USER MOD reduce.3.24.130724 H: found=0, std=0, add=249, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 249 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 1 DT O5' : rot -99:sc= 1.29 USER MOD Single : A 7 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 11 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 16 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 20 DT C7 :methyl 150:sc= -0.122 (180deg=-0.122) USER MOD Single : A 22 DA O3' : rot -72:sc= 1.28 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 -1.973 -9.633 2.989 1.00 0.00 O ATOM 2 C5' DT A 1 -2.621 -8.604 3.732 1.00 0.00 C ATOM 3 C4' DT A 1 -3.659 -9.048 4.816 1.00 0.00 C ATOM 4 O4' DT A 1 -4.963 -9.032 4.219 1.00 0.00 O ATOM 5 C3' DT A 1 -3.490 -10.450 5.496 1.00 0.00 C ATOM 6 O3' DT A 1 -3.857 -10.366 6.863 1.00 0.00 O ATOM 7 C2' DT A 1 -4.543 -11.282 4.739 1.00 0.00 C ATOM 8 C1' DT A 1 -5.638 -10.230 4.496 1.00 0.00 C ATOM 9 N1 DT A 1 -6.598 -10.475 3.397 1.00 0.00 N ATOM 10 C2 DT A 1 -7.704 -11.257 3.623 1.00 0.00 C ATOM 11 O2 DT A 1 -7.908 -11.842 4.690 1.00 0.00 O ATOM 12 N3 DT A 1 -8.596 -11.329 2.581 1.00 0.00 N ATOM 13 C4 DT A 1 -8.521 -10.667 1.361 1.00 0.00 C ATOM 14 O4 DT A 1 -9.466 -10.712 0.584 1.00 0.00 O ATOM 15 C5 DT A 1 -7.247 -9.975 1.109 1.00 0.00 C ATOM 16 C7 DT A 1 -7.008 -9.353 -0.252 1.00 0.00 C ATOM 17 C6 DT A 1 -6.371 -9.917 2.122 1.00 0.00 C ATOM 0 H5' DT A 1 -3.130 -7.947 3.026 1.00 0.00 H new ATOM 0 H5'' DT A 1 -1.853 -8.008 4.225 1.00 0.00 H new ATOM 0 H4' DT A 1 -3.494 -8.332 5.621 1.00 0.00 H new ATOM 0 H3' DT A 1 -2.476 -10.849 5.458 1.00 0.00 H new ATOM 0 H2' DT A 1 -4.152 -11.691 3.808 1.00 0.00 H new ATOM 0 H2'' DT A 1 -4.905 -12.123 5.330 1.00 0.00 H new ATOM 0 HO5' DT A 1 -1.085 -9.800 3.368 1.00 0.00 H new ATOM 0 H1' DT A 1 -6.261 -10.235 5.391 1.00 0.00 H new ATOM 0 H3 DT A 1 -9.404 -11.936 2.718 1.00 0.00 H new ATOM 0 H71 DT A 1 -6.355 -8.487 -0.147 1.00 0.00 H new ATOM 0 H72 DT A 1 -6.537 -10.085 -0.909 1.00 0.00 H new ATOM 0 H73 DT A 1 -7.960 -9.039 -0.681 1.00 0.00 H new ATOM 0 H6 DT A 1 -5.432 -9.411 1.951 1.00 0.00 H new ATOM 31 P DG A 2 -3.124 -11.149 8.013 1.00 0.00 P ATOM 32 OP1 DG A 2 -2.907 -12.576 7.637 1.00 0.00 O ATOM 33 OP2 DG A 2 -3.882 -10.855 9.260 1.00 0.00 O ATOM 34 O5' DG A 2 -1.693 -10.475 8.064 1.00 0.00 O ATOM 35 C5' DG A 2 -1.544 -9.087 8.338 1.00 0.00 C ATOM 36 C4' DG A 2 -0.855 -8.322 7.182 1.00 0.00 C ATOM 37 O4' DG A 2 -1.156 -6.931 7.302 1.00 0.00 O ATOM 38 C3' DG A 2 0.688 -8.350 7.046 1.00 0.00 C ATOM 39 O3' DG A 2 1.234 -9.591 6.644 1.00 0.00 O ATOM 40 C2' DG A 2 0.940 -7.072 6.243 1.00 0.00 C ATOM 41 C1' DG A 2 -0.079 -6.120 6.902 1.00 0.00 C ATOM 42 N9 DG A 2 0.423 -5.388 8.089 1.00 0.00 N ATOM 43 C8 DG A 2 1.690 -4.985 8.461 1.00 0.00 C ATOM 44 N7 DG A 2 1.712 -4.199 9.503 1.00 0.00 N ATOM 45 C5 DG A 2 0.378 -4.045 9.841 1.00 0.00 C ATOM 46 C6 DG A 2 -0.266 -3.295 10.899 1.00 0.00 C ATOM 47 O6 DG A 2 0.256 -2.608 11.764 1.00 0.00 O ATOM 48 N1 DG A 2 -1.669 -3.459 10.841 1.00 0.00 N ATOM 49 C2 DG A 2 -2.348 -4.182 9.898 1.00 0.00 C ATOM 50 N2 DG A 2 -3.696 -4.189 9.997 1.00 0.00 N ATOM 51 N3 DG A 2 -1.771 -4.837 8.920 1.00 0.00 N ATOM 52 C4 DG A 2 -0.416 -4.761 8.965 1.00 0.00 C ATOM 0 H5' DG A 2 -0.961 -8.961 9.250 1.00 0.00 H new ATOM 0 H5'' DG A 2 -2.525 -8.650 8.524 1.00 0.00 H new ATOM 0 H4' DG A 2 -1.250 -8.858 6.319 1.00 0.00 H new ATOM 0 H3' DG A 2 1.260 -8.319 7.973 1.00 0.00 H new ATOM 0 H2' DG A 2 1.965 -6.715 6.343 1.00 0.00 H new ATOM 0 H2'' DG A 2 0.752 -7.208 5.178 1.00 0.00 H new ATOM 0 H1' DG A 2 -0.336 -5.348 6.177 1.00 0.00 H new ATOM 0 H8 DG A 2 2.583 -5.292 7.937 1.00 0.00 H new ATOM 0 H1 DG A 2 -2.223 -2.999 11.564 1.00 0.00 H new ATOM 0 H21 DG A 2 -4.254 -4.711 9.322 1.00 0.00 H new ATOM 0 H22 DG A 2 -4.155 -3.672 10.747 1.00 0.00 H new ATOM 64 P DA A 3 1.529 -10.129 5.217 1.00 0.00 P ATOM 65 OP1 DA A 3 0.407 -9.854 4.268 1.00 0.00 O ATOM 66 OP2 DA A 3 1.956 -11.548 5.388 1.00 0.00 O ATOM 67 O5' DA A 3 2.824 -9.302 4.816 1.00 0.00 O ATOM 68 C5' DA A 3 2.978 -8.937 3.452 1.00 0.00 C ATOM 69 C4' DA A 3 4.201 -8.019 3.186 1.00 0.00 C ATOM 70 O4' DA A 3 4.057 -7.560 1.844 1.00 0.00 O ATOM 71 C3' DA A 3 4.285 -6.753 4.095 1.00 0.00 C ATOM 72 O3' DA A 3 5.090 -6.824 5.277 1.00 0.00 O ATOM 73 C2' DA A 3 4.547 -5.592 3.119 1.00 0.00 C ATOM 74 C1' DA A 3 4.410 -6.202 1.705 1.00 0.00 C ATOM 75 N9 DA A 3 3.457 -5.592 0.795 1.00 0.00 N ATOM 76 C8 DA A 3 3.653 -5.367 -0.560 1.00 0.00 C ATOM 77 N7 DA A 3 2.571 -5.229 -1.253 1.00 0.00 N ATOM 78 C5 DA A 3 1.545 -5.376 -0.313 1.00 0.00 C ATOM 79 C6 DA A 3 0.129 -5.417 -0.388 1.00 0.00 C ATOM 80 N6 DA A 3 -0.552 -5.333 -1.548 1.00 0.00 N ATOM 81 N1 DA A 3 -0.557 -5.591 0.754 1.00 0.00 N ATOM 82 C2 DA A 3 0.116 -5.726 1.912 1.00 0.00 C ATOM 83 N3 DA A 3 1.437 -5.754 2.100 1.00 0.00 N ATOM 84 C4 DA A 3 2.094 -5.596 0.950 1.00 0.00 C ATOM 0 H5' DA A 3 2.074 -8.429 3.117 1.00 0.00 H new ATOM 0 H5'' DA A 3 3.077 -9.842 2.852 1.00 0.00 H new ATOM 0 H4' DA A 3 5.100 -8.602 3.388 1.00 0.00 H new ATOM 0 H3' DA A 3 3.349 -6.606 4.634 1.00 0.00 H new ATOM 0 H2' DA A 3 3.831 -4.784 3.269 1.00 0.00 H new ATOM 0 H2'' DA A 3 5.540 -5.169 3.270 1.00 0.00 H new ATOM 0 H1' DA A 3 5.383 -6.025 1.246 1.00 0.00 H new ATOM 0 H8 DA A 3 4.637 -5.311 -1.003 1.00 0.00 H new ATOM 0 H61 DA A 3 -1.571 -5.368 -1.545 1.00 0.00 H new ATOM 0 H62 DA A 3 -0.048 -5.235 -2.429 1.00 0.00 H new ATOM 0 H2 DA A 3 -0.489 -5.824 2.801 1.00 0.00 H new ATOM 96 P DG A 4 6.611 -7.265 5.280 1.00 0.00 P ATOM 97 OP1 DG A 4 7.363 -6.570 4.193 1.00 0.00 O ATOM 98 OP2 DG A 4 6.673 -8.759 5.302 1.00 0.00 O ATOM 99 O5' DG A 4 7.114 -6.781 6.682 1.00 0.00 O ATOM 100 C5' DG A 4 6.896 -5.524 7.298 1.00 0.00 C ATOM 101 C4' DG A 4 7.636 -4.311 6.680 1.00 0.00 C ATOM 102 O4' DG A 4 6.860 -3.728 5.621 1.00 0.00 O ATOM 103 C3' DG A 4 7.933 -3.151 7.672 1.00 0.00 C ATOM 104 O3' DG A 4 9.151 -2.511 7.325 1.00 0.00 O ATOM 105 C2' DG A 4 6.605 -2.376 7.542 1.00 0.00 C ATOM 106 C1' DG A 4 6.264 -2.516 6.050 1.00 0.00 C ATOM 107 N9 DG A 4 4.838 -2.500 5.764 1.00 0.00 N ATOM 108 C8 DG A 4 3.694 -2.595 6.532 1.00 0.00 C ATOM 109 N7 DG A 4 2.593 -2.556 5.834 1.00 0.00 N ATOM 110 C5 DG A 4 3.025 -2.429 4.523 1.00 0.00 C ATOM 111 C6 DG A 4 2.300 -2.343 3.280 1.00 0.00 C ATOM 112 O6 DG A 4 1.089 -2.291 3.120 1.00 0.00 O ATOM 113 N1 DG A 4 3.194 -2.271 2.186 1.00 0.00 N ATOM 114 C2 DG A 4 4.562 -2.279 2.277 1.00 0.00 C ATOM 115 N2 DG A 4 5.209 -2.250 1.095 1.00 0.00 N ATOM 116 N3 DG A 4 5.233 -2.334 3.403 1.00 0.00 N ATOM 117 C4 DG A 4 4.404 -2.402 4.480 1.00 0.00 C ATOM 0 H5' DG A 4 7.187 -5.603 8.346 1.00 0.00 H new ATOM 0 H5'' DG A 4 5.826 -5.316 7.279 1.00 0.00 H new ATOM 0 H4' DG A 4 8.581 -4.733 6.338 1.00 0.00 H new ATOM 0 H3' DG A 4 8.142 -3.375 8.718 1.00 0.00 H new ATOM 0 H2' DG A 4 5.826 -2.802 8.175 1.00 0.00 H new ATOM 0 H2'' DG A 4 6.718 -1.332 7.833 1.00 0.00 H new ATOM 0 H1' DG A 4 6.651 -1.652 5.509 1.00 0.00 H new ATOM 0 H8 DG A 4 3.710 -2.692 7.607 1.00 0.00 H new ATOM 0 H1 DG A 4 2.787 -2.208 1.253 1.00 0.00 H new ATOM 0 H21 DG A 4 6.229 -2.253 1.072 1.00 0.00 H new ATOM 0 H22 DG A 4 4.679 -2.225 0.224 1.00 0.00 H new ATOM 129 P DG A 5 9.478 -0.987 7.162 1.00 0.00 P ATOM 130 OP1 DG A 5 10.964 -0.838 7.227 1.00 0.00 O ATOM 131 OP2 DG A 5 8.692 -0.149 8.109 1.00 0.00 O ATOM 132 O5' DG A 5 8.998 -0.649 5.698 1.00 0.00 O ATOM 133 C5' DG A 5 9.564 -1.387 4.621 1.00 0.00 C ATOM 134 C4' DG A 5 9.502 -0.666 3.267 1.00 0.00 C ATOM 135 O4' DG A 5 8.150 -0.553 2.808 1.00 0.00 O ATOM 136 C3' DG A 5 10.156 0.746 3.198 1.00 0.00 C ATOM 137 O3' DG A 5 11.096 0.761 2.130 1.00 0.00 O ATOM 138 C2' DG A 5 8.917 1.645 3.007 1.00 0.00 C ATOM 139 C1' DG A 5 7.943 0.730 2.253 1.00 0.00 C ATOM 140 N9 DG A 5 6.554 1.078 2.421 1.00 0.00 N ATOM 141 C8 DG A 5 5.921 1.179 3.649 1.00 0.00 C ATOM 142 N7 DG A 5 4.627 1.212 3.566 1.00 0.00 N ATOM 143 C5 DG A 5 4.373 1.096 2.217 1.00 0.00 C ATOM 144 C6 DG A 5 3.120 0.994 1.521 1.00 0.00 C ATOM 145 O6 DG A 5 1.994 0.956 2.009 1.00 0.00 O ATOM 146 N1 DG A 5 3.337 0.936 0.127 1.00 0.00 N ATOM 147 C2 DG A 5 4.571 0.912 -0.483 1.00 0.00 C ATOM 148 N2 DG A 5 4.537 0.867 -1.831 1.00 0.00 N ATOM 149 N3 DG A 5 5.721 0.932 0.152 1.00 0.00 N ATOM 150 C4 DG A 5 5.555 1.003 1.504 1.00 0.00 C ATOM 0 H5' DG A 5 9.045 -2.342 4.536 1.00 0.00 H new ATOM 0 H5'' DG A 5 10.605 -1.610 4.855 1.00 0.00 H new ATOM 0 H4' DG A 5 10.104 -1.308 2.624 1.00 0.00 H new ATOM 0 H3' DG A 5 10.740 1.071 4.059 1.00 0.00 H new ATOM 0 H2' DG A 5 8.506 1.974 3.961 1.00 0.00 H new ATOM 0 H2'' DG A 5 9.153 2.542 2.435 1.00 0.00 H new ATOM 0 H1' DG A 5 8.138 0.805 1.183 1.00 0.00 H new ATOM 0 H8 DG A 5 6.454 1.226 4.587 1.00 0.00 H new ATOM 0 H1 DG A 5 2.515 0.910 -0.476 1.00 0.00 H new ATOM 0 H21 DG A 5 5.407 0.847 -2.363 1.00 0.00 H new ATOM 0 H22 DG A 5 3.641 0.853 -2.318 1.00 0.00 H new ATOM 162 P DG A 6 11.930 2.066 1.830 1.00 0.00 P ATOM 163 OP1 DG A 6 13.163 1.660 1.092 1.00 0.00 O ATOM 164 OP2 DG A 6 12.094 2.852 3.086 1.00 0.00 O ATOM 165 O5' DG A 6 10.979 2.850 0.837 1.00 0.00 O ATOM 166 C5' DG A 6 10.671 2.202 -0.397 1.00 0.00 C ATOM 167 C4' DG A 6 9.745 3.008 -1.332 1.00 0.00 C ATOM 168 O4' DG A 6 8.391 3.003 -0.856 1.00 0.00 O ATOM 169 C3' DG A 6 10.147 4.497 -1.551 1.00 0.00 C ATOM 170 O3' DG A 6 9.929 4.884 -2.896 1.00 0.00 O ATOM 171 C2' DG A 6 9.119 5.216 -0.662 1.00 0.00 C ATOM 172 C1' DG A 6 7.892 4.325 -0.899 1.00 0.00 C ATOM 173 N9 DG A 6 6.796 4.457 0.024 1.00 0.00 N ATOM 174 C8 DG A 6 6.773 4.529 1.404 1.00 0.00 C ATOM 175 N7 DG A 6 5.572 4.499 1.907 1.00 0.00 N ATOM 176 C5 DG A 6 4.745 4.384 0.799 1.00 0.00 C ATOM 177 C6 DG A 6 3.315 4.250 0.692 1.00 0.00 C ATOM 178 O6 DG A 6 2.498 4.167 1.599 1.00 0.00 O ATOM 179 N1 DG A 6 2.927 4.178 -0.668 1.00 0.00 N ATOM 180 C2 DG A 6 3.778 4.174 -1.745 1.00 0.00 C ATOM 181 N2 DG A 6 3.170 4.062 -2.948 1.00 0.00 N ATOM 182 N3 DG A 6 5.086 4.236 -1.655 1.00 0.00 N ATOM 183 C4 DG A 6 5.498 4.349 -0.359 1.00 0.00 C ATOM 0 H5' DG A 6 10.201 1.242 -0.181 1.00 0.00 H new ATOM 0 H5'' DG A 6 11.602 1.990 -0.923 1.00 0.00 H new ATOM 0 H4' DG A 6 9.847 2.493 -2.287 1.00 0.00 H new ATOM 0 H3' DG A 6 11.193 4.705 -1.328 1.00 0.00 H new ATOM 0 H2' DG A 6 9.419 5.241 0.385 1.00 0.00 H new ATOM 0 H2'' DG A 6 8.951 6.248 -0.970 1.00 0.00 H new ATOM 0 H1' DG A 6 7.444 4.626 -1.846 1.00 0.00 H new ATOM 0 H8 DG A 6 7.666 4.603 2.008 1.00 0.00 H new ATOM 0 H1 DG A 6 1.928 4.124 -0.865 1.00 0.00 H new ATOM 0 H21 DG A 6 3.727 4.051 -3.802 1.00 0.00 H new ATOM 0 H22 DG A 6 2.154 3.989 -3.001 1.00 0.00 H new ATOM 195 P DT A 7 11.070 5.090 -3.947 1.00 0.00 P ATOM 196 OP1 DT A 7 12.309 5.576 -3.256 1.00 0.00 O ATOM 197 OP2 DT A 7 10.480 5.904 -5.044 1.00 0.00 O ATOM 198 O5' DT A 7 11.256 3.640 -4.539 1.00 0.00 O ATOM 199 C5' DT A 7 12.270 2.766 -4.075 1.00 0.00 C ATOM 200 C4' DT A 7 12.321 1.459 -4.906 1.00 0.00 C ATOM 201 O4' DT A 7 13.458 0.691 -4.479 1.00 0.00 O ATOM 202 C3' DT A 7 11.066 0.511 -4.848 1.00 0.00 C ATOM 203 O3' DT A 7 10.733 0.025 -6.144 1.00 0.00 O ATOM 204 C2' DT A 7 11.622 -0.659 -4.015 1.00 0.00 C ATOM 205 C1' DT A 7 13.094 -0.665 -4.453 1.00 0.00 C ATOM 206 N1 DT A 7 14.037 -1.405 -3.599 1.00 0.00 N ATOM 207 C2 DT A 7 14.257 -2.742 -3.843 1.00 0.00 C ATOM 208 O2 DT A 7 13.687 -3.353 -4.750 1.00 0.00 O ATOM 209 N3 DT A 7 15.209 -3.340 -3.050 1.00 0.00 N ATOM 210 C4 DT A 7 15.822 -2.791 -1.933 1.00 0.00 C ATOM 211 O4 DT A 7 16.556 -3.483 -1.237 1.00 0.00 O ATOM 212 C5 DT A 7 15.500 -1.379 -1.667 1.00 0.00 C ATOM 213 C7 DT A 7 16.135 -0.720 -0.461 1.00 0.00 C ATOM 214 C6 DT A 7 14.644 -0.771 -2.502 1.00 0.00 C ATOM 0 H5' DT A 7 12.092 2.525 -3.027 1.00 0.00 H new ATOM 0 H5'' DT A 7 13.236 3.269 -4.127 1.00 0.00 H new ATOM 0 H4' DT A 7 12.367 1.807 -5.938 1.00 0.00 H new ATOM 0 H3' DT A 7 10.171 0.994 -4.455 1.00 0.00 H new ATOM 0 H2' DT A 7 11.512 -0.490 -2.944 1.00 0.00 H new ATOM 0 H2'' DT A 7 11.121 -1.600 -4.242 1.00 0.00 H new ATOM 0 H1' DT A 7 13.160 -1.190 -5.406 1.00 0.00 H new ATOM 0 H3 DT A 7 15.493 -4.284 -3.310 1.00 0.00 H new ATOM 0 H71 DT A 7 16.267 0.344 -0.656 1.00 0.00 H new ATOM 0 H72 DT A 7 15.490 -0.853 0.408 1.00 0.00 H new ATOM 0 H73 DT A 7 17.105 -1.177 -0.266 1.00 0.00 H new ATOM 0 H6 DT A 7 14.408 0.267 -2.320 1.00 0.00 H new ATOM 227 P DG A 8 9.304 0.183 -6.777 1.00 0.00 P ATOM 228 OP1 DG A 8 9.414 -0.238 -8.207 1.00 0.00 O ATOM 229 OP2 DG A 8 8.763 1.547 -6.511 1.00 0.00 O ATOM 230 O5' DG A 8 8.423 -0.847 -5.970 1.00 0.00 O ATOM 231 C5' DG A 8 8.344 -2.235 -6.283 1.00 0.00 C ATOM 232 C4' DG A 8 6.914 -2.777 -6.626 1.00 0.00 C ATOM 233 O4' DG A 8 6.244 -3.182 -5.420 1.00 0.00 O ATOM 234 C3' DG A 8 5.946 -1.819 -7.400 1.00 0.00 C ATOM 235 O3' DG A 8 5.418 -2.456 -8.561 1.00 0.00 O ATOM 236 C2' DG A 8 4.869 -1.551 -6.329 1.00 0.00 C ATOM 237 C1' DG A 8 4.885 -2.827 -5.475 1.00 0.00 C ATOM 238 N9 DG A 8 4.435 -2.692 -4.089 1.00 0.00 N ATOM 239 C8 DG A 8 5.241 -2.451 -2.992 1.00 0.00 C ATOM 240 N7 DG A 8 4.574 -2.253 -1.893 1.00 0.00 N ATOM 241 C5 DG A 8 3.247 -2.354 -2.272 1.00 0.00 C ATOM 242 C6 DG A 8 2.034 -2.228 -1.497 1.00 0.00 C ATOM 243 O6 DG A 8 1.908 -1.960 -0.308 1.00 0.00 O ATOM 244 N1 DG A 8 0.898 -2.439 -2.321 1.00 0.00 N ATOM 245 C2 DG A 8 0.931 -2.733 -3.661 1.00 0.00 C ATOM 246 N2 DG A 8 -0.285 -2.904 -4.232 1.00 0.00 N ATOM 247 N3 DG A 8 2.034 -2.851 -4.377 1.00 0.00 N ATOM 248 C4 DG A 8 3.155 -2.634 -3.627 1.00 0.00 C ATOM 0 H5' DG A 8 8.733 -2.802 -5.437 1.00 0.00 H new ATOM 0 H5'' DG A 8 9.000 -2.435 -7.130 1.00 0.00 H new ATOM 0 H4' DG A 8 7.123 -3.599 -7.311 1.00 0.00 H new ATOM 0 H3' DG A 8 6.409 -0.910 -7.784 1.00 0.00 H new ATOM 0 H2' DG A 8 5.105 -0.668 -5.735 1.00 0.00 H new ATOM 0 H2'' DG A 8 3.890 -1.381 -6.778 1.00 0.00 H new ATOM 0 H1' DG A 8 4.197 -3.538 -5.931 1.00 0.00 H new ATOM 0 H8 DG A 8 6.320 -2.429 -3.043 1.00 0.00 H new ATOM 0 H1 DG A 8 -0.019 -2.366 -1.881 1.00 0.00 H new ATOM 0 H21 DG A 8 -0.355 -3.125 -5.225 1.00 0.00 H new ATOM 0 H22 DG A 8 -1.130 -2.811 -3.669 1.00 0.00 H new ATOM 260 P DG A 9 4.961 -1.600 -9.803 1.00 0.00 P ATOM 261 OP1 DG A 9 4.572 -2.561 -10.873 1.00 0.00 O ATOM 262 OP2 DG A 9 5.969 -0.545 -10.122 1.00 0.00 O ATOM 263 O5' DG A 9 3.671 -0.851 -9.286 1.00 0.00 O ATOM 264 C5' DG A 9 2.438 -1.560 -9.266 1.00 0.00 C ATOM 265 C4' DG A 9 1.293 -0.799 -8.578 1.00 0.00 C ATOM 266 O4' DG A 9 1.426 -0.838 -7.167 1.00 0.00 O ATOM 267 C3' DG A 9 1.115 0.712 -8.850 1.00 0.00 C ATOM 268 O3' DG A 9 0.647 0.960 -10.170 1.00 0.00 O ATOM 269 C2' DG A 9 0.191 1.109 -7.684 1.00 0.00 C ATOM 270 C1' DG A 9 0.474 0.023 -6.605 1.00 0.00 C ATOM 271 N9 DG A 9 0.956 0.436 -5.304 1.00 0.00 N ATOM 272 C8 DG A 9 2.230 0.557 -4.795 1.00 0.00 C ATOM 273 N7 DG A 9 2.251 0.779 -3.510 1.00 0.00 N ATOM 274 C5 DG A 9 0.911 0.815 -3.142 1.00 0.00 C ATOM 275 C6 DG A 9 0.254 0.941 -1.866 1.00 0.00 C ATOM 276 O6 DG A 9 0.750 1.027 -0.749 1.00 0.00 O ATOM 277 N1 DG A 9 -1.158 0.929 -2.028 1.00 0.00 N ATOM 278 C2 DG A 9 -1.823 0.798 -3.223 1.00 0.00 C ATOM 279 N2 DG A 9 -3.164 0.893 -3.177 1.00 0.00 N ATOM 280 N3 DG A 9 -1.235 0.624 -4.382 1.00 0.00 N ATOM 281 C4 DG A 9 0.117 0.619 -4.257 1.00 0.00 C ATOM 0 H5' DG A 9 2.586 -2.512 -8.757 1.00 0.00 H new ATOM 0 H5'' DG A 9 2.145 -1.789 -10.291 1.00 0.00 H new ATOM 0 H4' DG A 9 0.447 -1.331 -9.013 1.00 0.00 H new ATOM 0 H3' DG A 9 2.020 1.319 -8.856 1.00 0.00 H new ATOM 0 H2' DG A 9 0.418 2.109 -7.315 1.00 0.00 H new ATOM 0 H2'' DG A 9 -0.856 1.111 -7.986 1.00 0.00 H new ATOM 0 H1' DG A 9 -0.500 -0.409 -6.376 1.00 0.00 H new ATOM 0 H8 DG A 9 3.122 0.476 -5.399 1.00 0.00 H new ATOM 0 H1 DG A 9 -1.725 1.026 -1.186 1.00 0.00 H new ATOM 0 H21 DG A 9 -3.711 0.804 -4.033 1.00 0.00 H new ATOM 0 H22 DG A 9 -3.634 1.054 -2.286 1.00 0.00 H new ATOM 293 P DG A 10 0.469 2.450 -10.636 1.00 0.00 P ATOM 294 OP1 DG A 10 0.164 2.395 -12.090 1.00 0.00 O ATOM 295 OP2 DG A 10 1.616 3.298 -10.176 1.00 0.00 O ATOM 296 O5' DG A 10 -0.863 2.861 -9.879 1.00 0.00 O ATOM 297 C5' DG A 10 -1.052 4.233 -9.554 1.00 0.00 C ATOM 298 C4' DG A 10 -2.271 4.478 -8.647 1.00 0.00 C ATOM 299 O4' DG A 10 -2.073 3.884 -7.349 1.00 0.00 O ATOM 300 C3' DG A 10 -2.540 5.996 -8.424 1.00 0.00 C ATOM 301 O3' DG A 10 -3.926 6.287 -8.333 1.00 0.00 O ATOM 302 C2' DG A 10 -1.872 6.204 -7.056 1.00 0.00 C ATOM 303 C1' DG A 10 -2.203 4.871 -6.353 1.00 0.00 C ATOM 304 N9 DG A 10 -1.353 4.526 -5.230 1.00 0.00 N ATOM 305 C8 DG A 10 0.021 4.358 -5.223 1.00 0.00 C ATOM 306 N7 DG A 10 0.519 4.172 -4.034 1.00 0.00 N ATOM 307 C5 DG A 10 -0.589 4.213 -3.198 1.00 0.00 C ATOM 308 C6 DG A 10 -0.695 4.142 -1.763 1.00 0.00 C ATOM 309 O6 DG A 10 0.201 4.009 -0.941 1.00 0.00 O ATOM 310 N1 DG A 10 -2.051 4.220 -1.360 1.00 0.00 N ATOM 311 C2 DG A 10 -3.125 4.381 -2.197 1.00 0.00 C ATOM 312 N2 DG A 10 -4.331 4.387 -1.588 1.00 0.00 N ATOM 313 N3 DG A 10 -3.037 4.484 -3.508 1.00 0.00 N ATOM 314 C4 DG A 10 -1.743 4.417 -3.935 1.00 0.00 C ATOM 0 H5' DG A 10 -1.171 4.805 -10.474 1.00 0.00 H new ATOM 0 H5'' DG A 10 -0.157 4.609 -9.059 1.00 0.00 H new ATOM 0 H4' DG A 10 -3.121 4.025 -9.158 1.00 0.00 H new ATOM 0 H3' DG A 10 -2.172 6.628 -9.232 1.00 0.00 H new ATOM 0 H2' DG A 10 -0.798 6.367 -7.143 1.00 0.00 H new ATOM 0 H2'' DG A 10 -2.282 7.062 -6.524 1.00 0.00 H new ATOM 0 H1' DG A 10 -3.200 4.955 -5.920 1.00 0.00 H new ATOM 0 H8 DG A 10 0.623 4.379 -6.119 1.00 0.00 H new ATOM 0 H1 DG A 10 -2.245 4.150 -0.361 1.00 0.00 H new ATOM 0 H21 DG A 10 -5.181 4.502 -2.140 1.00 0.00 H new ATOM 0 H22 DG A 10 -4.392 4.277 -0.576 1.00 0.00 H new ATOM 326 P DT A 11 -4.571 7.565 -8.987 1.00 0.00 P ATOM 327 OP1 DT A 11 -3.553 8.651 -9.130 1.00 0.00 O ATOM 328 OP2 DT A 11 -5.806 7.856 -8.196 1.00 0.00 O ATOM 329 O5' DT A 11 -4.949 7.072 -10.435 1.00 0.00 O ATOM 330 C5' DT A 11 -6.115 6.273 -10.600 1.00 0.00 C ATOM 331 C4' DT A 11 -6.328 5.790 -12.047 1.00 0.00 C ATOM 332 O4' DT A 11 -6.638 6.906 -12.897 1.00 0.00 O ATOM 333 C3' DT A 11 -5.144 5.013 -12.714 1.00 0.00 C ATOM 334 O3' DT A 11 -5.631 3.889 -13.436 1.00 0.00 O ATOM 335 C2' DT A 11 -4.611 6.046 -13.718 1.00 0.00 C ATOM 336 C1' DT A 11 -5.903 6.791 -14.095 1.00 0.00 C ATOM 337 N1 DT A 11 -5.713 8.137 -14.643 1.00 0.00 N ATOM 338 C2 DT A 11 -5.875 8.385 -15.985 1.00 0.00 C ATOM 339 O2 DT A 11 -6.219 7.520 -16.790 1.00 0.00 O ATOM 340 N3 DT A 11 -5.621 9.682 -16.366 1.00 0.00 N ATOM 341 C4 DT A 11 -5.201 10.735 -15.562 1.00 0.00 C ATOM 342 O4 DT A 11 -5.035 11.842 -16.062 1.00 0.00 O ATOM 343 C5 DT A 11 -5.010 10.407 -14.139 1.00 0.00 C ATOM 344 C7 DT A 11 -4.531 11.481 -13.185 1.00 0.00 C ATOM 345 C6 DT A 11 -5.280 9.149 -13.767 1.00 0.00 C ATOM 0 H5' DT A 11 -6.987 6.847 -10.285 1.00 0.00 H new ATOM 0 H5'' DT A 11 -6.048 5.407 -9.942 1.00 0.00 H new ATOM 0 H4' DT A 11 -7.145 5.075 -11.953 1.00 0.00 H new ATOM 0 H3' DT A 11 -4.411 4.644 -11.997 1.00 0.00 H new ATOM 0 H2' DT A 11 -3.869 6.709 -13.272 1.00 0.00 H new ATOM 0 H2'' DT A 11 -4.140 5.576 -14.581 1.00 0.00 H new ATOM 0 H1' DT A 11 -6.395 6.225 -14.886 1.00 0.00 H new ATOM 0 H3 DT A 11 -5.757 9.896 -17.354 1.00 0.00 H new ATOM 0 H71 DT A 11 -4.929 11.287 -12.189 1.00 0.00 H new ATOM 0 H72 DT A 11 -3.442 11.475 -13.148 1.00 0.00 H new ATOM 0 H73 DT A 11 -4.877 12.455 -13.531 1.00 0.00 H new ATOM 0 H6 DT A 11 -5.157 8.894 -12.725 1.00 0.00 H new ATOM 358 P DA A 12 -5.240 2.429 -13.018 1.00 0.00 P ATOM 359 OP1 DA A 12 -3.770 2.320 -12.778 1.00 0.00 O ATOM 360 OP2 DA A 12 -5.849 1.497 -14.005 1.00 0.00 O ATOM 361 O5' DA A 12 -6.038 2.271 -11.669 1.00 0.00 O ATOM 362 C5' DA A 12 -5.387 2.294 -10.408 1.00 0.00 C ATOM 363 C4' DA A 12 -6.309 1.771 -9.285 1.00 0.00 C ATOM 364 O4' DA A 12 -7.341 2.724 -8.998 1.00 0.00 O ATOM 365 C3' DA A 12 -7.011 0.428 -9.630 1.00 0.00 C ATOM 366 O3' DA A 12 -7.138 -0.413 -8.487 1.00 0.00 O ATOM 367 C2' DA A 12 -8.385 0.920 -10.111 1.00 0.00 C ATOM 368 C1' DA A 12 -8.616 2.171 -9.250 1.00 0.00 C ATOM 369 N9 DA A 12 -9.451 3.184 -9.881 1.00 0.00 N ATOM 370 C8 DA A 12 -10.176 3.184 -11.059 1.00 0.00 C ATOM 371 N7 DA A 12 -10.809 4.289 -11.298 1.00 0.00 N ATOM 372 C5 DA A 12 -10.505 5.102 -10.202 1.00 0.00 C ATOM 373 C6 DA A 12 -10.843 6.418 -9.822 1.00 0.00 C ATOM 374 N6 DA A 12 -11.649 7.187 -10.576 1.00 0.00 N ATOM 375 N1 DA A 12 -10.332 6.901 -8.671 1.00 0.00 N ATOM 376 C2 DA A 12 -9.543 6.100 -7.924 1.00 0.00 C ATOM 377 N3 DA A 12 -9.157 4.844 -8.175 1.00 0.00 N ATOM 378 C4 DA A 12 -9.665 4.413 -9.325 1.00 0.00 C ATOM 0 H5' DA A 12 -5.073 3.312 -10.178 1.00 0.00 H new ATOM 0 H5'' DA A 12 -4.484 1.685 -10.452 1.00 0.00 H new ATOM 0 H4' DA A 12 -5.653 1.612 -8.429 1.00 0.00 H new ATOM 0 H3' DA A 12 -6.469 -0.178 -10.356 1.00 0.00 H new ATOM 0 H2' DA A 12 -8.381 1.156 -11.175 1.00 0.00 H new ATOM 0 H2'' DA A 12 -9.161 0.171 -9.954 1.00 0.00 H new ATOM 0 H1' DA A 12 -9.147 1.869 -8.347 1.00 0.00 H new ATOM 0 H8 DA A 12 -10.211 2.334 -11.724 1.00 0.00 H new ATOM 0 H61 DA A 12 -11.876 8.135 -10.276 1.00 0.00 H new ATOM 0 H62 DA A 12 -12.033 6.822 -11.448 1.00 0.00 H new ATOM 0 H2 DA A 12 -9.175 6.529 -7.004 1.00 0.00 H new ATOM 390 P DG A 13 -6.887 -1.955 -8.713 1.00 0.00 P ATOM 391 OP1 DG A 13 -5.523 -2.174 -9.286 1.00 0.00 O ATOM 392 OP2 DG A 13 -8.048 -2.517 -9.483 1.00 0.00 O ATOM 393 O5' DG A 13 -6.897 -2.449 -7.233 1.00 0.00 O ATOM 394 C5' DG A 13 -7.798 -3.428 -6.740 1.00 0.00 C ATOM 395 C4' DG A 13 -7.958 -3.327 -5.214 1.00 0.00 C ATOM 396 O4' DG A 13 -6.708 -3.615 -4.585 1.00 0.00 O ATOM 397 C3' DG A 13 -8.473 -1.953 -4.658 1.00 0.00 C ATOM 398 O3' DG A 13 -9.756 -2.129 -4.068 1.00 0.00 O ATOM 399 C2' DG A 13 -7.348 -1.558 -3.670 1.00 0.00 C ATOM 400 C1' DG A 13 -6.603 -2.879 -3.402 1.00 0.00 C ATOM 401 N9 DG A 13 -5.181 -2.809 -3.095 1.00 0.00 N ATOM 402 C8 DG A 13 -4.082 -2.865 -3.931 1.00 0.00 C ATOM 403 N7 DG A 13 -2.942 -2.714 -3.310 1.00 0.00 N ATOM 404 C5 DG A 13 -3.313 -2.544 -1.979 1.00 0.00 C ATOM 405 C6 DG A 13 -2.535 -2.324 -0.786 1.00 0.00 C ATOM 406 O6 DG A 13 -1.323 -2.188 -0.691 1.00 0.00 O ATOM 407 N1 DG A 13 -3.389 -2.248 0.349 1.00 0.00 N ATOM 408 C2 DG A 13 -4.760 -2.326 0.340 1.00 0.00 C ATOM 409 N2 DG A 13 -5.373 -2.173 1.536 1.00 0.00 N ATOM 410 N3 DG A 13 -5.474 -2.513 -0.746 1.00 0.00 N ATOM 411 C4 DG A 13 -4.690 -2.602 -1.853 1.00 0.00 C ATOM 0 H5' DG A 13 -7.437 -4.422 -7.004 1.00 0.00 H new ATOM 0 H5'' DG A 13 -8.770 -3.304 -7.218 1.00 0.00 H new ATOM 0 H4' DG A 13 -8.735 -4.054 -4.978 1.00 0.00 H new ATOM 0 H3' DG A 13 -8.635 -1.167 -5.396 1.00 0.00 H new ATOM 0 H2' DG A 13 -6.685 -0.807 -4.100 1.00 0.00 H new ATOM 0 H2'' DG A 13 -7.755 -1.136 -2.751 1.00 0.00 H new ATOM 0 H1' DG A 13 -7.064 -3.298 -2.507 1.00 0.00 H new ATOM 0 H8 DG A 13 -4.158 -3.019 -4.997 1.00 0.00 H new ATOM 0 H1 DG A 13 -2.940 -2.124 1.256 1.00 0.00 H new ATOM 0 H21 DG A 13 -6.390 -2.220 1.598 1.00 0.00 H new ATOM 0 H22 DG A 13 -4.818 -2.010 2.376 1.00 0.00 H new ATOM 423 P DG A 14 -10.759 -0.931 -3.862 1.00 0.00 P ATOM 424 OP1 DG A 14 -12.114 -1.521 -3.627 1.00 0.00 O ATOM 425 OP2 DG A 14 -10.616 0.065 -4.970 1.00 0.00 O ATOM 426 O5' DG A 14 -10.229 -0.251 -2.547 1.00 0.00 O ATOM 427 C5' DG A 14 -10.557 -0.821 -1.285 1.00 0.00 C ATOM 428 C4' DG A 14 -9.973 -0.005 -0.121 1.00 0.00 C ATOM 429 O4' DG A 14 -8.557 -0.151 -0.059 1.00 0.00 O ATOM 430 C3' DG A 14 -10.278 1.528 -0.160 1.00 0.00 C ATOM 431 O3' DG A 14 -11.365 1.827 0.710 1.00 0.00 O ATOM 432 C2' DG A 14 -8.886 2.140 0.158 1.00 0.00 C ATOM 433 C1' DG A 14 -8.025 0.954 0.630 1.00 0.00 C ATOM 434 N9 DG A 14 -6.622 1.044 0.303 1.00 0.00 N ATOM 435 C8 DG A 14 -6.063 0.977 -0.956 1.00 0.00 C ATOM 436 N7 DG A 14 -4.762 1.003 -0.941 1.00 0.00 N ATOM 437 C5 DG A 14 -4.431 1.082 0.399 1.00 0.00 C ATOM 438 C6 DG A 14 -3.151 1.104 1.060 1.00 0.00 C ATOM 439 O6 DG A 14 -2.035 1.065 0.551 1.00 0.00 O ATOM 440 N1 DG A 14 -3.322 1.171 2.468 1.00 0.00 N ATOM 441 C2 DG A 14 -4.538 1.217 3.113 1.00 0.00 C ATOM 442 N2 DG A 14 -4.507 1.315 4.455 1.00 0.00 N ATOM 443 N3 DG A 14 -5.709 1.187 2.513 1.00 0.00 N ATOM 444 C4 DG A 14 -5.582 1.102 1.169 1.00 0.00 C ATOM 0 H5' DG A 14 -10.179 -1.842 -1.238 1.00 0.00 H new ATOM 0 H5'' DG A 14 -11.641 -0.877 -1.182 1.00 0.00 H new ATOM 0 H4' DG A 14 -10.470 -0.417 0.757 1.00 0.00 H new ATOM 0 H3' DG A 14 -10.643 1.948 -1.097 1.00 0.00 H new ATOM 0 H2' DG A 14 -8.454 2.615 -0.723 1.00 0.00 H new ATOM 0 H2'' DG A 14 -8.959 2.906 0.930 1.00 0.00 H new ATOM 0 H1' DG A 14 -8.062 0.904 1.718 1.00 0.00 H new ATOM 0 H8 DG A 14 -6.646 0.910 -1.863 1.00 0.00 H new ATOM 0 H1 DG A 14 -2.481 1.186 3.045 1.00 0.00 H new ATOM 0 H21 DG A 14 -5.378 1.353 4.984 1.00 0.00 H new ATOM 0 H22 DG A 14 -3.612 1.351 4.943 1.00 0.00 H new ATOM 456 P DG A 15 -11.879 3.313 0.835 1.00 0.00 P ATOM 457 OP1 DG A 15 -13.237 3.281 1.457 1.00 0.00 O ATOM 458 OP2 DG A 15 -11.737 4.016 -0.475 1.00 0.00 O ATOM 459 O5' DG A 15 -10.881 3.958 1.879 1.00 0.00 O ATOM 460 C5' DG A 15 -10.737 3.284 3.128 1.00 0.00 C ATOM 461 C4' DG A 15 -9.603 3.829 4.000 1.00 0.00 C ATOM 462 O4' DG A 15 -8.335 3.666 3.372 1.00 0.00 O ATOM 463 C3' DG A 15 -9.721 5.318 4.451 1.00 0.00 C ATOM 464 O3' DG A 15 -9.961 5.421 5.853 1.00 0.00 O ATOM 465 C2' DG A 15 -8.343 5.891 4.057 1.00 0.00 C ATOM 466 C1' DG A 15 -7.462 4.644 3.881 1.00 0.00 C ATOM 467 N9 DG A 15 -6.341 4.719 2.971 1.00 0.00 N ATOM 468 C8 DG A 15 -6.351 4.690 1.587 1.00 0.00 C ATOM 469 N7 DG A 15 -5.164 4.591 1.058 1.00 0.00 N ATOM 470 C5 DG A 15 -4.317 4.536 2.161 1.00 0.00 C ATOM 471 C6 DG A 15 -2.890 4.373 2.258 1.00 0.00 C ATOM 472 O6 DG A 15 -2.094 4.214 1.343 1.00 0.00 O ATOM 473 N1 DG A 15 -2.476 4.376 3.616 1.00 0.00 N ATOM 474 C2 DG A 15 -3.303 4.481 4.704 1.00 0.00 C ATOM 475 N2 DG A 15 -2.704 4.420 5.915 1.00 0.00 N ATOM 476 N3 DG A 15 -4.609 4.604 4.626 1.00 0.00 N ATOM 477 C4 DG A 15 -5.042 4.613 3.334 1.00 0.00 C ATOM 0 H5' DG A 15 -10.561 2.225 2.940 1.00 0.00 H new ATOM 0 H5'' DG A 15 -11.674 3.358 3.680 1.00 0.00 H new ATOM 0 H4' DG A 15 -9.695 3.224 4.902 1.00 0.00 H new ATOM 0 H3' DG A 15 -10.555 5.850 3.994 1.00 0.00 H new ATOM 0 H2' DG A 15 -8.400 6.473 3.137 1.00 0.00 H new ATOM 0 H2'' DG A 15 -7.950 6.553 4.829 1.00 0.00 H new ATOM 0 H1' DG A 15 -6.999 4.459 4.850 1.00 0.00 H new ATOM 0 H8 DG A 15 -7.257 4.744 1.001 1.00 0.00 H new ATOM 0 H1 DG A 15 -1.476 4.293 3.798 1.00 0.00 H new ATOM 0 H21 DG A 15 -3.263 4.492 6.765 1.00 0.00 H new ATOM 0 H22 DG A 15 -1.693 4.302 5.978 1.00 0.00 H new ATOM 489 P DT A 16 -11.430 5.254 6.409 1.00 0.00 P ATOM 490 OP1 DT A 16 -12.420 5.726 5.397 1.00 0.00 O ATOM 491 OP2 DT A 16 -11.444 5.897 7.757 1.00 0.00 O ATOM 492 O5' DT A 16 -11.621 3.698 6.524 1.00 0.00 O ATOM 493 C5' DT A 16 -10.963 2.933 7.520 1.00 0.00 C ATOM 494 C4' DT A 16 -11.300 1.423 7.448 1.00 0.00 C ATOM 495 O4' DT A 16 -12.687 1.199 7.747 1.00 0.00 O ATOM 496 C3' DT A 16 -11.039 0.695 6.100 1.00 0.00 C ATOM 497 O3' DT A 16 -10.778 -0.684 6.324 1.00 0.00 O ATOM 498 C2' DT A 16 -12.414 0.820 5.425 1.00 0.00 C ATOM 499 C1' DT A 16 -13.357 0.656 6.632 1.00 0.00 C ATOM 500 N1 DT A 16 -14.688 1.295 6.501 1.00 0.00 N ATOM 501 C2 DT A 16 -15.672 0.656 5.783 1.00 0.00 C ATOM 502 O2 DT A 16 -15.499 -0.426 5.222 1.00 0.00 O ATOM 503 N3 DT A 16 -16.904 1.269 5.816 1.00 0.00 N ATOM 504 C4 DT A 16 -17.229 2.496 6.387 1.00 0.00 C ATOM 505 O4 DT A 16 -18.361 2.949 6.270 1.00 0.00 O ATOM 506 C5 DT A 16 -16.133 3.146 7.120 1.00 0.00 C ATOM 507 C7 DT A 16 -16.409 4.448 7.841 1.00 0.00 C ATOM 508 C6 DT A 16 -14.940 2.532 7.120 1.00 0.00 C ATOM 0 H5' DT A 16 -11.238 3.314 8.503 1.00 0.00 H new ATOM 0 H5'' DT A 16 -9.886 3.064 7.418 1.00 0.00 H new ATOM 0 H4' DT A 16 -10.608 1.005 8.179 1.00 0.00 H new ATOM 0 H3' DT A 16 -10.196 1.098 5.538 1.00 0.00 H new ATOM 0 H2' DT A 16 -12.543 1.782 4.930 1.00 0.00 H new ATOM 0 H2'' DT A 16 -12.574 0.050 4.671 1.00 0.00 H new ATOM 0 H1' DT A 16 -13.575 -0.408 6.725 1.00 0.00 H new ATOM 0 H3 DT A 16 -17.669 0.764 5.369 1.00 0.00 H new ATOM 0 H71 DT A 16 -15.757 4.528 8.711 1.00 0.00 H new ATOM 0 H72 DT A 16 -16.219 5.284 7.168 1.00 0.00 H new ATOM 0 H73 DT A 16 -17.450 4.471 8.164 1.00 0.00 H new ATOM 0 H6 DT A 16 -14.121 3.019 7.628 1.00 0.00 H new ATOM 521 P DG A 17 -9.508 -1.446 5.807 1.00 0.00 P ATOM 522 OP1 DG A 17 -8.861 -0.718 4.676 1.00 0.00 O ATOM 523 OP2 DG A 17 -9.922 -2.867 5.598 1.00 0.00 O ATOM 524 O5' DG A 17 -8.528 -1.332 7.024 1.00 0.00 O ATOM 525 C5' DG A 17 -8.467 -2.274 8.081 1.00 0.00 C ATOM 526 C4' DG A 17 -7.141 -2.144 8.869 1.00 0.00 C ATOM 527 O4' DG A 17 -6.049 -2.693 8.110 1.00 0.00 O ATOM 528 C3' DG A 17 -6.779 -0.676 9.230 1.00 0.00 C ATOM 529 O3' DG A 17 -6.246 -0.564 10.545 1.00 0.00 O ATOM 530 C2' DG A 17 -5.774 -0.347 8.111 1.00 0.00 C ATOM 531 C1' DG A 17 -5.092 -1.702 7.818 1.00 0.00 C ATOM 532 N9 DG A 17 -4.643 -1.873 6.445 1.00 0.00 N ATOM 533 C8 DG A 17 -5.408 -1.848 5.294 1.00 0.00 C ATOM 534 N7 DG A 17 -4.710 -1.912 4.194 1.00 0.00 N ATOM 535 C5 DG A 17 -3.402 -1.988 4.638 1.00 0.00 C ATOM 536 C6 DG A 17 -2.158 -2.044 3.914 1.00 0.00 C ATOM 537 O6 DG A 17 -1.975 -1.970 2.706 1.00 0.00 O ATOM 538 N1 DG A 17 -1.071 -2.187 4.805 1.00 0.00 N ATOM 539 C2 DG A 17 -1.164 -2.239 6.172 1.00 0.00 C ATOM 540 N2 DG A 17 0.011 -2.404 6.817 1.00 0.00 N ATOM 541 N3 DG A 17 -2.285 -2.134 6.847 1.00 0.00 N ATOM 542 C4 DG A 17 -3.359 -1.989 6.025 1.00 0.00 C ATOM 0 H5' DG A 17 -8.557 -3.283 7.678 1.00 0.00 H new ATOM 0 H5'' DG A 17 -9.310 -2.124 8.755 1.00 0.00 H new ATOM 0 H4' DG A 17 -7.297 -2.696 9.796 1.00 0.00 H new ATOM 0 H3' DG A 17 -7.621 0.015 9.267 1.00 0.00 H new ATOM 0 H2' DG A 17 -6.275 0.048 7.227 1.00 0.00 H new ATOM 0 H2'' DG A 17 -5.051 0.404 8.430 1.00 0.00 H new ATOM 0 H1' DG A 17 -4.189 -1.764 8.426 1.00 0.00 H new ATOM 0 H8 DG A 17 -6.486 -1.782 5.305 1.00 0.00 H new ATOM 0 H1 DG A 17 -0.139 -2.257 4.397 1.00 0.00 H new ATOM 0 H21 DG A 17 0.031 -2.453 7.836 1.00 0.00 H new ATOM 0 H22 DG A 17 0.878 -2.480 6.285 1.00 0.00 H new ATOM 554 P DG A 18 -5.959 0.876 11.132 1.00 0.00 P ATOM 555 OP1 DG A 18 -6.218 0.829 12.603 1.00 0.00 O ATOM 556 OP2 DG A 18 -6.656 1.923 10.324 1.00 0.00 O ATOM 557 O5' DG A 18 -4.406 1.046 10.881 1.00 0.00 O ATOM 558 C5' DG A 18 -3.542 0.142 11.566 1.00 0.00 C ATOM 559 C4' DG A 18 -2.071 0.224 11.142 1.00 0.00 C ATOM 560 O4' DG A 18 -1.907 -0.223 9.803 1.00 0.00 O ATOM 561 C3' DG A 18 -1.338 1.583 11.193 1.00 0.00 C ATOM 562 O3' DG A 18 -0.996 1.913 12.527 1.00 0.00 O ATOM 563 C2' DG A 18 -0.145 1.299 10.283 1.00 0.00 C ATOM 564 C1' DG A 18 -0.726 0.300 9.253 1.00 0.00 C ATOM 565 N9 DG A 18 -1.062 0.854 7.947 1.00 0.00 N ATOM 566 C8 DG A 18 -2.303 1.088 7.394 1.00 0.00 C ATOM 567 N7 DG A 18 -2.272 1.261 6.106 1.00 0.00 N ATOM 568 C5 DG A 18 -0.933 1.128 5.773 1.00 0.00 C ATOM 569 C6 DG A 18 -0.260 1.082 4.500 1.00 0.00 C ATOM 570 O6 DG A 18 -0.762 1.144 3.381 1.00 0.00 O ATOM 571 N1 DG A 18 1.143 0.940 4.688 1.00 0.00 N ATOM 572 C2 DG A 18 1.769 0.810 5.907 1.00 0.00 C ATOM 573 N2 DG A 18 3.115 0.778 5.910 1.00 0.00 N ATOM 574 N3 DG A 18 1.149 0.755 7.062 1.00 0.00 N ATOM 575 C4 DG A 18 -0.190 0.893 6.913 1.00 0.00 C ATOM 0 H5' DG A 18 -3.898 -0.875 11.403 1.00 0.00 H new ATOM 0 H5'' DG A 18 -3.610 0.335 12.637 1.00 0.00 H new ATOM 0 H4' DG A 18 -1.620 -0.400 11.914 1.00 0.00 H new ATOM 0 H3' DG A 18 -1.910 2.452 10.866 1.00 0.00 H new ATOM 0 H2' DG A 18 0.222 2.206 9.803 1.00 0.00 H new ATOM 0 H2'' DG A 18 0.691 0.870 10.835 1.00 0.00 H new ATOM 0 H1' DG A 18 0.058 -0.435 9.071 1.00 0.00 H new ATOM 0 H8 DG A 18 -3.213 1.124 7.975 1.00 0.00 H new ATOM 0 H1 DG A 18 1.731 0.934 3.854 1.00 0.00 H new ATOM 0 H21 DG A 18 3.621 0.683 6.791 1.00 0.00 H new ATOM 0 H22 DG A 18 3.629 0.849 5.032 1.00 0.00 H new ATOM 587 P DG A 19 -0.818 3.406 12.985 1.00 0.00 P ATOM 588 OP1 DG A 19 -0.512 3.350 14.447 1.00 0.00 O ATOM 589 OP2 DG A 19 -1.964 4.246 12.530 1.00 0.00 O ATOM 590 O5' DG A 19 0.425 3.905 12.161 1.00 0.00 O ATOM 591 C5' DG A 19 1.732 3.441 12.443 1.00 0.00 C ATOM 592 C4' DG A 19 2.778 4.136 11.550 1.00 0.00 C ATOM 593 O4' DG A 19 2.608 3.730 10.178 1.00 0.00 O ATOM 594 C3' DG A 19 2.742 5.697 11.611 1.00 0.00 C ATOM 595 O3' DG A 19 4.049 6.211 11.832 1.00 0.00 O ATOM 596 C2' DG A 19 2.131 6.030 10.236 1.00 0.00 C ATOM 597 C1' DG A 19 2.589 4.862 9.342 1.00 0.00 C ATOM 598 N9 DG A 19 1.736 4.603 8.195 1.00 0.00 N ATOM 599 C8 DG A 19 0.363 4.443 8.157 1.00 0.00 C ATOM 600 N7 DG A 19 -0.120 4.281 6.955 1.00 0.00 N ATOM 601 C5 DG A 19 1.001 4.312 6.142 1.00 0.00 C ATOM 602 C6 DG A 19 1.140 4.219 4.709 1.00 0.00 C ATOM 603 O6 DG A 19 0.266 4.083 3.863 1.00 0.00 O ATOM 604 N1 DG A 19 2.501 4.297 4.338 1.00 0.00 N ATOM 605 C2 DG A 19 3.557 4.457 5.199 1.00 0.00 C ATOM 606 N2 DG A 19 4.765 4.522 4.607 1.00 0.00 N ATOM 607 N3 DG A 19 3.441 4.568 6.505 1.00 0.00 N ATOM 608 C4 DG A 19 2.145 4.494 6.905 1.00 0.00 C ATOM 0 H5' DG A 19 1.778 2.363 12.289 1.00 0.00 H new ATOM 0 H5'' DG A 19 1.967 3.624 13.492 1.00 0.00 H new ATOM 0 H4' DG A 19 3.745 3.822 11.943 1.00 0.00 H new ATOM 0 H3' DG A 19 2.169 6.139 12.426 1.00 0.00 H new ATOM 0 H2' DG A 19 1.044 6.094 10.286 1.00 0.00 H new ATOM 0 H2'' DG A 19 2.490 6.988 9.859 1.00 0.00 H new ATOM 0 H1' DG A 19 3.559 5.112 8.913 1.00 0.00 H new ATOM 0 H8 DG A 19 -0.255 4.451 9.043 1.00 0.00 H new ATOM 0 H1 DG A 19 2.717 4.228 3.344 1.00 0.00 H new ATOM 0 H21 DG A 19 5.605 4.640 5.174 1.00 0.00 H new ATOM 0 H22 DG A 19 4.840 4.453 3.592 1.00 0.00 H new ATOM 620 P DT A 20 4.318 7.759 11.975 1.00 0.00 P ATOM 621 OP1 DT A 20 5.297 7.955 13.087 1.00 0.00 O ATOM 622 OP2 DT A 20 3.041 8.531 12.058 1.00 0.00 O ATOM 623 O5' DT A 20 4.985 8.103 10.586 1.00 0.00 O ATOM 624 C5' DT A 20 6.150 7.389 10.190 1.00 0.00 C ATOM 625 C4' DT A 20 6.579 7.668 8.739 1.00 0.00 C ATOM 626 O4' DT A 20 5.584 7.185 7.813 1.00 0.00 O ATOM 627 C3' DT A 20 6.866 9.161 8.382 1.00 0.00 C ATOM 628 O3' DT A 20 8.029 9.255 7.569 1.00 0.00 O ATOM 629 C2' DT A 20 5.625 9.500 7.545 1.00 0.00 C ATOM 630 C1' DT A 20 5.403 8.164 6.812 1.00 0.00 C ATOM 631 N1 DT A 20 4.099 7.971 6.188 1.00 0.00 N ATOM 632 C2 DT A 20 3.972 7.766 4.833 1.00 0.00 C ATOM 633 O2 DT A 20 4.922 7.719 4.051 1.00 0.00 O ATOM 634 N3 DT A 20 2.674 7.618 4.393 1.00 0.00 N ATOM 635 C4 DT A 20 1.514 7.630 5.156 1.00 0.00 C ATOM 636 O4 DT A 20 0.425 7.439 4.627 1.00 0.00 O ATOM 637 C5 DT A 20 1.706 7.882 6.592 1.00 0.00 C ATOM 638 C7 DT A 20 0.482 7.985 7.476 1.00 0.00 C ATOM 639 C6 DT A 20 2.969 8.012 7.021 1.00 0.00 C ATOM 0 H5' DT A 20 5.969 6.321 10.308 1.00 0.00 H new ATOM 0 H5'' DT A 20 6.970 7.649 10.859 1.00 0.00 H new ATOM 0 H4' DT A 20 7.527 7.137 8.651 1.00 0.00 H new ATOM 0 H3' DT A 20 7.035 9.809 9.242 1.00 0.00 H new ATOM 0 H2' DT A 20 4.772 9.779 8.164 1.00 0.00 H new ATOM 0 H2'' DT A 20 5.803 10.326 6.856 1.00 0.00 H new ATOM 0 H1' DT A 20 6.094 8.118 5.970 1.00 0.00 H new ATOM 0 H3 DT A 20 2.551 7.484 3.389 1.00 0.00 H new ATOM 0 H71 DT A 20 0.730 7.644 8.481 1.00 0.00 H new ATOM 0 H72 DT A 20 0.148 9.022 7.516 1.00 0.00 H new ATOM 0 H73 DT A 20 -0.315 7.363 7.068 1.00 0.00 H new ATOM 0 H6 DT A 20 3.129 8.158 8.079 1.00 0.00 H new ATOM 652 P DA A 21 8.848 10.591 7.438 1.00 0.00 P ATOM 653 OP1 DA A 21 10.193 10.351 8.037 1.00 0.00 O ATOM 654 OP2 DA A 21 8.069 11.774 7.936 1.00 0.00 O ATOM 655 O5' DA A 21 9.047 10.641 5.884 1.00 0.00 O ATOM 656 C5' DA A 21 8.415 11.517 4.958 1.00 0.00 C ATOM 657 C4' DA A 21 7.539 10.776 3.918 1.00 0.00 C ATOM 658 O4' DA A 21 6.227 10.508 4.446 1.00 0.00 O ATOM 659 C3' DA A 21 7.329 11.522 2.564 1.00 0.00 C ATOM 660 O3' DA A 21 7.270 10.589 1.480 1.00 0.00 O ATOM 661 C2' DA A 21 5.942 12.140 2.811 1.00 0.00 C ATOM 662 C1' DA A 21 5.258 10.972 3.534 1.00 0.00 C ATOM 663 N9 DA A 21 4.024 11.245 4.250 1.00 0.00 N ATOM 664 C8 DA A 21 3.806 11.681 5.540 1.00 0.00 C ATOM 665 N7 DA A 21 2.560 11.669 5.906 1.00 0.00 N ATOM 666 C5 DA A 21 1.870 11.206 4.777 1.00 0.00 C ATOM 667 C6 DA A 21 0.520 10.932 4.449 1.00 0.00 C ATOM 668 N6 DA A 21 -0.526 11.017 5.294 1.00 0.00 N ATOM 669 N1 DA A 21 0.236 10.532 3.188 1.00 0.00 N ATOM 670 C2 DA A 21 1.237 10.382 2.305 1.00 0.00 C ATOM 671 N3 DA A 21 2.547 10.568 2.505 1.00 0.00 N ATOM 672 C4 DA A 21 2.787 10.963 3.749 1.00 0.00 C ATOM 0 H5' DA A 21 9.178 12.095 4.436 1.00 0.00 H new ATOM 0 H5'' DA A 21 7.796 12.228 5.505 1.00 0.00 H new ATOM 0 H4' DA A 21 8.106 9.867 3.717 1.00 0.00 H new ATOM 0 H3' DA A 21 8.115 12.230 2.300 1.00 0.00 H new ATOM 0 H2' DA A 21 5.989 13.040 3.424 1.00 0.00 H new ATOM 0 H2'' DA A 21 5.435 12.412 1.885 1.00 0.00 H new ATOM 0 H1' DA A 21 4.934 10.265 2.771 1.00 0.00 H new ATOM 0 H8 DA A 21 4.604 12.005 6.191 1.00 0.00 H new ATOM 0 H61 DA A 21 -1.467 10.799 4.965 1.00 0.00 H new ATOM 0 H62 DA A 21 -0.377 11.299 6.263 1.00 0.00 H new ATOM 0 H2 DA A 21 0.949 10.073 1.311 1.00 0.00 H new ATOM 684 P DA A 22 7.628 11.079 0.021 1.00 0.00 P ATOM 685 OP1 DA A 22 9.018 11.611 0.006 1.00 0.00 O ATOM 686 OP2 DA A 22 6.576 12.015 -0.486 1.00 0.00 O ATOM 687 O5' DA A 22 7.600 9.767 -0.828 1.00 0.00 O ATOM 688 C5' DA A 22 6.636 8.734 -0.734 1.00 0.00 C ATOM 689 C4' DA A 22 5.499 8.765 -1.783 1.00 0.00 C ATOM 690 O4' DA A 22 4.747 7.544 -1.672 1.00 0.00 O ATOM 691 C3' DA A 22 4.424 9.883 -1.734 1.00 0.00 C ATOM 692 O3' DA A 22 4.808 11.134 -2.306 1.00 0.00 O ATOM 693 C2' DA A 22 3.288 9.210 -2.486 1.00 0.00 C ATOM 694 C1' DA A 22 3.386 7.767 -1.934 1.00 0.00 C ATOM 695 N9 DA A 22 2.647 7.556 -0.681 1.00 0.00 N ATOM 696 C8 DA A 22 3.076 7.476 0.628 1.00 0.00 C ATOM 697 N7 DA A 22 2.115 7.308 1.486 1.00 0.00 N ATOM 698 C5 DA A 22 0.953 7.261 0.706 1.00 0.00 C ATOM 699 C6 DA A 22 -0.434 7.179 0.964 1.00 0.00 C ATOM 700 N6 DA A 22 -0.968 7.098 2.195 1.00 0.00 N ATOM 701 N1 DA A 22 -1.280 7.206 -0.084 1.00 0.00 N ATOM 702 C2 DA A 22 -0.786 7.307 -1.329 1.00 0.00 C ATOM 703 N3 DA A 22 0.494 7.435 -1.695 1.00 0.00 N ATOM 704 C4 DA A 22 1.295 7.403 -0.640 1.00 0.00 C ATOM 0 H5' DA A 22 6.188 8.773 0.259 1.00 0.00 H new ATOM 0 H5'' DA A 22 7.151 7.776 -0.814 1.00 0.00 H new ATOM 0 H4' DA A 22 6.060 8.938 -2.701 1.00 0.00 H new ATOM 0 H3' DA A 22 4.189 10.198 -0.717 1.00 0.00 H new ATOM 0 H2' DA A 22 2.323 9.669 -2.273 1.00 0.00 H new ATOM 0 H2'' DA A 22 3.428 9.249 -3.566 1.00 0.00 H new ATOM 0 HO3' DA A 22 5.454 11.578 -1.718 1.00 0.00 H new ATOM 0 H1' DA A 22 2.952 7.089 -2.669 1.00 0.00 H new ATOM 0 H8 DA A 22 4.115 7.547 0.913 1.00 0.00 H new ATOM 0 H61 DA A 22 -1.980 7.041 2.309 1.00 0.00 H new ATOM 0 H62 DA A 22 -0.361 7.093 3.015 1.00 0.00 H new ATOM 0 H2 DA A 22 -1.509 7.282 -2.131 1.00 0.00 H new TER 717 DA A 22 HETATM 718 K K A 31 -0.045 -0.868 1.201 1.00 0.00 K HETATM 719 K K A 30 0.184 2.932 1.445 1.00 0.00 K