USER MOD reduce.3.24.130724 H: found=0, std=0, add=238, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 238 hydrogens (148 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 10 DG O3' : rot 180:sc= 0 USER MOD Single : B 20 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- HETATM 1 N1 5CM A 1 -11.448 0.443 -14.236 1.00 0.00 N HETATM 2 C2 5CM A 1 -10.128 0.440 -14.692 1.00 0.00 C HETATM 3 N3 5CM A 1 -9.458 1.611 -14.792 1.00 0.00 N HETATM 4 C4 5CM A 1 -10.059 2.754 -14.455 1.00 0.00 C HETATM 5 C5 5CM A 1 -11.407 2.787 -13.984 1.00 0.00 C HETATM 6 C5A 5CM A 1 -12.016 3.973 -13.831 1.00 0.00 C HETATM 7 C6 5CM A 1 -12.057 1.618 -13.892 1.00 0.00 C HETATM 8 O2 5CM A 1 -9.599 -0.640 -14.992 1.00 0.00 O HETATM 9 N4 5CM A 1 -9.359 3.884 -14.573 1.00 0.00 N HETATM 10 C1' 5CM A 1 -12.166 -0.839 -14.137 1.00 0.00 C HETATM 11 C2' 5CM A 1 -12.981 -1.027 -12.873 1.00 0.00 C HETATM 12 C3' 5CM A 1 -14.047 -2.005 -13.331 1.00 0.00 C HETATM 13 C4' 5CM A 1 -14.287 -1.607 -14.788 1.00 0.00 C HETATM 14 O4' 5CM A 1 -13.092 -0.904 -15.209 1.00 0.00 O HETATM 15 O3' 5CM A 1 -13.561 -3.352 -13.256 1.00 0.00 O HETATM 16 C5' 5CM A 1 -15.483 -0.711 -15.017 1.00 0.00 C HETATM 17 O5' 5CM A 1 -16.630 -1.476 -15.400 1.00 0.00 O HETATM 0 HN42 5CM A 1 -9.786 4.777 -14.325 1.00 0.00 H new HETATM 0 HN41 5CM A 1 -8.397 3.855 -14.912 1.00 0.00 H new HETATM 0 H5A3 5CM A 1 -11.462 4.577 -13.112 1.00 0.00 H new HETATM 0 H5A2 5CM A 1 -12.050 4.491 -14.790 1.00 0.00 H new HETATM 0 H5A1 5CM A 1 -13.031 3.816 -13.467 1.00 0.00 H new HETATM 0 H5'' 5CM A 1 -15.702 -0.151 -14.108 1.00 0.00 H new HETATM 0 H2'' 5CM A 1 -12.381 -1.429 -12.056 1.00 0.00 H new HETATM 0 H6 5CM A 1 -13.088 1.604 -13.537 1.00 0.00 H new HETATM 0 H5' 5CM A 1 -15.252 0.019 -15.793 1.00 0.00 H new HETATM 0 H4' 5CM A 1 -14.498 -2.514 -15.354 1.00 0.00 H new HETATM 0 H3' 5CM A 1 -14.949 -1.970 -12.720 1.00 0.00 H new HETATM 0 H2' 5CM A 1 -13.411 -0.089 -12.521 1.00 0.00 H new HETATM 0 H1' 5CM A 1 -11.394 -1.608 -14.149 1.00 0.00 H new ATOM 31 P DG A 2 -13.667 -4.166 -11.872 1.00 0.00 P ATOM 32 OP1 DG A 2 -14.647 -5.263 -12.077 1.00 0.00 O ATOM 33 OP2 DG A 2 -13.873 -3.195 -10.766 1.00 0.00 O ATOM 34 O5' DG A 2 -12.224 -4.817 -11.694 1.00 0.00 O ATOM 35 C5' DG A 2 -11.688 -5.705 -12.678 1.00 0.00 C ATOM 36 C4' DG A 2 -10.307 -6.164 -12.273 1.00 0.00 C ATOM 37 O4' DG A 2 -9.376 -5.071 -12.454 1.00 0.00 O ATOM 38 C3' DG A 2 -10.162 -6.581 -10.812 1.00 0.00 C ATOM 39 O3' DG A 2 -9.141 -7.577 -10.670 1.00 0.00 O ATOM 40 C2' DG A 2 -9.753 -5.293 -10.123 1.00 0.00 C ATOM 41 C1' DG A 2 -8.972 -4.543 -11.197 1.00 0.00 C ATOM 42 N9 DG A 2 -9.219 -3.104 -11.221 1.00 0.00 N ATOM 43 C8 DG A 2 -10.416 -2.470 -11.000 1.00 0.00 C ATOM 44 N7 DG A 2 -10.337 -1.171 -11.094 1.00 0.00 N ATOM 45 C5 DG A 2 -9.003 -0.931 -11.394 1.00 0.00 C ATOM 46 C6 DG A 2 -8.317 0.292 -11.612 1.00 0.00 C ATOM 47 O6 DG A 2 -8.765 1.441 -11.584 1.00 0.00 O ATOM 48 N1 DG A 2 -6.969 0.081 -11.888 1.00 0.00 N ATOM 49 C2 DG A 2 -6.361 -1.148 -11.943 1.00 0.00 C ATOM 50 N2 DG A 2 -5.052 -1.146 -12.223 1.00 0.00 N ATOM 51 N3 DG A 2 -6.987 -2.296 -11.740 1.00 0.00 N ATOM 52 C4 DG A 2 -8.298 -2.113 -11.473 1.00 0.00 C ATOM 0 H5' DG A 2 -11.643 -5.203 -13.645 1.00 0.00 H new ATOM 0 H5'' DG A 2 -12.345 -6.567 -12.796 1.00 0.00 H new ATOM 0 H4' DG A 2 -10.112 -7.035 -12.898 1.00 0.00 H new ATOM 0 H3' DG A 2 -11.070 -7.019 -10.398 1.00 0.00 H new ATOM 0 H2' DG A 2 -10.621 -4.725 -9.788 1.00 0.00 H new ATOM 0 H2'' DG A 2 -9.140 -5.487 -9.243 1.00 0.00 H new ATOM 0 H1' DG A 2 -7.912 -4.677 -10.982 1.00 0.00 H new ATOM 0 H8 DG A 2 -11.332 -2.994 -10.771 1.00 0.00 H new ATOM 0 H1 DG A 2 -6.389 0.902 -12.063 1.00 0.00 H new ATOM 0 H21 DG A 2 -4.541 -2.027 -12.278 1.00 0.00 H new ATOM 0 H22 DG A 2 -4.566 -0.263 -12.381 1.00 0.00 H new HETATM 64 N1 5CM A 3 -6.184 -4.599 -7.986 1.00 0.00 N HETATM 65 C2 5CM A 3 -5.805 -3.267 -8.186 1.00 0.00 C HETATM 66 N3 5CM A 3 -6.712 -2.283 -7.986 1.00 0.00 N HETATM 67 C4 5CM A 3 -7.952 -2.588 -7.599 1.00 0.00 C HETATM 68 C5 5CM A 3 -8.365 -3.937 -7.382 1.00 0.00 C HETATM 69 C5A 5CM A 3 -9.569 -4.175 -6.838 1.00 0.00 C HETATM 70 C6 5CM A 3 -7.457 -4.901 -7.586 1.00 0.00 C HETATM 71 O2 5CM A 3 -4.644 -3.020 -8.543 1.00 0.00 O HETATM 72 N4 5CM A 3 -8.813 -1.585 -7.416 1.00 0.00 N HETATM 73 C1' 5CM A 3 -5.195 -5.665 -8.215 1.00 0.00 C HETATM 74 C2' 5CM A 3 -5.172 -6.751 -7.156 1.00 0.00 C HETATM 75 C3' 5CM A 3 -4.683 -7.961 -7.933 1.00 0.00 C HETATM 76 C4' 5CM A 3 -5.208 -7.722 -9.351 1.00 0.00 C HETATM 77 O4' 5CM A 3 -5.528 -6.312 -9.430 1.00 0.00 O HETATM 78 O3' 5CM A 3 -3.251 -8.012 -7.937 1.00 0.00 O HETATM 79 C5' 5CM A 3 -6.433 -8.524 -9.726 1.00 0.00 C HETATM 80 O5' 5CM A 3 -7.516 -8.214 -8.847 1.00 0.00 O HETATM 81 P 5CM A 3 -9.029 -8.420 -9.304 1.00 0.00 P HETATM 82 OP1 5CM A 3 -9.219 -9.852 -9.652 1.00 0.00 O HETATM 83 OP2 5CM A 3 -9.907 -7.791 -8.283 1.00 0.00 O HETATM 0 HN42 5CM A 3 -9.769 -1.781 -7.120 1.00 0.00 H new HETATM 0 HN41 5CM A 3 -8.515 -0.622 -7.572 1.00 0.00 H new HETATM 0 H5A3 5CM A 3 -9.620 -3.715 -5.851 1.00 0.00 H new HETATM 0 H5A2 5CM A 3 -10.346 -3.754 -7.476 1.00 0.00 H new HETATM 0 H5A1 5CM A 3 -9.720 -5.250 -6.745 1.00 0.00 H new HETATM 0 H5'' 5CM A 3 -6.717 -8.307 -10.756 1.00 0.00 H new HETATM 0 H2'' 5CM A 3 -4.503 -6.500 -6.333 1.00 0.00 H new HETATM 0 H6 5CM A 3 -7.737 -5.943 -7.431 1.00 0.00 H new HETATM 0 H5' 5CM A 3 -6.208 -9.589 -9.676 1.00 0.00 H new HETATM 0 H4' 5CM A 3 -4.436 -8.044 -10.050 1.00 0.00 H new HETATM 0 H3' 5CM A 3 -5.026 -8.903 -7.504 1.00 0.00 H new HETATM 0 H2' 5CM A 3 -6.159 -6.918 -6.725 1.00 0.00 H new HETATM 0 H1' 5CM A 3 -4.221 -5.175 -8.210 1.00 0.00 H new ATOM 97 P DG A 4 -2.467 -8.603 -6.663 1.00 0.00 P ATOM 98 OP1 DG A 4 -1.860 -9.892 -7.082 1.00 0.00 O ATOM 99 OP2 DG A 4 -3.371 -8.566 -5.485 1.00 0.00 O ATOM 100 O5' DG A 4 -1.289 -7.559 -6.419 1.00 0.00 O ATOM 101 C5' DG A 4 -0.780 -6.759 -7.487 1.00 0.00 C ATOM 102 C4' DG A 4 -0.275 -5.437 -6.956 1.00 0.00 C ATOM 103 O4' DG A 4 -1.415 -4.599 -6.648 1.00 0.00 O ATOM 104 C3' DG A 4 0.553 -5.536 -5.670 1.00 0.00 C ATOM 105 O3' DG A 4 1.775 -4.799 -5.811 1.00 0.00 O ATOM 106 C2' DG A 4 -0.329 -4.904 -4.605 1.00 0.00 C ATOM 107 C1' DG A 4 -1.213 -3.967 -5.401 1.00 0.00 C ATOM 108 N9 DG A 4 -2.522 -3.711 -4.808 1.00 0.00 N ATOM 109 C8 DG A 4 -3.436 -4.648 -4.388 1.00 0.00 C ATOM 110 N7 DG A 4 -4.520 -4.123 -3.890 1.00 0.00 N ATOM 111 C5 DG A 4 -4.315 -2.753 -3.989 1.00 0.00 C ATOM 112 C6 DG A 4 -5.148 -1.668 -3.611 1.00 0.00 C ATOM 113 O6 DG A 4 -6.268 -1.701 -3.088 1.00 0.00 O ATOM 114 N1 DG A 4 -4.555 -0.443 -3.894 1.00 0.00 N ATOM 115 C2 DG A 4 -3.316 -0.282 -4.464 1.00 0.00 C ATOM 116 N2 DG A 4 -2.917 0.980 -4.657 1.00 0.00 N ATOM 117 N3 DG A 4 -2.527 -1.283 -4.818 1.00 0.00 N ATOM 118 C4 DG A 4 -3.087 -2.482 -4.554 1.00 0.00 C ATOM 0 H5' DG A 4 -1.562 -6.587 -8.227 1.00 0.00 H new ATOM 0 H5'' DG A 4 0.027 -7.288 -7.994 1.00 0.00 H new ATOM 0 H4' DG A 4 0.372 -5.036 -7.736 1.00 0.00 H new ATOM 0 H3' DG A 4 0.830 -6.562 -5.426 1.00 0.00 H new ATOM 0 H2' DG A 4 -0.914 -5.652 -4.070 1.00 0.00 H new ATOM 0 H2'' DG A 4 0.260 -4.368 -3.861 1.00 0.00 H new ATOM 0 H1' DG A 4 -0.717 -2.998 -5.454 1.00 0.00 H new ATOM 0 H8 DG A 4 -3.272 -5.713 -4.463 1.00 0.00 H new ATOM 0 H1 DG A 4 -5.080 0.400 -3.661 1.00 0.00 H new ATOM 0 H21 DG A 4 -2.007 1.169 -5.076 1.00 0.00 H new ATOM 0 H22 DG A 4 -3.523 1.754 -4.385 1.00 0.00 H new HETATM 130 P 0DC A 5 3.117 -5.329 -5.099 1.00 0.00 P HETATM 131 OP1 0DC A 5 4.099 -5.669 -6.160 1.00 0.00 O HETATM 132 OP2 0DC A 5 2.728 -6.361 -4.104 1.00 0.00 O HETATM 133 O5' 0DC A 5 3.660 -4.056 -4.308 1.00 0.00 O HETATM 134 C5' 0DC A 5 3.193 -3.752 -2.992 1.00 0.00 C HETATM 135 C4' 0DC A 5 3.009 -2.260 -2.832 1.00 0.00 C HETATM 136 O4' 0DC A 5 2.019 -2.022 -1.801 1.00 0.00 O HETATM 137 C3' 0DC A 5 2.500 -1.537 -4.078 1.00 0.00 C HETATM 138 O3' 0DC A 5 3.074 -0.228 -4.166 1.00 0.00 O HETATM 139 C2' 0DC A 5 1.002 -1.446 -3.848 1.00 0.00 C HETATM 140 C1' 0DC A 5 0.895 -1.339 -2.337 1.00 0.00 C HETATM 141 N1 0DC A 5 -0.319 -1.953 -1.777 1.00 0.00 N HETATM 142 C2 0DC A 5 -1.401 -1.133 -1.437 1.00 0.00 C HETATM 143 O2 0DC A 5 -1.306 0.090 -1.612 1.00 0.00 O HETATM 144 N3 0DC A 5 -2.522 -1.694 -0.930 1.00 0.00 N HETATM 145 C4 0DC A 5 -2.585 -3.017 -0.757 1.00 0.00 C HETATM 146 N4 0DC A 5 -3.708 -3.526 -0.256 1.00 0.00 N HETATM 147 C5 0DC A 5 -1.500 -3.874 -1.091 1.00 0.00 C HETATM 148 C6 0DC A 5 -0.396 -3.306 -1.591 1.00 0.00 C HETATM 0 H5'' 0DC A 5 2.249 -4.264 -2.807 1.00 0.00 H new HETATM 0 H2'' 0DC A 5 0.569 -0.578 -4.346 1.00 0.00 H new HETATM 0 H6 0DC A 5 0.456 -3.932 -1.854 1.00 0.00 H new HETATM 0 H5' 0DC A 5 3.905 -4.119 -2.252 1.00 0.00 H new HETATM 0 H5 0DC A 5 -1.565 -4.952 -0.945 1.00 0.00 H new HETATM 0 H42 0DC A 5 -3.791 -4.532 -0.110 1.00 0.00 H new HETATM 0 H41 0DC A 5 -4.485 -2.910 -0.018 1.00 0.00 H new HETATM 0 H4' 0DC A 5 4.001 -1.873 -2.599 1.00 0.00 H new HETATM 0 H3' 0DC A 5 2.759 -2.049 -5.005 1.00 0.00 H new HETATM 0 H2' 0DC A 5 0.481 -2.325 -4.228 1.00 0.00 H new HETATM 0 H1' 0DC A 5 0.855 -0.281 -2.078 1.00 0.00 H new HETATM 160 P 0DG A 6 3.904 0.197 -5.478 1.00 0.00 P HETATM 161 OP1 0DG A 6 3.666 1.643 -5.722 1.00 0.00 O HETATM 162 OP2 0DG A 6 3.611 -0.785 -6.554 1.00 0.00 O HETATM 163 O5' 0DG A 6 5.426 0.014 -5.043 1.00 0.00 O HETATM 164 C5' 0DG A 6 5.914 0.572 -3.822 1.00 0.00 C HETATM 165 C4' 0DG A 6 7.324 0.097 -3.558 1.00 0.00 C HETATM 166 O4' 0DG A 6 7.279 -1.274 -3.094 1.00 0.00 O HETATM 167 C3' 0DG A 6 8.075 0.867 -2.471 1.00 0.00 C HETATM 168 O3' 0DG A 6 9.481 0.869 -2.757 1.00 0.00 O HETATM 169 C2' 0DG A 6 7.759 0.067 -1.222 1.00 0.00 C HETATM 170 C1' 0DG A 6 7.764 -1.353 -1.761 1.00 0.00 C HETATM 171 N9 0DG A 6 6.913 -2.288 -1.030 1.00 0.00 N HETATM 172 C8 0DG A 6 7.164 -3.618 -0.796 1.00 0.00 C HETATM 173 N7 0DG A 6 6.220 -4.207 -0.115 1.00 0.00 N HETATM 174 C5 0DG A 6 5.287 -3.205 0.116 1.00 0.00 C HETATM 175 C6 0DG A 6 4.048 -3.243 0.803 1.00 0.00 C HETATM 176 O6 0DG A 6 3.510 -4.202 1.366 1.00 0.00 O HETATM 177 N1 0DG A 6 3.421 -2.003 0.800 1.00 0.00 N HETATM 178 C2 0DG A 6 3.923 -0.869 0.214 1.00 0.00 C HETATM 179 N2 0DG A 6 3.174 0.234 0.323 1.00 0.00 N HETATM 180 N3 0DG A 6 5.076 -0.817 -0.431 1.00 0.00 N HETATM 181 C4 0DG A 6 5.701 -2.013 -0.442 1.00 0.00 C HETATM 0 H5'' 0DG A 6 5.894 1.660 -3.877 1.00 0.00 H new HETATM 0 H2'' 0DG A 6 8.507 0.212 -0.442 1.00 0.00 H new HETATM 0 H8 0DG A 6 8.061 -4.130 -1.144 1.00 0.00 H new HETATM 0 H5' 0DG A 6 5.264 0.282 -2.996 1.00 0.00 H new HETATM 0 H4' 0DG A 6 7.846 0.239 -4.504 1.00 0.00 H new HETATM 0 H3' 0DG A 6 7.789 1.915 -2.383 1.00 0.00 H new HETATM 0 H22 0DG A 6 3.493 1.110 -0.092 1.00 0.00 H new HETATM 0 H21 0DG A 6 2.284 0.199 0.821 1.00 0.00 H new HETATM 0 H2' 0DG A 6 6.794 0.340 -0.794 1.00 0.00 H new HETATM 0 H1' 0DG A 6 8.780 -1.737 -1.670 1.00 0.00 H new HETATM 0 H1 0DG A 6 2.518 -1.930 1.269 1.00 0.00 H new HETATM 193 N1 5CM A 7 7.633 1.085 2.716 1.00 0.00 N HETATM 194 C2 5CM A 7 6.421 0.695 3.296 1.00 0.00 C HETATM 195 N3 5CM A 7 6.100 -0.618 3.343 1.00 0.00 N HETATM 196 C4 5CM A 7 6.938 -1.527 2.838 1.00 0.00 C HETATM 197 C5 5CM A 7 8.179 -1.158 2.239 1.00 0.00 C HETATM 198 C5A 5CM A 7 9.037 -2.119 1.861 1.00 0.00 C HETATM 199 C6 5CM A 7 8.483 0.147 2.200 1.00 0.00 C HETATM 200 O2 5CM A 7 5.668 1.566 3.754 1.00 0.00 O HETATM 201 N4 5CM A 7 6.577 -2.809 2.908 1.00 0.00 N HETATM 202 C1' 5CM A 7 7.973 2.516 2.673 1.00 0.00 C HETATM 203 C2' 5CM A 7 9.255 2.887 3.404 1.00 0.00 C HETATM 204 C3' 5CM A 7 9.750 4.079 2.608 1.00 0.00 C HETATM 205 C4' 5CM A 7 9.322 3.741 1.180 1.00 0.00 C HETATM 206 O4' 5CM A 7 8.167 2.878 1.314 1.00 0.00 O HETATM 207 O3' 5CM A 7 9.109 5.283 3.050 1.00 0.00 O HETATM 208 C5' 5CM A 7 10.373 3.035 0.355 1.00 0.00 C HETATM 209 O5' 5CM A 7 9.781 2.449 -0.805 1.00 0.00 O HETATM 210 P 5CM A 7 10.535 1.307 -1.622 1.00 0.00 P HETATM 211 OP1 5CM A 7 11.709 1.919 -2.292 1.00 0.00 O HETATM 212 OP2 5CM A 7 10.729 0.139 -0.724 1.00 0.00 O HETATM 0 HN42 5CM A 7 7.190 -3.533 2.533 1.00 0.00 H new HETATM 0 HN41 5CM A 7 5.688 -3.066 3.336 1.00 0.00 H new HETATM 0 H5A3 5CM A 7 9.322 -2.714 2.729 1.00 0.00 H new HETATM 0 H5A2 5CM A 7 8.560 -2.762 1.121 1.00 0.00 H new HETATM 0 H5A1 5CM A 7 9.926 -1.662 1.426 1.00 0.00 H new HETATM 0 H5'' 5CM A 7 11.148 3.742 0.059 1.00 0.00 H new HETATM 0 H2'' 5CM A 7 9.068 3.144 4.447 1.00 0.00 H new HETATM 0 H6 5CM A 7 9.423 0.465 1.750 1.00 0.00 H new HETATM 0 H5' 5CM A 7 10.857 2.264 0.954 1.00 0.00 H new HETATM 0 H4' 5CM A 7 9.125 4.672 0.648 1.00 0.00 H new HETATM 0 H3' 5CM A 7 10.822 4.249 2.711 1.00 0.00 H new HETATM 0 H2' 5CM A 7 9.976 2.069 3.401 1.00 0.00 H new HETATM 0 H1' 5CM A 7 7.151 3.036 3.165 1.00 0.00 H new ATOM 226 P DG A 8 9.914 6.327 3.974 1.00 0.00 P ATOM 227 OP1 DG A 8 10.063 7.596 3.217 1.00 0.00 O ATOM 228 OP2 DG A 8 11.123 5.638 4.496 1.00 0.00 O ATOM 229 O5' DG A 8 8.934 6.591 5.202 1.00 0.00 O ATOM 230 C5' DG A 8 7.558 6.914 4.990 1.00 0.00 C ATOM 231 C4' DG A 8 6.801 6.867 6.296 1.00 0.00 C ATOM 232 O4' DG A 8 6.317 5.518 6.505 1.00 0.00 O ATOM 233 C3' DG A 8 7.628 7.213 7.535 1.00 0.00 C ATOM 234 O3' DG A 8 6.828 7.921 8.491 1.00 0.00 O ATOM 235 C2' DG A 8 8.035 5.857 8.079 1.00 0.00 C ATOM 236 C1' DG A 8 6.857 4.974 7.700 1.00 0.00 C ATOM 237 N9 DG A 8 7.206 3.581 7.439 1.00 0.00 N ATOM 238 C8 DG A 8 8.342 3.116 6.824 1.00 0.00 C ATOM 239 N7 DG A 8 8.379 1.817 6.723 1.00 0.00 N ATOM 240 C5 DG A 8 7.192 1.395 7.310 1.00 0.00 C ATOM 241 C6 DG A 8 6.674 0.089 7.497 1.00 0.00 C ATOM 242 O6 DG A 8 7.176 -0.993 7.171 1.00 0.00 O ATOM 243 N1 DG A 8 5.440 0.114 8.138 1.00 0.00 N ATOM 244 C2 DG A 8 4.789 1.250 8.546 1.00 0.00 C ATOM 245 N2 DG A 8 3.607 1.067 9.147 1.00 0.00 N ATOM 246 N3 DG A 8 5.260 2.475 8.379 1.00 0.00 N ATOM 247 C4 DG A 8 6.458 2.473 7.758 1.00 0.00 C ATOM 0 H5' DG A 8 7.118 6.212 4.281 1.00 0.00 H new ATOM 0 H5'' DG A 8 7.474 7.907 4.549 1.00 0.00 H new ATOM 0 H4' DG A 8 6.015 7.616 6.196 1.00 0.00 H new ATOM 0 H3' DG A 8 8.480 7.856 7.314 1.00 0.00 H new ATOM 0 H2' DG A 8 8.965 5.505 7.632 1.00 0.00 H new ATOM 0 H2'' DG A 8 8.190 5.884 9.158 1.00 0.00 H new ATOM 0 H1' DG A 8 6.165 4.963 8.542 1.00 0.00 H new ATOM 0 H8 DG A 8 9.127 3.762 6.460 1.00 0.00 H new ATOM 0 H1 DG A 8 4.985 -0.781 8.318 1.00 0.00 H new ATOM 0 H21 DG A 8 3.072 1.871 9.475 1.00 0.00 H new ATOM 0 H22 DG A 8 3.242 0.124 9.277 1.00 0.00 H new HETATM 259 N1 5CM A 9 7.333 4.378 11.958 1.00 0.00 N HETATM 260 C2 5CM A 9 7.157 2.990 11.975 1.00 0.00 C HETATM 261 N3 5CM A 9 8.114 2.195 11.443 1.00 0.00 N HETATM 262 C4 5CM A 9 9.212 2.738 10.910 1.00 0.00 C HETATM 263 C5 5CM A 9 9.419 4.148 10.883 1.00 0.00 C HETATM 264 C5A 5CM A 9 10.466 4.642 10.205 1.00 0.00 C HETATM 265 C6 5CM A 9 8.463 4.923 11.413 1.00 0.00 C HETATM 266 O2 5CM A 9 6.126 2.522 12.479 1.00 0.00 O HETATM 267 N4 5CM A 9 10.126 1.915 10.395 1.00 0.00 N HETATM 268 C1' 5CM A 9 6.283 5.239 12.528 1.00 0.00 C HETATM 269 C2' 5CM A 9 6.774 6.303 13.488 1.00 0.00 C HETATM 270 C3' 5CM A 9 5.704 7.376 13.376 1.00 0.00 C HETATM 271 C4' 5CM A 9 5.111 7.173 11.977 1.00 0.00 C HETATM 272 O4' 5CM A 9 5.678 5.944 11.467 1.00 0.00 O HETATM 273 O3' 5CM A 9 4.694 7.185 14.374 1.00 0.00 O HETATM 274 C5' 5CM A 9 5.406 8.280 10.992 1.00 0.00 C HETATM 275 O5' 5CM A 9 6.813 8.530 10.941 1.00 0.00 O HETATM 276 P 5CM A 9 7.536 8.886 9.566 1.00 0.00 P HETATM 277 OP1 5CM A 9 7.181 10.283 9.207 1.00 0.00 O HETATM 278 OP2 5CM A 9 8.965 8.500 9.685 1.00 0.00 O HETATM 0 HN42 5CM A 9 10.977 2.294 9.980 1.00 0.00 H new HETATM 0 HN41 5CM A 9 9.974 0.907 10.416 1.00 0.00 H new HETATM 0 H5A3 5CM A 9 11.390 4.240 10.620 1.00 0.00 H new HETATM 0 H5A2 5CM A 9 10.386 4.359 9.155 1.00 0.00 H new HETATM 0 H5A1 5CM A 9 10.474 5.729 10.288 1.00 0.00 H new HETATM 0 H5'' 5CM A 9 5.042 8.004 10.003 1.00 0.00 H new HETATM 0 H2'' 5CM A 9 6.860 5.922 14.505 1.00 0.00 H new HETATM 0 H6 5CM A 9 8.588 6.006 11.410 1.00 0.00 H new HETATM 0 H5' 5CM A 9 4.878 9.188 11.284 1.00 0.00 H new HETATM 0 H4' 5CM A 9 4.026 7.156 12.079 1.00 0.00 H new HETATM 0 H3' 5CM A 9 6.104 8.379 13.523 1.00 0.00 H new HETATM 0 H2' 5CM A 9 7.757 6.681 13.205 1.00 0.00 H new HETATM 0 H1' 5CM A 9 5.622 4.568 13.077 1.00 0.00 H new ATOM 292 P DG A 10 4.898 7.798 15.847 1.00 0.00 P ATOM 293 OP1 DG A 10 3.939 8.920 16.022 1.00 0.00 O ATOM 294 OP2 DG A 10 6.351 8.039 16.041 1.00 0.00 O ATOM 295 O5' DG A 10 4.466 6.613 16.821 1.00 0.00 O ATOM 296 C5' DG A 10 3.190 5.983 16.695 1.00 0.00 C ATOM 297 C4' DG A 10 3.210 4.624 17.354 1.00 0.00 C ATOM 298 O4' DG A 10 4.100 3.757 16.609 1.00 0.00 O ATOM 299 C3' DG A 10 3.719 4.608 18.796 1.00 0.00 C ATOM 300 O3' DG A 10 2.999 3.649 19.576 1.00 0.00 O ATOM 301 C2' DG A 10 5.172 4.194 18.655 1.00 0.00 C ATOM 302 C1' DG A 10 5.139 3.277 17.447 1.00 0.00 C ATOM 303 N9 DG A 10 6.372 3.260 16.665 1.00 0.00 N ATOM 304 C8 DG A 10 7.136 4.342 16.301 1.00 0.00 C ATOM 305 N7 DG A 10 8.187 4.018 15.598 1.00 0.00 N ATOM 306 C5 DG A 10 8.112 2.635 15.491 1.00 0.00 C ATOM 307 C6 DG A 10 8.977 1.716 14.842 1.00 0.00 C ATOM 308 O6 DG A 10 10.012 1.947 14.208 1.00 0.00 O ATOM 309 N1 DG A 10 8.530 0.407 14.982 1.00 0.00 N ATOM 310 C2 DG A 10 7.396 0.030 15.657 1.00 0.00 C ATOM 311 N2 DG A 10 7.134 -1.281 15.680 1.00 0.00 N ATOM 312 N3 DG A 10 6.581 0.874 16.265 1.00 0.00 N ATOM 313 C4 DG A 10 6.998 2.152 16.143 1.00 0.00 C ATOM 0 H5' DG A 10 2.930 5.880 15.642 1.00 0.00 H new ATOM 0 H5'' DG A 10 2.422 6.606 17.154 1.00 0.00 H new ATOM 0 H4' DG A 10 2.169 4.300 17.362 1.00 0.00 H new ATOM 0 H3' DG A 10 3.594 5.566 19.300 1.00 0.00 H new ATOM 0 H2' DG A 10 5.824 5.052 18.495 1.00 0.00 H new ATOM 0 H2'' DG A 10 5.535 3.680 19.545 1.00 0.00 H new ATOM 0 HO3' DG A 10 3.340 3.652 20.495 1.00 0.00 H new ATOM 0 H1' DG A 10 4.993 2.259 17.808 1.00 0.00 H new ATOM 0 H8 DG A 10 6.892 5.359 16.570 1.00 0.00 H new ATOM 0 H1 DG A 10 9.088 -0.330 14.550 1.00 0.00 H new ATOM 0 H21 DG A 10 6.306 -1.627 16.165 1.00 0.00 H new ATOM 0 H22 DG A 10 7.762 -1.935 15.212 1.00 0.00 H new TER 326 DG A 10 HETATM 327 N1 5CM B 11 10.911 -3.908 13.664 1.00 0.00 N HETATM 328 C2 5CM B 11 10.009 -2.924 14.088 1.00 0.00 C HETATM 329 N3 5CM B 11 10.323 -1.619 13.912 1.00 0.00 N HETATM 330 C4 5CM B 11 11.478 -1.283 13.336 1.00 0.00 C HETATM 331 C5 5CM B 11 12.413 -2.266 12.891 1.00 0.00 C HETATM 332 C5A 5CM B 11 13.518 -1.872 12.238 1.00 0.00 C HETATM 333 C6 5CM B 11 12.093 -3.552 13.075 1.00 0.00 C HETATM 334 O2 5CM B 11 8.943 -3.273 14.616 1.00 0.00 O HETATM 335 N4 5CM B 11 11.744 0.014 13.181 1.00 0.00 N HETATM 336 C1' 5CM B 11 10.566 -5.325 13.863 1.00 0.00 C HETATM 337 C2' 5CM B 11 10.816 -6.209 12.646 1.00 0.00 C HETATM 338 C3' 5CM B 11 11.381 -7.489 13.236 1.00 0.00 C HETATM 339 C4' 5CM B 11 12.090 -7.010 14.500 1.00 0.00 C HETATM 340 O4' 5CM B 11 11.379 -5.824 14.919 1.00 0.00 O HETATM 341 O3' 5CM B 11 10.329 -8.402 13.568 1.00 0.00 O HETATM 342 C5' 5CM B 11 13.552 -6.669 14.325 1.00 0.00 C HETATM 343 O5' 5CM B 11 14.388 -7.686 14.887 1.00 0.00 O HETATM 0 HN42 5CM B 11 12.618 0.307 12.744 1.00 0.00 H new HETATM 0 HN41 5CM B 11 11.073 0.714 13.499 1.00 0.00 H new HETATM 0 H5A3 5CM B 11 13.234 -1.339 11.331 1.00 0.00 H new HETATM 0 H5A2 5CM B 11 14.103 -1.212 12.878 1.00 0.00 H new HETATM 0 H5A1 5CM B 11 14.115 -2.745 11.974 1.00 0.00 H new HETATM 0 H5'' 5CM B 11 13.777 -6.553 13.265 1.00 0.00 H new HETATM 0 H2'' 5CM B 11 9.896 -6.396 12.092 1.00 0.00 H new HETATM 0 H6 5CM B 11 12.785 -4.329 12.750 1.00 0.00 H new HETATM 0 H5' 5CM B 11 13.766 -5.713 14.803 1.00 0.00 H new HETATM 0 H4' 5CM B 11 12.078 -7.823 15.226 1.00 0.00 H new HETATM 0 H3' 5CM B 11 12.039 -8.021 12.548 1.00 0.00 H new HETATM 0 H2' 5CM B 11 11.517 -5.745 11.952 1.00 0.00 H new HETATM 0 H1' 5CM B 11 9.497 -5.361 14.074 1.00 0.00 H new ATOM 357 P DG B 12 9.588 -9.226 12.402 1.00 0.00 P ATOM 358 OP1 DG B 12 9.402 -10.615 12.892 1.00 0.00 O ATOM 359 OP2 DG B 12 10.307 -8.991 11.123 1.00 0.00 O ATOM 360 O5' DG B 12 8.155 -8.538 12.296 1.00 0.00 O ATOM 361 C5' DG B 12 7.317 -8.405 13.444 1.00 0.00 C ATOM 362 C4' DG B 12 6.193 -7.435 13.165 1.00 0.00 C ATOM 363 O4' DG B 12 6.751 -6.104 13.037 1.00 0.00 O ATOM 364 C3' DG B 12 5.410 -7.704 11.875 1.00 0.00 C ATOM 365 O3' DG B 12 4.006 -7.706 12.149 1.00 0.00 O ATOM 366 C2' DG B 12 5.776 -6.547 10.959 1.00 0.00 C ATOM 367 C1' DG B 12 6.190 -5.449 11.918 1.00 0.00 C ATOM 368 N9 DG B 12 7.193 -4.528 11.392 1.00 0.00 N ATOM 369 C8 DG B 12 8.335 -4.857 10.703 1.00 0.00 C ATOM 370 N7 DG B 12 9.050 -3.821 10.365 1.00 0.00 N ATOM 371 C5 DG B 12 8.336 -2.737 10.860 1.00 0.00 C ATOM 372 C6 DG B 12 8.616 -1.348 10.799 1.00 0.00 C ATOM 373 O6 DG B 12 9.582 -0.780 10.280 1.00 0.00 O ATOM 374 N1 DG B 12 7.628 -0.597 11.428 1.00 0.00 N ATOM 375 C2 DG B 12 6.512 -1.118 12.036 1.00 0.00 C ATOM 376 N2 DG B 12 5.673 -0.232 12.585 1.00 0.00 N ATOM 377 N3 DG B 12 6.237 -2.410 12.098 1.00 0.00 N ATOM 378 C4 DG B 12 7.186 -3.157 11.495 1.00 0.00 C ATOM 0 H5' DG B 12 7.905 -8.056 14.293 1.00 0.00 H new ATOM 0 H5'' DG B 12 6.907 -9.377 13.718 1.00 0.00 H new ATOM 0 H4' DG B 12 5.501 -7.548 13.999 1.00 0.00 H new ATOM 0 H3' DG B 12 5.648 -8.670 11.430 1.00 0.00 H new ATOM 0 H2' DG B 12 6.587 -6.814 10.281 1.00 0.00 H new ATOM 0 H2'' DG B 12 4.931 -6.242 10.341 1.00 0.00 H new ATOM 0 H1' DG B 12 5.310 -4.844 12.136 1.00 0.00 H new ATOM 0 H8 DG B 12 8.613 -5.873 10.465 1.00 0.00 H new ATOM 0 H1 DG B 12 7.741 0.417 11.438 1.00 0.00 H new ATOM 0 H21 DG B 12 4.825 -0.554 13.052 1.00 0.00 H new ATOM 0 H22 DG B 12 5.881 0.765 12.536 1.00 0.00 H new HETATM 390 N1 5CM B 13 2.544 -3.747 9.429 1.00 0.00 N HETATM 391 C2 5CM B 13 3.058 -2.491 9.087 1.00 0.00 C HETATM 392 N3 5CM B 13 4.187 -2.420 8.343 1.00 0.00 N HETATM 393 C4 5CM B 13 4.791 -3.539 7.938 1.00 0.00 C HETATM 394 C5 5CM B 13 4.289 -4.832 8.270 1.00 0.00 C HETATM 395 C5A 5CM B 13 4.789 -5.904 7.636 1.00 0.00 C HETATM 396 C6 5CM B 13 3.177 -4.887 9.016 1.00 0.00 C HETATM 397 O2 5CM B 13 2.466 -1.471 9.472 1.00 0.00 O HETATM 398 N4 5CM B 13 5.895 -3.418 7.200 1.00 0.00 N HETATM 399 C1' 5CM B 13 1.316 -3.820 10.239 1.00 0.00 C HETATM 400 C2' 5CM B 13 0.257 -4.766 9.699 1.00 0.00 C HETATM 401 C3' 5CM B 13 -0.427 -5.274 10.955 1.00 0.00 C HETATM 402 C4' 5CM B 13 0.681 -5.243 12.009 1.00 0.00 C HETATM 403 O4' 5CM B 13 1.672 -4.305 11.523 1.00 0.00 O HETATM 404 O3' 5CM B 13 -1.497 -4.405 11.341 1.00 0.00 O HETATM 405 C5' 5CM B 13 1.351 -6.572 12.269 1.00 0.00 C HETATM 406 O5' 5CM B 13 1.815 -7.142 11.043 1.00 0.00 O HETATM 407 P 5CM B 13 2.972 -8.237 11.037 1.00 0.00 P HETATM 408 OP1 5CM B 13 2.397 -9.519 11.515 1.00 0.00 O HETATM 409 OP2 5CM B 13 3.648 -8.184 9.716 1.00 0.00 O HETATM 0 HN42 5CM B 13 6.383 -4.251 6.873 1.00 0.00 H new HETATM 0 HN41 5CM B 13 6.251 -2.492 6.963 1.00 0.00 H new HETATM 0 H5A3 5CM B 13 4.612 -5.808 6.565 1.00 0.00 H new HETATM 0 H5A2 5CM B 13 5.861 -5.970 7.823 1.00 0.00 H new HETATM 0 H5A1 5CM B 13 4.300 -6.806 8.005 1.00 0.00 H new HETATM 0 H5'' 5CM B 13 2.187 -6.437 12.955 1.00 0.00 H new HETATM 0 H2'' 5CM B 13 -0.442 -4.253 9.039 1.00 0.00 H new HETATM 0 H6 5CM B 13 2.770 -5.858 9.299 1.00 0.00 H new HETATM 0 H5' 5CM B 13 0.649 -7.252 12.752 1.00 0.00 H new HETATM 0 H4' 5CM B 13 0.231 -4.961 12.961 1.00 0.00 H new HETATM 0 H3' 5CM B 13 -0.866 -6.262 10.820 1.00 0.00 H new HETATM 0 H2' 5CM B 13 0.699 -5.580 9.124 1.00 0.00 H new HETATM 0 H1' 5CM B 13 0.891 -2.816 10.239 1.00 0.00 H new ATOM 423 P DG B 14 -2.912 -4.491 10.582 1.00 0.00 P ATOM 424 OP1 DG B 14 -3.982 -4.171 11.561 1.00 0.00 O ATOM 425 OP2 DG B 14 -2.957 -5.780 9.844 1.00 0.00 O ATOM 426 O5' DG B 14 -2.845 -3.315 9.511 1.00 0.00 O ATOM 427 C5' DG B 14 -2.427 -2.002 9.885 1.00 0.00 C ATOM 428 C4' DG B 14 -2.257 -1.140 8.656 1.00 0.00 C ATOM 429 O4' DG B 14 -0.922 -1.341 8.134 1.00 0.00 O ATOM 430 C3' DG B 14 -3.222 -1.458 7.509 1.00 0.00 C ATOM 431 O3' DG B 14 -3.869 -0.262 7.057 1.00 0.00 O ATOM 432 C2' DG B 14 -2.332 -2.026 6.414 1.00 0.00 C ATOM 433 C1' DG B 14 -0.983 -1.415 6.726 1.00 0.00 C ATOM 434 N9 DG B 14 0.167 -2.186 6.263 1.00 0.00 N ATOM 435 C8 DG B 14 0.371 -3.537 6.393 1.00 0.00 C ATOM 436 N7 DG B 14 1.498 -3.940 5.876 1.00 0.00 N ATOM 437 C5 DG B 14 2.078 -2.783 5.373 1.00 0.00 C ATOM 438 C6 DG B 14 3.313 -2.589 4.698 1.00 0.00 C ATOM 439 O6 DG B 14 4.167 -3.430 4.396 1.00 0.00 O ATOM 440 N1 DG B 14 3.508 -1.252 4.367 1.00 0.00 N ATOM 441 C2 DG B 14 2.629 -0.235 4.644 1.00 0.00 C ATOM 442 N2 DG B 14 2.992 0.986 4.239 1.00 0.00 N ATOM 443 N3 DG B 14 1.478 -0.402 5.272 1.00 0.00 N ATOM 444 C4 DG B 14 1.268 -1.691 5.605 1.00 0.00 C ATOM 0 H5' DG B 14 -1.487 -2.054 10.435 1.00 0.00 H new ATOM 0 H5'' DG B 14 -3.163 -1.555 10.553 1.00 0.00 H new ATOM 0 H4' DG B 14 -2.457 -0.120 8.985 1.00 0.00 H new ATOM 0 H3' DG B 14 -4.011 -2.149 7.805 1.00 0.00 H new ATOM 0 H2' DG B 14 -2.299 -3.115 6.444 1.00 0.00 H new ATOM 0 H2'' DG B 14 -2.683 -1.745 5.421 1.00 0.00 H new ATOM 0 H1' DG B 14 -0.917 -0.457 6.209 1.00 0.00 H new ATOM 0 H8 DG B 14 -0.332 -4.200 6.875 1.00 0.00 H new ATOM 0 H1 DG B 14 4.371 -1.009 3.881 1.00 0.00 H new ATOM 0 H21 DG B 14 2.382 1.784 4.415 1.00 0.00 H new ATOM 0 H22 DG B 14 3.879 1.120 3.754 1.00 0.00 H new HETATM 456 P 0DC B 15 -5.384 -0.326 6.519 1.00 0.00 P HETATM 457 OP1 0DC B 15 -6.257 0.351 7.512 1.00 0.00 O HETATM 458 OP2 0DC B 15 -5.668 -1.730 6.129 1.00 0.00 O HETATM 459 O5' 0DC B 15 -5.358 0.561 5.194 1.00 0.00 O HETATM 460 C5' 0DC B 15 -4.952 0.003 3.942 1.00 0.00 C HETATM 461 C4' 0DC B 15 -4.122 1.001 3.168 1.00 0.00 C HETATM 462 O4' 0DC B 15 -3.243 0.280 2.271 1.00 0.00 O HETATM 463 C3' 0DC B 15 -3.212 1.887 4.019 1.00 0.00 C HETATM 464 O3' 0DC B 15 -3.091 3.188 3.431 1.00 0.00 O HETATM 465 C2' 0DC B 15 -1.883 1.158 3.985 1.00 0.00 C HETATM 466 C1' 0DC B 15 -1.883 0.517 2.606 1.00 0.00 C HETATM 467 N1 0DC B 15 -1.169 -0.769 2.533 1.00 0.00 N HETATM 468 C2 0DC B 15 0.130 -0.796 2.014 1.00 0.00 C HETATM 469 O2 0DC B 15 0.646 0.264 1.628 1.00 0.00 O HETATM 470 N3 0DC B 15 0.790 -1.974 1.946 1.00 0.00 N HETATM 471 C4 0DC B 15 0.202 -3.093 2.374 1.00 0.00 C HETATM 472 N4 0DC B 15 0.889 -4.231 2.292 1.00 0.00 N HETATM 473 C5 0DC B 15 -1.120 -3.095 2.908 1.00 0.00 C HETATM 474 C6 0DC B 15 -1.762 -1.923 2.967 1.00 0.00 C HETATM 0 H5'' 0DC B 15 -4.375 -0.906 4.111 1.00 0.00 H new HETATM 0 H2'' 0DC B 15 -1.044 1.842 4.113 1.00 0.00 H new HETATM 0 H6 0DC B 15 -2.775 -1.887 3.368 1.00 0.00 H new HETATM 0 H5' 0DC B 15 -5.829 -0.280 3.360 1.00 0.00 H new HETATM 0 H5 0DC B 15 -1.589 -4.016 3.255 1.00 0.00 H new HETATM 0 H42 0DC B 15 0.469 -5.104 2.610 1.00 0.00 H new HETATM 0 H41 0DC B 15 1.835 -4.229 1.911 1.00 0.00 H new HETATM 0 H4' 0DC B 15 -4.847 1.644 2.669 1.00 0.00 H new HETATM 0 H3' 0DC B 15 -3.586 2.043 5.031 1.00 0.00 H new HETATM 0 H2' 0DC B 15 -1.811 0.413 4.777 1.00 0.00 H new HETATM 0 H1' 0DC B 15 -1.366 1.194 1.926 1.00 0.00 H new HETATM 486 P 0DG B 16 -3.309 4.502 4.335 1.00 0.00 P HETATM 487 OP1 0DG B 16 -2.275 5.497 3.955 1.00 0.00 O HETATM 488 OP2 0DG B 16 -3.429 4.077 5.755 1.00 0.00 O HETATM 489 O5' 0DG B 16 -4.728 5.059 3.867 1.00 0.00 O HETATM 490 C5' 0DG B 16 -5.053 5.170 2.479 1.00 0.00 C HETATM 491 C4' 0DG B 16 -6.543 5.348 2.306 1.00 0.00 C HETATM 492 O4' 0DG B 16 -7.192 4.064 2.477 1.00 0.00 O HETATM 493 C3' 0DG B 16 -6.980 5.848 0.928 1.00 0.00 C HETATM 494 O3' 0DG B 16 -8.159 6.657 1.051 1.00 0.00 O HETATM 495 C2' 0DG B 16 -7.269 4.560 0.179 1.00 0.00 C HETATM 496 C1' 0DG B 16 -7.844 3.681 1.275 1.00 0.00 C HETATM 497 N9 0DG B 16 -7.632 2.249 1.088 1.00 0.00 N HETATM 498 C8 0DG B 16 -8.518 1.242 1.380 1.00 0.00 C HETATM 499 N7 0DG B 16 -8.051 0.052 1.116 1.00 0.00 N HETATM 500 C5 0DG B 16 -6.777 0.288 0.617 1.00 0.00 C HETATM 501 C6 0DG B 16 -5.789 -0.619 0.162 1.00 0.00 C HETATM 502 O6 0DG B 16 -5.845 -1.851 0.104 1.00 0.00 O HETATM 503 N1 0DG B 16 -4.640 0.042 -0.256 1.00 0.00 N HETATM 504 C2 0DG B 16 -4.467 1.403 -0.246 1.00 0.00 C HETATM 505 N2 0DG B 16 -3.290 1.851 -0.698 1.00 0.00 N HETATM 506 N3 0DG B 16 -5.380 2.262 0.175 1.00 0.00 N HETATM 507 C4 0DG B 16 -6.504 1.639 0.591 1.00 0.00 C HETATM 0 H5'' 0DG B 16 -4.525 6.017 2.041 1.00 0.00 H new HETATM 0 H2'' 0DG B 16 -7.977 4.712 -0.636 1.00 0.00 H new HETATM 0 H8 0DG B 16 -9.512 1.418 1.791 1.00 0.00 H new HETATM 0 H5' 0DG B 16 -4.722 4.278 1.948 1.00 0.00 H new HETATM 0 H4' 0DG B 16 -6.823 6.098 3.046 1.00 0.00 H new HETATM 0 H3' 0DG B 16 -6.240 6.471 0.426 1.00 0.00 H new HETATM 0 H22 0DG B 16 -3.099 2.853 -0.717 1.00 0.00 H new HETATM 0 H21 0DG B 16 -2.584 1.191 -1.024 1.00 0.00 H new HETATM 0 H2' 0DG B 16 -6.367 4.131 -0.258 1.00 0.00 H new HETATM 0 H1' 0DG B 16 -8.924 3.826 1.279 1.00 0.00 H new HETATM 0 H1 0DG B 16 -3.866 -0.529 -0.596 1.00 0.00 H new HETATM 519 N1 5CM B 17 -6.637 4.100 -3.722 1.00 0.00 N HETATM 520 C2 5CM B 17 -5.802 2.982 -3.844 1.00 0.00 C HETATM 521 N3 5CM B 17 -6.210 1.792 -3.349 1.00 0.00 N HETATM 522 C4 5CM B 17 -7.399 1.692 -2.750 1.00 0.00 C HETATM 523 C5 5CM B 17 -8.271 2.812 -2.614 1.00 0.00 C HETATM 524 C5A 5CM B 17 -9.500 2.628 -2.104 1.00 0.00 C HETATM 525 C6 5CM B 17 -7.854 3.986 -3.109 1.00 0.00 C HETATM 526 O2 5CM B 17 -4.704 3.111 -4.407 1.00 0.00 O HETATM 527 N4 5CM B 17 -7.757 0.498 -2.275 1.00 0.00 N HETATM 528 C1' 5CM B 17 -6.180 5.393 -4.258 1.00 0.00 C HETATM 529 C2' 5CM B 17 -7.110 6.019 -5.289 1.00 0.00 C HETATM 530 C3' 5CM B 17 -6.965 7.506 -5.017 1.00 0.00 C HETATM 531 C4' 5CM B 17 -6.749 7.555 -3.507 1.00 0.00 C HETATM 532 O4' 5CM B 17 -6.097 6.307 -3.171 1.00 0.00 O HETATM 533 O3' 5CM B 17 -5.824 8.045 -5.694 1.00 0.00 O HETATM 534 C5' 5CM B 17 -8.012 7.691 -2.689 1.00 0.00 C HETATM 535 O5' 5CM B 17 -7.732 7.462 -1.307 1.00 0.00 O HETATM 536 P 5CM B 17 -8.909 7.192 -0.267 1.00 0.00 P HETATM 537 OP1 5CM B 17 -9.542 8.494 0.060 1.00 0.00 O HETATM 538 OP2 5CM B 17 -9.746 6.081 -0.789 1.00 0.00 O HETATM 0 HN42 5CM B 17 -8.658 0.383 -1.811 1.00 0.00 H new HETATM 0 HN41 5CM B 17 -7.130 -0.300 -2.376 1.00 0.00 H new HETATM 0 H5A3 5CM B 17 -10.053 1.929 -2.731 1.00 0.00 H new HETATM 0 H5A2 5CM B 17 -9.418 2.224 -1.095 1.00 0.00 H new HETATM 0 H5A1 5CM B 17 -10.027 3.582 -2.072 1.00 0.00 H new HETATM 0 H5'' 5CM B 17 -8.434 8.687 -2.822 1.00 0.00 H new HETATM 0 H2'' 5CM B 17 -6.815 5.764 -6.307 1.00 0.00 H new HETATM 0 H6 5CM B 17 -8.495 4.863 -3.021 1.00 0.00 H new HETATM 0 H5' 5CM B 17 -8.759 6.979 -3.039 1.00 0.00 H new HETATM 0 H4' 5CM B 17 -6.166 8.445 -3.268 1.00 0.00 H new HETATM 0 H3' 5CM B 17 -7.822 8.086 -5.360 1.00 0.00 H new HETATM 0 H2' 5CM B 17 -8.139 5.683 -5.162 1.00 0.00 H new HETATM 0 H1' 5CM B 17 -5.229 5.200 -4.755 1.00 0.00 H new ATOM 552 P DG B 18 -5.960 8.566 -7.210 1.00 0.00 P ATOM 553 OP1 DG B 18 -5.850 10.046 -7.181 1.00 0.00 O ATOM 554 OP2 DG B 18 -7.152 7.930 -7.828 1.00 0.00 O ATOM 555 O5' DG B 18 -4.659 7.990 -7.925 1.00 0.00 O ATOM 556 C5' DG B 18 -3.520 7.587 -7.160 1.00 0.00 C ATOM 557 C4' DG B 18 -2.600 6.728 -7.999 1.00 0.00 C ATOM 558 O4' DG B 18 -3.008 5.346 -7.875 1.00 0.00 O ATOM 559 C3' DG B 18 -2.612 7.033 -9.495 1.00 0.00 C ATOM 560 O3' DG B 18 -1.313 6.803 -10.051 1.00 0.00 O ATOM 561 C2' DG B 18 -3.628 6.049 -10.046 1.00 0.00 C ATOM 562 C1' DG B 18 -3.517 4.857 -9.107 1.00 0.00 C ATOM 563 N9 DG B 18 -4.783 4.187 -8.825 1.00 0.00 N ATOM 564 C8 DG B 18 -5.991 4.781 -8.551 1.00 0.00 C ATOM 565 N7 DG B 18 -6.946 3.924 -8.321 1.00 0.00 N ATOM 566 C5 DG B 18 -6.334 2.684 -8.454 1.00 0.00 C ATOM 567 C6 DG B 18 -6.866 1.377 -8.316 1.00 0.00 C ATOM 568 O6 DG B 18 -8.023 1.042 -8.041 1.00 0.00 O ATOM 569 N1 DG B 18 -5.896 0.404 -8.533 1.00 0.00 N ATOM 570 C2 DG B 18 -4.586 0.657 -8.848 1.00 0.00 C ATOM 571 N2 DG B 18 -3.805 -0.415 -9.025 1.00 0.00 N ATOM 572 N3 DG B 18 -4.076 1.869 -8.982 1.00 0.00 N ATOM 573 C4 DG B 18 -5.000 2.829 -8.770 1.00 0.00 C ATOM 0 H5' DG B 18 -3.843 7.032 -6.279 1.00 0.00 H new ATOM 0 H5'' DG B 18 -2.983 8.466 -6.804 1.00 0.00 H new ATOM 0 H4' DG B 18 -1.599 6.937 -7.621 1.00 0.00 H new ATOM 0 H3' DG B 18 -2.864 8.067 -9.729 1.00 0.00 H new ATOM 0 H2' DG B 18 -4.634 6.468 -10.044 1.00 0.00 H new ATOM 0 H2'' DG B 18 -3.400 5.771 -11.075 1.00 0.00 H new ATOM 0 H1' DG B 18 -2.877 4.121 -9.595 1.00 0.00 H new ATOM 0 H8 DG B 18 -6.135 5.851 -8.528 1.00 0.00 H new ATOM 0 H1 DG B 18 -6.181 -0.572 -8.452 1.00 0.00 H new ATOM 0 H21 DG B 18 -2.820 -0.295 -9.261 1.00 0.00 H new ATOM 0 H22 DG B 18 -4.195 -1.352 -8.924 1.00 0.00 H new HETATM 585 N1 5CM B 19 -3.309 3.355 -13.093 1.00 0.00 N HETATM 586 C2 5CM B 19 -4.080 2.208 -12.877 1.00 0.00 C HETATM 587 N3 5CM B 19 -5.409 2.335 -12.654 1.00 0.00 N HETATM 588 C4 5CM B 19 -5.970 3.546 -12.646 1.00 0.00 C HETATM 589 C5 5CM B 19 -5.208 4.732 -12.866 1.00 0.00 C HETATM 590 C5A 5CM B 19 -5.846 5.907 -12.981 1.00 0.00 C HETATM 591 C6 5CM B 19 -3.893 4.591 -13.082 1.00 0.00 C HETATM 592 O2 5CM B 19 -3.527 1.098 -12.896 1.00 0.00 O HETATM 593 N4 5CM B 19 -7.283 3.621 -12.425 1.00 0.00 N HETATM 594 C1' 5CM B 19 -1.860 3.208 -13.325 1.00 0.00 C HETATM 595 C2' 5CM B 19 -1.277 4.095 -14.404 1.00 0.00 C HETATM 596 C3' 5CM B 19 0.174 4.236 -13.975 1.00 0.00 C HETATM 597 C4' 5CM B 19 0.139 4.033 -12.458 1.00 0.00 C HETATM 598 O4' 5CM B 19 -1.196 3.576 -12.137 1.00 0.00 O HETATM 599 O3' 5CM B 19 0.983 3.227 -14.590 1.00 0.00 O HETATM 600 C5' 5CM B 19 0.425 5.277 -11.649 1.00 0.00 C HETATM 601 O5' 5CM B 19 -0.175 6.414 -12.271 1.00 0.00 O HETATM 602 P 5CM B 19 -0.879 7.552 -11.406 1.00 0.00 P HETATM 603 OP1 5CM B 19 0.138 8.580 -11.069 1.00 0.00 O HETATM 604 OP2 5CM B 19 -2.122 7.954 -12.116 1.00 0.00 O HETATM 0 HN42 5CM B 19 -7.747 4.529 -12.412 1.00 0.00 H new HETATM 0 HN41 5CM B 19 -7.823 2.770 -12.269 1.00 0.00 H new HETATM 0 H5A3 5CM B 19 -6.534 5.866 -13.825 1.00 0.00 H new HETATM 0 H5A2 5CM B 19 -6.404 6.109 -12.067 1.00 0.00 H new HETATM 0 H5A1 5CM B 19 -5.118 6.702 -13.144 1.00 0.00 H new HETATM 0 H5'' 5CM B 19 0.038 5.159 -10.637 1.00 0.00 H new HETATM 0 H2'' 5CM B 19 -1.365 3.642 -15.391 1.00 0.00 H new HETATM 0 H6 5CM B 19 -3.279 5.476 -13.252 1.00 0.00 H new HETATM 0 H5' 5CM B 19 1.501 5.425 -11.563 1.00 0.00 H new HETATM 0 H4' 5CM B 19 0.926 3.324 -12.199 1.00 0.00 H new HETATM 0 H3' 5CM B 19 0.600 5.197 -14.263 1.00 0.00 H new HETATM 0 H2' 5CM B 19 -1.781 5.060 -14.450 1.00 0.00 H new HETATM 0 H1' 5CM B 19 -1.722 2.173 -13.639 1.00 0.00 H new ATOM 618 P DG B 20 1.541 3.447 -16.083 1.00 0.00 P ATOM 619 OP1 DG B 20 3.014 3.258 -16.043 1.00 0.00 O ATOM 620 OP2 DG B 20 0.979 4.713 -16.620 1.00 0.00 O ATOM 621 O5' DG B 20 0.910 2.240 -16.909 1.00 0.00 O ATOM 622 C5' DG B 20 1.062 0.888 -16.469 1.00 0.00 C ATOM 623 C4' DG B 20 0.063 -0.004 -17.168 1.00 0.00 C ATOM 624 O4' DG B 20 -1.260 0.281 -16.648 1.00 0.00 O ATOM 625 C3' DG B 20 -0.031 0.192 -18.682 1.00 0.00 C ATOM 626 O3' DG B 20 -0.258 -1.056 -19.341 1.00 0.00 O ATOM 627 C2' DG B 20 -1.234 1.104 -18.843 1.00 0.00 C ATOM 628 C1' DG B 20 -2.128 0.647 -17.708 1.00 0.00 C ATOM 629 N9 DG B 20 -3.049 1.662 -17.204 1.00 0.00 N ATOM 630 C8 DG B 20 -2.812 3.009 -17.076 1.00 0.00 C ATOM 631 N7 DG B 20 -3.831 3.668 -16.598 1.00 0.00 N ATOM 632 C5 DG B 20 -4.801 2.696 -16.394 1.00 0.00 C ATOM 633 C6 DG B 20 -6.124 2.806 -15.889 1.00 0.00 C ATOM 634 O6 DG B 20 -6.723 3.819 -15.510 1.00 0.00 O ATOM 635 N1 DG B 20 -6.759 1.569 -15.849 1.00 0.00 N ATOM 636 C2 DG B 20 -6.197 0.382 -16.246 1.00 0.00 C ATOM 637 N2 DG B 20 -6.968 -0.703 -16.135 1.00 0.00 N ATOM 638 N3 DG B 20 -4.968 0.265 -16.715 1.00 0.00 N ATOM 639 C4 DG B 20 -4.332 1.453 -16.763 1.00 0.00 C ATOM 0 H5' DG B 20 0.919 0.831 -15.390 1.00 0.00 H new ATOM 0 H5'' DG B 20 2.075 0.543 -16.675 1.00 0.00 H new ATOM 0 H4' DG B 20 0.410 -1.020 -16.981 1.00 0.00 H new ATOM 0 H3' DG B 20 0.881 0.603 -19.115 1.00 0.00 H new ATOM 0 H2' DG B 20 -0.964 2.156 -18.752 1.00 0.00 H new ATOM 0 H2'' DG B 20 -1.713 0.981 -19.815 1.00 0.00 H new ATOM 0 HO3' DG B 20 -0.317 -0.909 -20.308 1.00 0.00 H new ATOM 0 H1' DG B 20 -2.754 -0.162 -18.084 1.00 0.00 H new ATOM 0 H8 DG B 20 -1.876 3.476 -17.344 1.00 0.00 H new ATOM 0 H1 DG B 20 -7.716 1.542 -15.497 1.00 0.00 H new ATOM 0 H21 DG B 20 -6.607 -1.616 -16.414 1.00 0.00 H new ATOM 0 H22 DG B 20 -7.917 -0.619 -15.771 1.00 0.00 H new TER 652 DG B 20