USER MOD reduce.3.24.130724 H: found=0, std=0, add=251, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 253 hydrogens (139 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 10 DT C7 :methyl 150:sc= -0.725 (180deg=-0.725) USER MOD Single : A 10 DT O3' : rot 180:sc= 0 USER MOD Single : B 13 DT C7 :methyl 150:sc= -1.6! (180deg=-1.6!) USER MOD Single : B 20 DA O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- HETATM 1 C5' XTY A 1 -14.871 -9.039 -8.856 1.00 0.00 C HETATM 2 C4' XTY A 1 -14.157 -10.098 -8.016 1.00 0.00 C HETATM 3 O4' XTY A 1 -12.924 -10.453 -8.661 1.00 0.00 O HETATM 4 C3' XTY A 1 -13.748 -9.642 -6.622 1.00 0.00 C HETATM 5 C2' XTY A 1 -12.348 -9.096 -6.841 1.00 0.00 C HETATM 6 C1' XTY A 1 -11.789 -10.102 -7.851 1.00 0.00 C HETATM 7 O5' XTY A 1 -15.027 -7.811 -8.139 1.00 0.00 O HETATM 8 C2 XTY A 1 -10.411 -12.336 -11.019 1.00 0.00 C HETATM 9 O2 XTY A 1 -10.841 -13.473 -11.194 1.00 0.00 O HETATM 10 N3 XTY A 1 -9.475 -11.786 -11.875 1.00 0.00 N HETATM 11 C4 XTY A 1 -8.949 -10.515 -11.753 1.00 0.00 C HETATM 12 O4 XTY A 1 -8.120 -10.103 -12.562 1.00 0.00 O HETATM 13 C5 XTY A 1 -9.395 -9.728 -10.685 1.00 0.00 C HETATM 14 C6 XTY A 1 -10.354 -10.268 -9.792 1.00 0.00 C HETATM 15 N XTY A 1 -10.858 -11.558 -9.956 1.00 0.00 N HETATM 16 CP XTY A 1 -8.898 -8.416 -10.501 1.00 0.00 C HETATM 17 CD XTY A 1 -10.318 -8.193 -8.537 1.00 0.00 C HETATM 18 C8 XTY A 1 -10.830 -9.508 -8.706 1.00 0.00 C HETATM 19 C7 XTY A 1 -9.364 -7.658 -9.427 1.00 0.00 C HETATM 20 C7A XTY A 1 -8.837 -6.241 -9.215 1.00 0.00 C HETATM 21 O3' XTY A 1 -13.629 -10.821 -5.818 1.00 0.00 O HETATM 0 H7A3 XTY A 1 -7.757 -6.272 -9.069 1.00 0.00 H new HETATM 0 H7A2 XTY A 1 -9.068 -5.632 -10.089 1.00 0.00 H new HETATM 0 H7A1 XTY A 1 -9.309 -5.805 -8.335 1.00 0.00 H new HETATM 0 H5'2 XTY A 1 -14.305 -8.857 -9.770 1.00 0.00 H new HETATM 0 H5'1 XTY A 1 -15.850 -9.412 -9.156 1.00 0.00 H new HETATM 0 H2'2 XTY A 1 -12.360 -8.080 -7.236 1.00 0.00 H new HETATM 0 H2'1 XTY A 1 -11.767 -9.073 -5.919 1.00 0.00 H new HETATM 0 HP XTY A 1 -8.161 -8.003 -11.190 1.00 0.00 H new HETATM 0 HN3 XTY A 1 -9.150 -12.360 -12.653 1.00 0.00 H new HETATM 0 HN XTY A 1 -11.548 -11.928 -9.302 1.00 0.00 H new HETATM 0 HD XTY A 1 -10.670 -7.586 -7.703 1.00 0.00 H new HETATM 0 H4' XTY A 1 -14.877 -10.911 -7.925 1.00 0.00 H new HETATM 0 H3' XTY A 1 -14.433 -8.932 -6.159 1.00 0.00 H new HETATM 0 H1' XTY A 1 -11.310 -10.938 -7.341 1.00 0.00 H new ATOM 37 P DG A 2 -13.883 -10.765 -4.228 1.00 0.00 P ATOM 38 OP1 DG A 2 -14.790 -9.631 -3.940 1.00 0.00 O ATOM 39 OP2 DG A 2 -14.235 -12.127 -3.767 1.00 0.00 O ATOM 40 O5' DG A 2 -12.424 -10.402 -3.654 1.00 0.00 O ATOM 41 C5' DG A 2 -11.285 -11.197 -4.001 1.00 0.00 C ATOM 42 C4' DG A 2 -10.107 -10.933 -3.068 1.00 0.00 C ATOM 43 O4' DG A 2 -8.940 -10.663 -3.859 1.00 0.00 O ATOM 44 C3' DG A 2 -10.264 -9.712 -2.165 1.00 0.00 C ATOM 45 O3' DG A 2 -9.469 -9.952 -0.999 1.00 0.00 O ATOM 46 C2' DG A 2 -9.590 -8.597 -2.950 1.00 0.00 C ATOM 47 C1' DG A 2 -8.436 -9.345 -3.604 1.00 0.00 C ATOM 48 N9 DG A 2 -8.013 -8.738 -4.883 1.00 0.00 N ATOM 49 C8 DG A 2 -8.048 -7.420 -5.261 1.00 0.00 C ATOM 50 N7 DG A 2 -7.565 -7.202 -6.452 1.00 0.00 N ATOM 51 C5 DG A 2 -7.184 -8.463 -6.896 1.00 0.00 C ATOM 52 C6 DG A 2 -6.590 -8.854 -8.127 1.00 0.00 C ATOM 53 O6 DG A 2 -6.267 -8.145 -9.077 1.00 0.00 O ATOM 54 N1 DG A 2 -6.367 -10.221 -8.174 1.00 0.00 N ATOM 55 C2 DG A 2 -6.674 -11.105 -7.165 1.00 0.00 C ATOM 56 N2 DG A 2 -6.393 -12.389 -7.379 1.00 0.00 N ATOM 57 N3 DG A 2 -7.230 -10.748 -6.006 1.00 0.00 N ATOM 58 C4 DG A 2 -7.455 -9.414 -5.943 1.00 0.00 C ATOM 0 H5' DG A 2 -10.991 -10.982 -5.028 1.00 0.00 H new ATOM 0 H5'' DG A 2 -11.552 -12.253 -3.960 1.00 0.00 H new ATOM 0 H4' DG A 2 -10.039 -11.824 -2.444 1.00 0.00 H new ATOM 0 H3' DG A 2 -11.296 -9.492 -1.890 1.00 0.00 H new ATOM 0 H2' DG A 2 -10.259 -8.150 -3.685 1.00 0.00 H new ATOM 0 H2'' DG A 2 -9.243 -7.791 -2.303 1.00 0.00 H new ATOM 0 H1' DG A 2 -7.562 -9.327 -2.952 1.00 0.00 H new ATOM 0 H8 DG A 2 -8.439 -6.635 -4.630 1.00 0.00 H new ATOM 0 H1 DG A 2 -5.943 -10.601 -9.021 1.00 0.00 H new ATOM 0 H21 DG A 2 -6.602 -13.083 -6.661 1.00 0.00 H new ATOM 0 H22 DG A 2 -5.969 -12.678 -8.261 1.00 0.00 H new HETATM 70 P XTY A 3 -9.839 -9.271 0.414 1.00 0.00 P HETATM 71 OP1 XTY A 3 -9.875 -10.334 1.443 1.00 0.00 O HETATM 72 OP2 XTY A 3 -11.016 -8.395 0.218 1.00 0.00 O HETATM 73 C5' XTY A 3 -7.368 -8.461 -0.080 1.00 0.00 C HETATM 74 C4' XTY A 3 -6.275 -7.505 0.390 1.00 0.00 C HETATM 75 O4' XTY A 3 -5.554 -7.034 -0.755 1.00 0.00 O HETATM 76 C3' XTY A 3 -6.781 -6.254 1.101 1.00 0.00 C HETATM 77 C2' XTY A 3 -6.749 -5.175 0.030 1.00 0.00 C HETATM 78 C1' XTY A 3 -5.567 -5.603 -0.845 1.00 0.00 C HETATM 79 O5' XTY A 3 -8.560 -8.335 0.704 1.00 0.00 O HETATM 80 C2 XTY A 3 -3.717 -7.802 -3.859 1.00 0.00 C HETATM 81 O2 XTY A 3 -2.973 -8.736 -3.575 1.00 0.00 O HETATM 82 N3 XTY A 3 -3.963 -7.463 -5.175 1.00 0.00 N HETATM 83 C4 XTY A 3 -4.784 -6.430 -5.580 1.00 0.00 C HETATM 84 O4 XTY A 3 -4.944 -6.191 -6.775 1.00 0.00 O HETATM 85 C5 XTY A 3 -5.414 -5.672 -4.587 1.00 0.00 C HETATM 86 C6 XTY A 3 -5.181 -5.997 -3.226 1.00 0.00 C HETATM 87 N XTY A 3 -4.341 -7.051 -2.865 1.00 0.00 N HETATM 88 CP XTY A 3 -6.265 -4.598 -4.939 1.00 0.00 C HETATM 89 CD XTY A 3 -6.655 -4.180 -2.576 1.00 0.00 C HETATM 90 C8 XTY A 3 -5.804 -5.251 -2.197 1.00 0.00 C HETATM 91 C7 XTY A 3 -6.879 -3.859 -3.929 1.00 0.00 C HETATM 92 C7A XTY A 3 -7.799 -2.697 -4.294 1.00 0.00 C HETATM 93 O3' XTY A 3 -5.805 -5.906 2.088 1.00 0.00 O HETATM 0 H7A3 XTY A 3 -7.239 -1.955 -4.864 1.00 0.00 H new HETATM 0 H7A2 XTY A 3 -8.630 -3.066 -4.896 1.00 0.00 H new HETATM 0 H7A1 XTY A 3 -8.186 -2.239 -3.384 1.00 0.00 H new HETATM 0 H5'2 XTY A 3 -7.599 -8.262 -1.127 1.00 0.00 H new HETATM 0 H5'1 XTY A 3 -7.003 -9.486 -0.023 1.00 0.00 H new HETATM 0 H2'2 XTY A 3 -7.680 -5.139 -0.536 1.00 0.00 H new HETATM 0 H2'1 XTY A 3 -6.598 -4.184 0.458 1.00 0.00 H new HETATM 0 HP XTY A 3 -6.438 -4.352 -5.987 1.00 0.00 H new HETATM 0 HN3 XTY A 3 -3.505 -8.016 -5.900 1.00 0.00 H new HETATM 0 HN XTY A 3 -4.185 -7.270 -1.881 1.00 0.00 H new HETATM 0 HD XTY A 3 -7.147 -3.592 -1.801 1.00 0.00 H new HETATM 0 H4' XTY A 3 -5.675 -8.080 1.096 1.00 0.00 H new HETATM 0 H3' XTY A 3 -7.763 -6.380 1.557 1.00 0.00 H new HETATM 0 H1' XTY A 3 -4.637 -5.133 -0.525 1.00 0.00 H new ATOM 108 P DA A 4 -6.188 -5.886 3.655 1.00 0.00 P ATOM 109 OP1 DA A 4 -5.998 -4.507 4.157 1.00 0.00 O ATOM 110 OP2 DA A 4 -7.495 -6.560 3.826 1.00 0.00 O ATOM 111 O5' DA A 4 -5.048 -6.821 4.306 1.00 0.00 O ATOM 112 C5' DA A 4 -5.001 -8.225 4.023 1.00 0.00 C ATOM 113 C4' DA A 4 -3.568 -8.751 4.040 1.00 0.00 C ATOM 114 O4' DA A 4 -2.989 -8.519 2.747 1.00 0.00 O ATOM 115 C3' DA A 4 -2.637 -8.041 5.017 1.00 0.00 C ATOM 116 O3' DA A 4 -1.556 -8.933 5.309 1.00 0.00 O ATOM 117 C2' DA A 4 -2.059 -6.904 4.198 1.00 0.00 C ATOM 118 C1' DA A 4 -1.948 -7.533 2.814 1.00 0.00 C ATOM 119 N9 DA A 4 -2.156 -6.540 1.745 1.00 0.00 N ATOM 120 C8 DA A 4 -3.001 -5.460 1.736 1.00 0.00 C ATOM 121 N7 DA A 4 -2.911 -4.733 0.662 1.00 0.00 N ATOM 122 C5 DA A 4 -1.941 -5.376 -0.093 1.00 0.00 C ATOM 123 C6 DA A 4 -1.386 -5.098 -1.345 1.00 0.00 C ATOM 124 N6 DA A 4 -1.709 -4.027 -2.063 1.00 0.00 N ATOM 125 N1 DA A 4 -0.448 -5.936 -1.815 1.00 0.00 N ATOM 126 C2 DA A 4 -0.089 -6.978 -1.075 1.00 0.00 C ATOM 127 N3 DA A 4 -0.531 -7.345 0.119 1.00 0.00 N ATOM 128 C4 DA A 4 -1.473 -6.482 0.554 1.00 0.00 C ATOM 0 H5' DA A 4 -5.448 -8.416 3.047 1.00 0.00 H new ATOM 0 H5'' DA A 4 -5.597 -8.766 4.758 1.00 0.00 H new ATOM 0 H4' DA A 4 -3.649 -9.798 4.332 1.00 0.00 H new ATOM 0 H3' DA A 4 -3.131 -7.723 5.935 1.00 0.00 H new ATOM 0 H2' DA A 4 -2.710 -6.030 4.198 1.00 0.00 H new ATOM 0 H2'' DA A 4 -1.090 -6.580 4.577 1.00 0.00 H new ATOM 0 H1' DA A 4 -0.954 -7.956 2.670 1.00 0.00 H new ATOM 0 H8 DA A 4 -3.679 -5.234 2.546 1.00 0.00 H new ATOM 0 H61 DA A 4 -1.273 -3.872 -2.972 1.00 0.00 H new ATOM 0 H62 DA A 4 -2.393 -3.360 -1.705 1.00 0.00 H new ATOM 0 H2 DA A 4 0.669 -7.615 -1.506 1.00 0.00 H new HETATM 140 P XCS A 5 -0.698 -8.769 6.665 1.00 0.00 P HETATM 141 OP2 XCS A 5 -1.455 -7.897 7.592 1.00 0.00 O HETATM 142 C6 XCS A 5 0.750 -3.645 2.129 1.00 0.00 C HETATM 143 C2 XCS A 5 1.927 -3.178 0.082 1.00 0.00 C HETATM 144 O2 XCS A 5 2.952 -3.269 -0.590 1.00 0.00 O HETATM 145 N3 XCS A 5 0.821 -2.526 -0.401 1.00 0.00 N HETATM 146 C4 XCS A 5 -0.301 -2.418 0.327 1.00 0.00 C HETATM 147 N4 XCS A 5 -1.336 -1.777 -0.214 1.00 0.00 N HETATM 148 C5 XCS A 5 -0.378 -2.979 1.635 1.00 0.00 C HETATM 149 OP1 XCS A 5 -0.266 -10.114 7.106 1.00 0.00 O HETATM 150 O5' XCS A 5 0.604 -7.959 6.166 1.00 0.00 O HETATM 151 C5' XCS A 5 1.136 -8.170 4.853 1.00 0.00 C HETATM 152 C4' XCS A 5 2.240 -7.168 4.509 1.00 0.00 C HETATM 153 O4' XCS A 5 1.759 -6.280 3.490 1.00 0.00 O HETATM 154 C1' XCS A 5 1.896 -4.907 3.875 1.00 0.00 C HETATM 155 ND XCS A 5 1.896 -3.746 1.360 1.00 0.00 N HETATM 156 CP XCS A 5 -1.554 -2.862 2.401 1.00 0.00 C HETATM 157 CD XCS A 5 -0.468 -4.101 4.184 1.00 0.00 C HETATM 158 C8 XCS A 5 0.732 -4.226 3.422 1.00 0.00 C HETATM 159 C7 XCS A 5 -1.591 -3.425 3.673 1.00 0.00 C HETATM 160 C7A XCS A 5 -2.858 -3.309 4.517 1.00 0.00 C HETATM 161 C2' XCS A 5 1.982 -4.943 5.406 1.00 0.00 C HETATM 162 C3' XCS A 5 2.683 -6.270 5.662 1.00 0.00 C HETATM 163 O3' XCS A 5 4.085 -6.043 5.509 1.00 0.00 O HETATM 0 HN42 XCS A 5 -2.205 -1.676 0.311 1.00 0.00 H new HETATM 0 HN41 XCS A 5 -1.260 -1.387 -1.153 1.00 0.00 H new HETATM 0 H7A3 XCS A 5 -3.088 -2.257 4.686 1.00 0.00 H new HETATM 0 H7A2 XCS A 5 -3.689 -3.782 3.993 1.00 0.00 H new HETATM 0 H7A1 XCS A 5 -2.704 -3.805 5.475 1.00 0.00 H new HETATM 0 H5'2 XCS A 5 1.532 -9.183 4.782 1.00 0.00 H new HETATM 0 H5'1 XCS A 5 0.333 -8.089 4.120 1.00 0.00 H new HETATM 0 H2'2 XCS A 5 2.550 -4.101 5.801 1.00 0.00 H new HETATM 0 H2'1 XCS A 5 0.996 -4.908 5.869 1.00 0.00 H new HETATM 0 HP XCS A 5 -2.423 -2.338 2.003 1.00 0.00 H new HETATM 0 HND XCS A 5 2.715 -4.233 1.724 1.00 0.00 H new HETATM 0 HD XCS A 5 -0.515 -4.538 5.182 1.00 0.00 H new HETATM 0 H4' XCS A 5 3.091 -7.781 4.210 1.00 0.00 H new HETATM 0 H3' XCS A 5 2.463 -6.691 6.643 1.00 0.00 H new HETATM 0 H1' XCS A 5 2.765 -4.397 3.459 1.00 0.00 H new HETATM 179 P XGA A 6 5.030 -5.869 6.802 1.00 0.00 P HETATM 180 OP1 XGA A 6 5.861 -7.087 6.937 1.00 0.00 O HETATM 181 OP2 XGA A 6 4.191 -5.420 7.937 1.00 0.00 O HETATM 182 C5' XGA A 6 6.388 -4.478 5.011 1.00 0.00 C HETATM 183 O5' XGA A 6 5.989 -4.650 6.375 1.00 0.00 O HETATM 184 C4' XGA A 6 6.965 -3.087 4.767 1.00 0.00 C HETATM 185 O4' XGA A 6 5.929 -2.236 4.255 1.00 0.00 O HETATM 186 C3' XGA A 6 7.491 -2.384 6.018 1.00 0.00 C HETATM 187 C2' XGA A 6 6.378 -1.423 6.406 1.00 0.00 C HETATM 188 C1' XGA A 6 5.798 -1.054 5.047 1.00 0.00 C HETATM 189 N9 XGA A 6 4.404 -0.640 5.091 1.00 0.00 N HETATM 190 C8 XGA A 6 3.478 -0.972 6.051 1.00 0.00 C HETATM 191 N7 XGA A 6 2.304 -0.443 5.806 1.00 0.00 N HETATM 192 C4 XGA A 6 3.269 1.555 2.260 1.00 0.00 C HETATM 193 C5 XGA A 6 1.942 1.675 2.724 1.00 0.00 C HETATM 194 N3 XGA A 6 3.691 2.149 1.137 1.00 0.00 N HETATM 195 C2 XGA A 6 2.785 2.881 0.451 1.00 0.00 C HETATM 196 N2 XGA A 6 3.190 3.484 -0.692 1.00 0.00 N HETATM 197 N1 XGA A 6 1.501 3.047 0.825 1.00 0.00 N HETATM 198 C6 XGA A 6 1.043 2.443 1.980 1.00 0.00 C HETATM 199 O6 XGA A 6 -0.131 2.578 2.325 1.00 0.00 O HETATM 200 C10 XGA A 6 3.770 0.160 4.166 1.00 0.00 C HETATM 201 C11 XGA A 6 2.464 0.262 4.643 1.00 0.00 C HETATM 202 CP XGA A 6 1.535 1.025 3.921 1.00 0.00 C HETATM 203 CD XGA A 6 4.189 0.796 2.982 1.00 0.00 C HETATM 204 O3' XGA A 6 8.609 -1.590 5.614 1.00 0.00 O HETATM 0 HN22 XGA A 6 2.532 4.044 -1.234 1.00 0.00 H new HETATM 0 HN21 XGA A 6 4.153 3.378 -1.011 1.00 0.00 H new HETATM 0 H5'2 XGA A 6 7.131 -5.232 4.751 1.00 0.00 H new HETATM 0 H5'1 XGA A 6 5.530 -4.637 4.357 1.00 0.00 H new HETATM 0 H2'2 XGA A 6 5.638 -1.894 7.052 1.00 0.00 H new HETATM 0 H2'1 XGA A 6 6.758 -0.551 6.939 1.00 0.00 H new HETATM 0 HP XGA A 6 0.508 1.119 4.275 1.00 0.00 H new HETATM 0 HN1 XGA A 6 0.871 3.615 0.259 1.00 0.00 H new HETATM 0 HD XGA A 6 5.217 0.697 2.635 1.00 0.00 H new HETATM 0 H8 XGA A 6 3.694 -1.601 6.914 1.00 0.00 H new HETATM 0 H4' XGA A 6 7.798 -3.243 4.082 1.00 0.00 H new HETATM 0 H3' XGA A 6 7.769 -3.071 6.817 1.00 0.00 H new HETATM 0 H1' XGA A 6 6.331 -0.193 4.643 1.00 0.00 H new ATOM 218 P DC A 7 9.946 -1.542 6.511 1.00 0.00 P ATOM 219 OP1 DC A 7 10.912 -2.516 5.956 1.00 0.00 O ATOM 220 OP2 DC A 7 9.553 -1.623 7.936 1.00 0.00 O ATOM 221 O5' DC A 7 10.505 -0.059 6.228 1.00 0.00 O ATOM 222 C5' DC A 7 10.605 0.444 4.891 1.00 0.00 C ATOM 223 C4' DC A 7 10.610 1.970 4.865 1.00 0.00 C ATOM 224 O4' DC A 7 9.290 2.438 4.540 1.00 0.00 O ATOM 225 C3' DC A 7 10.957 2.629 6.201 1.00 0.00 C ATOM 226 O3' DC A 7 11.640 3.850 5.904 1.00 0.00 O ATOM 227 C2' DC A 7 9.604 3.004 6.787 1.00 0.00 C ATOM 228 C1' DC A 7 8.819 3.359 5.530 1.00 0.00 C ATOM 229 N1 DC A 7 7.347 3.206 5.675 1.00 0.00 N ATOM 230 C2 DC A 7 6.559 3.545 4.579 1.00 0.00 C ATOM 231 O2 DC A 7 7.079 3.941 3.536 1.00 0.00 O ATOM 232 N3 DC A 7 5.207 3.436 4.686 1.00 0.00 N ATOM 233 C4 DC A 7 4.641 3.011 5.822 1.00 0.00 C ATOM 234 N4 DC A 7 3.312 2.941 5.867 1.00 0.00 N ATOM 235 C5 DC A 7 5.438 2.656 6.952 1.00 0.00 C ATOM 236 C6 DC A 7 6.774 2.767 6.841 1.00 0.00 C ATOM 0 H5' DC A 7 9.770 0.072 4.298 1.00 0.00 H new ATOM 0 H5'' DC A 7 11.517 0.068 4.427 1.00 0.00 H new ATOM 0 H4' DC A 7 11.374 2.238 4.135 1.00 0.00 H new ATOM 0 H3' DC A 7 11.558 1.999 6.856 1.00 0.00 H new ATOM 0 H2' DC A 7 9.151 2.178 7.335 1.00 0.00 H new ATOM 0 H2'' DC A 7 9.674 3.844 7.478 1.00 0.00 H new ATOM 0 H1' DC A 7 8.975 4.409 5.282 1.00 0.00 H new ATOM 0 H41 DC A 7 2.847 2.621 6.717 1.00 0.00 H new ATOM 0 H42 DC A 7 2.759 3.207 5.052 1.00 0.00 H new ATOM 0 H5 DC A 7 4.982 2.309 7.868 1.00 0.00 H new ATOM 0 H6 DC A 7 7.403 2.507 7.680 1.00 0.00 H new HETATM 248 P XAE A 8 12.757 4.427 6.912 1.00 0.00 P HETATM 249 OP1 XAE A 8 14.014 3.679 6.688 1.00 0.00 O HETATM 250 OP2 XAE A 8 12.167 4.492 8.268 1.00 0.00 O HETATM 251 C5' XAE A 8 12.766 6.264 5.006 1.00 0.00 C HETATM 252 C4' XAE A 8 12.279 7.701 4.841 1.00 0.00 C HETATM 253 O4' XAE A 8 10.847 7.720 4.950 1.00 0.00 O HETATM 254 C3' XAE A 8 12.770 8.666 5.914 1.00 0.00 C HETATM 255 C2' XAE A 8 11.670 8.620 6.961 1.00 0.00 C HETATM 256 C1' XAE A 8 10.425 8.479 6.091 1.00 0.00 C HETATM 257 O5' XAE A 8 12.966 5.934 6.384 1.00 0.00 O HETATM 258 N9 XAE A 8 9.317 7.803 6.750 1.00 0.00 N HETATM 259 C8 XAE A 8 9.406 6.880 7.765 1.00 0.00 C HETATM 260 N7 XAE A 8 8.227 6.447 8.141 1.00 0.00 N HETATM 261 C5 XAE A 8 5.210 7.831 6.386 1.00 0.00 C HETATM 262 C4 XAE A 8 5.881 8.696 5.497 1.00 0.00 C HETATM 263 C6 XAE A 8 3.787 7.792 6.312 1.00 0.00 C HETATM 264 N6 XAE A 8 3.059 7.004 7.104 1.00 0.00 N HETATM 265 N1 XAE A 8 3.155 8.562 5.420 1.00 0.00 N HETATM 266 C2 XAE A 8 3.897 9.340 4.632 1.00 0.00 C HETATM 267 N3 XAE A 8 5.230 9.483 4.586 1.00 0.00 N HETATM 268 C10 XAE A 8 7.979 7.971 6.460 1.00 0.00 C HETATM 269 C11 XAE A 8 7.331 7.110 7.346 1.00 0.00 C HETATM 270 CP XAE A 8 5.931 7.033 7.315 1.00 0.00 C HETATM 271 CD XAE A 8 7.275 8.767 5.534 1.00 0.00 C HETATM 272 O3' XAE A 8 12.753 9.978 5.341 1.00 0.00 O HETATM 0 HN62 XAE A 8 2.042 7.001 7.025 1.00 0.00 H new HETATM 0 HN61 XAE A 8 3.519 6.405 7.789 1.00 0.00 H new HETATM 0 H5'2 XAE A 8 12.039 5.580 4.569 1.00 0.00 H new HETATM 0 H5'1 XAE A 8 13.699 6.130 4.459 1.00 0.00 H new HETATM 0 H2'2 XAE A 8 11.790 7.779 7.645 1.00 0.00 H new HETATM 0 H2'1 XAE A 8 11.645 9.524 7.569 1.00 0.00 H new HETATM 0 HP XAE A 8 5.401 6.368 7.997 1.00 0.00 H new HETATM 0 HD XAE A 8 7.812 9.430 4.855 1.00 0.00 H new HETATM 0 H8 XAE A 8 10.346 6.547 8.205 1.00 0.00 H new HETATM 0 H4' XAE A 8 12.666 8.022 3.874 1.00 0.00 H new HETATM 0 H3' XAE A 8 13.760 8.429 6.303 1.00 0.00 H new HETATM 0 H2 XAE A 8 3.339 9.949 3.921 1.00 0.00 H new HETATM 0 H1' XAE A 8 10.042 9.468 5.841 1.00 0.00 H new HETATM 286 P XGA A 9 13.741 11.129 5.886 1.00 0.00 P HETATM 287 OP1 XGA A 9 14.865 11.262 4.932 1.00 0.00 O HETATM 288 OP2 XGA A 9 14.014 10.870 7.317 1.00 0.00 O HETATM 289 C5' XGA A 9 12.027 12.698 4.621 1.00 0.00 C HETATM 290 O5' XGA A 9 12.830 12.452 5.781 1.00 0.00 O HETATM 291 C4' XGA A 9 10.914 13.703 4.906 1.00 0.00 C HETATM 292 O4' XGA A 9 9.757 12.996 5.382 1.00 0.00 O HETATM 293 C3' XGA A 9 11.235 14.726 5.998 1.00 0.00 C HETATM 294 C2' XGA A 9 10.577 14.151 7.241 1.00 0.00 C HETATM 295 C1' XGA A 9 9.332 13.511 6.648 1.00 0.00 C HETATM 296 N9 XGA A 9 8.779 12.444 7.463 1.00 0.00 N HETATM 297 C8 XGA A 9 9.482 11.434 8.067 1.00 0.00 C HETATM 298 N7 XGA A 9 8.699 10.618 8.731 1.00 0.00 N HETATM 299 C4 XGA A 9 5.049 12.496 7.922 1.00 0.00 C HETATM 300 C5 XGA A 9 5.012 11.339 8.727 1.00 0.00 C HETATM 301 N3 XGA A 9 3.943 13.178 7.599 1.00 0.00 N HETATM 302 C2 XGA A 9 2.768 12.711 8.080 1.00 0.00 C HETATM 303 N2 XGA A 9 1.639 13.387 7.759 1.00 0.00 N HETATM 304 N1 XGA A 9 2.646 11.614 8.854 1.00 0.00 N HETATM 305 C6 XGA A 9 3.777 10.895 9.199 1.00 0.00 C HETATM 306 O6 XGA A 9 3.682 9.887 9.894 1.00 0.00 O HETATM 307 C10 XGA A 9 7.447 12.262 7.764 1.00 0.00 C HETATM 308 C11 XGA A 9 7.435 11.115 8.556 1.00 0.00 C HETATM 309 CP XGA A 9 6.210 10.642 9.046 1.00 0.00 C HETATM 310 CD XGA A 9 6.271 12.962 7.439 1.00 0.00 C HETATM 311 O3' XGA A 9 10.527 15.925 5.665 1.00 0.00 O HETATM 0 HN22 XGA A 9 0.735 13.063 8.104 1.00 0.00 H new HETATM 0 HN21 XGA A 9 1.693 14.220 7.172 1.00 0.00 H new HETATM 0 H5'2 XGA A 9 12.658 13.073 3.815 1.00 0.00 H new HETATM 0 H5'1 XGA A 9 11.591 11.761 4.275 1.00 0.00 H new HETATM 0 H2'2 XGA A 9 11.214 13.423 7.744 1.00 0.00 H new HETATM 0 H2'1 XGA A 9 10.335 14.922 7.972 1.00 0.00 H new HETATM 0 HP XGA A 9 6.176 9.747 9.667 1.00 0.00 H new HETATM 0 HN1 XGA A 9 1.727 11.316 9.183 1.00 0.00 H new HETATM 0 HD XGA A 9 6.315 13.857 6.818 1.00 0.00 H new HETATM 0 H8 XGA A 9 10.564 11.322 8.003 1.00 0.00 H new HETATM 0 H4' XGA A 9 10.767 14.232 3.964 1.00 0.00 H new HETATM 0 H3' XGA A 9 12.300 14.922 6.118 1.00 0.00 H new HETATM 0 H1' XGA A 9 8.530 14.246 6.575 1.00 0.00 H new ATOM 325 P DT A 10 11.017 17.361 6.211 1.00 0.00 P ATOM 326 OP1 DT A 10 11.179 18.265 5.050 1.00 0.00 O ATOM 327 OP2 DT A 10 12.149 17.147 7.142 1.00 0.00 O ATOM 328 O5' DT A 10 9.748 17.866 7.069 1.00 0.00 O ATOM 329 C5' DT A 10 8.531 17.110 7.087 1.00 0.00 C ATOM 330 C4' DT A 10 7.479 17.733 7.999 1.00 0.00 C ATOM 331 O4' DT A 10 6.713 16.678 8.600 1.00 0.00 O ATOM 332 C3' DT A 10 8.036 18.555 9.166 1.00 0.00 C ATOM 333 O3' DT A 10 7.155 19.636 9.481 1.00 0.00 O ATOM 334 C2' DT A 10 8.067 17.542 10.304 1.00 0.00 C ATOM 335 C1' DT A 10 6.813 16.721 10.024 1.00 0.00 C ATOM 336 N1 DT A 10 6.886 15.331 10.543 1.00 0.00 N ATOM 337 C2 DT A 10 5.707 14.760 11.005 1.00 0.00 C ATOM 338 O2 DT A 10 4.632 15.356 10.989 1.00 0.00 O ATOM 339 N3 DT A 10 5.806 13.469 11.488 1.00 0.00 N ATOM 340 C4 DT A 10 6.958 12.707 11.552 1.00 0.00 C ATOM 341 O4 DT A 10 6.923 11.566 12.004 1.00 0.00 O ATOM 342 C5 DT A 10 8.136 13.377 11.052 1.00 0.00 C ATOM 343 C7 DT A 10 9.481 12.653 11.079 1.00 0.00 C ATOM 344 C6 DT A 10 8.070 14.634 10.572 1.00 0.00 C ATOM 0 H5' DT A 10 8.742 16.094 7.420 1.00 0.00 H new ATOM 0 H5'' DT A 10 8.135 17.038 6.074 1.00 0.00 H new ATOM 0 H4' DT A 10 6.906 18.402 7.357 1.00 0.00 H new ATOM 0 H3' DT A 10 9.007 19.005 8.958 1.00 0.00 H new ATOM 0 H2' DT A 10 8.969 16.931 10.283 1.00 0.00 H new ATOM 0 H2'' DT A 10 8.031 18.023 11.281 1.00 0.00 H new ATOM 0 HO3' DT A 10 7.523 20.151 10.229 1.00 0.00 H new ATOM 0 H1' DT A 10 5.956 17.178 10.520 1.00 0.00 H new ATOM 0 H3 DT A 10 4.947 13.037 11.830 1.00 0.00 H new ATOM 0 H71 DT A 10 10.100 13.005 10.254 1.00 0.00 H new ATOM 0 H72 DT A 10 9.985 12.857 12.024 1.00 0.00 H new ATOM 0 H73 DT A 10 9.319 11.580 10.979 1.00 0.00 H new ATOM 0 H6 DT A 10 8.968 15.105 10.201 1.00 0.00 H new TER 358 DT A 10 HETATM 359 C5' XAE B 11 -3.785 5.001 15.085 1.00 0.00 C HETATM 360 C4' XAE B 11 -4.123 6.414 14.614 1.00 0.00 C HETATM 361 O4' XAE B 11 -2.996 7.267 14.857 1.00 0.00 O HETATM 362 C3' XAE B 11 -4.404 6.536 13.122 1.00 0.00 C HETATM 363 C2' XAE B 11 -3.062 6.923 12.521 1.00 0.00 C HETATM 364 C1' XAE B 11 -2.427 7.751 13.632 1.00 0.00 C HETATM 365 O5' XAE B 11 -3.136 4.243 14.060 1.00 0.00 O HETATM 366 N9 XAE B 11 -0.981 7.611 13.689 1.00 0.00 N HETATM 367 C8 XAE B 11 -0.295 6.494 14.096 1.00 0.00 C HETATM 368 N7 XAE B 11 1.003 6.673 14.063 1.00 0.00 N HETATM 369 C5 XAE B 11 2.285 10.011 12.930 1.00 0.00 C HETATM 370 C4 XAE B 11 1.041 10.625 12.674 1.00 0.00 C HETATM 371 C6 XAE B 11 3.459 10.784 12.695 1.00 0.00 C HETATM 372 N6 XAE B 11 4.681 10.295 12.907 1.00 0.00 N HETATM 373 N1 XAE B 11 3.340 12.039 12.250 1.00 0.00 N HETATM 374 C2 XAE B 11 2.112 12.514 12.044 1.00 0.00 C HETATM 375 N3 XAE B 11 0.924 11.912 12.219 1.00 0.00 N HETATM 376 C10 XAE B 11 -0.048 8.577 13.369 1.00 0.00 C HETATM 377 C11 XAE B 11 1.176 7.954 13.616 1.00 0.00 C HETATM 378 CP XAE B 11 2.359 8.672 13.397 1.00 0.00 C HETATM 379 CD XAE B 11 -0.136 9.904 12.903 1.00 0.00 C HETATM 380 O3' XAE B 11 -5.281 7.655 12.947 1.00 0.00 O HETATM 0 HN62 XAE B 11 5.501 10.875 12.729 1.00 0.00 H new HETATM 0 HN61 XAE B 11 4.796 9.340 13.248 1.00 0.00 H new HETATM 0 H5'2 XAE B 11 -3.140 5.054 15.962 1.00 0.00 H new HETATM 0 H5'1 XAE B 11 -4.698 4.491 15.392 1.00 0.00 H new HETATM 0 H2'2 XAE B 11 -2.461 6.048 12.274 1.00 0.00 H new HETATM 0 H2'1 XAE B 11 -3.180 7.499 11.603 1.00 0.00 H new HETATM 0 HP XAE B 11 3.327 8.207 13.583 1.00 0.00 H new HETATM 0 HD XAE B 11 -1.108 10.363 12.723 1.00 0.00 H new HETATM 0 H8 XAE B 11 -0.774 5.566 14.410 1.00 0.00 H new HETATM 0 H4' XAE B 11 -5.024 6.688 15.163 1.00 0.00 H new HETATM 0 H3' XAE B 11 -4.833 5.634 12.686 1.00 0.00 H new HETATM 0 H2 XAE B 11 2.065 13.541 11.681 1.00 0.00 H new HETATM 0 H1' XAE B 11 -2.623 8.808 13.454 1.00 0.00 H new ATOM 395 P DC B 12 -6.491 7.593 11.884 1.00 0.00 P ATOM 396 OP1 DC B 12 -6.265 6.438 10.985 1.00 0.00 O ATOM 397 OP2 DC B 12 -7.765 7.707 12.628 1.00 0.00 O ATOM 398 O5' DC B 12 -6.288 8.942 11.025 1.00 0.00 O ATOM 399 C5' DC B 12 -5.363 9.953 11.443 1.00 0.00 C ATOM 400 C4' DC B 12 -5.070 10.949 10.324 1.00 0.00 C ATOM 401 O4' DC B 12 -3.650 11.137 10.228 1.00 0.00 O ATOM 402 C3' DC B 12 -5.517 10.501 8.932 1.00 0.00 C ATOM 403 O3' DC B 12 -5.897 11.682 8.219 1.00 0.00 O ATOM 404 C2' DC B 12 -4.250 9.969 8.278 1.00 0.00 C ATOM 405 C1' DC B 12 -3.172 10.836 8.912 1.00 0.00 C ATOM 406 N1 DC B 12 -1.874 10.132 9.031 1.00 0.00 N ATOM 407 C2 DC B 12 -0.756 10.723 8.457 1.00 0.00 C ATOM 408 O2 DC B 12 -0.855 11.792 7.855 1.00 0.00 O ATOM 409 N3 DC B 12 0.445 10.094 8.575 1.00 0.00 N ATOM 410 C4 DC B 12 0.548 8.930 9.229 1.00 0.00 C ATOM 411 N4 DC B 12 1.751 8.367 9.317 1.00 0.00 N ATOM 412 C5 DC B 12 -0.596 8.315 9.819 1.00 0.00 C ATOM 413 C6 DC B 12 -1.779 8.945 9.698 1.00 0.00 C ATOM 0 H5' DC B 12 -4.433 9.484 11.765 1.00 0.00 H new ATOM 0 H5'' DC B 12 -5.768 10.483 12.305 1.00 0.00 H new ATOM 0 H4' DC B 12 -5.626 11.847 10.593 1.00 0.00 H new ATOM 0 H3' DC B 12 -6.329 9.774 8.949 1.00 0.00 H new ATOM 0 H2' DC B 12 -4.097 8.910 8.488 1.00 0.00 H new ATOM 0 H2'' DC B 12 -4.275 10.078 7.194 1.00 0.00 H new ATOM 0 H1' DC B 12 -2.997 11.718 8.296 1.00 0.00 H new ATOM 0 H41 DC B 12 1.864 7.480 9.808 1.00 0.00 H new ATOM 0 H42 DC B 12 2.559 8.822 8.893 1.00 0.00 H new ATOM 0 H5 DC B 12 -0.515 7.375 10.345 1.00 0.00 H new ATOM 0 H6 DC B 12 -2.664 8.506 10.134 1.00 0.00 H new ATOM 425 P DT B 13 -6.958 11.608 7.009 1.00 0.00 P ATOM 426 OP1 DT B 13 -7.838 12.796 7.094 1.00 0.00 O ATOM 427 OP2 DT B 13 -7.551 10.252 6.986 1.00 0.00 O ATOM 428 O5' DT B 13 -6.019 11.768 5.711 1.00 0.00 O ATOM 429 C5' DT B 13 -4.908 12.670 5.722 1.00 0.00 C ATOM 430 C4' DT B 13 -4.021 12.493 4.492 1.00 0.00 C ATOM 431 O4' DT B 13 -2.802 11.840 4.882 1.00 0.00 O ATOM 432 C3' DT B 13 -4.618 11.618 3.386 1.00 0.00 C ATOM 433 O3' DT B 13 -4.202 12.176 2.137 1.00 0.00 O ATOM 434 C2' DT B 13 -3.907 10.281 3.540 1.00 0.00 C ATOM 435 C1' DT B 13 -2.535 10.724 4.032 1.00 0.00 C ATOM 436 N1 DT B 13 -1.817 9.682 4.809 1.00 0.00 N ATOM 437 C2 DT B 13 -0.435 9.639 4.690 1.00 0.00 C ATOM 438 O2 DT B 13 0.193 10.421 3.979 1.00 0.00 O ATOM 439 N3 DT B 13 0.209 8.657 5.420 1.00 0.00 N ATOM 440 C4 DT B 13 -0.395 7.727 6.246 1.00 0.00 C ATOM 441 O4 DT B 13 0.286 6.897 6.844 1.00 0.00 O ATOM 442 C5 DT B 13 -1.833 7.843 6.312 1.00 0.00 C ATOM 443 C7 DT B 13 -2.627 6.869 7.180 1.00 0.00 C ATOM 444 C6 DT B 13 -2.487 8.792 5.613 1.00 0.00 C ATOM 0 H5' DT B 13 -4.317 12.507 6.623 1.00 0.00 H new ATOM 0 H5'' DT B 13 -5.273 13.696 5.762 1.00 0.00 H new ATOM 0 H4' DT B 13 -3.885 13.501 4.099 1.00 0.00 H new ATOM 0 H3' DT B 13 -5.704 11.539 3.433 1.00 0.00 H new ATOM 0 H2' DT B 13 -4.409 9.629 4.255 1.00 0.00 H new ATOM 0 H2'' DT B 13 -3.849 9.736 2.598 1.00 0.00 H new ATOM 0 H1' DT B 13 -1.890 10.949 3.183 1.00 0.00 H new ATOM 0 H3 DT B 13 1.225 8.615 5.342 1.00 0.00 H new ATOM 0 H71 DT B 13 -3.528 7.360 7.547 1.00 0.00 H new ATOM 0 H72 DT B 13 -2.904 5.997 6.588 1.00 0.00 H new ATOM 0 H73 DT B 13 -2.016 6.554 8.026 1.00 0.00 H new ATOM 0 H6 DT B 13 -3.563 8.854 5.687 1.00 0.00 H new HETATM 457 P XGA B 14 -5.079 11.950 0.804 1.00 0.00 P HETATM 458 OP1 XGA B 14 -5.467 13.277 0.275 1.00 0.00 O HETATM 459 OP2 XGA B 14 -6.121 10.939 1.094 1.00 0.00 O HETATM 460 C5' XGA B 14 -2.734 11.901 -0.415 1.00 0.00 C HETATM 461 O5' XGA B 14 -4.014 11.295 -0.209 1.00 0.00 O HETATM 462 C4' XGA B 14 -1.797 10.984 -1.196 1.00 0.00 C HETATM 463 O4' XGA B 14 -1.064 10.169 -0.269 1.00 0.00 O HETATM 464 C3' XGA B 14 -2.499 10.004 -2.137 1.00 0.00 C HETATM 465 C2' XGA B 14 -2.524 8.694 -1.363 1.00 0.00 C HETATM 466 C1' XGA B 14 -1.230 8.779 -0.562 1.00 0.00 C HETATM 467 N9 XGA B 14 -1.253 8.013 0.675 1.00 0.00 N HETATM 468 C8 XGA B 14 -2.362 7.696 1.421 1.00 0.00 C HETATM 469 N7 XGA B 14 -2.056 6.996 2.486 1.00 0.00 N HETATM 470 C4 XGA B 14 2.085 6.804 1.920 1.00 0.00 C HETATM 471 C5 XGA B 14 1.560 6.163 3.061 1.00 0.00 C HETATM 472 N3 XGA B 14 3.395 6.807 1.641 1.00 0.00 N HETATM 473 C2 XGA B 14 4.211 6.162 2.507 1.00 0.00 C HETATM 474 N2 XGA B 14 5.539 6.150 2.240 1.00 0.00 N HETATM 475 N1 XGA B 14 3.789 5.527 3.618 1.00 0.00 N HETATM 476 C6 XGA B 14 2.441 5.511 3.924 1.00 0.00 C HETATM 477 O6 XGA B 14 2.041 4.922 4.926 1.00 0.00 O HETATM 478 C10 XGA B 14 -0.157 7.473 1.314 1.00 0.00 C HETATM 479 C11 XGA B 14 -0.697 6.847 2.438 1.00 0.00 C HETATM 480 CP XGA B 14 0.163 6.183 3.324 1.00 0.00 C HETATM 481 CD XGA B 14 1.224 7.462 1.040 1.00 0.00 C HETATM 482 O3' XGA B 14 -1.638 9.811 -3.263 1.00 0.00 O HETATM 0 HN22 XGA B 14 6.182 5.673 2.872 1.00 0.00 H new HETATM 0 HN21 XGA B 14 5.896 6.618 1.407 1.00 0.00 H new HETATM 0 H5'2 XGA B 14 -2.858 12.840 -0.954 1.00 0.00 H new HETATM 0 H5'1 XGA B 14 -2.286 12.144 0.549 1.00 0.00 H new HETATM 0 H2'2 XGA B 14 -3.399 8.617 -0.718 1.00 0.00 H new HETATM 0 H2'1 XGA B 14 -2.539 7.828 -2.025 1.00 0.00 H new HETATM 0 HP XGA B 14 -0.236 5.686 4.208 1.00 0.00 H new HETATM 0 HN1 XGA B 14 4.460 5.061 4.229 1.00 0.00 H new HETATM 0 HD XGA B 14 1.615 7.960 0.153 1.00 0.00 H new HETATM 0 H8 XGA B 14 -3.378 7.992 1.158 1.00 0.00 H new HETATM 0 H4' XGA B 14 -1.178 11.653 -1.793 1.00 0.00 H new HETATM 0 H3' XGA B 14 -3.486 10.339 -2.455 1.00 0.00 H new HETATM 0 H1' XGA B 14 -0.411 8.353 -1.141 1.00 0.00 H new ATOM 496 P DC B 15 -2.242 9.390 -4.697 1.00 0.00 P ATOM 497 OP1 DC B 15 -2.285 10.597 -5.553 1.00 0.00 O ATOM 498 OP2 DC B 15 -3.475 8.603 -4.471 1.00 0.00 O ATOM 499 O5' DC B 15 -1.115 8.399 -5.283 1.00 0.00 O ATOM 500 C5' DC B 15 0.141 8.239 -4.615 1.00 0.00 C ATOM 501 C4' DC B 15 0.875 6.981 -5.073 1.00 0.00 C ATOM 502 O4' DC B 15 1.038 6.108 -3.948 1.00 0.00 O ATOM 503 C3' DC B 15 0.143 6.152 -6.126 1.00 0.00 C ATOM 504 O3' DC B 15 1.144 5.493 -6.906 1.00 0.00 O ATOM 505 C2' DC B 15 -0.576 5.077 -5.324 1.00 0.00 C ATOM 506 C1' DC B 15 0.385 4.852 -4.161 1.00 0.00 C ATOM 507 N1 DC B 15 -0.303 4.464 -2.908 1.00 0.00 N ATOM 508 C2 DC B 15 0.254 3.434 -2.164 1.00 0.00 C ATOM 509 O2 DC B 15 1.284 2.879 -2.542 1.00 0.00 O ATOM 510 N3 DC B 15 -0.350 3.069 -1.001 1.00 0.00 N ATOM 511 C4 DC B 15 -1.457 3.690 -0.578 1.00 0.00 C ATOM 512 N4 DC B 15 -1.982 3.299 0.584 1.00 0.00 N ATOM 513 C5 DC B 15 -2.041 4.751 -1.337 1.00 0.00 C ATOM 514 C6 DC B 15 -1.437 5.105 -2.488 1.00 0.00 C ATOM 0 H5' DC B 15 -0.024 8.191 -3.539 1.00 0.00 H new ATOM 0 H5'' DC B 15 0.766 9.112 -4.803 1.00 0.00 H new ATOM 0 H4' DC B 15 1.807 7.342 -5.508 1.00 0.00 H new ATOM 0 H3' DC B 15 -0.523 6.740 -6.758 1.00 0.00 H new ATOM 0 H2' DC B 15 -1.557 5.409 -4.984 1.00 0.00 H new ATOM 0 H2'' DC B 15 -0.731 4.169 -5.906 1.00 0.00 H new ATOM 0 H1' DC B 15 1.066 4.038 -4.409 1.00 0.00 H new ATOM 0 H41 DC B 15 -2.826 3.749 0.939 1.00 0.00 H new ATOM 0 H42 DC B 15 -1.540 2.550 1.117 1.00 0.00 H new ATOM 0 H5 DC B 15 -2.936 5.252 -0.999 1.00 0.00 H new ATOM 0 H6 DC B 15 -1.852 5.903 -3.086 1.00 0.00 H new ATOM 526 P DG B 16 0.899 5.180 -8.467 1.00 0.00 P ATOM 527 OP1 DG B 16 1.553 6.244 -9.261 1.00 0.00 O ATOM 528 OP2 DG B 16 -0.539 4.890 -8.665 1.00 0.00 O ATOM 529 O5' DG B 16 1.722 3.813 -8.681 1.00 0.00 O ATOM 530 C5' DG B 16 3.025 3.652 -8.113 1.00 0.00 C ATOM 531 C4' DG B 16 3.430 2.184 -8.026 1.00 0.00 C ATOM 532 O4' DG B 16 3.034 1.668 -6.748 1.00 0.00 O ATOM 533 C3' DG B 16 2.771 1.269 -9.059 1.00 0.00 C ATOM 534 O3' DG B 16 3.730 0.258 -9.383 1.00 0.00 O ATOM 535 C2' DG B 16 1.639 0.586 -8.300 1.00 0.00 C ATOM 536 C1' DG B 16 2.210 0.507 -6.890 1.00 0.00 C ATOM 537 N9 DG B 16 1.174 0.542 -5.837 1.00 0.00 N ATOM 538 C8 DG B 16 -0.138 0.942 -5.921 1.00 0.00 C ATOM 539 N7 DG B 16 -0.784 0.857 -4.793 1.00 0.00 N ATOM 540 C5 DG B 16 0.162 0.369 -3.899 1.00 0.00 C ATOM 541 C6 DG B 16 0.039 0.073 -2.515 1.00 0.00 C ATOM 542 O6 DG B 16 -0.947 0.207 -1.796 1.00 0.00 O ATOM 543 N1 DG B 16 1.230 -0.402 -1.984 1.00 0.00 N ATOM 544 C2 DG B 16 2.400 -0.566 -2.695 1.00 0.00 C ATOM 545 N2 DG B 16 3.466 -1.015 -2.028 1.00 0.00 N ATOM 546 N3 DG B 16 2.523 -0.289 -3.995 1.00 0.00 N ATOM 547 C4 DG B 16 1.366 0.172 -4.528 1.00 0.00 C ATOM 0 H5' DG B 16 3.044 4.093 -7.117 1.00 0.00 H new ATOM 0 H5'' DG B 16 3.753 4.194 -8.716 1.00 0.00 H new ATOM 0 H4' DG B 16 4.506 2.179 -8.202 1.00 0.00 H new ATOM 0 H3' DG B 16 2.433 1.794 -9.952 1.00 0.00 H new ATOM 0 H2' DG B 16 0.716 1.165 -8.335 1.00 0.00 H new ATOM 0 H2'' DG B 16 1.412 -0.400 -8.705 1.00 0.00 H new ATOM 0 H1' DG B 16 2.742 -0.437 -6.769 1.00 0.00 H new ATOM 0 H8 DG B 16 -0.591 1.294 -6.836 1.00 0.00 H new ATOM 0 H1 DG B 16 1.241 -0.648 -0.994 1.00 0.00 H new ATOM 0 H21 DG B 16 4.352 -1.151 -2.515 1.00 0.00 H new ATOM 0 H22 DG B 16 3.394 -1.222 -1.032 1.00 0.00 H new HETATM 559 P XTY B 17 3.795 -0.378 -10.862 1.00 0.00 P HETATM 560 OP1 XTY B 17 2.613 0.086 -11.624 1.00 0.00 O HETATM 561 OP2 XTY B 17 5.154 -0.154 -11.402 1.00 0.00 O HETATM 562 C5' XTY B 17 3.769 -2.477 -9.252 1.00 0.00 C HETATM 563 C4' XTY B 17 3.449 -3.968 -9.195 1.00 0.00 C HETATM 564 O4' XTY B 17 2.514 -4.195 -8.131 1.00 0.00 O HETATM 565 C3' XTY B 17 2.781 -4.528 -10.451 1.00 0.00 C HETATM 566 C2' XTY B 17 1.302 -4.547 -10.102 1.00 0.00 C HETATM 567 C1' XTY B 17 1.343 -4.866 -8.606 1.00 0.00 C HETATM 568 O5' XTY B 17 3.621 -1.953 -10.577 1.00 0.00 O HETATM 569 C2 XTY B 17 0.143 -6.699 -5.090 1.00 0.00 C HETATM 570 O2 XTY B 17 0.747 -7.682 -4.670 1.00 0.00 O HETATM 571 N3 XTY B 17 -0.945 -6.187 -4.410 1.00 0.00 N HETATM 572 C4 XTY B 17 -1.675 -5.089 -4.813 1.00 0.00 C HETATM 573 O4 XTY B 17 -2.634 -4.700 -4.154 1.00 0.00 O HETATM 574 C5 XTY B 17 -1.292 -4.446 -5.991 1.00 0.00 C HETATM 575 C6 XTY B 17 -0.180 -4.947 -6.714 1.00 0.00 C HETATM 576 N XTY B 17 0.533 -6.066 -6.266 1.00 0.00 N HETATM 577 CP XTY B 17 -2.005 -3.315 -6.448 1.00 0.00 C HETATM 578 CD XTY B 17 -0.503 -3.178 -8.351 1.00 0.00 C HETATM 579 C8 XTY B 17 0.233 -4.320 -7.911 1.00 0.00 C HETATM 580 C7 XTY B 17 -1.605 -2.690 -7.624 1.00 0.00 C HETATM 581 C7A XTY B 17 -2.363 -1.464 -8.124 1.00 0.00 C HETATM 582 O3' XTY B 17 3.201 -5.889 -10.582 1.00 0.00 O HETATM 0 H7A3 XTY B 17 -3.405 -1.729 -8.305 1.00 0.00 H new HETATM 0 H7A2 XTY B 17 -2.314 -0.675 -7.374 1.00 0.00 H new HETATM 0 H7A1 XTY B 17 -1.912 -1.111 -9.052 1.00 0.00 H new HETATM 0 H5'2 XTY B 17 3.110 -1.937 -8.572 1.00 0.00 H new HETATM 0 H5'1 XTY B 17 4.789 -2.310 -8.907 1.00 0.00 H new HETATM 0 H2'2 XTY B 17 0.821 -3.590 -10.304 1.00 0.00 H new HETATM 0 H2'1 XTY B 17 0.757 -5.303 -10.667 1.00 0.00 H new HETATM 0 HP XTY B 17 -2.859 -2.937 -5.885 1.00 0.00 H new HETATM 0 HN3 XTY B 17 -1.228 -6.654 -3.549 1.00 0.00 H new HETATM 0 HN XTY B 17 1.331 -6.414 -6.797 1.00 0.00 H new HETATM 0 HD XTY B 17 -0.205 -2.673 -9.270 1.00 0.00 H new HETATM 0 H4' XTY B 17 4.411 -4.463 -9.067 1.00 0.00 H new HETATM 0 H3' XTY B 17 3.010 -3.965 -11.356 1.00 0.00 H new HETATM 0 H1' XTY B 17 1.334 -5.944 -8.448 1.00 0.00 H new ATOM 597 P DA B 18 3.876 -6.404 -11.950 1.00 0.00 P ATOM 598 OP1 DA B 18 5.311 -6.039 -11.924 1.00 0.00 O ATOM 599 OP2 DA B 18 3.024 -5.967 -13.079 1.00 0.00 O ATOM 600 O5' DA B 18 3.760 -8.003 -11.824 1.00 0.00 O ATOM 601 C5' DA B 18 4.355 -8.698 -10.723 1.00 0.00 C ATOM 602 C4' DA B 18 3.712 -10.064 -10.512 1.00 0.00 C ATOM 603 O4' DA B 18 2.571 -9.910 -9.657 1.00 0.00 O ATOM 604 C3' DA B 18 3.179 -10.717 -11.783 1.00 0.00 C ATOM 605 O3' DA B 18 3.227 -12.129 -11.582 1.00 0.00 O ATOM 606 C2' DA B 18 1.713 -10.312 -11.824 1.00 0.00 C ATOM 607 C1' DA B 18 1.350 -10.218 -10.342 1.00 0.00 C ATOM 608 N9 DA B 18 0.384 -9.131 -10.064 1.00 0.00 N ATOM 609 C8 DA B 18 0.061 -8.049 -10.848 1.00 0.00 C ATOM 610 N7 DA B 18 -0.802 -7.243 -10.300 1.00 0.00 N ATOM 611 C5 DA B 18 -1.071 -7.829 -9.071 1.00 0.00 C ATOM 612 C6 DA B 18 -1.910 -7.459 -8.012 1.00 0.00 C ATOM 613 N6 DA B 18 -2.655 -6.357 -8.019 1.00 0.00 N ATOM 614 N1 DA B 18 -1.949 -8.257 -6.936 1.00 0.00 N ATOM 615 C2 DA B 18 -1.200 -9.351 -6.917 1.00 0.00 C ATOM 616 N3 DA B 18 -0.369 -9.810 -7.844 1.00 0.00 N ATOM 617 C4 DA B 18 -0.356 -8.982 -8.912 1.00 0.00 C ATOM 0 H5' DA B 18 4.252 -8.102 -9.816 1.00 0.00 H new ATOM 0 H5'' DA B 18 5.423 -8.821 -10.903 1.00 0.00 H new ATOM 0 H4' DA B 18 4.502 -10.693 -10.102 1.00 0.00 H new ATOM 0 H3' DA B 18 3.729 -10.437 -12.681 1.00 0.00 H new ATOM 0 H2' DA B 18 1.570 -9.361 -12.337 1.00 0.00 H new ATOM 0 H2'' DA B 18 1.103 -11.050 -12.344 1.00 0.00 H new ATOM 0 H1' DA B 18 0.890 -11.153 -10.022 1.00 0.00 H new ATOM 0 H8 DA B 18 0.484 -7.883 -11.828 1.00 0.00 H new ATOM 0 H61 DA B 18 -3.248 -6.137 -7.219 1.00 0.00 H new ATOM 0 H62 DA B 18 -2.633 -5.732 -8.825 1.00 0.00 H new ATOM 0 H2 DA B 18 -1.277 -9.952 -6.023 1.00 0.00 H new HETATM 629 P XCS B 19 3.316 -13.136 -12.838 1.00 0.00 P HETATM 630 OP2 XCS B 19 4.682 -13.703 -12.884 1.00 0.00 O HETATM 631 C6 XCS B 19 -2.414 -11.894 -10.832 1.00 0.00 C HETATM 632 C2 XCS B 19 -3.577 -11.782 -8.733 1.00 0.00 C HETATM 633 O2 XCS B 19 -3.909 -12.326 -7.685 1.00 0.00 O HETATM 634 N3 XCS B 19 -3.950 -10.492 -9.013 1.00 0.00 N HETATM 635 C4 XCS B 19 -3.584 -9.887 -10.156 1.00 0.00 C HETATM 636 N4 XCS B 19 -3.988 -8.631 -10.353 1.00 0.00 N HETATM 637 C5 XCS B 19 -2.789 -10.578 -11.123 1.00 0.00 C HETATM 638 OP1 XCS B 19 2.757 -12.453 -14.027 1.00 0.00 O HETATM 639 O5' XCS B 19 2.299 -14.303 -12.405 1.00 0.00 O HETATM 640 C5' XCS B 19 2.097 -14.606 -11.022 1.00 0.00 C HETATM 641 C4' XCS B 19 0.677 -15.089 -10.757 1.00 0.00 C HETATM 642 O4' XCS B 19 -0.165 -13.946 -10.528 1.00 0.00 O HETATM 643 C1' XCS B 19 -1.307 -13.975 -11.389 1.00 0.00 C HETATM 644 ND XCS B 19 -2.802 -12.493 -9.649 1.00 0.00 N HETATM 645 CP XCS B 19 -2.397 -9.958 -12.328 1.00 0.00 C HETATM 646 CD XCS B 19 -1.239 -12.004 -12.953 1.00 0.00 C HETATM 647 C8 XCS B 19 -1.631 -12.639 -11.739 1.00 0.00 C HETATM 648 C7 XCS B 19 -1.622 -10.678 -13.238 1.00 0.00 C HETATM 649 C7A XCS B 19 -1.184 -10.025 -14.546 1.00 0.00 C HETATM 650 C2' XCS B 19 -0.841 -14.794 -12.591 1.00 0.00 C HETATM 651 C3' XCS B 19 0.030 -15.842 -11.918 1.00 0.00 C HETATM 652 O3' XCS B 19 -0.843 -16.821 -11.348 1.00 0.00 O HETATM 0 HN42 XCS B 19 -3.729 -8.140 -11.209 1.00 0.00 H new HETATM 0 HN41 XCS B 19 -4.556 -8.161 -9.648 1.00 0.00 H new HETATM 0 H7A3 XCS B 19 -2.064 -9.734 -15.120 1.00 0.00 H new HETATM 0 H7A2 XCS B 19 -0.584 -9.141 -14.328 1.00 0.00 H new HETATM 0 H7A1 XCS B 19 -0.591 -10.733 -15.125 1.00 0.00 H new HETATM 0 H5'2 XCS B 19 2.807 -15.371 -10.709 1.00 0.00 H new HETATM 0 H5'1 XCS B 19 2.299 -13.719 -10.421 1.00 0.00 H new HETATM 0 H2'2 XCS B 19 -1.675 -15.239 -13.133 1.00 0.00 H new HETATM 0 H2'1 XCS B 19 -0.281 -14.192 -13.306 1.00 0.00 H new HETATM 0 HP XCS B 19 -2.695 -8.932 -12.545 1.00 0.00 H new HETATM 0 HND XCS B 19 -2.522 -13.453 -9.446 1.00 0.00 H new HETATM 0 HD XCS B 19 -0.633 -12.553 -13.673 1.00 0.00 H new HETATM 0 H4' XCS B 19 0.761 -15.767 -9.908 1.00 0.00 H new HETATM 0 H3' XCS B 19 0.746 -16.311 -12.593 1.00 0.00 H new HETATM 0 H1' XCS B 19 -2.203 -14.411 -10.947 1.00 0.00 H new ATOM 668 P DA B 20 -0.332 -18.329 -11.106 1.00 0.00 P ATOM 669 OP1 DA B 20 0.586 -18.692 -12.209 1.00 0.00 O ATOM 670 OP2 DA B 20 0.122 -18.443 -9.702 1.00 0.00 O ATOM 671 O5' DA B 20 -1.683 -19.189 -11.276 1.00 0.00 O ATOM 672 C5' DA B 20 -2.572 -19.384 -10.171 1.00 0.00 C ATOM 673 C4' DA B 20 -4.009 -19.614 -10.634 1.00 0.00 C ATOM 674 O4' DA B 20 -4.735 -18.378 -10.532 1.00 0.00 O ATOM 675 C3' DA B 20 -4.153 -20.055 -12.094 1.00 0.00 C ATOM 676 O3' DA B 20 -5.273 -20.931 -12.243 1.00 0.00 O ATOM 677 C2' DA B 20 -4.408 -18.737 -12.813 1.00 0.00 C ATOM 678 C1' DA B 20 -5.266 -17.998 -11.803 1.00 0.00 C ATOM 679 N9 DA B 20 -5.170 -16.531 -11.944 1.00 0.00 N ATOM 680 C8 DA B 20 -4.090 -15.719 -11.723 1.00 0.00 C ATOM 681 N7 DA B 20 -4.333 -14.453 -11.931 1.00 0.00 N ATOM 682 C5 DA B 20 -5.668 -14.431 -12.316 1.00 0.00 C ATOM 683 C6 DA B 20 -6.538 -13.388 -12.678 1.00 0.00 C ATOM 684 N6 DA B 20 -6.179 -12.104 -12.711 1.00 0.00 N ATOM 685 N1 DA B 20 -7.798 -13.713 -13.005 1.00 0.00 N ATOM 686 C2 DA B 20 -8.165 -14.988 -12.974 1.00 0.00 C ATOM 687 N3 DA B 20 -7.448 -16.054 -12.652 1.00 0.00 N ATOM 688 C4 DA B 20 -6.189 -15.693 -12.329 1.00 0.00 C ATOM 0 H5' DA B 20 -2.536 -18.513 -9.517 1.00 0.00 H new ATOM 0 H5'' DA B 20 -2.238 -20.239 -9.582 1.00 0.00 H new ATOM 0 H4' DA B 20 -4.386 -20.412 -9.995 1.00 0.00 H new ATOM 0 H3' DA B 20 -3.289 -20.600 -12.474 1.00 0.00 H new ATOM 0 H2' DA B 20 -3.483 -18.204 -13.032 1.00 0.00 H new ATOM 0 H2'' DA B 20 -4.925 -18.881 -13.762 1.00 0.00 H new ATOM 0 HO3' DA B 20 -5.353 -21.203 -13.181 1.00 0.00 H new ATOM 0 H1' DA B 20 -6.318 -18.250 -11.938 1.00 0.00 H new ATOM 0 H8 DA B 20 -3.127 -16.091 -11.406 1.00 0.00 H new ATOM 0 H61 DA B 20 -6.857 -11.392 -12.982 1.00 0.00 H new ATOM 0 H62 DA B 20 -5.227 -11.834 -12.465 1.00 0.00 H new ATOM 0 H2 DA B 20 -9.191 -15.183 -13.250 1.00 0.00 H new TER 701 DA B 20