537 1.00 0.00 C HETATM 518 C4' T41 B 17 5.493 -0.425 7.096 1.00 0.00 C HETATM 519 O3' T41 B 17 4.172 -1.621 8.684 1.00 0.00 O HETATM 520 O4' T41 B 17 4.806 -0.062 5.905 1.00 0.00 O HETATM 521 C5' T41 B 17 6.997 -0.384 6.795 1.00 0.00 C HETATM 522 O5' T41 B 17 7.362 -1.315 5.793 1.00 0.00 O HETATM 523 C6' T41 B 17 4.679 -4.304 5.533 1.00 0.00 C HETATM 524 P T41 B 17 8.838 -1.310 5.136 1.00 0.00 P HETATM 525 O1P T41 B 17 9.821 -1.513 6.223 1.00 0.00 O HETATM 526 O2P T41 B 17 8.826 -2.227 3.975 1.00 0.00 O HETATM 0 H5M3 T41 B 17 4.340 -2.694 0.407 1.00 0.00 H new HETATM 0 H5M2 T41 B 17 4.939 -1.027 0.228 1.00 0.00 H new HETATM 0 H5M1 T41 B 17 5.686 -2.118 1.420 1.00 0.00 H new HETATM 0 H5'2 T41 B 17 7.276 0.620 6.476 1.00 0.00 H new HETATM 0 H5'1 T41 B 17 7.555 -0.595 7.707 1.00 0.00 H new HETATM 0 H2'1 T41 B 17 3.374 -2.935 6.507 1.00 0.00 H new HETATM 0 H6 T41 B 17 5.147 -1.705 3.531 1.00 0.00 H new HETATM 0 H4' T41 B 17 5.305 0.260 7.923 1.00 0.00 H new HETATM 0 H3' T41 B 17 5.748 -2.537 7.822 1.00 0.00 H new HETATM 0 H3 T41 B 17 0.685 -0.280 2.449 1.00 0.00 H new HETATM 0 H13 T41 B 17 4.736 -4.664 6.560 1.00 0.00 H new HETATM 0 H12 T41 B 17 3.652 -4.383 5.178 1.00 0.00 H new HETATM 0 H11 T41 B 17 5.329 -4.907 4.900 1.00 0.00 H new HETATM 0 H1' T41 B 17 2.824 -0.704 6.212 1.00 0.00 H new ATOM 541 P DA B 18 3.508 -2.842 9.507 1.00 0.00 P ATOM 542 OP1 DA B 18 3.441 -2.448 10.932 1.00 0.00 O ATOM 543 OP2 DA B 18 4.194 -4.097 9.128 1.00 0.00 O ATOM 544 O5' DA B 18 2.001 -2.902 8.930 1.00 0.00 O ATOM 545 C5' DA B 18 1.009 -1.970 9.332 1.00 0.00 C ATOM 546 C4' DA B 18 -0.334 -2.340 8.693 1.00 0.00 C ATOM 547 O4' DA B 18 -0.192 -2.213 7.299 1.00 0.00 O ATOM 548 C3' DA B 18 -0.747 -3.786 8.998 1.00 0.00 C ATOM 549 O3' DA B 18 -1.974 -3.751 9.710 1.00 0.00 O ATOM 550 C2' DA B 18 -0.866 -4.382 7.596 1.00 0.00 C ATOM 551 C1' DA B 18 -1.053 -3.164 6.728 1.00 0.00 C ATOM 552 N9 DA B 18 -0.587 -3.343 5.338 1.00 0.00 N ATOM 553 C8 DA B 18 0.695 -3.626 4.938 1.00 0.00 C ATOM 554 N7 DA B 18 0.878 -3.600 3.650 1.00 0.00 N ATOM 555 C5 DA B 18 -0.375 -3.264 3.157 1.00 0.00 C ATOM 556 C6 DA B 18 -0.847 -3.028 1.854 1.00 0.00 C ATOM 557 N6 DA B 18 -0.078 -3.058 0.760 1.00 0.00 N ATOM 558 N1 DA B 18 -2.133 -2.687 1.705 1.00 0.00 N ATOM 559 C2 DA B 18 -2.935 -2.580 2.756 1.00 0.00 C ATOM 560 N3 DA B 18 -2.608 -2.769 4.037 1.00 0.00 N ATOM 561 C4 DA B 18 -1.291 -3.115 4.174 1.00 0.00 C ATOM 0 H5' DA B 18 1.300 -0.963 9.034 1.00 0.00 H new ATOM 0 H5'' DA B 18 0.918 -1.967 10.418 1.00 0.00 H new ATOM 0 H4' DA B 18 -1.100 -1.679 9.099 1.00 0.00 H new ATOM 0 H3' DA B 18 -0.067 -4.369 9.619 1.00 0.00 H new ATOM 0 H2' DA B 18 0.026 -4.943 7.318 1.00 0.00 H new ATOM 0 H2'' DA B 18 -1.710 -5.067 7.518 1.00 0.00 H new ATOM 0 H1' DA B 18 -2.112 -2.910 6.686 1.00 0.00 H new ATOM 0 H8 DA B 18 1.488 -3.852 5.636 1.00 0.00 H new ATOM 0 H61 DA B 18 -0.488 -2.877 -0.156 1.00 0.00 H new ATOM 0 H62 DA B 18 0.918 -3.262 0.842 1.00 0.00 H new ATOM 0 H2 DA B 18 -3.961 -2.312 2.554 1.00 0.00 H new ATOM 573 P DT B 19 -2.804 -5.081 10.100 1.00 0.00 P ATOM 574 OP1 DT B 19 -3.617 -4.785 11.301 1.00 0.00 O ATOM 575 OP2 DT B 19 -1.879 -6.237 10.102 1.00 0.00 O ATOM 576 O5' DT B 19 -3.799 -5.230 8.840 1.00 0.00 O ATOM 577 C5' DT B 19 -4.764 -4.236 8.550 1.00 0.00 C ATOM 578 C4' DT B 19 -5.567 -4.602 7.298 1.00 0.00 C ATOM 579 O4' DT B 19 -4.685 -4.511 6.191 1.00 0.00 O ATOM 580 C3' DT B 19 -6.115 -6.038 7.349 1.00 0.00 C ATOM 581 O3' DT B 19 -7.507 -6.010 7.074 1.00 0.00 O ATOM 582 C2' DT B 19 -5.322 -6.739 6.246 1.00 0.00 C ATOM 583 C1' DT B 19 -4.981 -5.589 5.330 1.00 0.00 C ATOM 584 N1 DT B 19 -3.864 -5.827 4.397 1.00 0.00 N ATOM 585 C2 DT B 19 -4.026 -5.683 3.022 1.00 0.00 C ATOM 586 O2 DT B 19 -5.091 -5.376 2.491 1.00 0.00 O ATOM 587 N3 DT B 19 -2.889 -5.909 2.259 1.00 0.00 N ATOM 588 C4 DT B 19 -1.638 -6.276 2.738 1.00 0.00 C ATOM 589 O4 DT B 19 -0.702 -6.428 1.957 1.00 0.00 O ATOM 590 C5 DT B 19 -1.576 -6.441 4.179 1.00 0.00 C ATOM 591 C7 DT B 19 -0.288 -6.905 4.830 1.00 0.00 C ATOM 592 C6 DT B 19 -2.678 -6.200 4.932 1.00 0.00 C ATOM 0 H5' DT B 19 -4.270 -3.276 8.402 1.00 0.00 H new ATOM 0 H5'' DT B 19 -5.438 -4.120 9.398 1.00 0.00 H new ATOM 0 H4' DT B 19 -6.417 -3.923 7.223 1.00 0.00 H new ATOM 0 H3' DT B 19 -6.008 -6.540 8.311 1.00 0.00 H new ATOM 0 H2' DT B 19 -4.430 -7.231 6.634 1.00 0.00 H new ATOM 0 H2'' DT B 19 -5.913 -7.503 5.740 1.00 0.00 H new ATOM 0 H1' DT B 19 -5.825 -5.408 4.665 1.00 0.00 H new ATOM 0 H3 DT B 19 -2.981 -5.795 1.250 1.00 0.00 H new ATOM 0 H71 DT B 19 -0.217 -6.488 5.835 1.00 0.00 H new ATOM 0 H72 DT B 19 -0.281 -7.993 4.887 1.00 0.00 H new ATOM 0 H73 DT B 19 0.562 -6.567 4.237 1.00 0.00 H new ATOM 0 H6 DT B 19 -2.606 -6.310 6.004 1.00 0.00 H new ATOM 605 P DG B 20 -8.415 -7.350 7.053 1.00 0.00 P ATOM 606 OP1 DG B 20 -9.780 -6.986 7.496 1.00 0.00 O ATOM 607 OP2 DG B 20 -7.682 -8.430 7.751 1.00 0.00 O ATOM 608 O5' DG B 20 -8.476 -7.722 5.482 1.00 0.00 O ATOM 609 C5' DG B 20 -9.206 -6.925 4.568 1.00 0.00 C ATOM 610 C4' DG B 20 -9.239 -7.551 3.169 1.00 0.00 C ATOM 611 O4' DG B 20 -7.945 -7.472 2.592 1.00 0.00 O ATOM 612 C3' DG B 20 -9.629 -9.035 3.194 1.00 0.00 C ATOM 613 O3' DG B 20 -10.552 -9.209 2.131 1.00 0.00 O ATOM 614 C2' DG B 20 -8.281 -9.723 2.976 1.00 0.00 C ATOM 615 C1' DG B 20 -7.636 -8.731 2.024 1.00 0.00 C ATOM 616 N9 DG B 20 -6.166 -8.804 1.926 1.00 0.00 N ATOM 617 C8 DG B 20 -5.263 -9.008 2.928 1.00 0.00 C ATOM 618 N7 DG B 20 -4.017 -8.970 2.547 1.00 0.00 N ATOM 619 C5 DG B 20 -4.099 -8.740 1.176 1.00 0.00 C ATOM 620 C6 DG B 20 -3.069 -8.653 0.191 1.00 0.00 C ATOM 621 O6 DG B 20 -1.854 -8.656 0.369 1.00 0.00 O ATOM 622 N1 DG B 20 -3.572 -8.556 -1.105 1.00 0.00 N ATOM 623 C2 DG B 20 -4.920 -8.504 -1.413 1.00 0.00 C ATOM 624 N2 DG B 20 -5.256 -8.432 -2.703 1.00 0.00 N ATOM 625 N3 DG B 20 -5.888 -8.533 -0.485 1.00 0.00 N ATOM 626 C4 DG B 20 -5.415 -8.660 0.784 1.00 0.00 C ATOM 0 H5' DG B 20 -8.758 -5.933 4.512 1.00 0.00 H new ATOM 0 H5'' DG B 20 -10.225 -6.795 4.932 1.00 0.00 H new ATOM 0 H4' DG B 20 -9.984 -6.999 2.596 1.00 0.00 H new ATOM 0 H3' DG B 20 -10.109 -9.425 4.092 1.00 0.00 H new ATOM 0 H2' DG B 20 -7.718 -9.840 3.902 1.00 0.00 H new ATOM 0 H2'' DG B 20 -8.385 -10.716 2.538 1.00 0.00 H new ATOM 0 H1' DG B 20 -8.006 -8.927 1.018 1.00 0.00 H new ATOM 0 H8 DG B 20 -5.556 -9.186 3.952 1.00 0.00 H new ATOM 0 H1 DG B 20 -2.904 -8.521 -1.875 1.00 0.00 H new ATOM 0 H21 DG B 20 -6.239 -8.392 -2.973 1.00 0.00 H new ATOM 0 H22 DG B 20 -4.530 -8.417 -3.419 1.00 0.00 H new ATOM 638 P DC B 21 -11.127 -10.639 1.648 1.00 0.00 P ATOM 639 OP1 DC B 21 -12.567 -10.479 1.348 1.00 0.00 O ATOM 640 OP2 DC B 21 -10.683 -11.693 2.587 1.00 0.00 O ATOM 641 O5' DC B 21 -10.337 -10.822 0.253 1.00 0.00 O ATOM 642 C5' DC B 21 -10.495 -9.880 -0.795 1.00 0.00 C ATOM 643 C4' DC B 21 -9.791 -10.322 -2.083 1.00 0.00 C ATOM 644 O4' DC B 21 -8.396 -10.253 -1.844 1.00 0.00 O ATOM 645 C3' DC B 21 -10.135 -11.768 -2.468 1.00 0.00 C ATOM 646 O3' DC B 21 -10.319 -11.823 -3.874 1.00 0.00 O ATOM 647 C2' DC B 21 -8.887 -12.517 -2.007 1.00 0.00 C ATOM 648 C1' DC B 21 -7.803 -11.470 -2.251 1.00 0.00 C ATOM 649 N1 DC B 21 -6.610 -11.670 -1.386 1.00 0.00 N ATOM 650 C2 DC B 21 -5.337 -11.703 -1.961 1.00 0.00 C ATOM 651 O2 DC B 21 -5.181 -11.653 -3.179 1.00 0.00 O ATOM 652 N3 DC B 21 -4.253 -11.794 -1.139 1.00 0.00 N ATOM 653 C4 DC B 21 -4.395 -11.857 0.193 1.00 0.00 C ATOM 654 N4 DC B 21 -3.301 -11.916 0.956 1.00 0.00 N ATOM 655 C5 DC B 21 -5.691 -11.791 0.805 1.00 0.00 C ATOM 656 C6 DC B 21 -6.757 -11.698 -0.021 1.00 0.00 C ATOM 0 H5' DC B 21 -10.097 -8.916 -0.478 1.00 0.00 H new ATOM 0 H5'' DC B 21 -11.557 -9.736 -0.995 1.00 0.00 H new ATOM 0 H4' DC B 21 -10.114 -9.673 -2.897 1.00 0.00 H new ATOM 0 H3' DC B 21 -11.045 -12.180 -2.031 1.00 0.00 H new ATOM 0 H2' DC B 21 -8.947 -12.810 -0.959 1.00 0.00 H new ATOM 0 H2'' DC B 21 -8.717 -13.427 -2.583 1.00 0.00 H new ATOM 0 H1' DC B 21 -7.473 -11.511 -3.289 1.00 0.00 H new ATOM 0 H41 DC B 21 -3.389 -11.964 1.971 1.00 0.00 H new ATOM 0 H42 DC B 21 -2.377 -11.913 0.524 1.00 0.00 H new ATOM 0 H5 DC B 21 -5.810 -11.815 1.878 1.00 0.00 H new ATOM 0 H6 DC B 21 -7.749 -11.644 0.403 1.00 0.00 H new ATOM 668 P DG B 22 -10.695 -13.190 -4.651 1.00 0.00 P ATOM 669 OP1 DG B 22 -11.479 -12.836 -5.855 1.00 0.00 O ATOM 670 OP2 DG B 22 -11.242 -14.158 -3.675 1.00 0.00 O ATOM 671 O5' DG B 22 -9.250 -13.722 -5.131 1.00 0.00 O ATOM 672 C5' DG B 22 -8.545 -13.078 -6.174 1.00 0.00 C ATOM 673 C4' DG B 22 -7.193 -13.756 -6.410 1.00 0.00 C ATOM 674 O4' DG B 22 -6.416 -13.599 -5.236 1.00 0.00 O ATOM 675 C3' DG B 22 -7.319 -15.267 -6.663 1.00 0.00 C ATOM 676 O3' DG B 22 -6.718 -15.604 -7.895 1.00 0.00 O ATOM 677 C2' DG B 22 -6.531 -15.884 -5.515 1.00 0.00 C ATOM 678 C1' DG B 22 -5.603 -14.747 -5.136 1.00 0.00 C ATOM 679 N9 DG B 22 -5.067 -14.830 -3.759 1.00 0.00 N ATOM 680 C8 DG B 22 -5.741 -14.974 -2.572 1.00 0.00 C ATOM 681 N7 DG B 22 -4.976 -14.940 -1.516 1.00 0.00 N ATOM 682 C5 DG B 22 -3.698 -14.763 -2.035 1.00 0.00 C ATOM 683 C6 DG B 22 -2.442 -14.617 -1.369 1.00 0.00 C ATOM 684 O6 DG B 22 -2.222 -14.607 -0.161 1.00 0.00 O ATOM 685 N1 DG B 22 -1.380 -14.471 -2.259 1.00 0.00 N ATOM 686 C2 DG B 22 -1.511 -14.463 -3.635 1.00 0.00 C ATOM 687 N2 DG B 22 -0.399 -14.305 -4.359 1.00 0.00 N ATOM 688 N3 DG B 22 -2.693 -14.571 -4.262 1.00 0.00 N ATOM 689 C4 DG B 22 -3.743 -14.714 -3.409 1.00 0.00 C ATOM 0 H5' DG B 22 -8.392 -12.028 -5.923 1.00 0.00 H new ATOM 0 H5'' DG B 22 -9.136 -13.104 -7.090 1.00 0.00 H new ATOM 0 H4' DG B 22 -6.745 -13.294 -7.290 1.00 0.00 H new ATOM 0 H3' DG B 22 -8.353 -15.609 -6.709 1.00 0.00 H new ATOM 0 H2' DG B 22 -7.176 -16.179 -4.688 1.00 0.00 H new ATOM 0 H2'' DG B 22 -5.983 -16.774 -5.826 1.00 0.00 H new ATOM 0 HO3' DG B 22 -6.802 -16.569 -8.047 1.00 0.00 H new ATOM 0 H1' DG B 22 -4.726 -14.755 -5.783 1.00 0.00 H new ATOM 0 H8 DG B 22 -6.812 -15.104 -2.517 1.00 0.00 H new ATOM 0 H1 DG B 22 -0.444 -14.363 -1.869 1.00 0.00 H new ATOM 0 H21 DG B 22 -0.451 -14.293 -5.378 1.00 0.00 H new ATOM 0 H22 DG B 22 0.502 -14.196 -3.893 1.00 0.00 H new TER 702 DG B 22