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 -80:sc= 1.24 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 (180deg=0) USER MOD Single : A 22 DA O3' : rot -74:sc= 0.974 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 -1.022 -9.311 2.342 1.00 0.00 O ATOM 2 C5' DT A 1 -1.701 -8.272 3.046 1.00 0.00 C ATOM 3 C4' DT A 1 -2.851 -8.692 4.028 1.00 0.00 C ATOM 4 O4' DT A 1 -4.114 -8.646 3.347 1.00 0.00 O ATOM 5 C3' DT A 1 -2.762 -10.098 4.693 1.00 0.00 C ATOM 6 O3' DT A 1 -3.273 -10.047 6.020 1.00 0.00 O ATOM 7 C2' DT A 1 -3.651 -10.932 3.752 1.00 0.00 C ATOM 8 C1' DT A 1 -4.721 -9.914 3.308 1.00 0.00 C ATOM 9 N1 DT A 1 -5.271 -10.134 1.952 1.00 0.00 N ATOM 10 C2 DT A 1 -6.299 -11.028 1.768 1.00 0.00 C ATOM 11 O2 DT A 1 -6.806 -11.672 2.690 1.00 0.00 O ATOM 12 N3 DT A 1 -6.715 -11.178 0.465 1.00 0.00 N ATOM 13 C4 DT A 1 -6.162 -10.599 -0.669 1.00 0.00 C ATOM 14 O4 DT A 1 -6.614 -10.881 -1.773 1.00 0.00 O ATOM 15 C5 DT A 1 -5.038 -9.684 -0.426 1.00 0.00 C ATOM 16 C7 DT A 1 -4.351 -9.021 -1.601 1.00 0.00 C ATOM 17 C6 DT A 1 -4.669 -9.503 0.849 1.00 0.00 C ATOM 0 H5' DT A 1 -2.121 -7.586 2.310 1.00 0.00 H new ATOM 0 H5'' DT A 1 -0.960 -7.712 3.616 1.00 0.00 H new ATOM 0 H4' DT A 1 -2.743 -7.968 4.836 1.00 0.00 H new ATOM 0 H3' DT A 1 -1.755 -10.500 4.800 1.00 0.00 H new ATOM 0 H2' DT A 1 -3.088 -11.324 2.905 1.00 0.00 H new ATOM 0 H2'' DT A 1 -4.093 -11.787 4.264 1.00 0.00 H new ATOM 0 HO5' DT A 1 -0.352 -9.720 2.929 1.00 0.00 H new ATOM 0 H1' DT A 1 -5.569 -10.019 3.984 1.00 0.00 H new ATOM 0 H3 DT A 1 -7.522 -11.784 0.315 1.00 0.00 H new ATOM 0 H71 DT A 1 -3.960 -8.051 -1.294 1.00 0.00 H new ATOM 0 H72 DT A 1 -3.530 -9.651 -1.945 1.00 0.00 H new ATOM 0 H73 DT A 1 -5.067 -8.883 -2.411 1.00 0.00 H new ATOM 0 H6 DT A 1 -3.851 -8.825 1.043 1.00 0.00 H new ATOM 31 P DG A 2 -2.636 -10.926 7.169 1.00 0.00 P ATOM 32 OP1 DG A 2 -2.620 -12.355 6.743 1.00 0.00 O ATOM 33 OP2 DG A 2 -3.329 -10.548 8.435 1.00 0.00 O ATOM 34 O5' DG A 2 -1.135 -10.439 7.254 1.00 0.00 O ATOM 35 C5' DG A 2 -0.844 -9.089 7.604 1.00 0.00 C ATOM 36 C4' DG A 2 -0.075 -8.370 6.479 1.00 0.00 C ATOM 37 O4' DG A 2 -0.362 -6.971 6.491 1.00 0.00 O ATOM 38 C3' DG A 2 1.469 -8.435 6.451 1.00 0.00 C ATOM 39 O3' DG A 2 2.026 -9.714 6.214 1.00 0.00 O ATOM 40 C2' DG A 2 1.783 -7.236 5.559 1.00 0.00 C ATOM 41 C1' DG A 2 0.759 -6.214 6.110 1.00 0.00 C ATOM 42 N9 DG A 2 1.245 -5.464 7.295 1.00 0.00 N ATOM 43 C8 DG A 2 2.518 -5.015 7.590 1.00 0.00 C ATOM 44 N7 DG A 2 2.577 -4.236 8.634 1.00 0.00 N ATOM 45 C5 DG A 2 1.260 -4.139 9.058 1.00 0.00 C ATOM 46 C6 DG A 2 0.662 -3.448 10.182 1.00 0.00 C ATOM 47 O6 DG A 2 1.206 -2.775 11.045 1.00 0.00 O ATOM 48 N1 DG A 2 -0.739 -3.647 10.198 1.00 0.00 N ATOM 49 C2 DG A 2 -1.452 -4.371 9.281 1.00 0.00 C ATOM 50 N2 DG A 2 -2.790 -4.411 9.468 1.00 0.00 N ATOM 51 N3 DG A 2 -0.919 -5.001 8.262 1.00 0.00 N ATOM 52 C4 DG A 2 0.436 -4.875 8.222 1.00 0.00 C ATOM 0 H5' DG A 2 -0.255 -9.068 8.521 1.00 0.00 H new ATOM 0 H5'' DG A 2 -1.773 -8.557 7.810 1.00 0.00 H new ATOM 0 H4' DG A 2 -0.433 -8.933 5.617 1.00 0.00 H new ATOM 0 H3' DG A 2 1.988 -8.335 7.404 1.00 0.00 H new ATOM 0 H2' DG A 2 2.812 -6.894 5.668 1.00 0.00 H new ATOM 0 H2'' DG A 2 1.629 -7.452 4.502 1.00 0.00 H new ATOM 0 H1' DG A 2 0.553 -5.468 5.342 1.00 0.00 H new ATOM 0 H8 DG A 2 3.387 -5.285 7.008 1.00 0.00 H new ATOM 0 H1 DG A 2 -1.263 -3.214 10.958 1.00 0.00 H new ATOM 0 H21 DG A 2 -3.380 -4.933 8.820 1.00 0.00 H new ATOM 0 H22 DG A 2 -3.210 -3.919 10.257 1.00 0.00 H new ATOM 64 P DA A 3 2.085 -10.487 4.866 1.00 0.00 P ATOM 65 OP1 DA A 3 0.812 -10.374 4.074 1.00 0.00 O ATOM 66 OP2 DA A 3 2.542 -11.866 5.202 1.00 0.00 O ATOM 67 O5' DA A 3 3.255 -9.742 4.116 1.00 0.00 O ATOM 68 C5' DA A 3 3.192 -9.551 2.713 1.00 0.00 C ATOM 69 C4' DA A 3 4.320 -8.629 2.193 1.00 0.00 C ATOM 70 O4' DA A 3 4.051 -8.364 0.823 1.00 0.00 O ATOM 71 C3' DA A 3 4.416 -7.220 2.845 1.00 0.00 C ATOM 72 O3' DA A 3 5.040 -7.088 4.123 1.00 0.00 O ATOM 73 C2' DA A 3 4.932 -6.330 1.705 1.00 0.00 C ATOM 74 C1' DA A 3 4.615 -7.134 0.416 1.00 0.00 C ATOM 75 N9 DA A 3 3.723 -6.543 -0.564 1.00 0.00 N ATOM 76 C8 DA A 3 3.841 -6.552 -1.945 1.00 0.00 C ATOM 77 N7 DA A 3 2.750 -6.270 -2.584 1.00 0.00 N ATOM 78 C5 DA A 3 1.804 -6.060 -1.575 1.00 0.00 C ATOM 79 C6 DA A 3 0.405 -5.825 -1.542 1.00 0.00 C ATOM 80 N6 DA A 3 -0.372 -5.743 -2.639 1.00 0.00 N ATOM 81 N1 DA A 3 -0.187 -5.706 -0.339 1.00 0.00 N ATOM 82 C2 DA A 3 0.549 -5.846 0.777 1.00 0.00 C ATOM 83 N3 DA A 3 1.850 -6.127 0.872 1.00 0.00 N ATOM 84 C4 DA A 3 2.411 -6.227 -0.329 1.00 0.00 C ATOM 0 H5' DA A 3 2.225 -9.122 2.450 1.00 0.00 H new ATOM 0 H5'' DA A 3 3.257 -10.518 2.214 1.00 0.00 H new ATOM 0 H4' DA A 3 5.243 -9.164 2.418 1.00 0.00 H new ATOM 0 H3' DA A 3 3.441 -6.899 3.211 1.00 0.00 H new ATOM 0 H2' DA A 3 4.434 -5.360 1.701 1.00 0.00 H new ATOM 0 H2'' DA A 3 6.001 -6.139 1.802 1.00 0.00 H new ATOM 0 H1' DA A 3 5.569 -7.199 -0.106 1.00 0.00 H new ATOM 0 H8 DA A 3 4.770 -6.776 -2.449 1.00 0.00 H new ATOM 0 H61 DA A 3 -1.373 -5.572 -2.543 1.00 0.00 H new ATOM 0 H62 DA A 3 0.041 -5.852 -3.565 1.00 0.00 H new ATOM 0 H2 DA A 3 0.023 -5.715 1.711 1.00 0.00 H new ATOM 96 P DG A 4 6.423 -7.734 4.505 1.00 0.00 P ATOM 97 OP1 DG A 4 7.480 -7.318 3.525 1.00 0.00 O ATOM 98 OP2 DG A 4 6.278 -9.201 4.735 1.00 0.00 O ATOM 99 O5' DG A 4 6.700 -7.142 5.926 1.00 0.00 O ATOM 100 C5' DG A 4 6.797 -5.784 6.309 1.00 0.00 C ATOM 101 C4' DG A 4 7.850 -4.935 5.566 1.00 0.00 C ATOM 102 O4' DG A 4 7.290 -4.301 4.413 1.00 0.00 O ATOM 103 C3' DG A 4 8.484 -3.774 6.364 1.00 0.00 C ATOM 104 O3' DG A 4 9.795 -3.575 5.862 1.00 0.00 O ATOM 105 C2' DG A 4 7.438 -2.661 6.109 1.00 0.00 C ATOM 106 C1' DG A 4 6.862 -2.988 4.715 1.00 0.00 C ATOM 107 N9 DG A 4 5.416 -2.867 4.608 1.00 0.00 N ATOM 108 C8 DG A 4 4.369 -2.852 5.510 1.00 0.00 C ATOM 109 N7 DG A 4 3.193 -2.803 4.948 1.00 0.00 N ATOM 110 C5 DG A 4 3.467 -2.796 3.590 1.00 0.00 C ATOM 111 C6 DG A 4 2.599 -2.727 2.442 1.00 0.00 C ATOM 112 O6 DG A 4 1.379 -2.623 2.437 1.00 0.00 O ATOM 113 N1 DG A 4 3.355 -2.739 1.245 1.00 0.00 N ATOM 114 C2 DG A 4 4.724 -2.817 1.170 1.00 0.00 C ATOM 115 N2 DG A 4 5.233 -2.847 -0.080 1.00 0.00 N ATOM 116 N3 DG A 4 5.523 -2.865 2.209 1.00 0.00 N ATOM 117 C4 DG A 4 4.831 -2.847 3.381 1.00 0.00 C ATOM 0 H5' DG A 4 7.017 -5.745 7.376 1.00 0.00 H new ATOM 0 H5'' DG A 4 5.821 -5.319 6.168 1.00 0.00 H new ATOM 0 H4' DG A 4 8.615 -5.679 5.345 1.00 0.00 H new ATOM 0 H3' DG A 4 8.651 -3.885 7.435 1.00 0.00 H new ATOM 0 H2' DG A 4 6.659 -2.665 6.872 1.00 0.00 H new ATOM 0 H2'' DG A 4 7.897 -1.673 6.127 1.00 0.00 H new ATOM 0 H1' DG A 4 7.231 -2.253 4.000 1.00 0.00 H new ATOM 0 H8 DG A 4 4.511 -2.878 6.580 1.00 0.00 H new ATOM 0 H1 DG A 4 2.840 -2.685 0.366 1.00 0.00 H new ATOM 0 H21 DG A 4 6.242 -2.905 -0.219 1.00 0.00 H new ATOM 0 H22 DG A 4 4.609 -2.812 -0.886 1.00 0.00 H new ATOM 129 P DG A 5 10.630 -2.249 5.958 1.00 0.00 P ATOM 130 OP1 DG A 5 12.064 -2.664 5.900 1.00 0.00 O ATOM 131 OP2 DG A 5 10.191 -1.414 7.113 1.00 0.00 O ATOM 132 O5' DG A 5 10.217 -1.485 4.641 1.00 0.00 O ATOM 133 C5' DG A 5 10.506 -2.073 3.379 1.00 0.00 C ATOM 134 C4' DG A 5 10.060 -1.194 2.194 1.00 0.00 C ATOM 135 O4' DG A 5 8.633 -1.115 2.098 1.00 0.00 O ATOM 136 C3' DG A 5 10.621 0.263 2.205 1.00 0.00 C ATOM 137 O3' DG A 5 11.476 0.454 1.085 1.00 0.00 O ATOM 138 C2' DG A 5 9.324 1.105 2.212 1.00 0.00 C ATOM 139 C1' DG A 5 8.270 0.160 1.615 1.00 0.00 C ATOM 140 N9 DG A 5 6.905 0.433 2.001 1.00 0.00 N ATOM 141 C8 DG A 5 6.392 0.438 3.284 1.00 0.00 C ATOM 142 N7 DG A 5 5.096 0.556 3.328 1.00 0.00 N ATOM 143 C5 DG A 5 4.713 0.616 2.001 1.00 0.00 C ATOM 144 C6 DG A 5 3.409 0.706 1.392 1.00 0.00 C ATOM 145 O6 DG A 5 2.305 0.748 1.926 1.00 0.00 O ATOM 146 N1 DG A 5 3.533 0.741 -0.017 1.00 0.00 N ATOM 147 C2 DG A 5 4.705 0.672 -0.725 1.00 0.00 C ATOM 148 N2 DG A 5 4.565 0.723 -2.066 1.00 0.00 N ATOM 149 N3 DG A 5 5.897 0.574 -0.179 1.00 0.00 N ATOM 150 C4 DG A 5 5.828 0.532 1.179 1.00 0.00 C ATOM 0 H5' DG A 5 10.011 -3.042 3.313 1.00 0.00 H new ATOM 0 H5'' DG A 5 11.578 -2.257 3.306 1.00 0.00 H new ATOM 0 H4' DG A 5 10.484 -1.704 1.329 1.00 0.00 H new ATOM 0 H3' DG A 5 11.257 0.534 3.047 1.00 0.00 H new ATOM 0 H2' DG A 5 9.055 1.417 3.221 1.00 0.00 H new ATOM 0 H2'' DG A 5 9.432 2.011 1.616 1.00 0.00 H new ATOM 0 H1' DG A 5 8.272 0.268 0.530 1.00 0.00 H new ATOM 0 H8 DG A 5 7.008 0.352 4.167 1.00 0.00 H new ATOM 0 H1 DG A 5 2.671 0.825 -0.556 1.00 0.00 H new ATOM 0 H21 DG A 5 5.388 0.678 -2.667 1.00 0.00 H new ATOM 0 H22 DG A 5 3.636 0.807 -2.479 1.00 0.00 H new ATOM 162 P DG A 6 12.283 1.806 0.933 1.00 0.00 P ATOM 163 OP1 DG A 6 13.526 1.473 0.173 1.00 0.00 O ATOM 164 OP2 DG A 6 12.399 2.497 2.248 1.00 0.00 O ATOM 165 O5' DG A 6 11.337 2.677 0.017 1.00 0.00 O ATOM 166 C5' DG A 6 11.004 2.168 -1.268 1.00 0.00 C ATOM 167 C4' DG A 6 9.850 2.915 -1.935 1.00 0.00 C ATOM 168 O4' DG A 6 8.636 2.814 -1.185 1.00 0.00 O ATOM 169 C3' DG A 6 10.087 4.432 -2.237 1.00 0.00 C ATOM 170 O3' DG A 6 9.974 4.701 -3.629 1.00 0.00 O ATOM 171 C2' DG A 6 8.930 5.102 -1.477 1.00 0.00 C ATOM 172 C1' DG A 6 7.886 3.983 -1.418 1.00 0.00 C ATOM 173 N9 DG A 6 6.870 4.074 -0.406 1.00 0.00 N ATOM 174 C8 DG A 6 6.993 3.984 0.967 1.00 0.00 C ATOM 175 N7 DG A 6 5.850 4.035 1.592 1.00 0.00 N ATOM 176 C5 DG A 6 4.914 4.141 0.567 1.00 0.00 C ATOM 177 C6 DG A 6 3.475 4.157 0.588 1.00 0.00 C ATOM 178 O6 DG A 6 2.734 4.072 1.557 1.00 0.00 O ATOM 179 N1 DG A 6 2.963 4.239 -0.729 1.00 0.00 N ATOM 180 C2 DG A 6 3.701 4.277 -1.884 1.00 0.00 C ATOM 181 N2 DG A 6 2.967 4.333 -3.016 1.00 0.00 N ATOM 182 N3 DG A 6 5.012 4.230 -1.918 1.00 0.00 N ATOM 183 C4 DG A 6 5.544 4.161 -0.662 1.00 0.00 C ATOM 0 H5' DG A 6 10.741 1.114 -1.176 1.00 0.00 H new ATOM 0 H5'' DG A 6 11.882 2.222 -1.911 1.00 0.00 H new ATOM 0 H4' DG A 6 9.777 2.403 -2.894 1.00 0.00 H new ATOM 0 H3' DG A 6 11.078 4.779 -1.943 1.00 0.00 H new ATOM 0 H2' DG A 6 9.232 5.429 -0.482 1.00 0.00 H new ATOM 0 H2'' DG A 6 8.555 5.981 -2.001 1.00 0.00 H new ATOM 0 H1' DG A 6 7.319 4.023 -2.348 1.00 0.00 H new ATOM 0 H8 DG A 6 7.942 3.882 1.473 1.00 0.00 H new ATOM 0 H1 DG A 6 1.948 4.273 -0.828 1.00 0.00 H new ATOM 0 H21 DG A 6 3.431 4.364 -3.924 1.00 0.00 H new ATOM 0 H22 DG A 6 1.948 4.344 -2.963 1.00 0.00 H new ATOM 195 P DT A 7 11.196 4.458 -4.575 1.00 0.00 P ATOM 196 OP1 DT A 7 12.472 4.323 -3.800 1.00 0.00 O ATOM 197 OP2 DT A 7 11.112 5.478 -5.655 1.00 0.00 O ATOM 198 O5' DT A 7 10.786 3.054 -5.202 1.00 0.00 O ATOM 199 C5' DT A 7 11.829 2.130 -5.495 1.00 0.00 C ATOM 200 C4' DT A 7 11.396 1.017 -6.481 1.00 0.00 C ATOM 201 O4' DT A 7 12.541 0.196 -6.778 1.00 0.00 O ATOM 202 C3' DT A 7 10.284 0.037 -6.016 1.00 0.00 C ATOM 203 O3' DT A 7 9.643 -0.531 -7.151 1.00 0.00 O ATOM 204 C2' DT A 7 11.144 -1.050 -5.347 1.00 0.00 C ATOM 205 C1' DT A 7 12.316 -1.126 -6.343 1.00 0.00 C ATOM 206 N1 DT A 7 13.583 -1.703 -5.845 1.00 0.00 N ATOM 207 C2 DT A 7 13.695 -3.072 -5.745 1.00 0.00 C ATOM 208 O2 DT A 7 12.759 -3.835 -5.986 1.00 0.00 O ATOM 209 N3 DT A 7 14.943 -3.534 -5.403 1.00 0.00 N ATOM 210 C4 DT A 7 16.042 -2.783 -5.009 1.00 0.00 C ATOM 211 O4 DT A 7 17.065 -3.348 -4.636 1.00 0.00 O ATOM 212 C5 DT A 7 15.860 -1.325 -5.094 1.00 0.00 C ATOM 213 C7 DT A 7 17.016 -0.420 -4.733 1.00 0.00 C ATOM 214 C6 DT A 7 14.660 -0.875 -5.492 1.00 0.00 C ATOM 0 H5' DT A 7 12.172 1.672 -4.567 1.00 0.00 H new ATOM 0 H5'' DT A 7 12.677 2.670 -5.916 1.00 0.00 H new ATOM 0 H4' DT A 7 10.982 1.573 -7.322 1.00 0.00 H new ATOM 0 H3' DT A 7 9.509 0.484 -5.393 1.00 0.00 H new ATOM 0 H2' DT A 7 11.468 -0.766 -4.346 1.00 0.00 H new ATOM 0 H2'' DT A 7 10.616 -1.999 -5.254 1.00 0.00 H new ATOM 0 H1' DT A 7 12.019 -1.821 -7.129 1.00 0.00 H new ATOM 0 H3 DT A 7 15.077 -4.544 -5.443 1.00 0.00 H new ATOM 0 H71 DT A 7 16.951 0.502 -5.311 1.00 0.00 H new ATOM 0 H72 DT A 7 16.976 -0.185 -3.669 1.00 0.00 H new ATOM 0 H73 DT A 7 17.956 -0.923 -4.958 1.00 0.00 H new ATOM 0 H6 DT A 7 14.513 0.194 -5.544 1.00 0.00 H new ATOM 227 P DG A 8 8.161 -0.234 -7.568 1.00 0.00 P ATOM 228 OP1 DG A 8 8.106 -0.318 -9.062 1.00 0.00 O ATOM 229 OP2 DG A 8 7.692 1.030 -6.930 1.00 0.00 O ATOM 230 O5' DG A 8 7.365 -1.424 -6.916 1.00 0.00 O ATOM 231 C5' DG A 8 7.164 -2.679 -7.558 1.00 0.00 C ATOM 232 C4' DG A 8 5.684 -3.015 -7.915 1.00 0.00 C ATOM 233 O4' DG A 8 4.986 -3.495 -6.750 1.00 0.00 O ATOM 234 C3' DG A 8 4.825 -1.861 -8.510 1.00 0.00 C ATOM 235 O3' DG A 8 3.915 -2.376 -9.470 1.00 0.00 O ATOM 236 C2' DG A 8 4.078 -1.393 -7.251 1.00 0.00 C ATOM 237 C1' DG A 8 3.824 -2.730 -6.524 1.00 0.00 C ATOM 238 N9 DG A 8 3.624 -2.679 -5.084 1.00 0.00 N ATOM 239 C8 DG A 8 4.591 -2.532 -4.109 1.00 0.00 C ATOM 240 N7 DG A 8 4.103 -2.417 -2.908 1.00 0.00 N ATOM 241 C5 DG A 8 2.728 -2.490 -3.089 1.00 0.00 C ATOM 242 C6 DG A 8 1.636 -2.375 -2.152 1.00 0.00 C ATOM 243 O6 DG A 8 1.683 -2.206 -0.939 1.00 0.00 O ATOM 244 N1 DG A 8 0.390 -2.461 -2.827 1.00 0.00 N ATOM 245 C2 DG A 8 0.227 -2.653 -4.176 1.00 0.00 C ATOM 246 N2 DG A 8 -1.054 -2.736 -4.600 1.00 0.00 N ATOM 247 N3 DG A 8 1.218 -2.782 -5.035 1.00 0.00 N ATOM 248 C4 DG A 8 2.433 -2.657 -4.432 1.00 0.00 C ATOM 0 H5' DG A 8 7.552 -3.466 -6.911 1.00 0.00 H new ATOM 0 H5'' DG A 8 7.755 -2.699 -8.474 1.00 0.00 H new ATOM 0 H4' DG A 8 5.788 -3.763 -8.701 1.00 0.00 H new ATOM 0 H3' DG A 8 5.387 -1.080 -9.023 1.00 0.00 H new ATOM 0 H2' DG A 8 4.677 -0.708 -6.651 1.00 0.00 H new ATOM 0 H2'' DG A 8 3.150 -0.876 -7.494 1.00 0.00 H new ATOM 0 H1' DG A 8 2.887 -3.125 -6.918 1.00 0.00 H new ATOM 0 H8 DG A 8 5.650 -2.514 -4.322 1.00 0.00 H new ATOM 0 H1 DG A 8 -0.455 -2.373 -2.262 1.00 0.00 H new ATOM 0 H21 DG A 8 -1.255 -2.878 -5.590 1.00 0.00 H new ATOM 0 H22 DG A 8 -1.819 -2.656 -3.930 1.00 0.00 H new ATOM 260 P DG A 9 3.378 -1.539 -10.686 1.00 0.00 P ATOM 261 OP1 DG A 9 2.697 -2.516 -11.587 1.00 0.00 O ATOM 262 OP2 DG A 9 4.451 -0.666 -11.251 1.00 0.00 O ATOM 263 O5' DG A 9 2.315 -0.566 -10.043 1.00 0.00 O ATOM 264 C5' DG A 9 1.008 -1.033 -9.743 1.00 0.00 C ATOM 265 C4' DG A 9 0.240 -0.151 -8.737 1.00 0.00 C ATOM 266 O4' DG A 9 0.717 -0.336 -7.410 1.00 0.00 O ATOM 267 C3' DG A 9 0.262 1.390 -8.885 1.00 0.00 C ATOM 268 O3' DG A 9 -0.523 1.848 -9.980 1.00 0.00 O ATOM 269 C2' DG A 9 -0.179 1.836 -7.473 1.00 0.00 C ATOM 270 C1' DG A 9 0.042 0.578 -6.590 1.00 0.00 C ATOM 271 N9 DG A 9 0.739 0.728 -5.333 1.00 0.00 N ATOM 272 C8 DG A 9 2.050 0.659 -4.922 1.00 0.00 C ATOM 273 N7 DG A 9 2.194 0.798 -3.629 1.00 0.00 N ATOM 274 C5 DG A 9 0.902 0.987 -3.153 1.00 0.00 C ATOM 275 C6 DG A 9 0.349 1.146 -1.830 1.00 0.00 C ATOM 276 O6 DG A 9 0.920 1.128 -0.747 1.00 0.00 O ATOM 277 N1 DG A 9 -1.063 1.293 -1.886 1.00 0.00 N ATOM 278 C2 DG A 9 -1.813 1.338 -3.036 1.00 0.00 C ATOM 279 N2 DG A 9 -3.123 1.605 -2.891 1.00 0.00 N ATOM 280 N3 DG A 9 -1.324 1.168 -4.235 1.00 0.00 N ATOM 281 C4 DG A 9 0.015 0.963 -4.210 1.00 0.00 C ATOM 0 H5' DG A 9 1.078 -2.045 -9.343 1.00 0.00 H new ATOM 0 H5'' DG A 9 0.434 -1.095 -10.668 1.00 0.00 H new ATOM 0 H4' DG A 9 -0.769 -0.500 -8.958 1.00 0.00 H new ATOM 0 H3' DG A 9 1.224 1.825 -9.156 1.00 0.00 H new ATOM 0 H2' DG A 9 0.413 2.680 -7.119 1.00 0.00 H new ATOM 0 H2'' DG A 9 -1.222 2.152 -7.463 1.00 0.00 H new ATOM 0 H1' DG A 9 -0.944 0.264 -6.249 1.00 0.00 H new ATOM 0 H8 DG A 9 2.877 0.505 -5.599 1.00 0.00 H new ATOM 0 H1 DG A 9 -1.561 1.372 -0.999 1.00 0.00 H new ATOM 0 H21 DG A 9 -3.728 1.651 -3.711 1.00 0.00 H new ATOM 0 H22 DG A 9 -3.512 1.762 -1.961 1.00 0.00 H new ATOM 293 P DG A 10 -0.656 3.397 -10.211 1.00 0.00 P ATOM 294 OP1 DG A 10 -1.045 3.580 -11.636 1.00 0.00 O ATOM 295 OP2 DG A 10 0.563 4.105 -9.697 1.00 0.00 O ATOM 296 O5' DG A 10 -1.923 3.739 -9.327 1.00 0.00 O ATOM 297 C5' DG A 10 -2.176 5.106 -9.016 1.00 0.00 C ATOM 298 C4' DG A 10 -3.250 5.277 -7.927 1.00 0.00 C ATOM 299 O4' DG A 10 -2.824 4.615 -6.724 1.00 0.00 O ATOM 300 C3' DG A 10 -3.491 6.774 -7.562 1.00 0.00 C ATOM 301 O3' DG A 10 -4.825 7.030 -7.131 1.00 0.00 O ATOM 302 C2' DG A 10 -2.536 6.913 -6.366 1.00 0.00 C ATOM 303 C1' DG A 10 -2.754 5.553 -5.680 1.00 0.00 C ATOM 304 N9 DG A 10 -1.739 5.140 -4.739 1.00 0.00 N ATOM 305 C8 DG A 10 -0.395 4.878 -4.914 1.00 0.00 C ATOM 306 N7 DG A 10 0.226 4.574 -3.807 1.00 0.00 N ATOM 307 C5 DG A 10 -0.767 4.628 -2.838 1.00 0.00 C ATOM 308 C6 DG A 10 -0.730 4.454 -1.407 1.00 0.00 C ATOM 309 O6 DG A 10 0.227 4.181 -0.696 1.00 0.00 O ATOM 310 N1 DG A 10 -2.026 4.601 -0.852 1.00 0.00 N ATOM 311 C2 DG A 10 -3.158 4.926 -1.549 1.00 0.00 C ATOM 312 N2 DG A 10 -4.301 4.964 -0.838 1.00 0.00 N ATOM 313 N3 DG A 10 -3.198 5.125 -2.847 1.00 0.00 N ATOM 314 C4 DG A 10 -1.975 4.969 -3.416 1.00 0.00 C ATOM 0 H5' DG A 10 -2.494 5.627 -9.919 1.00 0.00 H new ATOM 0 H5'' DG A 10 -1.250 5.577 -8.685 1.00 0.00 H new ATOM 0 H4' DG A 10 -4.171 4.851 -8.325 1.00 0.00 H new ATOM 0 H3' DG A 10 -3.333 7.455 -8.398 1.00 0.00 H new ATOM 0 H2' DG A 10 -1.501 7.061 -6.676 1.00 0.00 H new ATOM 0 H2'' DG A 10 -2.798 7.751 -5.720 1.00 0.00 H new ATOM 0 H1' DG A 10 -3.655 5.632 -5.071 1.00 0.00 H new ATOM 0 H8 DG A 10 0.096 4.921 -5.875 1.00 0.00 H new ATOM 0 H1 DG A 10 -2.123 4.452 0.152 1.00 0.00 H new ATOM 0 H21 DG A 10 -5.180 5.200 -1.298 1.00 0.00 H new ATOM 0 H22 DG A 10 -4.287 4.757 0.161 1.00 0.00 H new ATOM 326 P DT A 11 -5.554 8.365 -7.538 1.00 0.00 P ATOM 327 OP1 DT A 11 -4.579 9.497 -7.530 1.00 0.00 O ATOM 328 OP2 DT A 11 -6.776 8.521 -6.689 1.00 0.00 O ATOM 329 O5' DT A 11 -5.980 8.088 -9.037 1.00 0.00 O ATOM 330 C5' DT A 11 -6.998 7.106 -9.231 1.00 0.00 C ATOM 331 C4' DT A 11 -7.311 6.771 -10.702 1.00 0.00 C ATOM 332 O4' DT A 11 -7.958 7.887 -11.330 1.00 0.00 O ATOM 333 C3' DT A 11 -6.115 6.355 -11.612 1.00 0.00 C ATOM 334 O3' DT A 11 -6.521 5.338 -12.514 1.00 0.00 O ATOM 335 C2' DT A 11 -5.881 7.651 -12.407 1.00 0.00 C ATOM 336 C1' DT A 11 -7.326 8.164 -12.556 1.00 0.00 C ATOM 337 N1 DT A 11 -7.503 9.595 -12.859 1.00 0.00 N ATOM 338 C2 DT A 11 -7.466 10.016 -14.167 1.00 0.00 C ATOM 339 O2 DT A 11 -7.246 9.256 -15.110 1.00 0.00 O ATOM 340 N3 DT A 11 -7.733 11.352 -14.360 1.00 0.00 N ATOM 341 C4 DT A 11 -8.030 12.296 -13.384 1.00 0.00 C ATOM 342 O4 DT A 11 -8.340 13.437 -13.707 1.00 0.00 O ATOM 343 C5 DT A 11 -7.926 11.820 -11.994 1.00 0.00 C ATOM 344 C7 DT A 11 -8.115 12.804 -10.857 1.00 0.00 C ATOM 345 C6 DT A 11 -7.669 10.518 -11.812 1.00 0.00 C ATOM 0 H5' DT A 11 -7.913 7.454 -8.751 1.00 0.00 H new ATOM 0 H5'' DT A 11 -6.699 6.190 -8.722 1.00 0.00 H new ATOM 0 H4' DT A 11 -7.942 5.886 -10.621 1.00 0.00 H new ATOM 0 H3' DT A 11 -5.250 5.978 -11.066 1.00 0.00 H new ATOM 0 H2' DT A 11 -5.246 8.356 -11.871 1.00 0.00 H new ATOM 0 H2'' DT A 11 -5.407 7.465 -13.371 1.00 0.00 H new ATOM 0 H1' DT A 11 -7.747 7.660 -13.426 1.00 0.00 H new ATOM 0 H3 DT A 11 -7.711 11.686 -15.324 1.00 0.00 H new ATOM 0 H71 DT A 11 -8.530 12.286 -9.992 1.00 0.00 H new ATOM 0 H72 DT A 11 -7.153 13.241 -10.591 1.00 0.00 H new ATOM 0 H73 DT A 11 -8.799 13.594 -11.169 1.00 0.00 H new ATOM 0 H6 DT A 11 -7.584 10.155 -10.798 1.00 0.00 H new ATOM 358 P DA A 12 -6.052 3.847 -12.422 1.00 0.00 P ATOM 359 OP1 DA A 12 -4.592 3.783 -12.088 1.00 0.00 O ATOM 360 OP2 DA A 12 -6.495 3.197 -13.684 1.00 0.00 O ATOM 361 O5' DA A 12 -6.905 3.261 -11.235 1.00 0.00 O ATOM 362 C5' DA A 12 -6.314 3.113 -9.949 1.00 0.00 C ATOM 363 C4' DA A 12 -7.218 2.434 -8.896 1.00 0.00 C ATOM 364 O4' DA A 12 -8.282 3.302 -8.489 1.00 0.00 O ATOM 365 C3' DA A 12 -7.893 1.105 -9.321 1.00 0.00 C ATOM 366 O3' DA A 12 -8.086 0.239 -8.202 1.00 0.00 O ATOM 367 C2' DA A 12 -9.242 1.612 -9.848 1.00 0.00 C ATOM 368 C1' DA A 12 -9.534 2.841 -8.963 1.00 0.00 C ATOM 369 N9 DA A 12 -10.210 3.927 -9.665 1.00 0.00 N ATOM 370 C8 DA A 12 -10.765 4.025 -10.924 1.00 0.00 C ATOM 371 N7 DA A 12 -11.233 5.200 -11.211 1.00 0.00 N ATOM 372 C5 DA A 12 -10.991 5.964 -10.068 1.00 0.00 C ATOM 373 C6 DA A 12 -11.203 7.309 -9.692 1.00 0.00 C ATOM 374 N6 DA A 12 -11.757 8.243 -10.482 1.00 0.00 N ATOM 375 N1 DA A 12 -10.834 7.682 -8.448 1.00 0.00 N ATOM 376 C2 DA A 12 -10.285 6.778 -7.621 1.00 0.00 C ATOM 377 N3 DA A 12 -10.018 5.493 -7.869 1.00 0.00 N ATOM 378 C4 DA A 12 -10.375 5.161 -9.101 1.00 0.00 C ATOM 0 H5' DA A 12 -6.027 4.098 -9.581 1.00 0.00 H new ATOM 0 H5'' DA A 12 -5.398 2.531 -10.050 1.00 0.00 H new ATOM 0 H4' DA A 12 -6.512 2.210 -8.097 1.00 0.00 H new ATOM 0 H3' DA A 12 -7.313 0.522 -10.037 1.00 0.00 H new ATOM 0 H2' DA A 12 -9.186 1.881 -10.903 1.00 0.00 H new ATOM 0 H2'' DA A 12 -10.020 0.855 -9.753 1.00 0.00 H new ATOM 0 H1' DA A 12 -10.211 2.538 -8.164 1.00 0.00 H new ATOM 0 H8 DA A 12 -10.806 3.194 -11.612 1.00 0.00 H new ATOM 0 H61 DA A 12 -11.877 9.196 -10.138 1.00 0.00 H new ATOM 0 H62 DA A 12 -12.058 8.000 -11.426 1.00 0.00 H new ATOM 0 H2 DA A 12 -10.028 7.133 -6.634 1.00 0.00 H new ATOM 390 P DG A 13 -7.262 -1.111 -8.181 1.00 0.00 P ATOM 391 OP1 DG A 13 -5.812 -0.816 -8.378 1.00 0.00 O ATOM 392 OP2 DG A 13 -7.911 -2.075 -9.130 1.00 0.00 O ATOM 393 O5' DG A 13 -7.461 -1.572 -6.704 1.00 0.00 O ATOM 394 C5' DG A 13 -8.510 -2.462 -6.344 1.00 0.00 C ATOM 395 C4' DG A 13 -8.732 -2.477 -4.822 1.00 0.00 C ATOM 396 O4' DG A 13 -7.567 -3.017 -4.179 1.00 0.00 O ATOM 397 C3' DG A 13 -9.042 -1.082 -4.178 1.00 0.00 C ATOM 398 O3' DG A 13 -10.188 -1.153 -3.338 1.00 0.00 O ATOM 399 C2' DG A 13 -7.753 -0.810 -3.384 1.00 0.00 C ATOM 400 C1' DG A 13 -7.208 -2.219 -3.086 1.00 0.00 C ATOM 401 N9 DG A 13 -5.768 -2.334 -2.927 1.00 0.00 N ATOM 402 C8 DG A 13 -4.779 -2.455 -3.883 1.00 0.00 C ATOM 403 N7 DG A 13 -3.572 -2.455 -3.381 1.00 0.00 N ATOM 404 C5 DG A 13 -3.776 -2.313 -2.013 1.00 0.00 C ATOM 405 C6 DG A 13 -2.850 -2.228 -0.909 1.00 0.00 C ATOM 406 O6 DG A 13 -1.624 -2.215 -0.946 1.00 0.00 O ATOM 407 N1 DG A 13 -3.561 -2.131 0.315 1.00 0.00 N ATOM 408 C2 DG A 13 -4.928 -2.066 0.456 1.00 0.00 C ATOM 409 N2 DG A 13 -5.370 -1.890 1.718 1.00 0.00 N ATOM 410 N3 DG A 13 -5.777 -2.107 -0.546 1.00 0.00 N ATOM 411 C4 DG A 13 -5.131 -2.243 -1.737 1.00 0.00 C ATOM 0 H5' DG A 13 -8.271 -3.468 -6.689 1.00 0.00 H new ATOM 0 H5'' DG A 13 -9.431 -2.164 -6.845 1.00 0.00 H new ATOM 0 H4' DG A 13 -9.620 -3.091 -4.669 1.00 0.00 H new ATOM 0 H3' DG A 13 -9.279 -0.296 -4.895 1.00 0.00 H new ATOM 0 H2' DG A 13 -7.043 -0.219 -3.963 1.00 0.00 H new ATOM 0 H2'' DG A 13 -7.956 -0.256 -2.467 1.00 0.00 H new ATOM 0 H1' DG A 13 -7.631 -2.514 -2.126 1.00 0.00 H new ATOM 0 H8 DG A 13 -4.982 -2.541 -4.940 1.00 0.00 H new ATOM 0 H1 DG A 13 -3.007 -2.107 1.171 1.00 0.00 H new ATOM 0 H21 DG A 13 -6.371 -1.832 1.904 1.00 0.00 H new ATOM 0 H22 DG A 13 -4.703 -1.815 2.486 1.00 0.00 H new ATOM 423 P DG A 14 -11.184 0.053 -3.163 1.00 0.00 P ATOM 424 OP1 DG A 14 -12.462 -0.502 -2.618 1.00 0.00 O ATOM 425 OP2 DG A 14 -11.243 0.869 -4.410 1.00 0.00 O ATOM 426 O5' DG A 14 -10.465 0.928 -2.056 1.00 0.00 O ATOM 427 C5' DG A 14 -10.755 0.646 -0.689 1.00 0.00 C ATOM 428 C4' DG A 14 -9.824 1.326 0.325 1.00 0.00 C ATOM 429 O4' DG A 14 -8.505 0.810 0.244 1.00 0.00 O ATOM 430 C3' DG A 14 -9.639 2.866 0.297 1.00 0.00 C ATOM 431 O3' DG A 14 -10.749 3.502 0.911 1.00 0.00 O ATOM 432 C2' DG A 14 -8.262 3.021 0.982 1.00 0.00 C ATOM 433 C1' DG A 14 -7.687 1.585 1.078 1.00 0.00 C ATOM 434 N9 DG A 14 -6.325 1.395 0.661 1.00 0.00 N ATOM 435 C8 DG A 14 -5.824 1.226 -0.609 1.00 0.00 C ATOM 436 N7 DG A 14 -4.527 1.140 -0.632 1.00 0.00 N ATOM 437 C5 DG A 14 -4.142 1.274 0.687 1.00 0.00 C ATOM 438 C6 DG A 14 -2.840 1.271 1.295 1.00 0.00 C ATOM 439 O6 DG A 14 -1.749 1.175 0.740 1.00 0.00 O ATOM 440 N1 DG A 14 -2.956 1.409 2.701 1.00 0.00 N ATOM 441 C2 DG A 14 -4.135 1.569 3.390 1.00 0.00 C ATOM 442 N2 DG A 14 -4.023 1.722 4.726 1.00 0.00 N ATOM 443 N3 DG A 14 -5.328 1.596 2.835 1.00 0.00 N ATOM 444 C4 DG A 14 -5.255 1.431 1.491 1.00 0.00 C ATOM 0 H5' DG A 14 -10.707 -0.432 -0.538 1.00 0.00 H new ATOM 0 H5'' DG A 14 -11.780 0.951 -0.480 1.00 0.00 H new ATOM 0 H4' DG A 14 -10.373 1.095 1.238 1.00 0.00 H new ATOM 0 H3' DG A 14 -9.627 3.351 -0.679 1.00 0.00 H new ATOM 0 H2' DG A 14 -7.605 3.669 0.402 1.00 0.00 H new ATOM 0 H2'' DG A 14 -8.363 3.471 1.970 1.00 0.00 H new ATOM 0 H1' DG A 14 -7.680 1.316 2.134 1.00 0.00 H new ATOM 0 H8 DG A 14 -6.442 1.171 -1.493 1.00 0.00 H new ATOM 0 H1 DG A 14 -2.094 1.388 3.246 1.00 0.00 H new ATOM 0 H21 DG A 14 -4.859 1.845 5.297 1.00 0.00 H new ATOM 0 H22 DG A 14 -3.102 1.714 5.165 1.00 0.00 H new ATOM 456 P DG A 15 -10.765 5.048 1.226 1.00 0.00 P ATOM 457 OP1 DG A 15 -12.197 5.394 1.445 1.00 0.00 O ATOM 458 OP2 DG A 15 -9.985 5.797 0.200 1.00 0.00 O ATOM 459 O5' DG A 15 -9.983 5.226 2.588 1.00 0.00 O ATOM 460 C5' DG A 15 -10.242 4.378 3.696 1.00 0.00 C ATOM 461 C4' DG A 15 -9.205 4.522 4.833 1.00 0.00 C ATOM 462 O4' DG A 15 -7.881 4.201 4.383 1.00 0.00 O ATOM 463 C3' DG A 15 -9.138 5.923 5.511 1.00 0.00 C ATOM 464 O3' DG A 15 -9.056 5.825 6.931 1.00 0.00 O ATOM 465 C2' DG A 15 -7.822 6.476 4.947 1.00 0.00 C ATOM 466 C1' DG A 15 -6.978 5.199 4.816 1.00 0.00 C ATOM 467 N9 DG A 15 -5.893 5.256 3.861 1.00 0.00 N ATOM 468 C8 DG A 15 -6.034 5.185 2.487 1.00 0.00 C ATOM 469 N7 DG A 15 -4.920 4.966 1.857 1.00 0.00 N ATOM 470 C5 DG A 15 -3.974 4.877 2.867 1.00 0.00 C ATOM 471 C6 DG A 15 -2.552 4.639 2.817 1.00 0.00 C ATOM 472 O6 DG A 15 -1.861 4.380 1.840 1.00 0.00 O ATOM 473 N1 DG A 15 -1.991 4.713 4.116 1.00 0.00 N ATOM 474 C2 DG A 15 -2.689 4.969 5.268 1.00 0.00 C ATOM 475 N2 DG A 15 -1.950 5.063 6.390 1.00 0.00 N ATOM 476 N3 DG A 15 -3.986 5.166 5.326 1.00 0.00 N ATOM 477 C4 DG A 15 -4.573 5.057 4.100 1.00 0.00 C ATOM 0 H5' DG A 15 -10.257 3.342 3.356 1.00 0.00 H new ATOM 0 H5'' DG A 15 -11.234 4.599 4.089 1.00 0.00 H new ATOM 0 H4' DG A 15 -9.564 3.814 5.580 1.00 0.00 H new ATOM 0 H3' DG A 15 -10.018 6.536 5.316 1.00 0.00 H new ATOM 0 H2' DG A 15 -7.965 6.973 3.987 1.00 0.00 H new ATOM 0 H2'' DG A 15 -7.363 7.203 5.617 1.00 0.00 H new ATOM 0 H1' DG A 15 -6.499 5.019 5.779 1.00 0.00 H new ATOM 0 H8 DG A 15 -6.983 5.301 1.985 1.00 0.00 H new ATOM 0 H1 DG A 15 -0.986 4.564 4.201 1.00 0.00 H new ATOM 0 H21 DG A 15 -2.403 5.252 7.284 1.00 0.00 H new ATOM 0 H22 DG A 15 -0.938 4.945 6.345 1.00 0.00 H new ATOM 489 P DT A 16 -10.372 5.899 7.792 1.00 0.00 P ATOM 490 OP1 DT A 16 -11.271 6.948 7.230 1.00 0.00 O ATOM 491 OP2 DT A 16 -9.952 6.021 9.222 1.00 0.00 O ATOM 492 O5' DT A 16 -11.020 4.475 7.535 1.00 0.00 O ATOM 493 C5' DT A 16 -10.871 3.459 8.524 1.00 0.00 C ATOM 494 C4' DT A 16 -11.374 2.057 8.124 1.00 0.00 C ATOM 495 O4' DT A 16 -12.772 2.094 7.790 1.00 0.00 O ATOM 496 C3' DT A 16 -10.642 1.314 6.968 1.00 0.00 C ATOM 497 O3' DT A 16 -10.564 -0.071 7.278 1.00 0.00 O ATOM 498 C2' DT A 16 -11.620 1.541 5.803 1.00 0.00 C ATOM 499 C1' DT A 16 -12.980 1.500 6.528 1.00 0.00 C ATOM 500 N1 DT A 16 -14.070 2.221 5.841 1.00 0.00 N ATOM 501 C2 DT A 16 -14.832 1.582 4.893 1.00 0.00 C ATOM 502 O2 DT A 16 -14.645 0.408 4.569 1.00 0.00 O ATOM 503 N3 DT A 16 -15.822 2.346 4.321 1.00 0.00 N ATOM 504 C4 DT A 16 -16.079 3.693 4.541 1.00 0.00 C ATOM 505 O4 DT A 16 -17.013 4.246 3.972 1.00 0.00 O ATOM 506 C5 DT A 16 -15.133 4.368 5.446 1.00 0.00 C ATOM 507 C7 DT A 16 -15.227 5.868 5.630 1.00 0.00 C ATOM 508 C6 DT A 16 -14.209 3.604 6.047 1.00 0.00 C ATOM 0 H5' DT A 16 -11.402 3.772 9.423 1.00 0.00 H new ATOM 0 H5'' DT A 16 -9.816 3.385 8.786 1.00 0.00 H new ATOM 0 H4' DT A 16 -11.153 1.482 9.023 1.00 0.00 H new ATOM 0 H3' DT A 16 -9.625 1.652 6.771 1.00 0.00 H new ATOM 0 H2' DT A 16 -11.450 2.496 5.305 1.00 0.00 H new ATOM 0 H2'' DT A 16 -11.538 0.765 5.042 1.00 0.00 H new ATOM 0 H1' DT A 16 -13.304 0.460 6.573 1.00 0.00 H new ATOM 0 H3 DT A 16 -16.437 1.870 3.661 1.00 0.00 H new ATOM 0 H71 DT A 16 -14.889 6.134 6.632 1.00 0.00 H new ATOM 0 H72 DT A 16 -14.598 6.365 4.891 1.00 0.00 H new ATOM 0 H73 DT A 16 -16.261 6.186 5.500 1.00 0.00 H new ATOM 0 H6 DT A 16 -13.527 4.083 6.734 1.00 0.00 H new ATOM 521 P DG A 17 -9.487 -1.029 6.682 1.00 0.00 P ATOM 522 OP1 DG A 17 -8.763 -0.396 5.535 1.00 0.00 O ATOM 523 OP2 DG A 17 -10.152 -2.349 6.467 1.00 0.00 O ATOM 524 O5' DG A 17 -8.491 -1.171 7.914 1.00 0.00 O ATOM 525 C5' DG A 17 -7.406 -2.081 7.736 1.00 0.00 C ATOM 526 C4' DG A 17 -6.241 -1.919 8.773 1.00 0.00 C ATOM 527 O4' DG A 17 -5.011 -2.428 8.225 1.00 0.00 O ATOM 528 C3' DG A 17 -5.923 -0.484 9.251 1.00 0.00 C ATOM 529 O3' DG A 17 -5.429 -0.491 10.592 1.00 0.00 O ATOM 530 C2' DG A 17 -4.886 -0.062 8.195 1.00 0.00 C ATOM 531 C1' DG A 17 -4.155 -1.376 7.810 1.00 0.00 C ATOM 532 N9 DG A 17 -3.848 -1.474 6.391 1.00 0.00 N ATOM 533 C8 DG A 17 -4.714 -1.331 5.320 1.00 0.00 C ATOM 534 N7 DG A 17 -4.161 -1.543 4.161 1.00 0.00 N ATOM 535 C5 DG A 17 -2.854 -1.849 4.469 1.00 0.00 C ATOM 536 C6 DG A 17 -1.740 -2.109 3.599 1.00 0.00 C ATOM 537 O6 DG A 17 -1.729 -2.131 2.375 1.00 0.00 O ATOM 538 N1 DG A 17 -0.562 -2.312 4.351 1.00 0.00 N ATOM 539 C2 DG A 17 -0.481 -2.250 5.720 1.00 0.00 C ATOM 540 N2 DG A 17 0.761 -2.432 6.218 1.00 0.00 N ATOM 541 N3 DG A 17 -1.494 -2.005 6.525 1.00 0.00 N ATOM 542 C4 DG A 17 -2.655 -1.822 5.840 1.00 0.00 C ATOM 0 H5' DG A 17 -7.002 -1.952 6.732 1.00 0.00 H new ATOM 0 H5'' DG A 17 -7.790 -3.099 7.796 1.00 0.00 H new ATOM 0 H4' DG A 17 -6.614 -2.473 9.634 1.00 0.00 H new ATOM 0 H3' DG A 17 -6.769 0.201 9.310 1.00 0.00 H new ATOM 0 H2' DG A 17 -5.366 0.392 7.328 1.00 0.00 H new ATOM 0 H2'' DG A 17 -4.190 0.675 8.596 1.00 0.00 H new ATOM 0 H1' DG A 17 -3.182 -1.418 8.300 1.00 0.00 H new ATOM 0 H8 DG A 17 -5.755 -1.067 5.436 1.00 0.00 H new ATOM 0 H1 DG A 17 0.294 -2.521 3.838 1.00 0.00 H new ATOM 0 H21 DG A 17 0.916 -2.402 7.226 1.00 0.00 H new ATOM 0 H22 DG A 17 1.544 -2.599 5.586 1.00 0.00 H new ATOM 554 P DG A 18 -5.170 0.891 11.327 1.00 0.00 P ATOM 555 OP1 DG A 18 -5.560 0.736 12.760 1.00 0.00 O ATOM 556 OP2 DG A 18 -5.805 2.000 10.550 1.00 0.00 O ATOM 557 O5' DG A 18 -3.610 1.068 11.214 1.00 0.00 O ATOM 558 C5' DG A 18 -2.755 0.115 11.835 1.00 0.00 C ATOM 559 C4' DG A 18 -1.330 0.146 11.269 1.00 0.00 C ATOM 560 O4' DG A 18 -1.341 -0.085 9.866 1.00 0.00 O ATOM 561 C3' DG A 18 -0.476 1.423 11.443 1.00 0.00 C ATOM 562 O3' DG A 18 0.077 1.484 12.745 1.00 0.00 O ATOM 563 C2' DG A 18 0.577 1.225 10.351 1.00 0.00 C ATOM 564 C1' DG A 18 -0.134 0.345 9.294 1.00 0.00 C ATOM 565 N9 DG A 18 -0.448 0.973 8.020 1.00 0.00 N ATOM 566 C8 DG A 18 -1.662 1.434 7.549 1.00 0.00 C ATOM 567 N7 DG A 18 -1.695 1.598 6.258 1.00 0.00 N ATOM 568 C5 DG A 18 -0.417 1.232 5.843 1.00 0.00 C ATOM 569 C6 DG A 18 0.168 1.073 4.537 1.00 0.00 C ATOM 570 O6 DG A 18 -0.377 1.176 3.446 1.00 0.00 O ATOM 571 N1 DG A 18 1.548 0.766 4.638 1.00 0.00 N ATOM 572 C2 DG A 18 2.226 0.549 5.810 1.00 0.00 C ATOM 573 N2 DG A 18 3.552 0.338 5.706 1.00 0.00 N ATOM 574 N3 DG A 18 1.676 0.564 7.000 1.00 0.00 N ATOM 575 C4 DG A 18 0.352 0.876 6.934 1.00 0.00 C ATOM 0 H5' DG A 18 -3.173 -0.883 11.703 1.00 0.00 H new ATOM 0 H5'' DG A 18 -2.721 0.307 12.907 1.00 0.00 H new ATOM 0 H4' DG A 18 -0.866 -0.630 11.878 1.00 0.00 H new ATOM 0 H3' DG A 18 -1.019 2.363 11.347 1.00 0.00 H new ATOM 0 H2' DG A 18 0.896 2.177 9.927 1.00 0.00 H new ATOM 0 H2'' DG A 18 1.469 0.736 10.742 1.00 0.00 H new ATOM 0 H1' DG A 18 0.572 -0.449 9.049 1.00 0.00 H new ATOM 0 H8 DG A 18 -2.505 1.639 8.192 1.00 0.00 H new ATOM 0 H1 DG A 18 2.079 0.701 3.770 1.00 0.00 H new ATOM 0 H21 DG A 18 4.109 0.171 6.544 1.00 0.00 H new ATOM 0 H22 DG A 18 3.999 0.345 4.789 1.00 0.00 H new ATOM 587 P DG A 19 0.422 2.837 13.458 1.00 0.00 P ATOM 588 OP1 DG A 19 1.010 2.457 14.778 1.00 0.00 O ATOM 589 OP2 DG A 19 -0.746 3.762 13.417 1.00 0.00 O ATOM 590 O5' DG A 19 1.530 3.514 12.549 1.00 0.00 O ATOM 591 C5' DG A 19 2.836 2.955 12.517 1.00 0.00 C ATOM 592 C4' DG A 19 3.764 3.566 11.447 1.00 0.00 C ATOM 593 O4' DG A 19 3.321 3.245 10.120 1.00 0.00 O ATOM 594 C3' DG A 19 4.010 5.109 11.504 1.00 0.00 C ATOM 595 O3' DG A 19 5.405 5.377 11.477 1.00 0.00 O ATOM 596 C2' DG A 19 3.325 5.576 10.208 1.00 0.00 C ATOM 597 C1' DG A 19 3.520 4.362 9.284 1.00 0.00 C ATOM 598 N9 DG A 19 2.596 4.294 8.179 1.00 0.00 N ATOM 599 C8 DG A 19 1.218 4.359 8.250 1.00 0.00 C ATOM 600 N7 DG A 19 0.638 4.327 7.087 1.00 0.00 N ATOM 601 C5 DG A 19 1.685 4.223 6.189 1.00 0.00 C ATOM 602 C6 DG A 19 1.682 4.157 4.750 1.00 0.00 C ATOM 603 O6 DG A 19 0.724 4.178 3.987 1.00 0.00 O ATOM 604 N1 DG A 19 3.010 4.041 4.274 1.00 0.00 N ATOM 605 C2 DG A 19 4.145 3.973 5.044 1.00 0.00 C ATOM 606 N2 DG A 19 5.285 3.782 4.344 1.00 0.00 N ATOM 607 N3 DG A 19 4.156 4.042 6.359 1.00 0.00 N ATOM 608 C4 DG A 19 2.897 4.188 6.861 1.00 0.00 C ATOM 0 H5' DG A 19 2.755 1.882 12.341 1.00 0.00 H new ATOM 0 H5'' DG A 19 3.297 3.083 13.496 1.00 0.00 H new ATOM 0 H4' DG A 19 4.718 3.101 11.693 1.00 0.00 H new ATOM 0 H3' DG A 19 3.632 5.602 12.399 1.00 0.00 H new ATOM 0 H2' DG A 19 2.271 5.804 10.364 1.00 0.00 H new ATOM 0 H2'' DG A 19 3.789 6.475 9.803 1.00 0.00 H new ATOM 0 H1' DG A 19 4.505 4.417 8.820 1.00 0.00 H new ATOM 0 H8 DG A 19 0.675 4.430 9.181 1.00 0.00 H new ATOM 0 H1 DG A 19 3.136 4.004 3.262 1.00 0.00 H new ATOM 0 H21 DG A 19 6.179 3.719 4.832 1.00 0.00 H new ATOM 0 H22 DG A 19 5.252 3.701 3.328 1.00 0.00 H new ATOM 620 P DT A 20 5.984 6.785 11.883 1.00 0.00 P ATOM 621 OP1 DT A 20 7.282 6.531 12.587 1.00 0.00 O ATOM 622 OP2 DT A 20 4.953 7.599 12.586 1.00 0.00 O ATOM 623 O5' DT A 20 6.266 7.467 10.491 1.00 0.00 O ATOM 624 C5' DT A 20 7.293 6.913 9.679 1.00 0.00 C ATOM 625 C4' DT A 20 7.320 7.490 8.258 1.00 0.00 C ATOM 626 O4' DT A 20 6.155 7.098 7.522 1.00 0.00 O ATOM 627 C3' DT A 20 7.482 9.050 8.139 1.00 0.00 C ATOM 628 O3' DT A 20 8.779 9.328 7.613 1.00 0.00 O ATOM 629 C2' DT A 20 6.218 9.412 7.304 1.00 0.00 C ATOM 630 C1' DT A 20 5.905 8.100 6.567 1.00 0.00 C ATOM 631 N1 DT A 20 4.567 7.898 6.028 1.00 0.00 N ATOM 632 C2 DT A 20 4.380 7.502 4.723 1.00 0.00 C ATOM 633 O2 DT A 20 5.299 7.252 3.942 1.00 0.00 O ATOM 634 N3 DT A 20 3.063 7.391 4.336 1.00 0.00 N ATOM 635 C4 DT A 20 1.926 7.560 5.117 1.00 0.00 C ATOM 636 O4 DT A 20 0.816 7.417 4.614 1.00 0.00 O ATOM 637 C5 DT A 20 2.187 7.867 6.534 1.00 0.00 C ATOM 638 C7 DT A 20 1.016 8.019 7.482 1.00 0.00 C ATOM 639 C6 DT A 20 3.470 8.011 6.900 1.00 0.00 C ATOM 0 H5' DT A 20 7.159 5.833 9.623 1.00 0.00 H new ATOM 0 H5'' DT A 20 8.258 7.090 10.154 1.00 0.00 H new ATOM 0 H4' DT A 20 8.230 7.062 7.837 1.00 0.00 H new ATOM 0 H3' DT A 20 7.488 9.664 9.040 1.00 0.00 H new ATOM 0 H2' DT A 20 5.390 9.725 7.940 1.00 0.00 H new ATOM 0 H2'' DT A 20 6.413 10.229 6.609 1.00 0.00 H new ATOM 0 H1' DT A 20 6.519 8.097 5.666 1.00 0.00 H new ATOM 0 H3 DT A 20 2.902 7.156 3.356 1.00 0.00 H new ATOM 0 H71 DT A 20 1.318 7.716 8.485 1.00 0.00 H new ATOM 0 H72 DT A 20 0.695 9.060 7.499 1.00 0.00 H new ATOM 0 H73 DT A 20 0.191 7.391 7.145 1.00 0.00 H new ATOM 0 H6 DT A 20 3.674 8.229 7.938 1.00 0.00 H new ATOM 652 P DA A 21 9.138 10.619 6.799 1.00 0.00 P ATOM 653 OP1 DA A 21 10.618 10.717 6.709 1.00 0.00 O ATOM 654 OP2 DA A 21 8.413 11.813 7.342 1.00 0.00 O ATOM 655 O5' DA A 21 8.573 10.205 5.380 1.00 0.00 O ATOM 656 C5' DA A 21 8.220 11.212 4.443 1.00 0.00 C ATOM 657 C4' DA A 21 7.421 10.617 3.273 1.00 0.00 C ATOM 658 O4' DA A 21 6.119 10.198 3.715 1.00 0.00 O ATOM 659 C3' DA A 21 7.202 11.592 2.090 1.00 0.00 C ATOM 660 O3' DA A 21 7.203 10.882 0.858 1.00 0.00 O ATOM 661 C2' DA A 21 5.795 12.126 2.406 1.00 0.00 C ATOM 662 C1' DA A 21 5.111 10.878 3.003 1.00 0.00 C ATOM 663 N9 DA A 21 4.010 11.117 3.921 1.00 0.00 N ATOM 664 C8 DA A 21 4.065 11.506 5.245 1.00 0.00 C ATOM 665 N7 DA A 21 2.908 11.576 5.829 1.00 0.00 N ATOM 666 C5 DA A 21 1.995 11.207 4.839 1.00 0.00 C ATOM 667 C6 DA A 21 0.585 11.110 4.764 1.00 0.00 C ATOM 668 N6 DA A 21 -0.236 11.358 5.805 1.00 0.00 N ATOM 669 N1 DA A 21 0.039 10.761 3.581 1.00 0.00 N ATOM 670 C2 DA A 21 0.848 10.527 2.527 1.00 0.00 C ATOM 671 N3 DA A 21 2.185 10.603 2.471 1.00 0.00 N ATOM 672 C4 DA A 21 2.687 10.927 3.653 1.00 0.00 C ATOM 0 H5' DA A 21 9.121 11.694 4.065 1.00 0.00 H new ATOM 0 H5'' DA A 21 7.629 11.983 4.937 1.00 0.00 H new ATOM 0 H4' DA A 21 8.028 9.782 2.922 1.00 0.00 H new ATOM 0 H3' DA A 21 7.965 12.364 1.988 1.00 0.00 H new ATOM 0 H2' DA A 21 5.822 12.955 3.113 1.00 0.00 H new ATOM 0 H2'' DA A 21 5.284 12.485 1.513 1.00 0.00 H new ATOM 0 H1' DA A 21 4.666 10.333 2.170 1.00 0.00 H new ATOM 0 H8 DA A 21 4.992 11.733 5.751 1.00 0.00 H new ATOM 0 H61 DA A 21 -1.246 11.271 5.690 1.00 0.00 H new ATOM 0 H62 DA A 21 0.153 11.632 6.707 1.00 0.00 H new ATOM 0 H2 DA A 21 0.354 10.242 1.610 1.00 0.00 H new ATOM 684 P DA A 22 8.110 11.369 -0.337 1.00 0.00 P ATOM 685 OP1 DA A 22 9.518 11.552 0.126 1.00 0.00 O ATOM 686 OP2 DA A 22 7.405 12.528 -0.976 1.00 0.00 O ATOM 687 O5' DA A 22 8.096 10.180 -1.355 1.00 0.00 O ATOM 688 C5' DA A 22 7.383 8.967 -1.243 1.00 0.00 C ATOM 689 C4' DA A 22 6.055 8.948 -2.037 1.00 0.00 C ATOM 690 O4' DA A 22 5.325 7.751 -1.743 1.00 0.00 O ATOM 691 C3' DA A 22 5.019 10.080 -1.831 1.00 0.00 C ATOM 692 O3' DA A 22 5.324 11.323 -2.465 1.00 0.00 O ATOM 693 C2' DA A 22 3.793 9.421 -2.434 1.00 0.00 C ATOM 694 C1' DA A 22 3.951 7.950 -1.966 1.00 0.00 C ATOM 695 N9 DA A 22 3.236 7.645 -0.724 1.00 0.00 N ATOM 696 C8 DA A 22 3.649 7.542 0.586 1.00 0.00 C ATOM 697 N7 DA A 22 2.676 7.373 1.431 1.00 0.00 N ATOM 698 C5 DA A 22 1.515 7.376 0.642 1.00 0.00 C ATOM 699 C6 DA A 22 0.118 7.384 0.877 1.00 0.00 C ATOM 700 N6 DA A 22 -0.473 7.343 2.086 1.00 0.00 N ATOM 701 N1 DA A 22 -0.704 7.476 -0.192 1.00 0.00 N ATOM 702 C2 DA A 22 -0.189 7.565 -1.427 1.00 0.00 C ATOM 703 N3 DA A 22 1.101 7.625 -1.769 1.00 0.00 N ATOM 704 C4 DA A 22 1.879 7.528 -0.699 1.00 0.00 C ATOM 0 H5' DA A 22 7.169 8.778 -0.191 1.00 0.00 H new ATOM 0 H5'' DA A 22 8.016 8.151 -1.592 1.00 0.00 H new ATOM 0 H4' DA A 22 6.437 9.058 -3.052 1.00 0.00 H new ATOM 0 H3' DA A 22 4.940 10.395 -0.791 1.00 0.00 H new ATOM 0 H2' DA A 22 2.869 9.868 -2.068 1.00 0.00 H new ATOM 0 H2'' DA A 22 3.779 9.504 -3.521 1.00 0.00 H new ATOM 0 HO3' DA A 22 6.043 11.773 -1.974 1.00 0.00 H new ATOM 0 H1' DA A 22 3.530 7.299 -2.732 1.00 0.00 H new ATOM 0 H8 DA A 22 4.686 7.597 0.884 1.00 0.00 H new ATOM 0 H61 DA A 22 -1.490 7.353 2.157 1.00 0.00 H new ATOM 0 H62 DA A 22 0.097 7.302 2.931 1.00 0.00 H new ATOM 0 H2 DA A 22 -0.900 7.591 -2.240 1.00 0.00 H new TER 717 DA A 22 HETATM 718 K K A 31 0.056 -0.999 0.793 1.00 0.00 K HETATM 719 K K A 30 0.382 2.934 1.592 1.00 0.00 K