USER MOD reduce.3.24.130724 H: found=0, std=0, add=184, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 232 hydrogens (48 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 DG O5' : rot -14:sc= 0.751 USER MOD Single : A 5 DG O3' : rot 180:sc= 0 USER MOD Single : B 1 DG O5' : rot -16:sc= 0.542 USER MOD Single : B 5 DG O3' : rot 180:sc= 0 USER MOD Single : C 1 DG O5' : rot -14:sc= 0.48 USER MOD Single : C 5 DG O3' : rot 180:sc= 0 USER MOD Single : D 1 DG O5' : rot -16:sc= 0.516 USER MOD Single : D 5 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -7.700 -2.396 -0.765 1.00 1.00 O ATOM 2 C5' DG A 1 -8.532 -3.384 -1.361 1.00 1.00 C ATOM 3 C4' DG A 1 -8.253 -3.484 -2.840 1.00 1.00 C ATOM 4 O4' DG A 1 -6.973 -2.864 -3.111 1.00 1.00 O ATOM 5 C3' DG A 1 -8.149 -4.909 -3.384 1.00 1.00 C ATOM 6 O3' DG A 1 -8.683 -4.960 -4.712 1.00 1.00 O ATOM 7 C2' DG A 1 -6.649 -5.151 -3.399 1.00 1.00 C ATOM 8 C1' DG A 1 -6.146 -3.781 -3.804 1.00 1.00 C ATOM 9 N9 DG A 1 -4.757 -3.485 -3.470 1.00 1.00 N ATOM 10 C8 DG A 1 -3.779 -3.090 -4.349 1.00 1.00 C ATOM 11 N7 DG A 1 -2.645 -2.808 -3.771 1.00 1.00 N ATOM 12 C5 DG A 1 -2.883 -3.037 -2.424 1.00 1.00 C ATOM 13 C6 DG A 1 -2.018 -2.903 -1.310 1.00 1.00 C ATOM 14 O6 DG A 1 -0.839 -2.516 -1.296 1.00 1.00 O ATOM 15 N1 DG A 1 -2.649 -3.240 -0.117 1.00 1.00 N ATOM 16 C2 DG A 1 -3.959 -3.651 -0.021 1.00 1.00 C ATOM 17 N2 DG A 1 -4.411 -3.922 1.212 1.00 1.00 N ATOM 18 N3 DG A 1 -4.778 -3.779 -1.053 1.00 1.00 N ATOM 19 C4 DG A 1 -4.180 -3.458 -2.219 1.00 1.00 C ATOM 0 H5' DG A 1 -9.580 -3.132 -1.198 1.00 1.00 H new ATOM 0 H5'' DG A 1 -8.359 -4.349 -0.886 1.00 1.00 H new ATOM 0 H4' DG A 1 -9.101 -3.000 -3.324 1.00 1.00 H new ATOM 0 H3' DG A 1 -8.697 -5.649 -2.801 1.00 1.00 H new ATOM 0 H2' DG A 1 -6.270 -5.459 -2.425 1.00 1.00 H new ATOM 0 H2'' DG A 1 -6.362 -5.924 -4.112 1.00 1.00 H new ATOM 0 HO5' DG A 1 -6.979 -2.159 -1.385 1.00 1.00 H new ATOM 0 H1' DG A 1 -6.186 -3.721 -4.892 1.00 1.00 H new ATOM 0 H8 DG A 1 -3.934 -3.020 -5.415 1.00 1.00 H new ATOM 0 H1 DG A 1 -2.105 -3.178 0.744 1.00 1.00 H new ATOM 0 H21 DG A 1 -5.374 -4.231 1.346 1.00 1.00 H new ATOM 0 H22 DG A 1 -3.792 -3.819 2.016 1.00 1.00 H new ATOM 32 P DG A 2 -8.980 -6.372 -5.415 1.00 1.00 P ATOM 33 OP1 DG A 2 -10.084 -6.155 -6.379 1.00 1.00 O ATOM 34 OP2 DG A 2 -9.136 -7.394 -4.356 1.00 1.00 O ATOM 35 O5' DG A 2 -7.657 -6.689 -6.239 1.00 1.00 O ATOM 36 C5' DG A 2 -7.215 -5.816 -7.281 1.00 1.00 C ATOM 37 C4' DG A 2 -5.787 -6.129 -7.665 1.00 1.00 C ATOM 38 O4' DG A 2 -4.900 -5.761 -6.579 1.00 1.00 O ATOM 39 C3' DG A 2 -5.491 -7.610 -7.935 1.00 1.00 C ATOM 40 O3' DG A 2 -4.495 -7.736 -8.953 1.00 1.00 O ATOM 41 C2' DG A 2 -4.888 -8.058 -6.617 1.00 1.00 C ATOM 42 C1' DG A 2 -4.020 -6.849 -6.366 1.00 1.00 C ATOM 43 N9 DG A 2 -3.411 -6.735 -5.045 1.00 1.00 N ATOM 44 C8 DG A 2 -3.895 -7.176 -3.837 1.00 1.00 C ATOM 45 N7 DG A 2 -3.075 -6.955 -2.843 1.00 1.00 N ATOM 46 C5 DG A 2 -1.986 -6.327 -3.435 1.00 1.00 C ATOM 47 C6 DG A 2 -0.776 -5.842 -2.868 1.00 1.00 C ATOM 48 O6 DG A 2 -0.426 -5.852 -1.680 1.00 1.00 O ATOM 49 N1 DG A 2 0.060 -5.274 -3.827 1.00 1.00 N ATOM 50 C2 DG A 2 -0.247 -5.184 -5.167 1.00 1.00 C ATOM 51 N2 DG A 2 0.658 -4.601 -5.960 1.00 1.00 N ATOM 52 N3 DG A 2 -1.365 -5.630 -5.704 1.00 1.00 N ATOM 53 C4 DG A 2 -2.183 -6.184 -4.789 1.00 1.00 C ATOM 0 H5' DG A 2 -7.290 -4.780 -6.951 1.00 1.00 H new ATOM 0 H5'' DG A 2 -7.863 -5.922 -8.151 1.00 1.00 H new ATOM 0 H4' DG A 2 -5.631 -5.567 -8.586 1.00 1.00 H new ATOM 0 H3' DG A 2 -6.366 -8.175 -8.258 1.00 1.00 H new ATOM 0 H2' DG A 2 -5.635 -8.215 -5.839 1.00 1.00 H new ATOM 0 H2'' DG A 2 -4.317 -8.982 -6.702 1.00 1.00 H new ATOM 0 H1' DG A 2 -3.151 -6.900 -7.022 1.00 1.00 H new ATOM 0 H8 DG A 2 -4.855 -7.656 -3.720 1.00 1.00 H new ATOM 0 H1 DG A 2 0.957 -4.901 -3.517 1.00 1.00 H new ATOM 0 H21 DG A 2 0.477 -4.510 -6.960 1.00 1.00 H new ATOM 0 H22 DG A 2 1.529 -4.247 -5.565 1.00 1.00 H new HETATM 65 P AZW A 3 -4.863 -7.725 -10.513 1.00 1.00 P HETATM 66 OP1 AZW A 3 -5.327 -6.370 -10.890 1.00 1.00 O HETATM 67 OP2 AZW A 3 -5.727 -8.900 -10.773 1.00 1.00 O HETATM 68 O5' AZW A 3 -3.449 -7.980 -11.197 1.00 1.00 O HETATM 69 C5' AZW A 3 -2.591 -8.998 -10.686 1.00 1.00 C HETATM 70 C1A AZW A 3 -1.422 -8.383 -9.946 1.00 1.00 C HETATM 71 C2A AZW A 3 -0.382 -7.753 -10.647 1.00 1.00 C HETATM 72 C6A AZW A 3 -1.349 -8.504 -8.550 1.00 1.00 C HETATM 73 C3A AZW A 3 0.735 -7.260 -9.953 1.00 1.00 C HETATM 74 C5A AZW A 3 -0.237 -8.011 -7.858 1.00 1.00 C HETATM 75 C4A AZW A 3 0.810 -7.394 -8.559 1.00 1.00 C HETATM 76 N5A AZW A 3 1.971 -6.983 -7.865 1.00 1.00 N HETATM 77 C1B AZW A 3 6.083 -6.883 -4.851 1.00 1.00 C HETATM 78 C2B AZW A 3 6.084 -6.777 -6.248 1.00 1.00 C HETATM 79 C6B AZW A 3 4.911 -7.252 -4.181 1.00 1.00 C HETATM 80 C3B AZW A 3 4.914 -7.046 -6.974 1.00 1.00 C HETATM 81 C5B AZW A 3 3.744 -7.521 -4.903 1.00 1.00 C HETATM 82 C4B AZW A 3 3.744 -7.422 -6.300 1.00 1.00 C HETATM 83 N5B AZW A 3 2.582 -7.767 -7.024 1.00 1.00 N HETATM 84 C3' AZW A 3 7.349 -6.621 -4.062 1.00 1.00 C HETATM 85 O3' AZW A 3 8.492 -7.160 -4.722 1.00 1.00 O ATOM 98 P DG A 4 9.684 -6.181 -5.171 1.00 1.00 P ATOM 99 OP1 DG A 4 10.659 -6.949 -5.981 1.00 1.00 O ATOM 100 OP2 DG A 4 10.155 -5.473 -3.959 1.00 1.00 O ATOM 101 O5' DG A 4 8.960 -5.128 -6.118 1.00 1.00 O ATOM 102 C5' DG A 4 9.284 -3.742 -6.073 1.00 1.00 C ATOM 103 C4' DG A 4 8.633 -3.045 -7.242 1.00 1.00 C ATOM 104 O4' DG A 4 7.257 -3.486 -7.341 1.00 1.00 O ATOM 105 C3' DG A 4 8.569 -1.522 -7.133 1.00 1.00 C ATOM 106 O3' DG A 4 8.613 -0.935 -8.438 1.00 1.00 O ATOM 107 C2' DG A 4 7.219 -1.289 -6.479 1.00 1.00 C ATOM 108 C1' DG A 4 6.376 -2.402 -7.081 1.00 1.00 C ATOM 109 N9 DG A 4 5.279 -2.892 -6.248 1.00 1.00 N ATOM 110 C8 DG A 4 4.003 -3.163 -6.680 1.00 1.00 C ATOM 111 N7 DG A 4 3.217 -3.600 -5.735 1.00 1.00 N ATOM 112 C5 DG A 4 4.018 -3.621 -4.604 1.00 1.00 C ATOM 113 C6 DG A 4 3.705 -4.006 -3.276 1.00 1.00 C ATOM 114 O6 DG A 4 2.620 -4.408 -2.829 1.00 1.00 O ATOM 115 N1 DG A 4 4.797 -3.882 -2.423 1.00 1.00 N ATOM 116 C2 DG A 4 6.037 -3.436 -2.813 1.00 1.00 C ATOM 117 N2 DG A 4 6.974 -3.372 -1.855 1.00 1.00 N ATOM 118 N3 DG A 4 6.342 -3.074 -4.050 1.00 1.00 N ATOM 119 C4 DG A 4 5.294 -3.188 -4.895 1.00 1.00 C ATOM 0 H5' DG A 4 10.365 -3.607 -6.109 1.00 1.00 H new ATOM 0 H5'' DG A 4 8.940 -3.305 -5.136 1.00 1.00 H new ATOM 0 H4' DG A 4 9.253 -3.299 -8.102 1.00 1.00 H new ATOM 0 H3' DG A 4 9.396 -1.084 -6.574 1.00 1.00 H new ATOM 0 H2' DG A 4 7.274 -1.362 -5.393 1.00 1.00 H new ATOM 0 H2'' DG A 4 6.818 -0.303 -6.712 1.00 1.00 H new ATOM 0 H1' DG A 4 5.896 -1.987 -7.967 1.00 1.00 H new ATOM 0 H8 DG A 4 3.682 -3.027 -7.702 1.00 1.00 H new ATOM 0 H1 DG A 4 4.669 -4.139 -1.444 1.00 1.00 H new ATOM 0 H21 DG A 4 7.914 -3.049 -2.082 1.00 1.00 H new ATOM 0 H22 DG A 4 6.746 -3.647 -0.899 1.00 1.00 H new ATOM 131 P DG A 5 8.800 0.651 -8.604 1.00 1.00 P ATOM 132 OP1 DG A 5 9.441 0.902 -9.917 1.00 1.00 O ATOM 133 OP2 DG A 5 9.440 1.166 -7.371 1.00 1.00 O ATOM 134 O5' DG A 5 7.312 1.211 -8.654 1.00 1.00 O ATOM 135 C5' DG A 5 6.397 0.759 -9.646 1.00 1.00 C ATOM 136 C4' DG A 5 4.975 1.088 -9.258 1.00 1.00 C ATOM 137 O4' DG A 5 4.495 0.181 -8.246 1.00 1.00 O ATOM 138 C3' DG A 5 4.760 2.454 -8.612 1.00 1.00 C ATOM 139 O3' DG A 5 4.694 3.487 -9.600 1.00 1.00 O ATOM 140 C2' DG A 5 3.422 2.271 -7.914 1.00 1.00 C ATOM 141 C1' DG A 5 3.332 0.761 -7.669 1.00 1.00 C ATOM 142 N9 DG A 5 3.273 0.384 -6.260 1.00 1.00 N ATOM 143 C8 DG A 5 4.230 0.593 -5.296 1.00 1.00 C ATOM 144 N7 DG A 5 3.877 0.164 -4.113 1.00 1.00 N ATOM 145 C5 DG A 5 2.607 -0.363 -4.307 1.00 1.00 C ATOM 146 C6 DG A 5 1.712 -0.974 -3.384 1.00 1.00 C ATOM 147 O6 DG A 5 1.866 -1.160 -2.166 1.00 1.00 O ATOM 148 N1 DG A 5 0.525 -1.371 -3.994 1.00 1.00 N ATOM 149 C2 DG A 5 0.241 -1.194 -5.328 1.00 1.00 C ATOM 150 N2 DG A 5 -0.954 -1.633 -5.746 1.00 1.00 N ATOM 151 N3 DG A 5 1.061 -0.626 -6.196 1.00 1.00 N ATOM 152 C4 DG A 5 2.220 -0.237 -5.623 1.00 1.00 C ATOM 0 H5' DG A 5 6.502 -0.318 -9.779 1.00 1.00 H new ATOM 0 H5'' DG A 5 6.634 1.223 -10.603 1.00 1.00 H new ATOM 0 H4' DG A 5 4.459 1.035 -10.217 1.00 1.00 H new ATOM 0 H3' DG A 5 5.565 2.755 -7.941 1.00 1.00 H new ATOM 0 H2' DG A 5 3.380 2.830 -6.979 1.00 1.00 H new ATOM 0 H2'' DG A 5 2.598 2.624 -8.533 1.00 1.00 H new ATOM 0 HO3' DG A 5 4.554 4.352 -9.160 1.00 1.00 H new ATOM 0 H1' DG A 5 2.402 0.406 -8.113 1.00 1.00 H new ATOM 0 H8 DG A 5 5.180 1.065 -5.496 1.00 1.00 H new ATOM 0 H1 DG A 5 -0.181 -1.823 -3.413 1.00 1.00 H new ATOM 0 H21 DG A 5 -1.221 -1.530 -6.725 1.00 1.00 H new ATOM 0 H22 DG A 5 -1.596 -2.071 -5.085 1.00 1.00 H new TER 165 DG A 5 ATOM 166 O5' DG B 1 7.400 2.692 1.287 1.00 1.00 O ATOM 167 C5' DG B 1 8.727 2.211 1.503 1.00 1.00 C ATOM 168 C4' DG B 1 8.820 1.488 2.825 1.00 1.00 C ATOM 169 O4' DG B 1 7.484 1.092 3.223 1.00 1.00 O ATOM 170 C3' DG B 1 9.653 0.206 2.803 1.00 1.00 C ATOM 171 O3' DG B 1 10.361 0.061 4.042 1.00 1.00 O ATOM 172 C2' DG B 1 8.602 -0.879 2.645 1.00 1.00 C ATOM 173 C1' DG B 1 7.448 -0.308 3.447 1.00 1.00 C ATOM 174 N9 DG B 1 6.122 -0.797 3.077 1.00 1.00 N ATOM 175 C8 DG B 1 5.206 -1.382 3.916 1.00 1.00 C ATOM 176 N7 DG B 1 4.090 -1.703 3.324 1.00 1.00 N ATOM 177 C5 DG B 1 4.276 -1.307 2.007 1.00 1.00 C ATOM 178 C6 DG B 1 3.403 -1.404 0.895 1.00 1.00 C ATOM 179 O6 DG B 1 2.246 -1.856 0.864 1.00 1.00 O ATOM 180 N1 DG B 1 3.973 -0.892 -0.266 1.00 1.00 N ATOM 181 C2 DG B 1 5.238 -0.345 -0.334 1.00 1.00 C ATOM 182 N2 DG B 1 5.627 0.114 -1.536 1.00 1.00 N ATOM 183 N3 DG B 1 6.063 -0.249 0.700 1.00 1.00 N ATOM 184 C4 DG B 1 5.523 -0.747 1.834 1.00 1.00 C ATOM 0 H5' DG B 1 9.429 3.045 1.488 1.00 1.00 H new ATOM 0 H5'' DG B 1 9.013 1.539 0.694 1.00 1.00 H new ATOM 0 H4' DG B 1 9.305 2.188 3.506 1.00 1.00 H new ATOM 0 H3' DG B 1 10.408 0.183 2.017 1.00 1.00 H new ATOM 0 H2' DG B 1 8.334 -1.041 1.601 1.00 1.00 H new ATOM 0 H2'' DG B 1 8.940 -1.837 3.040 1.00 1.00 H new ATOM 0 HO5' DG B 1 6.785 2.243 1.904 1.00 1.00 H new ATOM 0 H1' DG B 1 7.582 -0.613 4.485 1.00 1.00 H new ATOM 0 H8 DG B 1 5.392 -1.559 4.965 1.00 1.00 H new ATOM 0 H1 DG B 1 3.420 -0.923 -1.123 1.00 1.00 H new ATOM 0 H21 DG B 1 6.552 0.529 -1.648 1.00 1.00 H new ATOM 0 H22 DG B 1 4.997 0.047 -2.336 1.00 1.00 H new ATOM 197 P DG B 2 11.496 -1.062 4.216 1.00 1.00 P ATOM 198 OP1 DG B 2 12.392 -0.614 5.309 1.00 1.00 O ATOM 199 OP2 DG B 2 12.068 -1.385 2.888 1.00 1.00 O ATOM 200 O5' DG B 2 10.702 -2.339 4.734 1.00 1.00 O ATOM 201 C5' DG B 2 9.938 -2.276 5.937 1.00 1.00 C ATOM 202 C4' DG B 2 9.075 -3.508 6.073 1.00 1.00 C ATOM 203 O4' DG B 2 7.972 -3.429 5.137 1.00 1.00 O ATOM 204 C3' DG B 2 9.791 -4.827 5.765 1.00 1.00 C ATOM 205 O3' DG B 2 9.439 -5.810 6.744 1.00 1.00 O ATOM 206 C2' DG B 2 9.240 -5.208 4.401 1.00 1.00 C ATOM 207 C1' DG B 2 7.824 -4.696 4.527 1.00 1.00 C ATOM 208 N9 DG B 2 7.085 -4.553 3.275 1.00 1.00 N ATOM 209 C8 DG B 2 7.558 -4.131 2.054 1.00 1.00 C ATOM 210 N7 DG B 2 6.653 -4.154 1.113 1.00 1.00 N ATOM 211 C5 DG B 2 5.512 -4.621 1.750 1.00 1.00 C ATOM 212 C6 DG B 2 4.210 -4.858 1.239 1.00 1.00 C ATOM 213 O6 DG B 2 3.795 -4.681 0.086 1.00 1.00 O ATOM 214 N1 DG B 2 3.342 -5.334 2.220 1.00 1.00 N ATOM 215 C2 DG B 2 3.701 -5.546 3.532 1.00 1.00 C ATOM 216 N2 DG B 2 2.747 -6.005 4.353 1.00 1.00 N ATOM 217 N3 DG B 2 4.909 -5.328 4.020 1.00 1.00 N ATOM 218 C4 DG B 2 5.761 -4.870 3.081 1.00 1.00 C ATOM 0 H5' DG B 2 9.312 -1.384 5.932 1.00 1.00 H new ATOM 0 H5'' DG B 2 10.604 -2.194 6.796 1.00 1.00 H new ATOM 0 H4' DG B 2 8.766 -3.518 7.118 1.00 1.00 H new ATOM 0 H3' DG B 2 10.878 -4.750 5.778 1.00 1.00 H new ATOM 0 H2' DG B 2 9.783 -4.730 3.586 1.00 1.00 H new ATOM 0 H2'' DG B 2 9.279 -6.283 4.223 1.00 1.00 H new ATOM 0 H1' DG B 2 7.233 -5.419 5.089 1.00 1.00 H new ATOM 0 H8 DG B 2 8.577 -3.812 1.890 1.00 1.00 H new ATOM 0 H1 DG B 2 2.380 -5.538 1.949 1.00 1.00 H new ATOM 0 H21 DG B 2 2.960 -6.179 5.335 1.00 1.00 H new ATOM 0 H22 DG B 2 1.808 -6.180 3.996 1.00 1.00 H new HETATM 230 P AZW B 3 10.252 -7.190 6.843 1.00 1.00 P HETATM 231 OP1 AZW B 3 10.717 -7.353 8.238 1.00 1.00 O HETATM 232 OP2 AZW B 3 11.245 -7.220 5.743 1.00 1.00 O HETATM 233 O5' AZW B 3 9.154 -8.305 6.546 1.00 1.00 O HETATM 234 C5' AZW B 3 8.011 -8.454 7.388 1.00 1.00 C HETATM 235 C1A AZW B 3 6.833 -8.947 6.572 1.00 1.00 C HETATM 236 C2A AZW B 3 5.961 -9.903 7.113 1.00 1.00 C HETATM 237 C6A AZW B 3 6.608 -8.452 5.279 1.00 1.00 C HETATM 238 C3A AZW B 3 4.872 -10.366 6.364 1.00 1.00 C HETATM 239 C5A AZW B 3 5.517 -8.914 4.531 1.00 1.00 C HETATM 240 C4A AZW B 3 4.648 -9.872 5.073 1.00 1.00 C HETATM 241 N5A AZW B 3 3.559 -10.353 4.311 1.00 1.00 N HETATM 242 C1B AZW B 3 -0.698 -11.103 1.704 1.00 1.00 C HETATM 243 C2B AZW B 3 -0.662 -11.329 3.090 1.00 1.00 C HETATM 244 C6B AZW B 3 0.337 -10.387 1.091 1.00 1.00 C HETATM 245 C3B AZW B 3 0.405 -10.837 3.853 1.00 1.00 C HETATM 246 C5B AZW B 3 1.404 -9.896 1.855 1.00 1.00 C HETATM 247 C4B AZW B 3 1.440 -10.121 3.236 1.00 1.00 C HETATM 248 N5B AZW B 3 2.521 -9.628 4.005 1.00 1.00 N HETATM 249 C3' AZW B 3 -1.854 -11.615 0.865 1.00 1.00 C HETATM 250 O3' AZW B 3 -2.436 -12.782 1.442 1.00 1.00 O ATOM 263 P DG B 4 -3.876 -12.687 2.146 1.00 1.00 P ATOM 264 OP1 DG B 4 -3.979 -13.786 3.136 1.00 1.00 O ATOM 265 OP2 DG B 4 -4.896 -12.578 1.077 1.00 1.00 O ATOM 266 O5' DG B 4 -3.813 -11.307 2.934 1.00 1.00 O ATOM 267 C5' DG B 4 -4.940 -10.803 3.644 1.00 1.00 C ATOM 268 C4' DG B 4 -4.492 -10.258 4.980 1.00 1.00 C ATOM 269 O4' DG B 4 -3.117 -9.812 4.873 1.00 1.00 O ATOM 270 C3' DG B 4 -5.278 -9.052 5.499 1.00 1.00 C ATOM 271 O3' DG B 4 -5.381 -9.125 6.926 1.00 1.00 O ATOM 272 C2' DG B 4 -4.412 -7.880 5.078 1.00 1.00 C ATOM 273 C1' DG B 4 -3.025 -8.459 5.291 1.00 1.00 C ATOM 274 N9 DG B 4 -1.944 -7.815 4.553 1.00 1.00 N ATOM 275 C8 DG B 4 -0.761 -7.361 5.083 1.00 1.00 C ATOM 276 N7 DG B 4 0.038 -6.834 4.197 1.00 1.00 N ATOM 277 C5 DG B 4 -0.658 -6.945 3.002 1.00 1.00 C ATOM 278 C6 DG B 4 -0.291 -6.541 1.695 1.00 1.00 C ATOM 279 O6 DG B 4 0.755 -5.983 1.331 1.00 1.00 O ATOM 280 N1 DG B 4 -1.281 -6.832 0.761 1.00 1.00 N ATOM 281 C2 DG B 4 -2.477 -7.439 1.063 1.00 1.00 C ATOM 282 N2 DG B 4 -3.317 -7.649 0.038 1.00 1.00 N ATOM 283 N3 DG B 4 -2.833 -7.821 2.279 1.00 1.00 N ATOM 284 C4 DG B 4 -1.883 -7.546 3.200 1.00 1.00 C ATOM 0 H5' DG B 4 -5.675 -11.595 3.790 1.00 1.00 H new ATOM 0 H5'' DG B 4 -5.427 -10.019 3.064 1.00 1.00 H new ATOM 0 H4' DG B 4 -4.647 -11.083 5.675 1.00 1.00 H new ATOM 0 H3' DG B 4 -6.297 -8.985 5.117 1.00 1.00 H new ATOM 0 H2' DG B 4 -4.584 -7.591 4.041 1.00 1.00 H new ATOM 0 H2'' DG B 4 -4.589 -6.995 5.689 1.00 1.00 H new ATOM 0 H1' DG B 4 -2.761 -8.314 6.338 1.00 1.00 H new ATOM 0 H8 DG B 4 -0.516 -7.433 6.132 1.00 1.00 H new ATOM 0 H1 DG B 4 -1.108 -6.578 -0.212 1.00 1.00 H new ATOM 0 H21 DG B 4 -4.219 -8.096 0.201 1.00 1.00 H new ATOM 0 H22 DG B 4 -3.053 -7.362 -0.905 1.00 1.00 H new ATOM 296 P DG B 5 -6.294 -8.088 7.745 1.00 1.00 P ATOM 297 OP1 DG B 5 -6.595 -8.721 9.054 1.00 1.00 O ATOM 298 OP2 DG B 5 -7.407 -7.640 6.873 1.00 1.00 O ATOM 299 O5' DG B 5 -5.324 -6.856 8.016 1.00 1.00 O ATOM 300 C5' DG B 5 -4.189 -7.014 8.866 1.00 1.00 C ATOM 301 C4' DG B 5 -3.247 -5.843 8.737 1.00 1.00 C ATOM 302 O4' DG B 5 -2.776 -5.730 7.378 1.00 1.00 O ATOM 303 C3' DG B 5 -3.855 -4.473 9.049 1.00 1.00 C ATOM 304 O3' DG B 5 -3.522 -4.070 10.382 1.00 1.00 O ATOM 305 C2' DG B 5 -3.233 -3.532 8.025 1.00 1.00 C ATOM 306 C1' DG B 5 -2.271 -4.418 7.242 1.00 1.00 C ATOM 307 N9 DG B 5 -2.154 -4.100 5.821 1.00 1.00 N ATOM 308 C8 DG B 5 -3.124 -4.201 4.854 1.00 1.00 C ATOM 309 N7 DG B 5 -2.711 -3.840 3.668 1.00 1.00 N ATOM 310 C5 DG B 5 -1.384 -3.476 3.865 1.00 1.00 C ATOM 311 C6 DG B 5 -0.414 -2.997 2.943 1.00 1.00 C ATOM 312 O6 DG B 5 -0.544 -2.779 1.726 1.00 1.00 O ATOM 313 N1 DG B 5 0.810 -2.750 3.557 1.00 1.00 N ATOM 314 C2 DG B 5 1.060 -2.942 4.897 1.00 1.00 C ATOM 315 N2 DG B 5 2.297 -2.652 5.317 1.00 1.00 N ATOM 316 N3 DG B 5 0.167 -3.384 5.767 1.00 1.00 N ATOM 317 C4 DG B 5 -1.027 -3.632 5.187 1.00 1.00 C ATOM 0 H5' DG B 5 -3.666 -7.936 8.611 1.00 1.00 H new ATOM 0 H5'' DG B 5 -4.516 -7.109 9.901 1.00 1.00 H new ATOM 0 H4' DG B 5 -2.469 -6.063 9.468 1.00 1.00 H new ATOM 0 H3' DG B 5 -4.943 -4.477 8.991 1.00 1.00 H new ATOM 0 H2' DG B 5 -3.990 -3.094 7.375 1.00 1.00 H new ATOM 0 H2'' DG B 5 -2.711 -2.706 8.508 1.00 1.00 H new ATOM 0 HO3' DG B 5 -3.916 -3.192 10.566 1.00 1.00 H new ATOM 0 H1' DG B 5 -1.268 -4.274 7.643 1.00 1.00 H new ATOM 0 H8 DG B 5 -4.128 -4.545 5.054 1.00 1.00 H new ATOM 0 H1 DG B 5 1.573 -2.404 2.975 1.00 1.00 H new ATOM 0 H21 DG B 5 2.544 -2.774 6.299 1.00 1.00 H new ATOM 0 H22 DG B 5 2.993 -2.309 4.655 1.00 1.00 H new TER 330 DG B 5 ATOM 331 O5' DG C 1 7.014 2.426 -2.910 1.00 1.00 O ATOM 332 C5' DG C 1 7.463 3.725 -3.296 1.00 1.00 C ATOM 333 C4' DG C 1 6.792 4.150 -4.582 1.00 1.00 C ATOM 334 O4' DG C 1 5.510 3.482 -4.663 1.00 1.00 O ATOM 335 C3' DG C 1 6.489 5.643 -4.711 1.00 1.00 C ATOM 336 O3' DG C 1 6.567 6.026 -6.089 1.00 1.00 O ATOM 337 C2' DG C 1 5.064 5.734 -4.201 1.00 1.00 C ATOM 338 C1' DG C 1 4.474 4.450 -4.746 1.00 1.00 C ATOM 339 N9 DG C 1 3.310 3.941 -4.024 1.00 1.00 N ATOM 340 C8 DG C 1 2.084 3.650 -4.569 1.00 1.00 C ATOM 341 N7 DG C 1 1.231 3.174 -3.702 1.00 1.00 N ATOM 342 C5 DG C 1 1.936 3.155 -2.507 1.00 1.00 C ATOM 343 C6 DG C 1 1.523 2.740 -1.218 1.00 1.00 C ATOM 344 O6 DG C 1 0.426 2.267 -0.882 1.00 1.00 O ATOM 345 N1 DG C 1 2.531 2.884 -0.271 1.00 1.00 N ATOM 346 C2 DG C 1 3.792 3.365 -0.552 1.00 1.00 C ATOM 347 N2 DG C 1 4.650 3.425 0.479 1.00 1.00 N ATOM 348 N3 DG C 1 4.190 3.755 -1.755 1.00 1.00 N ATOM 349 C4 DG C 1 3.219 3.626 -2.683 1.00 1.00 C ATOM 0 H5' DG C 1 8.545 3.719 -3.427 1.00 1.00 H new ATOM 0 H5'' DG C 1 7.241 4.444 -2.507 1.00 1.00 H new ATOM 0 H4' DG C 1 7.500 3.891 -5.369 1.00 1.00 H new ATOM 0 H3' DG C 1 7.177 6.293 -4.169 1.00 1.00 H new ATOM 0 H2' DG C 1 5.018 5.778 -3.113 1.00 1.00 H new ATOM 0 H2'' DG C 1 4.548 6.617 -4.578 1.00 1.00 H new ATOM 0 HO5' DG C 1 6.219 2.187 -3.431 1.00 1.00 H new ATOM 0 H1' DG C 1 4.117 4.652 -5.756 1.00 1.00 H new ATOM 0 H8 DG C 1 1.848 3.800 -5.612 1.00 1.00 H new ATOM 0 H1 DG C 1 2.325 2.617 0.692 1.00 1.00 H new ATOM 0 H21 DG C 1 5.598 3.772 0.334 1.00 1.00 H new ATOM 0 H22 DG C 1 4.354 3.123 1.407 1.00 1.00 H new ATOM 362 P DG C 2 6.580 7.572 -6.523 1.00 1.00 P ATOM 363 OP1 DG C 2 7.191 7.662 -7.869 1.00 1.00 O ATOM 364 OP2 DG C 2 7.163 8.356 -5.409 1.00 1.00 O ATOM 365 O5' DG C 2 5.042 7.953 -6.650 1.00 1.00 O ATOM 366 C5' DG C 2 4.251 7.405 -7.702 1.00 1.00 C ATOM 367 C4' DG C 2 2.789 7.734 -7.492 1.00 1.00 C ATOM 368 O4' DG C 2 2.292 7.000 -6.344 1.00 1.00 O ATOM 369 C3' DG C 2 2.487 9.210 -7.209 1.00 1.00 C ATOM 370 O3' DG C 2 1.375 9.634 -8.008 1.00 1.00 O ATOM 371 C2' DG C 2 2.122 9.220 -5.735 1.00 1.00 C ATOM 372 C1' DG C 2 1.457 7.868 -5.603 1.00 1.00 C ATOM 373 N9 DG C 2 1.321 7.359 -4.241 1.00 1.00 N ATOM 374 C8 DG C 2 2.198 7.523 -3.194 1.00 1.00 C ATOM 375 N7 DG C 2 1.772 6.994 -2.080 1.00 1.00 N ATOM 376 C5 DG C 2 0.540 6.445 -2.409 1.00 1.00 C ATOM 377 C6 DG C 2 -0.393 5.739 -1.606 1.00 1.00 C ATOM 378 O6 DG C 2 -0.303 5.437 -0.408 1.00 1.00 O ATOM 379 N1 DG C 2 -1.519 5.354 -2.329 1.00 1.00 N ATOM 380 C2 DG C 2 -1.710 5.622 -3.667 1.00 1.00 C ATOM 381 N2 DG C 2 -2.847 5.170 -4.212 1.00 1.00 N ATOM 382 N3 DG C 2 -0.848 6.278 -4.427 1.00 1.00 N ATOM 383 C4 DG C 2 0.248 6.659 -3.738 1.00 1.00 C ATOM 0 H5' DG C 2 4.385 6.324 -7.740 1.00 1.00 H new ATOM 0 H5'' DG C 2 4.585 7.802 -8.661 1.00 1.00 H new ATOM 0 H4' DG C 2 2.310 7.465 -8.433 1.00 1.00 H new ATOM 0 H3' DG C 2 3.316 9.879 -7.440 1.00 1.00 H new ATOM 0 H2' DG C 2 2.997 9.315 -5.092 1.00 1.00 H new ATOM 0 H2'' DG C 2 1.449 10.039 -5.481 1.00 1.00 H new ATOM 0 H1' DG C 2 0.428 7.943 -5.956 1.00 1.00 H new ATOM 0 H8 DG C 2 3.143 8.037 -3.285 1.00 1.00 H new ATOM 0 H1 DG C 2 -2.250 4.840 -1.836 1.00 1.00 H new ATOM 0 H21 DG C 2 -3.042 5.339 -5.199 1.00 1.00 H new ATOM 0 H22 DG C 2 -3.518 4.657 -3.640 1.00 1.00 H new HETATM 395 P AZW C 3 1.088 11.192 -8.273 1.00 1.00 P HETATM 396 OP1 AZW C 3 1.122 11.426 -9.735 1.00 1.00 O HETATM 397 OP2 AZW C 3 1.976 11.988 -7.394 1.00 1.00 O HETATM 398 O5' AZW C 3 -0.407 11.388 -7.764 1.00 1.00 O HETATM 399 C5' AZW C 3 -1.482 10.657 -8.347 1.00 1.00 C HETATM 400 C1A AZW C 3 -2.251 9.922 -7.273 1.00 1.00 C HETATM 401 C2A AZW C 3 -3.006 8.796 -7.613 1.00 1.00 C HETATM 402 C6A AZW C 3 -2.223 10.369 -5.942 1.00 1.00 C HETATM 403 C3A AZW C 3 -3.736 8.115 -6.631 1.00 1.00 C HETATM 404 C5A AZW C 3 -2.950 9.689 -4.960 1.00 1.00 C HETATM 405 C4A AZW C 3 -3.710 8.561 -5.302 1.00 1.00 C HETATM 406 N5A AZW C 3 -4.466 7.896 -4.312 1.00 1.00 N HETATM 407 C1B AZW C 3 -7.763 6.663 -0.654 1.00 1.00 C HETATM 408 C2B AZW C 3 -8.194 6.668 -1.990 1.00 1.00 C HETATM 409 C6B AZW C 3 -6.536 7.252 -0.316 1.00 1.00 C HETATM 410 C3B AZW C 3 -7.406 7.263 -2.980 1.00 1.00 C HETATM 411 C5B AZW C 3 -5.747 7.850 -1.310 1.00 1.00 C HETATM 412 C4B AZW C 3 -6.182 7.857 -2.642 1.00 1.00 C HETATM 413 N5B AZW C 3 -5.408 8.489 -3.638 1.00 1.00 N HETATM 414 C3' AZW C 3 -8.632 6.049 0.423 1.00 1.00 C HETATM 415 O3' AZW C 3 -9.987 6.471 0.281 1.00 1.00 O ATOM 428 P DG C 4 -11.132 5.437 -0.171 1.00 1.00 P ATOM 429 OP1 DG C 4 -12.079 6.186 -1.031 1.00 1.00 O ATOM 430 OP2 DG C 4 -11.648 4.745 1.035 1.00 1.00 O ATOM 431 O5' DG C 4 -10.379 4.375 -1.084 1.00 1.00 O ATOM 432 C5' DG C 4 -10.970 3.114 -1.393 1.00 1.00 C ATOM 433 C4' DG C 4 -10.747 2.800 -2.854 1.00 1.00 C ATOM 434 O4' DG C 4 -9.537 3.466 -3.293 1.00 1.00 O ATOM 435 C3' DG C 4 -10.542 1.322 -3.187 1.00 1.00 C ATOM 436 O3' DG C 4 -11.002 1.055 -4.521 1.00 1.00 O ATOM 437 C2' DG C 4 -9.035 1.173 -3.083 1.00 1.00 C ATOM 438 C1' DG C 4 -8.555 2.502 -3.646 1.00 1.00 C ATOM 439 N9 DG C 4 -7.256 2.967 -3.164 1.00 1.00 N ATOM 440 C8 DG C 4 -6.237 3.458 -3.942 1.00 1.00 C ATOM 441 N7 DG C 4 -5.180 3.803 -3.260 1.00 1.00 N ATOM 442 C5 DG C 4 -5.517 3.520 -1.946 1.00 1.00 C ATOM 443 C6 DG C 4 -4.758 3.686 -0.759 1.00 1.00 C ATOM 444 O6 DG C 4 -3.600 4.116 -0.645 1.00 1.00 O ATOM 445 N1 DG C 4 -5.461 3.280 0.372 1.00 1.00 N ATOM 446 C2 DG C 4 -6.741 2.774 0.348 1.00 1.00 C ATOM 447 N2 DG C 4 -7.270 2.429 1.533 1.00 1.00 N ATOM 448 N3 DG C 4 -7.459 2.614 -0.753 1.00 1.00 N ATOM 449 C4 DG C 4 -6.794 3.003 -1.862 1.00 1.00 C ATOM 0 H5' DG C 4 -12.037 3.137 -1.173 1.00 1.00 H new ATOM 0 H5'' DG C 4 -10.533 2.333 -0.771 1.00 1.00 H new ATOM 0 H4' DG C 4 -11.659 3.132 -3.350 1.00 1.00 H new ATOM 0 H3' DG C 4 -11.085 0.634 -2.539 1.00 1.00 H new ATOM 0 H2' DG C 4 -8.708 1.022 -2.054 1.00 1.00 H new ATOM 0 H2'' DG C 4 -8.666 0.326 -3.662 1.00 1.00 H new ATOM 0 H1' DG C 4 -8.422 2.363 -4.719 1.00 1.00 H new ATOM 0 H8 DG C 4 -6.304 3.550 -5.016 1.00 1.00 H new ATOM 0 H1 DG C 4 -4.998 3.363 1.277 1.00 1.00 H new ATOM 0 H21 DG C 4 -8.215 2.048 1.578 1.00 1.00 H new ATOM 0 H22 DG C 4 -6.727 2.548 2.388 1.00 1.00 H new ATOM 461 P DG C 5 -10.899 -0.419 -5.153 1.00 1.00 P ATOM 462 OP1 DG C 5 -11.921 -0.534 -6.219 1.00 1.00 O ATOM 463 OP2 DG C 5 -10.912 -1.389 -4.035 1.00 1.00 O ATOM 464 O5' DG C 5 -9.463 -0.451 -5.839 1.00 1.00 O ATOM 465 C5' DG C 5 -9.163 0.403 -6.943 1.00 1.00 C ATOM 466 C4' DG C 5 -7.673 0.462 -7.179 1.00 1.00 C ATOM 467 O4' DG C 5 -7.004 0.879 -5.969 1.00 1.00 O ATOM 468 C3' DG C 5 -7.024 -0.870 -7.560 1.00 1.00 C ATOM 469 O3' DG C 5 -6.656 -0.874 -8.945 1.00 1.00 O ATOM 470 C2' DG C 5 -5.786 -0.973 -6.681 1.00 1.00 C ATOM 471 C1' DG C 5 -5.678 0.402 -6.044 1.00 1.00 C ATOM 472 N9 DG C 5 -5.095 0.414 -4.705 1.00 1.00 N ATOM 473 C8 DG C 5 -5.646 -0.070 -3.543 1.00 1.00 C ATOM 474 N7 DG C 5 -4.869 0.081 -2.503 1.00 1.00 N ATOM 475 C5 DG C 5 -3.738 0.705 -3.010 1.00 1.00 C ATOM 476 C6 DG C 5 -2.548 1.124 -2.360 1.00 1.00 C ATOM 477 O6 DG C 5 -2.246 1.013 -1.160 1.00 1.00 O ATOM 478 N1 DG C 5 -1.650 1.719 -3.245 1.00 1.00 N ATOM 479 C2 DG C 5 -1.884 1.879 -4.593 1.00 1.00 C ATOM 480 N2 DG C 5 -0.920 2.484 -5.299 1.00 1.00 N ATOM 481 N3 DG C 5 -2.986 1.490 -5.211 1.00 1.00 N ATOM 482 C4 DG C 5 -3.864 0.916 -4.365 1.00 1.00 C ATOM 0 H5' DG C 5 -9.546 1.405 -6.749 1.00 1.00 H new ATOM 0 H5'' DG C 5 -9.665 0.038 -7.839 1.00 1.00 H new ATOM 0 H4' DG C 5 -7.562 1.156 -8.012 1.00 1.00 H new ATOM 0 H3' DG C 5 -7.703 -1.710 -7.413 1.00 1.00 H new ATOM 0 H2' DG C 5 -5.893 -1.755 -5.929 1.00 1.00 H new ATOM 0 H2'' DG C 5 -4.899 -1.213 -7.267 1.00 1.00 H new ATOM 0 HO3' DG C 5 -6.241 -1.733 -9.171 1.00 1.00 H new ATOM 0 H1' DG C 5 -5.008 1.014 -6.647 1.00 1.00 H new ATOM 0 H8 DG C 5 -6.622 -0.529 -3.494 1.00 1.00 H new ATOM 0 H1 DG C 5 -0.764 2.057 -2.871 1.00 1.00 H new ATOM 0 H21 DG C 5 -1.037 2.630 -6.302 1.00 1.00 H new ATOM 0 H22 DG C 5 -0.068 2.799 -4.834 1.00 1.00 H new TER 495 DG C 5 ATOM 496 O5' DG D 1 -6.852 -4.252 3.112 1.00 1.00 O ATOM 497 C5' DG D 1 -7.965 -3.693 3.807 1.00 1.00 C ATOM 498 C4' DG D 1 -7.534 -3.123 5.137 1.00 1.00 C ATOM 499 O4' DG D 1 -6.124 -2.809 5.055 1.00 1.00 O ATOM 500 C3' DG D 1 -8.247 -1.834 5.555 1.00 1.00 C ATOM 501 O3' DG D 1 -8.685 -1.936 6.916 1.00 1.00 O ATOM 502 C2' DG D 1 -7.186 -0.757 5.405 1.00 1.00 C ATOM 503 C1' DG D 1 -5.896 -1.523 5.606 1.00 1.00 C ATOM 504 N9 DG D 1 -4.724 -0.938 4.954 1.00 1.00 N ATOM 505 C8 DG D 1 -3.557 -0.562 5.567 1.00 1.00 C ATOM 506 N7 DG D 1 -2.672 -0.070 4.742 1.00 1.00 N ATOM 507 C5 DG D 1 -3.293 -0.123 3.504 1.00 1.00 C ATOM 508 C6 DG D 1 -2.820 0.276 2.226 1.00 1.00 C ATOM 509 O6 DG D 1 -1.714 0.755 1.930 1.00 1.00 O ATOM 510 N1 DG D 1 -3.763 0.058 1.227 1.00 1.00 N ATOM 511 C2 DG D 1 -5.009 -0.487 1.445 1.00 1.00 C ATOM 512 N2 DG D 1 -5.785 -0.639 0.364 1.00 1.00 N ATOM 513 N3 DG D 1 -5.464 -0.863 2.631 1.00 1.00 N ATOM 514 C4 DG D 1 -4.562 -0.655 3.613 1.00 1.00 C ATOM 0 H5' DG D 1 -8.724 -4.459 3.963 1.00 1.00 H new ATOM 0 H5'' DG D 1 -8.422 -2.910 3.202 1.00 1.00 H new ATOM 0 H4' DG D 1 -7.783 -3.883 5.878 1.00 1.00 H new ATOM 0 H3' DG D 1 -9.134 -1.623 4.958 1.00 1.00 H new ATOM 0 H2' DG D 1 -7.226 -0.284 4.424 1.00 1.00 H new ATOM 0 H2'' DG D 1 -7.306 0.034 6.145 1.00 1.00 H new ATOM 0 HO5' DG D 1 -6.019 -3.931 3.516 1.00 1.00 H new ATOM 0 H1' DG D 1 -5.663 -1.522 6.671 1.00 1.00 H new ATOM 0 H8 DG D 1 -3.386 -0.663 6.629 1.00 1.00 H new ATOM 0 H1 DG D 1 -3.516 0.318 0.272 1.00 1.00 H new ATOM 0 H21 DG D 1 -6.719 -1.037 0.459 1.00 1.00 H new ATOM 0 H22 DG D 1 -5.442 -0.357 -0.554 1.00 1.00 H new ATOM 527 P DG D 2 -9.670 -0.826 7.531 1.00 1.00 P ATOM 528 OP1 DG D 2 -10.454 -1.463 8.615 1.00 1.00 O ATOM 529 OP2 DG D 2 -10.388 -0.165 6.415 1.00 1.00 O ATOM 530 O5' DG D 2 -8.687 0.230 8.200 1.00 1.00 O ATOM 531 C5' DG D 2 -7.735 -0.186 9.177 1.00 1.00 C ATOM 532 C4' DG D 2 -6.712 0.902 9.411 1.00 1.00 C ATOM 533 O4' DG D 2 -5.893 1.055 8.221 1.00 1.00 O ATOM 534 C3' DG D 2 -7.301 2.288 9.692 1.00 1.00 C ATOM 535 O3' DG D 2 -6.535 2.954 10.701 1.00 1.00 O ATOM 536 C2' DG D 2 -7.146 2.994 8.357 1.00 1.00 C ATOM 537 C1' DG D 2 -5.812 2.436 7.910 1.00 1.00 C ATOM 538 N9 DG D 2 -5.512 2.599 6.490 1.00 1.00 N ATOM 539 C8 DG D 2 -6.368 2.430 5.429 1.00 1.00 C ATOM 540 N7 DG D 2 -5.823 2.708 4.276 1.00 1.00 N ATOM 541 C5 DG D 2 -4.526 3.083 4.595 1.00 1.00 C ATOM 542 C6 DG D 2 -3.460 3.497 3.756 1.00 1.00 C ATOM 543 O6 DG D 2 -3.451 3.594 2.520 1.00 1.00 O ATOM 544 N1 DG D 2 -2.308 3.793 4.481 1.00 1.00 N ATOM 545 C2 DG D 2 -2.207 3.693 5.851 1.00 1.00 C ATOM 546 N2 DG D 2 -1.025 4.022 6.392 1.00 1.00 N ATOM 547 N3 DG D 2 -3.193 3.306 6.646 1.00 1.00 N ATOM 548 C4 DG D 2 -4.318 3.020 5.955 1.00 1.00 C ATOM 0 H5' DG D 2 -7.237 -1.097 8.844 1.00 1.00 H new ATOM 0 H5'' DG D 2 -8.243 -0.423 10.112 1.00 1.00 H new ATOM 0 H4' DG D 2 -6.158 0.578 10.292 1.00 1.00 H new ATOM 0 H3' DG D 2 -8.329 2.262 10.052 1.00 1.00 H new ATOM 0 H2' DG D 2 -7.951 2.752 7.663 1.00 1.00 H new ATOM 0 H2'' DG D 2 -7.129 4.079 8.460 1.00 1.00 H new ATOM 0 H1' DG D 2 -5.009 2.977 8.411 1.00 1.00 H new ATOM 0 H8 DG D 2 -7.391 2.100 5.538 1.00 1.00 H new ATOM 0 H1 DG D 2 -1.486 4.104 3.964 1.00 1.00 H new ATOM 0 H21 DG D 2 -0.893 3.967 7.402 1.00 1.00 H new ATOM 0 H22 DG D 2 -0.258 4.327 5.794 1.00 1.00 H new HETATM 560 P AZW D 3 -7.202 4.090 11.621 1.00 1.00 P HETATM 561 OP1 AZW D 3 -7.151 3.611 13.021 1.00 1.00 O HETATM 562 OP2 AZW D 3 -8.504 4.487 11.029 1.00 1.00 O HETATM 563 O5' AZW D 3 -6.205 5.326 11.493 1.00 1.00 O HETATM 564 C5' AZW D 3 -4.822 5.194 11.819 1.00 1.00 C HETATM 565 C1A AZW D 3 -3.989 5.951 10.807 1.00 1.00 C HETATM 566 C2A AZW D 3 -3.021 6.873 11.234 1.00 1.00 C HETATM 567 C6A AZW D 3 -4.180 5.725 9.437 1.00 1.00 C HETATM 568 C3A AZW D 3 -2.248 7.564 10.291 1.00 1.00 C HETATM 569 C5A AZW D 3 -3.408 6.413 8.497 1.00 1.00 C HETATM 570 C4A AZW D 3 -2.441 7.334 8.921 1.00 1.00 C HETATM 571 N5A AZW D 3 -1.663 8.031 7.971 1.00 1.00 N HETATM 572 C1B AZW D 3 1.143 9.561 4.070 1.00 1.00 C HETATM 573 C2B AZW D 3 1.715 9.167 5.288 1.00 1.00 C HETATM 574 C6B AZW D 3 -0.197 9.257 3.797 1.00 1.00 C HETATM 575 C3B AZW D 3 0.947 8.472 6.230 1.00 1.00 C HETATM 576 C5B AZW D 3 -0.964 8.564 4.741 1.00 1.00 C HETATM 577 C4B AZW D 3 -0.394 8.170 5.956 1.00 1.00 C HETATM 578 N5B AZW D 3 -1.169 7.471 6.906 1.00 1.00 N HETATM 579 C3' AZW D 3 1.968 10.310 3.048 1.00 1.00 C HETATM 580 O3' AZW D 3 2.761 11.312 3.677 1.00 1.00 O ATOM 593 P DG D 4 4.363 11.207 3.635 1.00 1.00 P ATOM 594 OP1 DG D 4 4.909 11.993 4.765 1.00 1.00 O ATOM 595 OP2 DG D 4 4.790 11.534 2.253 1.00 1.00 O ATOM 596 O5' DG D 4 4.658 9.668 3.905 1.00 1.00 O ATOM 597 C5' DG D 4 5.987 9.153 3.870 1.00 1.00 C ATOM 598 C4' DG D 4 6.196 8.196 5.021 1.00 1.00 C ATOM 599 O4' DG D 4 4.903 7.712 5.467 1.00 1.00 O ATOM 600 C3' DG D 4 7.023 6.950 4.691 1.00 1.00 C ATOM 601 O3' DG D 4 7.844 6.583 5.808 1.00 1.00 O ATOM 602 C2' DG D 4 5.963 5.895 4.433 1.00 1.00 C ATOM 603 C1' DG D 4 4.875 6.294 5.415 1.00 1.00 C ATOM 604 N9 DG D 4 3.525 5.866 5.058 1.00 1.00 N ATOM 605 C8 DG D 4 2.630 5.225 5.879 1.00 1.00 C ATOM 606 N7 DG D 4 1.511 4.912 5.284 1.00 1.00 N ATOM 607 C5 DG D 4 1.675 5.376 3.987 1.00 1.00 C ATOM 608 C6 DG D 4 0.793 5.319 2.877 1.00 1.00 C ATOM 609 O6 DG D 4 -0.340 4.822 2.824 1.00 1.00 O ATOM 610 N1 DG D 4 1.344 5.904 1.741 1.00 1.00 N ATOM 611 C2 DG D 4 2.595 6.476 1.692 1.00 1.00 C ATOM 612 N2 DG D 4 2.974 6.995 0.516 1.00 1.00 N ATOM 613 N3 DG D 4 3.424 6.535 2.718 1.00 1.00 N ATOM 614 C4 DG D 4 2.908 5.970 3.830 1.00 1.00 C ATOM 0 H5' DG D 4 6.705 9.971 3.930 1.00 1.00 H new ATOM 0 H5'' DG D 4 6.164 8.642 2.924 1.00 1.00 H new ATOM 0 H4' DG D 4 6.743 8.770 5.769 1.00 1.00 H new ATOM 0 H3' DG D 4 7.702 7.090 3.850 1.00 1.00 H new ATOM 0 H2' DG D 4 5.610 5.915 3.402 1.00 1.00 H new ATOM 0 H2'' DG D 4 6.335 4.888 4.623 1.00 1.00 H new ATOM 0 H1' DG D 4 5.084 5.801 6.364 1.00 1.00 H new ATOM 0 H8 DG D 4 2.832 5.002 6.916 1.00 1.00 H new ATOM 0 H1 DG D 4 0.784 5.909 0.888 1.00 1.00 H new ATOM 0 H21 DG D 4 3.891 7.431 0.423 1.00 1.00 H new ATOM 0 H22 DG D 4 2.345 6.954 -0.286 1.00 1.00 H new ATOM 626 P DG D 5 8.837 5.325 5.702 1.00 1.00 P ATOM 627 OP1 DG D 5 9.957 5.576 6.638 1.00 1.00 O ATOM 628 OP2 DG D 5 9.127 5.075 4.270 1.00 1.00 O ATOM 629 O5' DG D 5 7.983 4.108 6.268 1.00 1.00 O ATOM 630 C5' DG D 5 7.601 4.066 7.642 1.00 1.00 C ATOM 631 C4' DG D 5 6.485 3.066 7.842 1.00 1.00 C ATOM 632 O4' DG D 5 5.464 3.282 6.846 1.00 1.00 O ATOM 633 C3' DG D 5 6.896 1.602 7.673 1.00 1.00 C ATOM 634 O3' DG D 5 7.072 0.974 8.947 1.00 1.00 O ATOM 635 C2' DG D 5 5.749 0.955 6.908 1.00 1.00 C ATOM 636 C1' DG D 5 4.742 2.077 6.703 1.00 1.00 C ATOM 637 N9 DG D 5 4.105 2.081 5.389 1.00 1.00 N ATOM 638 C8 DG D 5 4.675 2.430 4.189 1.00 1.00 C ATOM 639 N7 DG D 5 3.852 2.332 3.180 1.00 1.00 N ATOM 640 C5 DG D 5 2.665 1.890 3.750 1.00 1.00 C ATOM 641 C6 DG D 5 1.410 1.599 3.151 1.00 1.00 C ATOM 642 O6 DG D 5 1.096 1.665 1.952 1.00 1.00 O ATOM 643 N1 DG D 5 0.471 1.179 4.088 1.00 1.00 N ATOM 644 C2 DG D 5 0.721 1.055 5.436 1.00 1.00 C ATOM 645 N2 DG D 5 -0.302 0.646 6.197 1.00 1.00 N ATOM 646 N3 DG D 5 1.884 1.320 6.007 1.00 1.00 N ATOM 647 C4 DG D 5 2.805 1.730 5.111 1.00 1.00 C ATOM 0 H5' DG D 5 7.276 5.054 7.967 1.00 1.00 H new ATOM 0 H5'' DG D 5 8.458 3.793 8.257 1.00 1.00 H new ATOM 0 H4' DG D 5 6.156 3.226 8.869 1.00 1.00 H new ATOM 0 H3' DG D 5 7.845 1.503 7.147 1.00 1.00 H new ATOM 0 H2' DG D 5 6.088 0.548 5.955 1.00 1.00 H new ATOM 0 H2'' DG D 5 5.313 0.129 7.471 1.00 1.00 H new ATOM 0 HO3' DG D 5 7.333 0.038 8.817 1.00 1.00 H new ATOM 0 H1' DG D 5 3.938 1.947 7.427 1.00 1.00 H new ATOM 0 H8 DG D 5 5.701 2.753 4.090 1.00 1.00 H new ATOM 0 H1 DG D 5 -0.465 0.948 3.754 1.00 1.00 H new ATOM 0 H21 DG D 5 -0.177 0.536 7.203 1.00 1.00 H new ATOM 0 H22 DG D 5 -1.206 0.445 5.770 1.00 1.00 H new TER 660 DG D 5 HETATM 661 K K A 101 1.262 -4.122 -0.531 1.00 1.00 K HETATM 662 K K A 102 0.096 -0.283 0.082 1.00 1.00 K HETATM 663 K K C 101 -1.455 3.382 0.811 1.00 1.00 K