USER MOD reduce.3.24.130724 H: found=0, std=0, add=257, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 257 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 DG O5' : rot 180:sc= 0 USER MOD Single : A 15 DT C7 :methyl 150:sc= -0.221 (180deg=-0.221) USER MOD Single : A 16 DT C7 :methyl -30:sc= -0.233 (180deg=-1.12) USER MOD Single : A 23 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -3.800 2.368 6.358 1.00 0.09 O ATOM 2 C5' DG A 1 -2.438 1.920 6.341 1.00 0.13 C ATOM 3 C4' DG A 1 -2.262 0.573 7.028 1.00 0.10 C ATOM 4 O4' DG A 1 -3.051 -0.443 6.367 1.00 0.07 O ATOM 5 C3' DG A 1 -0.801 0.130 7.005 1.00 0.12 C ATOM 6 O3' DG A 1 -0.241 0.121 8.326 1.00 0.12 O ATOM 7 C2' DG A 1 -0.802 -1.243 6.399 1.00 0.13 C ATOM 8 C1' DG A 1 -2.208 -1.525 5.917 1.00 0.10 C ATOM 9 N9 DG A 1 -2.225 -1.629 4.448 1.00 0.12 N ATOM 10 C8 DG A 1 -2.475 -2.699 3.655 1.00 0.18 C ATOM 11 N7 DG A 1 -2.388 -2.531 2.378 1.00 0.21 N ATOM 12 C5 DG A 1 -2.033 -1.179 2.291 1.00 0.17 C ATOM 13 C6 DG A 1 -1.782 -0.373 1.149 1.00 0.20 C ATOM 14 O6 DG A 1 -1.821 -0.694 -0.036 1.00 0.24 O ATOM 15 N1 DG A 1 -1.454 0.929 1.506 1.00 0.16 N ATOM 16 C2 DG A 1 -1.377 1.403 2.800 1.00 0.10 C ATOM 17 N2 DG A 1 -1.045 2.687 2.939 1.00 0.12 N ATOM 18 N3 DG A 1 -1.612 0.652 3.879 1.00 0.10 N ATOM 19 C4 DG A 1 -1.933 -0.622 3.556 1.00 0.11 C ATOM 0 H5' DG A 1 -1.808 2.661 6.833 1.00 0.13 H new ATOM 0 H5'' DG A 1 -2.095 1.846 5.309 1.00 0.13 H new ATOM 0 H4' DG A 1 -2.592 0.693 8.060 1.00 0.10 H new ATOM 0 H3' DG A 1 -0.184 0.817 6.426 1.00 0.12 H new ATOM 0 H2' DG A 1 -0.095 -1.298 5.572 1.00 0.13 H new ATOM 0 H2'' DG A 1 -0.492 -1.987 7.133 1.00 0.13 H new ATOM 0 HO5' DG A 1 -3.864 3.236 5.908 1.00 0.09 H new ATOM 0 H1' DG A 1 -2.573 -2.471 6.318 1.00 0.10 H new ATOM 0 H8 DG A 1 -2.738 -3.658 4.076 1.00 0.18 H new ATOM 0 H1 DG A 1 -1.254 1.587 0.752 1.00 0.16 H new ATOM 0 H21 DG A 1 -0.972 3.097 3.870 1.00 0.12 H new ATOM 0 H22 DG A 1 -0.865 3.259 2.114 1.00 0.12 H new ATOM 32 P DG A 2 -0.875 -0.788 9.497 1.00 0.14 P ATOM 33 OP1 DG A 2 -2.320 -0.955 9.226 1.00 0.18 O ATOM 34 OP2 DG A 2 -0.425 -0.245 10.798 1.00 0.14 O ATOM 35 O5' DG A 2 -0.153 -2.209 9.268 1.00 0.15 O ATOM 36 C5' DG A 2 -0.924 -3.417 9.244 1.00 0.12 C ATOM 37 C4' DG A 2 -0.383 -4.432 8.247 1.00 0.08 C ATOM 38 O4' DG A 2 -0.277 -3.858 6.926 1.00 0.13 O ATOM 39 C3' DG A 2 1.008 -4.921 8.645 1.00 0.16 C ATOM 40 O3' DG A 2 0.951 -6.258 9.158 1.00 0.22 O ATOM 41 C2' DG A 2 1.829 -4.854 7.382 1.00 0.17 C ATOM 42 C1' DG A 2 0.907 -4.368 6.284 1.00 0.12 C ATOM 43 N9 DG A 2 1.572 -3.343 5.465 1.00 0.13 N ATOM 44 C8 DG A 2 2.141 -2.173 5.838 1.00 0.15 C ATOM 45 N7 DG A 2 2.673 -1.448 4.915 1.00 0.13 N ATOM 46 C5 DG A 2 2.437 -2.217 3.774 1.00 0.09 C ATOM 47 C6 DG A 2 2.784 -1.961 2.425 1.00 0.07 C ATOM 48 O6 DG A 2 3.349 -0.971 1.961 1.00 0.10 O ATOM 49 N1 DG A 2 2.370 -2.995 1.589 1.00 0.08 N ATOM 50 C2 DG A 2 1.700 -4.128 1.998 1.00 0.08 C ATOM 51 N2 DG A 2 1.390 -5.006 1.041 1.00 0.13 N ATOM 52 N3 DG A 2 1.366 -4.372 3.270 1.00 0.09 N ATOM 53 C4 DG A 2 1.764 -3.382 4.101 1.00 0.10 C ATOM 0 H5' DG A 2 -1.958 -3.180 8.992 1.00 0.12 H new ATOM 0 H5'' DG A 2 -0.932 -3.859 10.240 1.00 0.12 H new ATOM 0 H4' DG A 2 -1.087 -5.265 8.246 1.00 0.08 H new ATOM 0 H3' DG A 2 1.443 -4.312 9.438 1.00 0.16 H new ATOM 0 H2' DG A 2 2.673 -4.176 7.506 1.00 0.17 H new ATOM 0 H2'' DG A 2 2.240 -5.833 7.136 1.00 0.17 H new ATOM 0 H1' DG A 2 0.642 -5.177 5.603 1.00 0.12 H new ATOM 0 H8 DG A 2 2.149 -1.859 6.871 1.00 0.15 H new ATOM 0 H1 DG A 2 2.579 -2.907 0.595 1.00 0.08 H new ATOM 0 H21 DG A 2 0.894 -5.865 1.278 1.00 0.13 H new ATOM 0 H22 DG A 2 1.649 -4.818 0.073 1.00 0.13 H new ATOM 65 P DG A 3 2.298 -7.107 9.389 1.00 0.26 P ATOM 66 OP1 DG A 3 1.971 -8.274 10.239 1.00 0.34 O ATOM 67 OP2 DG A 3 3.372 -6.174 9.795 1.00 0.32 O ATOM 68 O5' DG A 3 2.623 -7.639 7.906 1.00 0.29 O ATOM 69 C5' DG A 3 1.699 -8.503 7.231 1.00 0.24 C ATOM 70 C4' DG A 3 2.114 -8.798 5.796 1.00 0.12 C ATOM 71 O4' DG A 3 2.171 -7.585 5.010 1.00 0.09 O ATOM 72 C3' DG A 3 3.493 -9.451 5.744 1.00 0.09 C ATOM 73 O3' DG A 3 3.397 -10.832 5.374 1.00 0.08 O ATOM 74 C2' DG A 3 4.269 -8.667 4.721 1.00 0.12 C ATOM 75 C1' DG A 3 3.336 -7.613 4.163 1.00 0.08 C ATOM 76 N9 DG A 3 4.000 -6.303 4.121 1.00 0.06 N ATOM 77 C8 DG A 3 4.424 -5.515 5.132 1.00 0.07 C ATOM 78 N7 DG A 3 4.981 -4.390 4.820 1.00 0.11 N ATOM 79 C5 DG A 3 4.929 -4.428 3.422 1.00 0.07 C ATOM 80 C6 DG A 3 5.384 -3.484 2.462 1.00 0.09 C ATOM 81 O6 DG A 3 5.931 -2.402 2.656 1.00 0.17 O ATOM 82 N1 DG A 3 5.137 -3.919 1.166 1.00 0.06 N ATOM 83 C2 DG A 3 4.531 -5.112 0.829 1.00 0.05 C ATOM 84 N2 DG A 3 4.394 -5.361 -0.469 1.00 0.08 N ATOM 85 N3 DG A 3 4.101 -6.001 1.724 1.00 0.08 N ATOM 86 C4 DG A 3 4.329 -5.600 2.991 1.00 0.04 C ATOM 0 H5' DG A 3 0.711 -8.044 7.232 1.00 0.24 H new ATOM 0 H5'' DG A 3 1.616 -9.440 7.781 1.00 0.24 H new ATOM 0 H4' DG A 3 1.364 -9.475 5.387 1.00 0.12 H new ATOM 0 H3' DG A 3 3.982 -9.435 6.718 1.00 0.09 H new ATOM 0 H2' DG A 3 5.145 -8.204 5.175 1.00 0.12 H new ATOM 0 H2'' DG A 3 4.629 -9.321 3.927 1.00 0.12 H new ATOM 0 H1' DG A 3 3.050 -7.850 3.138 1.00 0.08 H new ATOM 0 H8 DG A 3 4.303 -5.813 6.163 1.00 0.07 H new ATOM 0 H1 DG A 3 5.427 -3.308 0.403 1.00 0.06 H new ATOM 0 H21 DG A 3 3.953 -6.227 -0.778 1.00 0.08 H new ATOM 0 H22 DG A 3 4.729 -4.686 -1.156 1.00 0.08 H new ATOM 98 P DC A 4 2.728 -11.271 3.976 1.00 0.14 P ATOM 99 OP1 DC A 4 1.530 -10.433 3.750 1.00 0.16 O ATOM 100 OP2 DC A 4 2.610 -12.746 3.963 1.00 0.17 O ATOM 101 O5' DC A 4 3.849 -10.847 2.900 1.00 0.13 O ATOM 102 C5' DC A 4 4.831 -11.790 2.464 1.00 0.13 C ATOM 103 C4' DC A 4 5.355 -11.437 1.073 1.00 0.15 C ATOM 104 O4' DC A 4 4.274 -11.434 0.110 1.00 0.16 O ATOM 105 C3' DC A 4 6.000 -10.055 1.068 1.00 0.16 C ATOM 106 O3' DC A 4 7.339 -10.120 0.567 1.00 0.15 O ATOM 107 C2' DC A 4 5.139 -9.215 0.169 1.00 0.19 C ATOM 108 C1' DC A 4 4.210 -10.160 -0.564 1.00 0.17 C ATOM 109 N1 DC A 4 2.826 -9.636 -0.579 1.00 0.17 N ATOM 110 C2 DC A 4 2.357 -9.094 -1.767 1.00 0.18 C ATOM 111 O2 DC A 4 3.081 -9.065 -2.759 1.00 0.22 O ATOM 112 N3 DC A 4 1.087 -8.606 -1.796 1.00 0.18 N ATOM 113 C4 DC A 4 0.309 -8.646 -0.706 1.00 0.15 C ATOM 114 N4 DC A 4 -0.929 -8.157 -0.769 1.00 0.16 N ATOM 115 C5 DC A 4 0.789 -9.203 0.520 1.00 0.15 C ATOM 116 C6 DC A 4 2.046 -9.685 0.539 1.00 0.16 C ATOM 0 H5' DC A 4 4.398 -12.790 2.450 1.00 0.13 H new ATOM 0 H5'' DC A 4 5.659 -11.811 3.173 1.00 0.13 H new ATOM 0 H4' DC A 4 6.096 -12.190 0.804 1.00 0.15 H new ATOM 0 H3' DC A 4 6.064 -9.638 2.073 1.00 0.16 H new ATOM 0 H2' DC A 4 4.570 -8.488 0.749 1.00 0.19 H new ATOM 0 H2'' DC A 4 5.751 -8.652 -0.536 1.00 0.19 H new ATOM 0 H1' DC A 4 4.517 -10.265 -1.605 1.00 0.17 H new ATOM 0 H41 DC A 4 -1.530 -8.182 0.055 1.00 0.16 H new ATOM 0 H42 DC A 4 -1.276 -7.757 -1.641 1.00 0.16 H new ATOM 0 H5 DC A 4 0.165 -9.236 1.401 1.00 0.15 H new ATOM 0 H6 DC A 4 2.440 -10.115 1.448 1.00 0.16 H new ATOM 128 P DG A 5 8.543 -9.396 1.353 1.00 0.07 P ATOM 129 OP1 DG A 5 9.743 -9.421 0.488 1.00 0.13 O ATOM 130 OP2 DG A 5 8.607 -9.958 2.721 1.00 0.14 O ATOM 131 O5' DG A 5 8.029 -7.873 1.458 1.00 0.10 O ATOM 132 C5' DG A 5 8.092 -6.996 0.323 1.00 0.06 C ATOM 133 C4' DG A 5 8.511 -5.588 0.710 1.00 0.05 C ATOM 134 O4' DG A 5 7.591 -5.031 1.675 1.00 0.06 O ATOM 135 C3' DG A 5 9.903 -5.595 1.324 1.00 0.09 C ATOM 136 O3' DG A 5 10.792 -4.763 0.574 1.00 0.10 O ATOM 137 C2' DG A 5 9.734 -5.082 2.727 1.00 0.13 C ATOM 138 C1' DG A 5 8.259 -4.803 2.933 1.00 0.08 C ATOM 139 N9 DG A 5 7.708 -5.681 3.982 1.00 0.10 N ATOM 140 C8 DG A 5 7.149 -6.911 3.871 1.00 0.12 C ATOM 141 N7 DG A 5 6.747 -7.486 4.955 1.00 0.12 N ATOM 142 C5 DG A 5 7.072 -6.530 5.922 1.00 0.10 C ATOM 143 C6 DG A 5 6.883 -6.558 7.330 1.00 0.12 C ATOM 144 O6 DG A 5 6.384 -7.449 8.014 1.00 0.14 O ATOM 145 N1 DG A 5 7.349 -5.396 7.931 1.00 0.15 N ATOM 146 C2 DG A 5 7.926 -4.333 7.265 1.00 0.14 C ATOM 147 N2 DG A 5 8.311 -3.304 8.020 1.00 0.27 N ATOM 148 N3 DG A 5 8.107 -4.297 5.941 1.00 0.10 N ATOM 149 C4 DG A 5 7.661 -5.421 5.333 1.00 0.09 C ATOM 0 H5' DG A 5 7.117 -6.963 -0.163 1.00 0.06 H new ATOM 0 H5'' DG A 5 8.798 -7.396 -0.405 1.00 0.06 H new ATOM 0 H4' DG A 5 8.508 -4.982 -0.196 1.00 0.05 H new ATOM 0 H3' DG A 5 10.340 -6.594 1.318 1.00 0.09 H new ATOM 0 H2' DG A 5 10.090 -5.816 3.450 1.00 0.13 H new ATOM 0 H2'' DG A 5 10.321 -4.176 2.878 1.00 0.13 H new ATOM 0 H1' DG A 5 8.109 -3.774 3.259 1.00 0.08 H new ATOM 0 H8 DG A 5 7.044 -7.393 2.910 1.00 0.12 H new ATOM 0 H1 DG A 5 7.258 -5.322 8.944 1.00 0.15 H new ATOM 0 H21 DG A 5 8.744 -2.488 7.588 1.00 0.27 H new ATOM 0 H22 DG A 5 8.172 -3.333 9.030 1.00 0.27 H new ATOM 161 P DC A 6 11.077 -5.069 -0.981 1.00 0.08 P ATOM 162 OP1 DC A 6 11.267 -6.530 -1.137 1.00 0.12 O ATOM 163 OP2 DC A 6 12.122 -4.135 -1.452 1.00 0.09 O ATOM 164 O5' DC A 6 9.682 -4.665 -1.680 1.00 0.14 O ATOM 165 C5' DC A 6 9.524 -4.743 -3.101 1.00 0.17 C ATOM 166 C4' DC A 6 9.791 -3.396 -3.775 1.00 0.17 C ATOM 167 O4' DC A 6 9.086 -2.328 -3.096 1.00 0.18 O ATOM 168 C3' DC A 6 11.279 -3.046 -3.760 1.00 0.17 C ATOM 169 O3' DC A 6 11.833 -3.091 -5.083 1.00 0.19 O ATOM 170 C2' DC A 6 11.362 -1.656 -3.187 1.00 0.20 C ATOM 171 C1' DC A 6 9.940 -1.168 -3.008 1.00 0.21 C ATOM 172 N1 DC A 6 9.772 -0.463 -1.713 1.00 0.20 N ATOM 173 C2 DC A 6 9.571 0.910 -1.757 1.00 0.18 C ATOM 174 O2 DC A 6 9.548 1.494 -2.839 1.00 0.22 O ATOM 175 N3 DC A 6 9.403 1.577 -0.583 1.00 0.26 N ATOM 176 C4 DC A 6 9.428 0.928 0.588 1.00 0.28 C ATOM 177 N4 DC A 6 9.257 1.614 1.719 1.00 0.39 N ATOM 178 C5 DC A 6 9.635 -0.485 0.642 1.00 0.25 C ATOM 179 C6 DC A 6 9.804 -1.139 -0.525 1.00 0.26 C ATOM 0 H5' DC A 6 8.513 -5.074 -3.337 1.00 0.17 H new ATOM 0 H5'' DC A 6 10.206 -5.492 -3.502 1.00 0.17 H new ATOM 0 H4' DC A 6 9.442 -3.492 -4.803 1.00 0.17 H new ATOM 0 H3' DC A 6 11.852 -3.759 -3.167 1.00 0.17 H new ATOM 0 H2' DC A 6 11.891 -1.662 -2.234 1.00 0.20 H new ATOM 0 H2'' DC A 6 11.916 -0.996 -3.854 1.00 0.20 H new ATOM 0 H1' DC A 6 9.679 -0.444 -3.780 1.00 0.21 H new ATOM 0 H41 DC A 6 9.274 1.130 2.617 1.00 0.39 H new ATOM 0 H42 DC A 6 9.109 2.623 1.686 1.00 0.39 H new ATOM 0 H5 DC A 6 9.655 -1.011 1.585 1.00 0.25 H new ATOM 0 H6 DC A 6 9.966 -2.207 -0.521 1.00 0.26 H new ATOM 191 P DG A 7 11.232 -2.177 -6.268 1.00 0.10 P ATOM 192 OP1 DG A 7 12.223 -2.133 -7.365 1.00 0.27 O ATOM 193 OP2 DG A 7 10.732 -0.915 -5.676 1.00 0.18 O ATOM 194 O5' DG A 7 9.964 -3.033 -6.769 1.00 0.21 O ATOM 195 C5' DG A 7 8.827 -2.377 -7.348 1.00 0.22 C ATOM 196 C4' DG A 7 7.743 -3.356 -7.781 1.00 0.15 C ATOM 197 O4' DG A 7 7.292 -4.147 -6.657 1.00 0.13 O ATOM 198 C3' DG A 7 6.533 -2.611 -8.334 1.00 0.17 C ATOM 199 O3' DG A 7 6.036 -3.243 -9.522 1.00 0.15 O ATOM 200 C2' DG A 7 5.514 -2.680 -7.242 1.00 0.17 C ATOM 201 C1' DG A 7 5.901 -3.867 -6.386 1.00 0.14 C ATOM 202 N9 DG A 7 5.686 -3.599 -4.954 1.00 0.11 N ATOM 203 C8 DG A 7 5.174 -4.409 -3.998 1.00 0.14 C ATOM 204 N7 DG A 7 5.109 -3.945 -2.797 1.00 0.16 N ATOM 205 C5 DG A 7 5.639 -2.661 -2.953 1.00 0.13 C ATOM 206 C6 DG A 7 5.840 -1.634 -1.992 1.00 0.18 C ATOM 207 O6 DG A 7 5.589 -1.656 -0.790 1.00 0.27 O ATOM 208 N1 DG A 7 6.397 -0.499 -2.569 1.00 0.16 N ATOM 209 C2 DG A 7 6.721 -0.366 -3.907 1.00 0.10 C ATOM 210 N2 DG A 7 7.238 0.803 -4.278 1.00 0.10 N ATOM 211 N3 DG A 7 6.535 -1.329 -4.814 1.00 0.06 N ATOM 212 C4 DG A 7 5.994 -2.442 -4.274 1.00 0.08 C ATOM 0 H5' DG A 7 9.149 -1.793 -8.210 1.00 0.22 H new ATOM 0 H5'' DG A 7 8.410 -1.675 -6.625 1.00 0.22 H new ATOM 0 H4' DG A 7 8.176 -3.998 -8.548 1.00 0.15 H new ATOM 0 H3' DG A 7 6.779 -1.586 -8.612 1.00 0.17 H new ATOM 0 H2' DG A 7 5.508 -1.761 -6.655 1.00 0.17 H new ATOM 0 H2'' DG A 7 4.511 -2.804 -7.651 1.00 0.17 H new ATOM 0 H1' DG A 7 5.276 -4.726 -6.630 1.00 0.14 H new ATOM 0 H8 DG A 7 4.833 -5.406 -4.233 1.00 0.14 H new ATOM 0 H1 DG A 7 6.581 0.297 -1.959 1.00 0.16 H new ATOM 0 H21 DG A 7 7.497 0.960 -5.252 1.00 0.10 H new ATOM 0 H22 DG A 7 7.376 1.542 -3.588 1.00 0.10 H new ATOM 224 P DG A 8 5.852 -4.844 -9.593 1.00 0.14 P ATOM 225 OP1 DG A 8 7.171 -5.472 -9.354 1.00 0.18 O ATOM 226 OP2 DG A 8 5.096 -5.166 -10.824 1.00 0.15 O ATOM 227 O5' DG A 8 4.907 -5.163 -8.325 1.00 0.14 O ATOM 228 C5' DG A 8 3.482 -5.241 -8.472 1.00 0.13 C ATOM 229 C4' DG A 8 2.857 -6.311 -7.587 1.00 0.12 C ATOM 230 O4' DG A 8 3.194 -6.112 -6.193 1.00 0.13 O ATOM 231 C3' DG A 8 1.337 -6.298 -7.701 1.00 0.13 C ATOM 232 O3' DG A 8 0.854 -7.512 -8.287 1.00 0.08 O ATOM 233 C2' DG A 8 0.839 -6.148 -6.291 1.00 0.19 C ATOM 234 C1' DG A 8 2.028 -6.384 -5.394 1.00 0.14 C ATOM 235 N9 DG A 8 1.969 -5.535 -4.191 1.00 0.11 N ATOM 236 C8 DG A 8 1.611 -5.864 -2.927 1.00 0.11 C ATOM 237 N7 DG A 8 1.665 -4.939 -2.026 1.00 0.12 N ATOM 238 C5 DG A 8 2.114 -3.846 -2.775 1.00 0.09 C ATOM 239 C6 DG A 8 2.382 -2.512 -2.365 1.00 0.10 C ATOM 240 O6 DG A 8 2.281 -2.025 -1.240 1.00 0.16 O ATOM 241 N1 DG A 8 2.813 -1.730 -3.430 1.00 0.10 N ATOM 242 C2 DG A 8 2.970 -2.172 -4.730 1.00 0.08 C ATOM 243 N2 DG A 8 3.389 -1.269 -5.615 1.00 0.11 N ATOM 244 N3 DG A 8 2.721 -3.424 -5.122 1.00 0.10 N ATOM 245 C4 DG A 8 2.300 -4.203 -4.102 1.00 0.08 C ATOM 0 H5' DG A 8 3.239 -5.450 -9.514 1.00 0.13 H new ATOM 0 H5'' DG A 8 3.043 -4.273 -8.230 1.00 0.13 H new ATOM 0 H4' DG A 8 3.255 -7.265 -7.932 1.00 0.12 H new ATOM 0 H3' DG A 8 0.987 -5.491 -8.345 1.00 0.13 H new ATOM 0 H2' DG A 8 0.422 -5.154 -6.130 1.00 0.19 H new ATOM 0 H2'' DG A 8 0.045 -6.865 -6.081 1.00 0.19 H new ATOM 0 H1' DG A 8 2.049 -7.409 -5.023 1.00 0.14 H new ATOM 0 H8 DG A 8 1.291 -6.866 -2.680 1.00 0.11 H new ATOM 0 H1 DG A 8 3.031 -0.752 -3.237 1.00 0.10 H new ATOM 0 H21 DG A 8 3.524 -1.535 -6.590 1.00 0.11 H new ATOM 0 H22 DG A 8 3.575 -0.311 -5.317 1.00 0.11 H new ATOM 257 P DG A 9 -0.699 -7.666 -8.684 1.00 0.09 P ATOM 258 OP1 DG A 9 -0.851 -8.900 -9.488 1.00 0.13 O ATOM 259 OP2 DG A 9 -1.169 -6.371 -9.224 1.00 0.12 O ATOM 260 O5' DG A 9 -1.407 -7.904 -7.258 1.00 0.11 O ATOM 261 C5' DG A 9 -1.322 -9.181 -6.609 1.00 0.11 C ATOM 262 C4' DG A 9 -2.084 -9.215 -5.291 1.00 0.11 C ATOM 263 O4' DG A 9 -1.562 -8.228 -4.372 1.00 0.12 O ATOM 264 C3' DG A 9 -3.570 -8.920 -5.503 1.00 0.11 C ATOM 265 O3' DG A 9 -4.388 -10.069 -5.219 1.00 0.10 O ATOM 266 C2' DG A 9 -3.891 -7.785 -4.571 1.00 0.12 C ATOM 267 C1' DG A 9 -2.649 -7.512 -3.753 1.00 0.12 C ATOM 268 N9 DG A 9 -2.374 -6.064 -3.697 1.00 0.12 N ATOM 269 C8 DG A 9 -2.142 -5.189 -4.703 1.00 0.11 C ATOM 270 N7 DG A 9 -1.927 -3.955 -4.386 1.00 0.11 N ATOM 271 C5 DG A 9 -2.028 -3.998 -2.992 1.00 0.09 C ATOM 272 C6 DG A 9 -1.895 -2.956 -2.036 1.00 0.12 C ATOM 273 O6 DG A 9 -1.653 -1.768 -2.234 1.00 0.10 O ATOM 274 N1 DG A 9 -2.073 -3.426 -0.741 1.00 0.20 N ATOM 275 C2 DG A 9 -2.346 -4.736 -0.400 1.00 0.25 C ATOM 276 N2 DG A 9 -2.495 -4.988 0.899 1.00 0.34 N ATOM 277 N3 DG A 9 -2.471 -5.723 -1.293 1.00 0.23 N ATOM 278 C4 DG A 9 -2.303 -5.288 -2.562 1.00 0.15 C ATOM 0 H5' DG A 9 -0.275 -9.424 -6.427 1.00 0.11 H new ATOM 0 H5'' DG A 9 -1.716 -9.950 -7.273 1.00 0.11 H new ATOM 0 H4' DG A 9 -1.961 -10.217 -4.880 1.00 0.11 H new ATOM 0 H3' DG A 9 -3.776 -8.663 -6.542 1.00 0.11 H new ATOM 0 H2' DG A 9 -4.185 -6.898 -5.132 1.00 0.12 H new ATOM 0 H2'' DG A 9 -4.729 -8.044 -3.924 1.00 0.12 H new ATOM 0 H1' DG A 9 -2.780 -7.848 -2.724 1.00 0.12 H new ATOM 0 H8 DG A 9 -2.137 -5.511 -5.734 1.00 0.11 H new ATOM 0 H1 DG A 9 -1.996 -2.750 0.019 1.00 0.20 H new ATOM 0 H21 DG A 9 -2.698 -5.936 1.214 1.00 0.34 H new ATOM 0 H22 DG A 9 -2.406 -4.233 1.578 1.00 0.34 H new ATOM 290 P DA A 10 -4.253 -10.888 -3.833 1.00 0.10 P ATOM 291 OP1 DA A 10 -2.816 -11.129 -3.575 1.00 0.13 O ATOM 292 OP2 DA A 10 -5.192 -12.031 -3.880 1.00 0.14 O ATOM 293 O5' DA A 10 -4.793 -9.842 -2.733 1.00 0.13 O ATOM 294 C5' DA A 10 -6.195 -9.607 -2.564 1.00 0.09 C ATOM 295 C4' DA A 10 -6.450 -8.595 -1.447 1.00 0.09 C ATOM 296 O4' DA A 10 -5.592 -7.440 -1.598 1.00 0.10 O ATOM 297 C3' DA A 10 -7.901 -8.105 -1.452 1.00 0.09 C ATOM 298 O3' DA A 10 -8.580 -8.457 -0.234 1.00 0.10 O ATOM 299 C2' DA A 10 -7.812 -6.611 -1.606 1.00 0.09 C ATOM 300 C1' DA A 10 -6.360 -6.239 -1.403 1.00 0.08 C ATOM 301 N9 DA A 10 -5.943 -5.172 -2.332 1.00 0.08 N ATOM 302 C8 DA A 10 -5.893 -5.163 -3.687 1.00 0.09 C ATOM 303 N7 DA A 10 -5.489 -4.079 -4.262 1.00 0.13 N ATOM 304 C5 DA A 10 -5.235 -3.254 -3.160 1.00 0.11 C ATOM 305 C6 DA A 10 -4.772 -1.937 -3.044 1.00 0.14 C ATOM 306 N6 DA A 10 -4.469 -1.171 -4.091 1.00 0.15 N ATOM 307 N1 DA A 10 -4.637 -1.436 -1.802 1.00 0.14 N ATOM 308 C2 DA A 10 -4.937 -2.182 -0.738 1.00 0.12 C ATOM 309 N3 DA A 10 -5.381 -3.434 -0.733 1.00 0.09 N ATOM 310 C4 DA A 10 -5.509 -3.914 -1.985 1.00 0.07 C ATOM 0 H5' DA A 10 -6.699 -10.545 -2.332 1.00 0.09 H new ATOM 0 H5'' DA A 10 -6.621 -9.239 -3.497 1.00 0.09 H new ATOM 0 H4' DA A 10 -6.240 -9.106 -0.508 1.00 0.09 H new ATOM 0 H3' DA A 10 -8.476 -8.565 -2.256 1.00 0.09 H new ATOM 0 H2' DA A 10 -8.156 -6.303 -2.593 1.00 0.09 H new ATOM 0 H2'' DA A 10 -8.446 -6.108 -0.876 1.00 0.09 H new ATOM 0 H1' DA A 10 -6.200 -5.841 -0.401 1.00 0.08 H new ATOM 0 H8 DA A 10 -6.180 -6.030 -4.264 1.00 0.09 H new ATOM 0 H61 DA A 10 -4.136 -0.218 -3.946 1.00 0.15 H new ATOM 0 H62 DA A 10 -4.570 -1.538 -5.037 1.00 0.15 H new ATOM 0 H2 DA A 10 -4.804 -1.716 0.227 1.00 0.12 H new ATOM 322 P DG A 11 -7.965 -8.088 1.212 1.00 0.11 P ATOM 323 OP1 DG A 11 -6.824 -7.167 1.013 1.00 0.08 O ATOM 324 OP2 DG A 11 -7.771 -9.347 1.965 1.00 0.21 O ATOM 325 O5' DG A 11 -9.160 -7.263 1.914 1.00 0.19 O ATOM 326 C5' DG A 11 -9.381 -5.881 1.594 1.00 0.19 C ATOM 327 C4' DG A 11 -9.984 -5.096 2.749 1.00 0.21 C ATOM 328 O4' DG A 11 -10.184 -3.718 2.365 1.00 0.25 O ATOM 329 C3' DG A 11 -11.339 -5.668 3.165 1.00 0.23 C ATOM 330 O3' DG A 11 -11.364 -5.988 4.566 1.00 0.19 O ATOM 331 C2' DG A 11 -12.346 -4.599 2.843 1.00 0.28 C ATOM 332 C1' DG A 11 -11.592 -3.451 2.203 1.00 0.26 C ATOM 333 N9 DG A 11 -11.939 -3.330 0.774 1.00 0.23 N ATOM 334 C8 DG A 11 -11.150 -3.461 -0.320 1.00 0.21 C ATOM 335 N7 DG A 11 -11.701 -3.304 -1.477 1.00 0.23 N ATOM 336 C5 DG A 11 -13.028 -3.033 -1.127 1.00 0.26 C ATOM 337 C6 DG A 11 -14.151 -2.765 -1.955 1.00 0.29 C ATOM 338 O6 DG A 11 -14.198 -2.713 -3.182 1.00 0.32 O ATOM 339 N1 DG A 11 -15.298 -2.545 -1.202 1.00 0.34 N ATOM 340 C2 DG A 11 -15.363 -2.578 0.177 1.00 0.36 C ATOM 341 N2 DG A 11 -16.558 -2.341 0.716 1.00 0.47 N ATOM 342 N3 DG A 11 -14.310 -2.830 0.963 1.00 0.33 N ATOM 343 C4 DG A 11 -13.181 -3.047 0.251 1.00 0.26 C ATOM 0 H5' DG A 11 -10.043 -5.814 0.731 1.00 0.19 H new ATOM 0 H5'' DG A 11 -8.434 -5.424 1.305 1.00 0.19 H new ATOM 0 H4' DG A 11 -9.287 -5.167 3.584 1.00 0.21 H new ATOM 0 H3' DG A 11 -11.554 -6.598 2.638 1.00 0.23 H new ATOM 0 H2' DG A 11 -13.110 -4.982 2.167 1.00 0.28 H new ATOM 0 H2'' DG A 11 -12.857 -4.267 3.747 1.00 0.28 H new ATOM 0 H1' DG A 11 -11.859 -2.507 2.679 1.00 0.26 H new ATOM 0 H8 DG A 11 -10.098 -3.689 -0.227 1.00 0.21 H new ATOM 0 H1 DG A 11 -16.160 -2.343 -1.708 1.00 0.34 H new ATOM 0 H21 DG A 11 -16.671 -2.351 1.730 1.00 0.47 H new ATOM 0 H22 DG A 11 -17.360 -2.149 0.115 1.00 0.47 H new ATOM 355 P DG A 12 -10.804 -4.959 5.676 1.00 0.21 P ATOM 356 OP1 DG A 12 -9.421 -4.584 5.306 1.00 0.22 O ATOM 357 OP2 DG A 12 -11.077 -5.531 7.013 1.00 0.35 O ATOM 358 O5' DG A 12 -11.744 -3.665 5.483 1.00 0.23 O ATOM 359 C5' DG A 12 -11.202 -2.346 5.647 1.00 0.14 C ATOM 360 C4' DG A 12 -12.247 -1.336 6.103 1.00 0.09 C ATOM 361 O4' DG A 12 -12.721 -1.659 7.430 1.00 0.12 O ATOM 362 C3' DG A 12 -11.667 0.076 6.134 1.00 0.08 C ATOM 363 O3' DG A 12 -12.391 0.940 5.250 1.00 0.12 O ATOM 364 C2' DG A 12 -11.793 0.538 7.559 1.00 0.11 C ATOM 365 C1' DG A 12 -12.569 -0.525 8.310 1.00 0.12 C ATOM 366 N9 DG A 12 -11.861 -0.913 9.550 1.00 0.13 N ATOM 367 C8 DG A 12 -10.639 -1.490 9.716 1.00 0.14 C ATOM 368 N7 DG A 12 -10.251 -1.725 10.924 1.00 0.15 N ATOM 369 C5 DG A 12 -11.335 -1.253 11.672 1.00 0.15 C ATOM 370 C6 DG A 12 -11.526 -1.227 13.079 1.00 0.18 C ATOM 371 O6 DG A 12 -10.765 -1.620 13.960 1.00 0.17 O ATOM 372 N1 DG A 12 -12.753 -0.668 13.417 1.00 0.23 N ATOM 373 C2 DG A 12 -13.685 -0.193 12.516 1.00 0.23 C ATOM 374 N2 DG A 12 -14.806 0.308 13.036 1.00 0.28 N ATOM 375 N3 DG A 12 -13.513 -0.215 11.190 1.00 0.19 N ATOM 376 C4 DG A 12 -12.324 -0.754 10.837 1.00 0.16 C ATOM 0 H5' DG A 12 -10.770 -2.015 4.703 1.00 0.14 H new ATOM 0 H5'' DG A 12 -10.391 -2.378 6.375 1.00 0.14 H new ATOM 0 H4' DG A 12 -13.071 -1.379 5.390 1.00 0.09 H new ATOM 0 H3' DG A 12 -10.629 0.091 5.801 1.00 0.08 H new ATOM 0 H2' DG A 12 -10.809 0.682 8.005 1.00 0.11 H new ATOM 0 H2'' DG A 12 -12.309 1.497 7.608 1.00 0.11 H new ATOM 0 H1' DG A 12 -13.546 -0.143 8.605 1.00 0.12 H new ATOM 0 H8 DG A 12 -10.018 -1.741 8.869 1.00 0.14 H new ATOM 0 H1 DG A 12 -12.983 -0.604 14.409 1.00 0.23 H new ATOM 0 H21 DG A 12 -15.533 0.675 12.422 1.00 0.28 H new ATOM 0 H22 DG A 12 -14.936 0.324 14.048 1.00 0.28 H new ATOM 388 P DA A 13 -13.957 1.234 5.493 1.00 0.19 P ATOM 389 OP1 DA A 13 -14.440 0.319 6.551 1.00 0.27 O ATOM 390 OP2 DA A 13 -14.631 1.262 4.177 1.00 0.28 O ATOM 391 O5' DA A 13 -13.947 2.732 6.087 1.00 0.17 O ATOM 392 C5' DA A 13 -14.387 3.836 5.288 1.00 0.18 C ATOM 393 C4' DA A 13 -13.233 4.764 4.918 1.00 0.13 C ATOM 394 O4' DA A 13 -12.637 5.341 6.103 1.00 0.16 O ATOM 395 C3' DA A 13 -12.152 4.004 4.159 1.00 0.13 C ATOM 396 O3' DA A 13 -12.024 4.495 2.819 1.00 0.19 O ATOM 397 C2' DA A 13 -10.883 4.211 4.934 1.00 0.15 C ATOM 398 C1' DA A 13 -11.230 5.029 6.161 1.00 0.14 C ATOM 399 N9 DA A 13 -10.911 4.285 7.393 1.00 0.13 N ATOM 400 C8 DA A 13 -9.729 3.773 7.807 1.00 0.16 C ATOM 401 N7 DA A 13 -9.715 3.134 8.930 1.00 0.18 N ATOM 402 C5 DA A 13 -11.055 3.226 9.321 1.00 0.15 C ATOM 403 C6 DA A 13 -11.749 2.756 10.440 1.00 0.19 C ATOM 404 N6 DA A 13 -11.169 2.065 11.422 1.00 0.22 N ATOM 405 N1 DA A 13 -13.065 3.024 10.510 1.00 0.20 N ATOM 406 C2 DA A 13 -13.667 3.715 9.538 1.00 0.18 C ATOM 407 N3 DA A 13 -13.106 4.207 8.438 1.00 0.15 N ATOM 408 C4 DA A 13 -11.788 3.925 8.390 1.00 0.13 C ATOM 0 H5' DA A 13 -15.146 4.399 5.832 1.00 0.18 H new ATOM 0 H5'' DA A 13 -14.858 3.462 4.379 1.00 0.18 H new ATOM 0 H4' DA A 13 -13.641 5.555 4.288 1.00 0.13 H new ATOM 0 H3' DA A 13 -12.396 2.945 4.073 1.00 0.13 H new ATOM 0 H2' DA A 13 -10.448 3.254 5.221 1.00 0.15 H new ATOM 0 H2'' DA A 13 -10.141 4.728 4.325 1.00 0.15 H new ATOM 0 H1' DA A 13 -10.643 5.947 6.177 1.00 0.14 H new ATOM 0 H8 DA A 13 -8.830 3.894 7.220 1.00 0.16 H new ATOM 0 H61 DA A 13 -11.723 1.745 12.217 1.00 0.22 H new ATOM 0 H62 DA A 13 -10.172 1.856 11.378 1.00 0.22 H new ATOM 0 H2 DA A 13 -14.725 3.893 9.659 1.00 0.18 H new ATOM 420 P DA A 14 -11.670 6.042 2.538 1.00 0.11 P ATOM 421 OP1 DA A 14 -11.300 6.673 3.824 1.00 0.16 O ATOM 422 OP2 DA A 14 -12.754 6.622 1.715 1.00 0.15 O ATOM 423 O5' DA A 14 -10.345 5.939 1.628 1.00 0.15 O ATOM 424 C5' DA A 14 -9.126 6.574 2.031 1.00 0.12 C ATOM 425 C4' DA A 14 -7.970 5.575 2.105 1.00 0.09 C ATOM 426 O4' DA A 14 -8.388 4.358 2.764 1.00 0.13 O ATOM 427 C3' DA A 14 -7.446 5.208 0.716 1.00 0.09 C ATOM 428 O3' DA A 14 -6.075 5.592 0.571 1.00 0.09 O ATOM 429 C2' DA A 14 -7.601 3.716 0.607 1.00 0.13 C ATOM 430 C1' DA A 14 -8.017 3.210 1.973 1.00 0.14 C ATOM 431 N9 DA A 14 -9.138 2.259 1.865 1.00 0.19 N ATOM 432 C8 DA A 14 -9.225 0.974 2.287 1.00 0.25 C ATOM 433 N7 DA A 14 -10.335 0.348 2.070 1.00 0.26 N ATOM 434 C5 DA A 14 -11.090 1.331 1.423 1.00 0.22 C ATOM 435 C6 DA A 14 -12.390 1.339 0.904 1.00 0.27 C ATOM 436 N6 DA A 14 -13.202 0.284 0.957 1.00 0.37 N ATOM 437 N1 DA A 14 -12.819 2.476 0.330 1.00 0.28 N ATOM 438 C2 DA A 14 -12.022 3.545 0.267 1.00 0.24 C ATOM 439 N3 DA A 14 -10.777 3.647 0.723 1.00 0.16 N ATOM 440 C4 DA A 14 -10.369 2.496 1.294 1.00 0.16 C ATOM 0 H5' DA A 14 -9.264 7.044 3.005 1.00 0.12 H new ATOM 0 H5'' DA A 14 -8.878 7.367 1.326 1.00 0.12 H new ATOM 0 H4' DA A 14 -7.175 6.060 2.672 1.00 0.09 H new ATOM 0 H3' DA A 14 -7.995 5.726 -0.071 1.00 0.09 H new ATOM 0 H2' DA A 14 -8.350 3.460 -0.143 1.00 0.13 H new ATOM 0 H2'' DA A 14 -6.665 3.253 0.294 1.00 0.13 H new ATOM 0 H1' DA A 14 -7.194 2.673 2.445 1.00 0.14 H new ATOM 0 H8 DA A 14 -8.398 0.491 2.786 1.00 0.25 H new ATOM 0 H61 DA A 14 -14.141 0.343 0.563 1.00 0.37 H new ATOM 0 H62 DA A 14 -12.885 -0.583 1.391 1.00 0.37 H new ATOM 0 H2 DA A 14 -12.434 4.424 -0.207 1.00 0.24 H new ATOM 452 P DT A 15 -5.681 7.132 0.318 1.00 0.06 P ATOM 453 OP1 DT A 15 -5.759 7.849 1.611 1.00 0.15 O ATOM 454 OP2 DT A 15 -6.456 7.623 -0.844 1.00 0.14 O ATOM 455 O5' DT A 15 -4.132 7.037 -0.114 1.00 0.10 O ATOM 456 C5' DT A 15 -3.662 7.693 -1.296 1.00 0.13 C ATOM 457 C4' DT A 15 -3.436 6.702 -2.439 1.00 0.14 C ATOM 458 O4' DT A 15 -2.767 5.515 -1.958 1.00 0.16 O ATOM 459 C3' DT A 15 -4.754 6.285 -3.084 1.00 0.15 C ATOM 460 O3' DT A 15 -4.806 6.697 -4.455 1.00 0.16 O ATOM 461 C2' DT A 15 -4.807 4.785 -2.969 1.00 0.19 C ATOM 462 C1' DT A 15 -3.510 4.333 -2.324 1.00 0.16 C ATOM 463 N1 DT A 15 -3.789 3.504 -1.138 1.00 0.11 N ATOM 464 C2 DT A 15 -3.911 2.139 -1.320 1.00 0.09 C ATOM 465 O2 DT A 15 -3.775 1.609 -2.422 1.00 0.15 O ATOM 466 N3 DT A 15 -4.202 1.401 -0.188 1.00 0.12 N ATOM 467 C4 DT A 15 -4.379 1.905 1.089 1.00 0.19 C ATOM 468 O4 DT A 15 -4.638 1.154 2.028 1.00 0.32 O ATOM 469 C5 DT A 15 -4.234 3.340 1.180 1.00 0.12 C ATOM 470 C7 DT A 15 -4.441 4.036 2.519 1.00 0.19 C ATOM 471 C6 DT A 15 -3.947 4.079 0.092 1.00 0.09 C ATOM 0 H5' DT A 15 -2.731 8.215 -1.077 1.00 0.13 H new ATOM 0 H5'' DT A 15 -4.385 8.448 -1.606 1.00 0.13 H new ATOM 0 H4' DT A 15 -2.817 7.206 -3.181 1.00 0.14 H new ATOM 0 H3' DT A 15 -5.606 6.753 -2.592 1.00 0.15 H new ATOM 0 H2' DT A 15 -5.662 4.476 -2.368 1.00 0.19 H new ATOM 0 H2'' DT A 15 -4.926 4.329 -3.952 1.00 0.19 H new ATOM 0 H1' DT A 15 -2.930 3.725 -3.018 1.00 0.16 H new ATOM 0 H3 DT A 15 -4.295 0.392 -0.304 1.00 0.12 H new ATOM 0 H71 DT A 15 -3.819 4.930 2.564 1.00 0.19 H new ATOM 0 H72 DT A 15 -5.489 4.317 2.625 1.00 0.19 H new ATOM 0 H73 DT A 15 -4.163 3.360 3.327 1.00 0.19 H new ATOM 0 H6 DT A 15 -3.839 5.149 0.193 1.00 0.09 H new ATOM 484 P DT A 16 -3.798 6.067 -5.541 1.00 0.20 P ATOM 485 OP1 DT A 16 -2.433 6.074 -4.967 1.00 0.26 O ATOM 486 OP2 DT A 16 -4.054 6.719 -6.845 1.00 0.21 O ATOM 487 O5' DT A 16 -4.300 4.538 -5.633 1.00 0.26 O ATOM 488 C5' DT A 16 -3.382 3.484 -5.939 1.00 0.33 C ATOM 489 C4' DT A 16 -3.788 2.735 -7.206 1.00 0.13 C ATOM 490 O4' DT A 16 -5.067 2.082 -7.031 1.00 0.19 O ATOM 491 C3' DT A 16 -3.897 3.688 -8.392 1.00 0.11 C ATOM 492 O3' DT A 16 -2.976 3.319 -9.423 1.00 0.18 O ATOM 493 C2' DT A 16 -5.318 3.581 -8.876 1.00 0.16 C ATOM 494 C1' DT A 16 -6.013 2.536 -8.026 1.00 0.16 C ATOM 495 N1 DT A 16 -7.221 3.099 -7.380 1.00 0.15 N ATOM 496 C2 DT A 16 -8.453 2.724 -7.884 1.00 0.18 C ATOM 497 O2 DT A 16 -8.564 1.962 -8.841 1.00 0.23 O ATOM 498 N3 DT A 16 -9.558 3.259 -7.246 1.00 0.16 N ATOM 499 C4 DT A 16 -9.536 4.122 -6.164 1.00 0.12 C ATOM 500 O4 DT A 16 -10.582 4.538 -5.671 1.00 0.14 O ATOM 501 C5 DT A 16 -8.205 4.458 -5.707 1.00 0.09 C ATOM 502 C7 DT A 16 -8.034 5.393 -4.512 1.00 0.07 C ATOM 503 C6 DT A 16 -7.114 3.950 -6.314 1.00 0.11 C ATOM 0 H5' DT A 16 -3.336 2.787 -5.102 1.00 0.33 H new ATOM 0 H5'' DT A 16 -2.381 3.897 -6.065 1.00 0.33 H new ATOM 0 H4' DT A 16 -3.015 1.991 -7.400 1.00 0.13 H new ATOM 0 H3' DT A 16 -3.651 4.711 -8.108 1.00 0.11 H new ATOM 0 H2' DT A 16 -5.825 4.542 -8.792 1.00 0.16 H new ATOM 0 H2'' DT A 16 -5.344 3.298 -9.928 1.00 0.16 H new ATOM 0 H1' DT A 16 -6.341 1.703 -8.647 1.00 0.16 H new ATOM 0 H3 DT A 16 -10.474 2.993 -7.607 1.00 0.16 H new ATOM 0 H71 DT A 16 -8.871 6.091 -4.473 1.00 0.07 H new ATOM 0 H72 DT A 16 -8.007 4.808 -3.593 1.00 0.07 H new ATOM 0 H73 DT A 16 -7.102 5.949 -4.616 1.00 0.07 H new ATOM 0 H6 DT A 16 -6.134 4.221 -5.951 1.00 0.11 H new ATOM 516 P DG A 17 -3.037 1.857 -10.096 1.00 0.18 P ATOM 517 OP1 DG A 17 -4.035 1.891 -11.188 1.00 0.29 O ATOM 518 OP2 DG A 17 -3.159 0.851 -9.016 1.00 0.30 O ATOM 519 O5' DG A 17 -1.573 1.714 -10.753 1.00 0.15 O ATOM 520 C5' DG A 17 -0.550 0.931 -10.118 1.00 0.09 C ATOM 521 C4' DG A 17 0.749 1.706 -9.951 1.00 0.08 C ATOM 522 O4' DG A 17 0.575 2.750 -8.963 1.00 0.10 O ATOM 523 C3' DG A 17 1.890 0.808 -9.466 1.00 0.08 C ATOM 524 O3' DG A 17 3.105 1.137 -10.172 1.00 0.12 O ATOM 525 C2' DG A 17 1.992 1.111 -8.006 1.00 0.08 C ATOM 526 C1' DG A 17 1.480 2.520 -7.863 1.00 0.07 C ATOM 527 N9 DG A 17 0.831 2.750 -6.565 1.00 0.12 N ATOM 528 C8 DG A 17 0.755 3.899 -5.868 1.00 0.13 C ATOM 529 N7 DG A 17 0.190 3.867 -4.710 1.00 0.13 N ATOM 530 C5 DG A 17 -0.165 2.518 -4.607 1.00 0.09 C ATOM 531 C6 DG A 17 -0.826 1.830 -3.555 1.00 0.10 C ATOM 532 O6 DG A 17 -1.222 2.282 -2.483 1.00 0.13 O ATOM 533 N1 DG A 17 -0.992 0.481 -3.852 1.00 0.14 N ATOM 534 C2 DG A 17 -0.574 -0.133 -5.017 1.00 0.18 C ATOM 535 N2 DG A 17 -0.831 -1.439 -5.124 1.00 0.22 N ATOM 536 N3 DG A 17 0.050 0.509 -6.012 1.00 0.18 N ATOM 537 C4 DG A 17 0.222 1.824 -5.744 1.00 0.12 C ATOM 0 H5' DG A 17 -0.362 0.034 -10.709 1.00 0.09 H new ATOM 0 H5'' DG A 17 -0.902 0.601 -9.141 1.00 0.09 H new ATOM 0 H4' DG A 17 1.000 2.118 -10.928 1.00 0.08 H new ATOM 0 H3' DG A 17 1.718 -0.253 -9.644 1.00 0.08 H new ATOM 0 H2' DG A 17 1.398 0.413 -7.416 1.00 0.08 H new ATOM 0 H2'' DG A 17 3.021 1.028 -7.657 1.00 0.08 H new ATOM 0 H1' DG A 17 2.310 3.226 -7.893 1.00 0.07 H new ATOM 0 H8 DG A 17 1.155 4.819 -6.267 1.00 0.13 H new ATOM 0 H1 DG A 17 -1.459 -0.100 -3.155 1.00 0.14 H new ATOM 0 H21 DG A 17 -0.547 -1.948 -5.961 1.00 0.22 H new ATOM 0 H22 DG A 17 -1.312 -1.928 -4.369 1.00 0.22 H new ATOM 549 P DG A 18 4.519 1.345 -9.416 1.00 0.21 P ATOM 550 OP1 DG A 18 5.557 1.601 -10.439 1.00 0.28 O ATOM 551 OP2 DG A 18 4.694 0.235 -8.451 1.00 0.29 O ATOM 552 O5' DG A 18 4.291 2.708 -8.578 1.00 0.28 O ATOM 553 C5' DG A 18 4.381 3.988 -9.224 1.00 0.18 C ATOM 554 C4' DG A 18 4.883 5.090 -8.297 1.00 0.14 C ATOM 555 O4' DG A 18 4.144 5.081 -7.056 1.00 0.23 O ATOM 556 C3' DG A 18 6.363 4.911 -7.965 1.00 0.10 C ATOM 557 O3' DG A 18 7.082 6.132 -8.197 1.00 0.16 O ATOM 558 C2' DG A 18 6.403 4.532 -6.513 1.00 0.19 C ATOM 559 C1' DG A 18 5.020 4.771 -5.951 1.00 0.18 C ATOM 560 N9 DG A 18 4.554 3.580 -5.231 1.00 0.10 N ATOM 561 C8 DG A 18 4.251 2.351 -5.707 1.00 0.11 C ATOM 562 N7 DG A 18 3.879 1.455 -4.855 1.00 0.19 N ATOM 563 C5 DG A 18 3.938 2.167 -3.651 1.00 0.10 C ATOM 564 C6 DG A 18 3.648 1.745 -2.325 1.00 0.12 C ATOM 565 O6 DG A 18 3.276 0.639 -1.941 1.00 0.23 O ATOM 566 N1 DG A 18 3.838 2.773 -1.410 1.00 0.09 N ATOM 567 C2 DG A 18 4.254 4.051 -1.726 1.00 0.22 C ATOM 568 N2 DG A 18 4.380 4.900 -0.709 1.00 0.31 N ATOM 569 N3 DG A 18 4.527 4.455 -2.969 1.00 0.25 N ATOM 570 C4 DG A 18 4.350 3.470 -3.876 1.00 0.12 C ATOM 0 H5' DG A 18 3.399 4.264 -9.609 1.00 0.18 H new ATOM 0 H5'' DG A 18 5.049 3.910 -10.081 1.00 0.18 H new ATOM 0 H4' DG A 18 4.740 6.035 -8.821 1.00 0.14 H new ATOM 0 H3' DG A 18 6.832 4.151 -8.590 1.00 0.10 H new ATOM 0 H2' DG A 18 6.691 3.487 -6.396 1.00 0.19 H new ATOM 0 H2'' DG A 18 7.143 5.128 -5.980 1.00 0.19 H new ATOM 0 H1' DG A 18 5.030 5.599 -5.242 1.00 0.18 H new ATOM 0 H8 DG A 18 4.318 2.127 -6.761 1.00 0.11 H new ATOM 0 H1 DG A 18 3.656 2.567 -0.428 1.00 0.09 H new ATOM 0 H21 DG A 18 4.684 5.859 -0.880 1.00 0.31 H new ATOM 0 H22 DG A 18 4.173 4.592 0.241 1.00 0.31 H new ATOM 582 P DG A 19 8.554 6.358 -7.578 1.00 0.19 P ATOM 583 OP1 DG A 19 9.079 7.644 -8.089 1.00 0.33 O ATOM 584 OP2 DG A 19 9.333 5.114 -7.769 1.00 0.22 O ATOM 585 O5' DG A 19 8.249 6.527 -6.003 1.00 0.16 O ATOM 586 C5' DG A 19 7.558 7.687 -5.516 1.00 0.19 C ATOM 587 C4' DG A 19 7.762 7.918 -4.030 1.00 0.08 C ATOM 588 O4' DG A 19 6.995 6.985 -3.238 1.00 0.07 O ATOM 589 C3' DG A 19 9.230 7.760 -3.656 1.00 0.12 C ATOM 590 O3' DG A 19 9.810 9.016 -3.239 1.00 0.13 O ATOM 591 C2' DG A 19 9.250 6.732 -2.553 1.00 0.18 C ATOM 592 C1' DG A 19 7.809 6.487 -2.160 1.00 0.10 C ATOM 593 N9 DG A 19 7.547 5.054 -1.924 1.00 0.08 N ATOM 594 C8 DG A 19 7.379 4.051 -2.817 1.00 0.08 C ATOM 595 N7 DG A 19 7.101 2.879 -2.356 1.00 0.08 N ATOM 596 C5 DG A 19 7.080 3.110 -0.979 1.00 0.06 C ATOM 597 C6 DG A 19 6.828 2.207 0.090 1.00 0.09 C ATOM 598 O6 DG A 19 6.569 1.005 0.023 1.00 0.08 O ATOM 599 N1 DG A 19 6.904 2.843 1.325 1.00 0.09 N ATOM 600 C2 DG A 19 7.188 4.184 1.510 1.00 0.06 C ATOM 601 N2 DG A 19 7.223 4.610 2.771 1.00 0.06 N ATOM 602 N3 DG A 19 7.424 5.039 0.507 1.00 0.04 N ATOM 603 C4 DG A 19 7.355 4.440 -0.703 1.00 0.05 C ATOM 0 H5' DG A 19 6.492 7.580 -5.719 1.00 0.19 H new ATOM 0 H5'' DG A 19 7.900 8.564 -6.065 1.00 0.19 H new ATOM 0 H4' DG A 19 7.426 8.934 -3.821 1.00 0.08 H new ATOM 0 H3' DG A 19 9.833 7.440 -4.506 1.00 0.12 H new ATOM 0 H2' DG A 19 9.721 5.809 -2.893 1.00 0.18 H new ATOM 0 H2'' DG A 19 9.828 7.090 -1.701 1.00 0.18 H new ATOM 0 H1' DG A 19 7.579 6.998 -1.225 1.00 0.10 H new ATOM 0 H8 DG A 19 7.474 4.226 -3.878 1.00 0.08 H new ATOM 0 H1 DG A 19 6.738 2.277 2.157 1.00 0.09 H new ATOM 0 H21 DG A 19 7.427 5.589 2.973 1.00 0.06 H new ATOM 0 H22 DG A 19 7.046 3.958 3.535 1.00 0.06 H new ATOM 615 P DC A 20 9.657 9.585 -1.731 1.00 0.15 P ATOM 616 OP1 DC A 20 11.013 9.752 -1.160 1.00 0.17 O ATOM 617 OP2 DC A 20 8.653 8.766 -1.017 1.00 0.16 O ATOM 618 O5' DC A 20 9.028 11.047 -1.969 1.00 0.18 O ATOM 619 C5' DC A 20 7.804 11.165 -2.685 1.00 0.14 C ATOM 620 C4' DC A 20 7.186 12.550 -2.586 1.00 0.14 C ATOM 621 O4' DC A 20 8.060 13.551 -3.152 1.00 0.22 O ATOM 622 C3' DC A 20 5.866 12.578 -3.344 1.00 0.12 C ATOM 623 O3' DC A 20 4.770 12.825 -2.456 1.00 0.11 O ATOM 624 C2' DC A 20 5.999 13.687 -4.352 1.00 0.11 C ATOM 625 C1' DC A 20 7.353 14.335 -4.138 1.00 0.20 C ATOM 626 N1 DC A 20 8.114 14.385 -5.404 1.00 0.24 N ATOM 627 C2 DC A 20 8.351 15.630 -5.970 1.00 0.28 C ATOM 628 O2 DC A 20 7.933 16.646 -5.420 1.00 0.34 O ATOM 629 N3 DC A 20 9.052 15.685 -7.135 1.00 0.30 N ATOM 630 C4 DC A 20 9.502 14.567 -7.721 1.00 0.36 C ATOM 631 N4 DC A 20 10.184 14.657 -8.863 1.00 0.47 N ATOM 632 C5 DC A 20 9.258 13.283 -7.140 1.00 0.46 C ATOM 633 C6 DC A 20 8.565 13.240 -5.987 1.00 0.38 C ATOM 0 H5' DC A 20 7.095 10.429 -2.305 1.00 0.14 H new ATOM 0 H5'' DC A 20 7.979 10.926 -3.734 1.00 0.14 H new ATOM 0 H4' DC A 20 7.026 12.771 -1.531 1.00 0.14 H new ATOM 0 H3' DC A 20 5.662 11.621 -3.825 1.00 0.12 H new ATOM 0 H2' DC A 20 5.917 13.296 -5.366 1.00 0.11 H new ATOM 0 H2'' DC A 20 5.200 14.418 -4.226 1.00 0.11 H new ATOM 0 H1' DC A 20 7.231 15.362 -3.792 1.00 0.20 H new ATOM 0 H41 DC A 20 10.531 13.812 -9.318 1.00 0.47 H new ATOM 0 H42 DC A 20 10.359 15.570 -9.282 1.00 0.47 H new ATOM 0 H5 DC A 20 9.617 12.379 -7.610 1.00 0.46 H new ATOM 0 H6 DC A 20 8.365 12.287 -5.519 1.00 0.38 H new ATOM 645 P DG A 21 4.453 11.816 -1.239 1.00 0.12 P ATOM 646 OP1 DG A 21 3.449 12.455 -0.360 1.00 0.13 O ATOM 647 OP2 DG A 21 5.738 11.351 -0.674 1.00 0.22 O ATOM 648 O5' DG A 21 3.749 10.572 -1.982 1.00 0.13 O ATOM 649 C5' DG A 21 2.523 10.020 -1.478 1.00 0.11 C ATOM 650 C4' DG A 21 2.516 9.912 0.042 1.00 0.10 C ATOM 651 O4' DG A 21 1.291 9.306 0.511 1.00 0.11 O ATOM 652 C3' DG A 21 3.678 9.060 0.543 1.00 0.12 C ATOM 653 O3' DG A 21 4.698 9.877 1.135 1.00 0.20 O ATOM 654 C2' DG A 21 3.076 8.117 1.553 1.00 0.12 C ATOM 655 C1' DG A 21 1.583 8.385 1.584 1.00 0.10 C ATOM 656 N9 DG A 21 0.828 7.126 1.432 1.00 0.14 N ATOM 657 C8 DG A 21 0.222 6.365 2.377 1.00 0.18 C ATOM 658 N7 DG A 21 -0.341 5.270 1.992 1.00 0.21 N ATOM 659 C5 DG A 21 -0.089 5.287 0.617 1.00 0.20 C ATOM 660 C6 DG A 21 -0.452 4.347 -0.385 1.00 0.21 C ATOM 661 O6 DG A 21 -1.071 3.295 -0.254 1.00 0.26 O ATOM 662 N1 DG A 21 -0.006 4.742 -1.640 1.00 0.18 N ATOM 663 C2 DG A 21 0.703 5.898 -1.903 1.00 0.15 C ATOM 664 N2 DG A 21 1.038 6.111 -3.176 1.00 0.18 N ATOM 665 N3 DG A 21 1.050 6.787 -0.965 1.00 0.13 N ATOM 666 C4 DG A 21 0.625 6.423 0.265 1.00 0.15 C ATOM 0 H5' DG A 21 2.368 9.032 -1.910 1.00 0.11 H new ATOM 0 H5'' DG A 21 1.688 10.643 -1.799 1.00 0.11 H new ATOM 0 H4' DG A 21 2.607 10.927 0.428 1.00 0.10 H new ATOM 0 H3' DG A 21 4.163 8.519 -0.270 1.00 0.12 H new ATOM 0 H2' DG A 21 3.275 7.081 1.278 1.00 0.12 H new ATOM 0 H2'' DG A 21 3.516 8.276 2.538 1.00 0.12 H new ATOM 0 H1' DG A 21 1.285 8.817 2.539 1.00 0.10 H new ATOM 0 H8 DG A 21 0.211 6.665 3.414 1.00 0.18 H new ATOM 0 H1 DG A 21 -0.219 4.131 -2.429 1.00 0.18 H new ATOM 0 H21 DG A 21 1.562 6.948 -3.432 1.00 0.18 H new ATOM 0 H22 DG A 21 0.770 5.437 -3.893 1.00 0.18 H new ATOM 678 P DG A 22 4.421 10.690 2.497 1.00 0.30 P ATOM 679 OP1 DG A 22 3.045 11.232 2.443 1.00 0.34 O ATOM 680 OP2 DG A 22 5.564 11.600 2.734 1.00 0.47 O ATOM 681 O5' DG A 22 4.462 9.527 3.611 1.00 0.27 O ATOM 682 C5' DG A 22 3.923 9.757 4.919 1.00 0.23 C ATOM 683 C4' DG A 22 4.089 8.558 5.844 1.00 0.19 C ATOM 684 O4' DG A 22 3.440 7.389 5.296 1.00 0.16 O ATOM 685 C3' DG A 22 5.563 8.215 6.060 1.00 0.21 C ATOM 686 O3' DG A 22 5.981 8.510 7.402 1.00 0.26 O ATOM 687 C2' DG A 22 5.683 6.745 5.772 1.00 0.19 C ATOM 688 C1' DG A 22 4.292 6.235 5.463 1.00 0.12 C ATOM 689 N9 DG A 22 4.293 5.398 4.249 1.00 0.14 N ATOM 690 C8 DG A 22 4.688 5.699 2.988 1.00 0.20 C ATOM 691 N7 DG A 22 4.588 4.774 2.094 1.00 0.21 N ATOM 692 C5 DG A 22 4.061 3.713 2.836 1.00 0.13 C ATOM 693 C6 DG A 22 3.720 2.394 2.426 1.00 0.15 C ATOM 694 O6 DG A 22 3.812 1.897 1.306 1.00 0.18 O ATOM 695 N1 DG A 22 3.225 1.643 3.485 1.00 0.17 N ATOM 696 C2 DG A 22 3.075 2.105 4.783 1.00 0.14 C ATOM 697 N2 DG A 22 2.578 1.245 5.667 1.00 0.26 N ATOM 698 N3 DG A 22 3.395 3.342 5.172 1.00 0.08 N ATOM 699 C4 DG A 22 3.880 4.089 4.157 1.00 0.09 C ATOM 0 H5' DG A 22 2.864 10.000 4.833 1.00 0.23 H new ATOM 0 H5'' DG A 22 4.414 10.623 5.362 1.00 0.23 H new ATOM 0 H4' DG A 22 3.632 8.835 6.794 1.00 0.19 H new ATOM 0 H3' DG A 22 6.205 8.808 5.409 1.00 0.21 H new ATOM 0 H2' DG A 22 6.352 6.571 4.930 1.00 0.19 H new ATOM 0 H2'' DG A 22 6.105 6.218 6.628 1.00 0.19 H new ATOM 0 H1' DG A 22 3.927 5.606 6.275 1.00 0.12 H new ATOM 0 H8 DG A 22 5.072 6.677 2.740 1.00 0.20 H new ATOM 0 H1 DG A 22 2.951 0.679 3.293 1.00 0.17 H new ATOM 0 H21 DG A 22 2.446 1.530 6.637 1.00 0.26 H new ATOM 0 H22 DG A 22 2.329 0.300 5.375 1.00 0.26 H new ATOM 711 P DG A 23 5.176 7.942 8.682 1.00 0.22 P ATOM 712 OP1 DG A 23 3.751 7.792 8.312 1.00 0.23 O ATOM 713 OP2 DG A 23 5.545 8.763 9.857 1.00 0.27 O ATOM 714 O5' DG A 23 5.797 6.469 8.888 1.00 0.14 O ATOM 715 C5' DG A 23 5.551 5.759 10.110 1.00 0.13 C ATOM 716 C4' DG A 23 6.170 4.367 10.129 1.00 0.06 C ATOM 717 O4' DG A 23 5.627 3.529 9.094 1.00 0.15 O ATOM 718 C3' DG A 23 7.676 4.418 9.915 1.00 0.16 C ATOM 719 O3' DG A 23 8.383 4.349 11.159 1.00 0.14 O ATOM 720 C2' DG A 23 7.988 3.239 9.040 1.00 0.40 C ATOM 721 C1' DG A 23 6.660 2.629 8.644 1.00 0.27 C ATOM 722 N9 DG A 23 6.584 2.405 7.186 1.00 0.21 N ATOM 723 C8 DG A 23 6.837 3.257 6.159 1.00 0.19 C ATOM 724 N7 DG A 23 6.707 2.801 4.959 1.00 0.16 N ATOM 725 C5 DG A 23 6.320 1.480 5.196 1.00 0.11 C ATOM 726 C6 DG A 23 6.021 0.442 4.273 1.00 0.09 C ATOM 727 O6 DG A 23 6.044 0.489 3.043 1.00 0.13 O ATOM 728 N1 DG A 23 5.673 -0.737 4.926 1.00 0.18 N ATOM 729 C2 DG A 23 5.620 -0.899 6.296 1.00 0.24 C ATOM 730 N2 DG A 23 5.262 -2.107 6.734 1.00 0.31 N ATOM 731 N3 DG A 23 5.900 0.073 7.170 1.00 0.25 N ATOM 732 C4 DG A 23 6.241 1.229 6.558 1.00 0.17 C ATOM 0 H5' DG A 23 4.475 5.674 10.263 1.00 0.13 H new ATOM 0 H5'' DG A 23 5.947 6.337 10.945 1.00 0.13 H new ATOM 0 H4' DG A 23 5.938 3.957 11.112 1.00 0.06 H new ATOM 0 H3' DG A 23 7.987 5.356 9.454 1.00 0.16 H new ATOM 0 H2' DG A 23 8.550 3.549 8.159 1.00 0.40 H new ATOM 0 H2'' DG A 23 8.604 2.514 9.572 1.00 0.40 H new ATOM 0 HO3' DG A 23 9.348 4.382 10.989 1.00 0.14 H new ATOM 0 H1' DG A 23 6.538 1.650 9.107 1.00 0.27 H new ATOM 0 H8 DG A 23 7.136 4.279 6.340 1.00 0.19 H new ATOM 0 H1 DG A 23 5.439 -1.544 4.347 1.00 0.18 H new ATOM 0 H21 DG A 23 5.204 -2.290 7.736 1.00 0.31 H new ATOM 0 H22 DG A 23 5.046 -2.848 6.067 1.00 0.31 H new TER 745 DG A 23