USER MOD reduce.3.24.130724 H: found=0, std=0, add=276, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 276 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 Set 1.1: A 7 DT C7 :methyl 150:sc= -1.32 (180deg=-1.32) USER MOD Set 1.2: B 1 DA O5' : rot 180:sc= 0 USER MOD Set 2.1: A 1 DA O5' : rot 180:sc= 0 USER MOD Set 2.2: B 7 DT C7 :methyl 150:sc= -1.29 (180deg=-1.29) USER MOD Single : A 5 DT C7 :methyl 150:sc= -1.14 (180deg=-1.14) USER MOD Single : A 6 DT C7 :methyl 150:sc= -0.241 (180deg=-0.241) USER MOD Single : A 8 DT C7 :methyl -30:sc=-0.00389 (180deg=-1.65!) USER MOD Single : A 12 DG O3' : rot 180:sc= 0 USER MOD Single : B 5 DT C7 :methyl 150:sc= -1.13 (180deg=-1.13) USER MOD Single : B 6 DT C7 :methyl 150:sc= -0.238 (180deg=-0.238) USER MOD Single : B 8 DT C7 :methyl -30:sc=-0.00398 (180deg=-1.66!) USER MOD Single : B 12 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 12.568 6.757 2.607 1.00 0.00 O ATOM 2 C5' DA A 1 12.025 7.856 1.867 1.00 0.00 C ATOM 3 C4' DA A 1 11.029 8.667 2.711 1.00 0.00 C ATOM 4 O4' DA A 1 10.500 9.788 1.956 1.00 0.00 O ATOM 5 C3' DA A 1 9.849 7.807 3.165 1.00 0.00 C ATOM 6 O3' DA A 1 9.761 7.779 4.600 1.00 0.00 O ATOM 7 C2' DA A 1 8.620 8.445 2.558 1.00 0.00 C ATOM 8 C1' DA A 1 9.055 9.779 1.994 1.00 0.00 C ATOM 9 N9 DA A 1 8.475 9.977 0.662 1.00 0.00 N ATOM 10 C8 DA A 1 7.366 10.663 0.332 1.00 0.00 C ATOM 11 N7 DA A 1 7.007 10.668 -0.906 1.00 0.00 N ATOM 12 C5 DA A 1 8.006 9.882 -1.486 1.00 0.00 C ATOM 13 C6 DA A 1 8.239 9.474 -2.798 1.00 0.00 C ATOM 14 N6 DA A 1 7.430 9.789 -3.806 1.00 0.00 N ATOM 15 N1 DA A 1 9.319 8.707 -3.029 1.00 0.00 N ATOM 16 C2 DA A 1 10.124 8.358 -2.026 1.00 0.00 C ATOM 17 N3 DA A 1 9.998 8.688 -0.741 1.00 0.00 N ATOM 18 C4 DA A 1 8.909 9.458 -0.539 1.00 0.00 C ATOM 0 H5' DA A 1 11.526 7.483 0.973 1.00 0.00 H new ATOM 0 H5'' DA A 1 12.834 8.506 1.533 1.00 0.00 H new ATOM 0 H4' DA A 1 11.579 9.025 3.581 1.00 0.00 H new ATOM 0 H3' DA A 1 9.959 6.771 2.843 1.00 0.00 H new ATOM 0 H2' DA A 1 8.202 7.812 1.775 1.00 0.00 H new ATOM 0 H2'' DA A 1 7.842 8.578 3.310 1.00 0.00 H new ATOM 0 HO5' DA A 1 13.196 6.261 2.042 1.00 0.00 H new ATOM 0 H1' DA A 1 8.704 10.601 2.617 1.00 0.00 H new ATOM 0 H8 DA A 1 6.795 11.193 1.080 1.00 0.00 H new ATOM 0 H61 DA A 1 7.642 9.467 -4.750 1.00 0.00 H new ATOM 0 H62 DA A 1 6.597 10.353 -3.635 1.00 0.00 H new ATOM 0 H2 DA A 1 10.972 7.740 -2.283 1.00 0.00 H new ATOM 31 P DA A 2 8.538 7.032 5.348 1.00 0.00 P ATOM 32 OP1 DA A 2 8.798 7.043 6.803 1.00 0.00 O ATOM 33 OP2 DA A 2 8.278 5.750 4.660 1.00 0.00 O ATOM 34 O5' DA A 2 7.300 8.012 5.054 1.00 0.00 O ATOM 35 C5' DA A 2 7.166 9.276 5.714 1.00 0.00 C ATOM 36 C4' DA A 2 5.870 9.964 5.283 1.00 0.00 C ATOM 37 O4' DA A 2 5.883 10.209 3.852 1.00 0.00 O ATOM 38 C3' DA A 2 4.624 9.116 5.594 1.00 0.00 C ATOM 39 O3' DA A 2 3.707 9.856 6.413 1.00 0.00 O ATOM 40 C2' DA A 2 4.016 8.800 4.258 1.00 0.00 C ATOM 41 C1' DA A 2 4.638 9.766 3.273 1.00 0.00 C ATOM 42 N9 DA A 2 4.834 9.133 1.948 1.00 0.00 N ATOM 43 C8 DA A 2 5.387 7.938 1.616 1.00 0.00 C ATOM 44 N7 DA A 2 5.399 7.614 0.363 1.00 0.00 N ATOM 45 C5 DA A 2 4.776 8.723 -0.218 1.00 0.00 C ATOM 46 C6 DA A 2 4.455 9.045 -1.542 1.00 0.00 C ATOM 47 N6 DA A 2 4.735 8.250 -2.574 1.00 0.00 N ATOM 48 N1 DA A 2 3.841 10.221 -1.761 1.00 0.00 N ATOM 49 C2 DA A 2 3.563 11.036 -0.741 1.00 0.00 C ATOM 50 N3 DA A 2 3.822 10.831 0.544 1.00 0.00 N ATOM 51 C4 DA A 2 4.432 9.649 0.738 1.00 0.00 C ATOM 0 H5' DA A 2 8.019 9.911 5.476 1.00 0.00 H new ATOM 0 H5'' DA A 2 7.168 9.132 6.794 1.00 0.00 H new ATOM 0 H4' DA A 2 5.818 10.896 5.845 1.00 0.00 H new ATOM 0 H3' DA A 2 4.872 8.209 6.146 1.00 0.00 H new ATOM 0 H2' DA A 2 4.219 7.768 3.972 1.00 0.00 H new ATOM 0 H2'' DA A 2 2.933 8.916 4.286 1.00 0.00 H new ATOM 0 H1' DA A 2 3.982 10.618 3.096 1.00 0.00 H new ATOM 0 H8 DA A 2 5.801 7.283 2.369 1.00 0.00 H new ATOM 0 H61 DA A 2 4.479 8.533 -3.520 1.00 0.00 H new ATOM 0 H62 DA A 2 5.205 7.359 -2.418 1.00 0.00 H new ATOM 0 H2 DA A 2 3.073 11.966 -0.989 1.00 0.00 H new ATOM 63 P DG A 3 3.255 9.308 7.866 1.00 0.00 P ATOM 64 OP1 DG A 3 3.379 10.420 8.836 1.00 0.00 O ATOM 65 OP2 DG A 3 3.949 8.026 8.116 1.00 0.00 O ATOM 66 O5' DG A 3 1.690 9.002 7.650 1.00 0.00 O ATOM 67 C5' DG A 3 1.138 9.103 6.343 1.00 0.00 C ATOM 68 C4' DG A 3 -0.338 9.464 6.359 1.00 0.00 C ATOM 69 O4' DG A 3 -0.865 9.510 5.008 1.00 0.00 O ATOM 70 C3' DG A 3 -1.126 8.432 7.138 1.00 0.00 C ATOM 71 O3' DG A 3 -2.061 9.082 8.013 1.00 0.00 O ATOM 72 C2' DG A 3 -1.829 7.618 6.074 1.00 0.00 C ATOM 73 C1' DG A 3 -1.902 8.523 4.854 1.00 0.00 C ATOM 74 N9 DG A 3 -1.740 7.780 3.586 1.00 0.00 N ATOM 75 C8 DG A 3 -2.379 7.972 2.407 1.00 0.00 C ATOM 76 N7 DG A 3 -2.054 7.212 1.413 1.00 0.00 N ATOM 77 C5 DG A 3 -1.073 6.398 1.995 1.00 0.00 C ATOM 78 C6 DG A 3 -0.315 5.345 1.423 1.00 0.00 C ATOM 79 O6 DG A 3 -0.359 4.917 0.271 1.00 0.00 O ATOM 80 N1 DG A 3 0.562 4.785 2.348 1.00 0.00 N ATOM 81 C2 DG A 3 0.696 5.191 3.664 1.00 0.00 C ATOM 82 N2 DG A 3 1.594 4.541 4.405 1.00 0.00 N ATOM 83 N3 DG A 3 -0.016 6.182 4.206 1.00 0.00 N ATOM 84 C4 DG A 3 -0.875 6.741 3.325 1.00 0.00 C ATOM 0 H5' DG A 3 1.271 8.155 5.822 1.00 0.00 H new ATOM 0 H5'' DG A 3 1.687 9.857 5.778 1.00 0.00 H new ATOM 0 H4' DG A 3 -0.435 10.442 6.830 1.00 0.00 H new ATOM 0 H3' DG A 3 -0.502 7.807 7.776 1.00 0.00 H new ATOM 0 H2' DG A 3 -1.279 6.703 5.852 1.00 0.00 H new ATOM 0 H2'' DG A 3 -2.825 7.320 6.402 1.00 0.00 H new ATOM 0 H1' DG A 3 -2.887 8.986 4.796 1.00 0.00 H new ATOM 0 H8 DG A 3 -3.136 8.735 2.301 1.00 0.00 H new ATOM 0 H1 DG A 3 1.152 4.016 2.031 1.00 0.00 H new ATOM 0 H21 DG A 3 1.733 4.800 5.382 1.00 0.00 H new ATOM 0 H22 DG A 3 2.142 3.785 3.995 1.00 0.00 H new ATOM 96 P DG A 4 -3.222 8.259 8.765 1.00 0.00 P ATOM 97 OP1 DG A 4 -3.908 9.185 9.696 1.00 0.00 O ATOM 98 OP2 DG A 4 -2.646 6.995 9.272 1.00 0.00 O ATOM 99 O5' DG A 4 -4.224 7.918 7.554 1.00 0.00 O ATOM 100 C5' DG A 4 -5.008 8.960 6.965 1.00 0.00 C ATOM 101 C4' DG A 4 -5.748 8.482 5.725 1.00 0.00 C ATOM 102 O4' DG A 4 -4.847 7.953 4.735 1.00 0.00 O ATOM 103 C3' DG A 4 -6.728 7.379 6.074 1.00 0.00 C ATOM 104 O3' DG A 4 -8.062 7.877 6.193 1.00 0.00 O ATOM 105 C2' DG A 4 -6.620 6.389 4.942 1.00 0.00 C ATOM 106 C1' DG A 4 -5.540 6.919 4.016 1.00 0.00 C ATOM 107 N9 DG A 4 -4.635 5.834 3.617 1.00 0.00 N ATOM 108 C8 DG A 4 -3.853 5.045 4.385 1.00 0.00 C ATOM 109 N7 DG A 4 -3.186 4.110 3.798 1.00 0.00 N ATOM 110 C5 DG A 4 -3.566 4.288 2.467 1.00 0.00 C ATOM 111 C6 DG A 4 -3.183 3.567 1.312 1.00 0.00 C ATOM 112 O6 DG A 4 -2.399 2.621 1.234 1.00 0.00 O ATOM 113 N1 DG A 4 -3.806 4.066 0.171 1.00 0.00 N ATOM 114 C2 DG A 4 -4.686 5.134 0.147 1.00 0.00 C ATOM 115 N2 DG A 4 -5.201 5.467 -1.038 1.00 0.00 N ATOM 116 N3 DG A 4 -5.042 5.818 1.233 1.00 0.00 N ATOM 117 C4 DG A 4 -4.453 5.345 2.351 1.00 0.00 C ATOM 0 H5' DG A 4 -4.361 9.796 6.701 1.00 0.00 H new ATOM 0 H5'' DG A 4 -5.726 9.331 7.696 1.00 0.00 H new ATOM 0 H4' DG A 4 -6.268 9.353 5.326 1.00 0.00 H new ATOM 0 H3' DG A 4 -6.496 6.928 7.039 1.00 0.00 H new ATOM 0 H2' DG A 4 -6.361 5.398 5.315 1.00 0.00 H new ATOM 0 H2'' DG A 4 -7.570 6.293 4.417 1.00 0.00 H new ATOM 0 H1' DG A 4 -5.964 7.323 3.097 1.00 0.00 H new ATOM 0 H8 DG A 4 -3.788 5.192 5.453 1.00 0.00 H new ATOM 0 H1 DG A 4 -3.598 3.609 -0.717 1.00 0.00 H new ATOM 0 H21 DG A 4 -5.855 6.247 -1.109 1.00 0.00 H new ATOM 0 H22 DG A 4 -4.941 4.942 -1.873 1.00 0.00 H new ATOM 129 P DT A 5 -9.216 6.958 6.843 1.00 0.00 P ATOM 130 OP1 DT A 5 -10.286 7.850 7.346 1.00 0.00 O ATOM 131 OP2 DT A 5 -8.573 5.989 7.761 1.00 0.00 O ATOM 132 O5' DT A 5 -9.786 6.152 5.571 1.00 0.00 O ATOM 133 C5' DT A 5 -10.601 6.822 4.605 1.00 0.00 C ATOM 134 C4' DT A 5 -10.640 6.082 3.276 1.00 0.00 C ATOM 135 O4' DT A 5 -9.308 5.701 2.858 1.00 0.00 O ATOM 136 C3' DT A 5 -11.483 4.810 3.366 1.00 0.00 C ATOM 137 O3' DT A 5 -12.615 4.860 2.484 1.00 0.00 O ATOM 138 C2' DT A 5 -10.557 3.703 2.922 1.00 0.00 C ATOM 139 C1' DT A 5 -9.382 4.406 2.254 1.00 0.00 C ATOM 140 N1 DT A 5 -8.135 3.637 2.417 1.00 0.00 N ATOM 141 C2 DT A 5 -7.481 3.258 1.262 1.00 0.00 C ATOM 142 O2 DT A 5 -7.889 3.578 0.145 1.00 0.00 O ATOM 143 N3 DT A 5 -6.334 2.508 1.432 1.00 0.00 N ATOM 144 C4 DT A 5 -5.787 2.118 2.641 1.00 0.00 C ATOM 145 O4 DT A 5 -4.751 1.457 2.675 1.00 0.00 O ATOM 146 C5 DT A 5 -6.539 2.564 3.796 1.00 0.00 C ATOM 147 C7 DT A 5 -6.047 2.208 5.196 1.00 0.00 C ATOM 148 C6 DT A 5 -7.666 3.290 3.654 1.00 0.00 C ATOM 0 H5' DT A 5 -10.219 7.831 4.447 1.00 0.00 H new ATOM 0 H5'' DT A 5 -11.615 6.922 4.993 1.00 0.00 H new ATOM 0 H4' DT A 5 -11.083 6.767 2.553 1.00 0.00 H new ATOM 0 H3' DT A 5 -11.875 4.671 4.373 1.00 0.00 H new ATOM 0 H2' DT A 5 -10.226 3.103 3.770 1.00 0.00 H new ATOM 0 H2'' DT A 5 -11.057 3.027 2.229 1.00 0.00 H new ATOM 0 H1' DT A 5 -9.522 4.493 1.177 1.00 0.00 H new ATOM 0 H3 DT A 5 -5.844 2.214 0.587 1.00 0.00 H new ATOM 0 H71 DT A 5 -6.346 2.988 5.896 1.00 0.00 H new ATOM 0 H72 DT A 5 -6.483 1.257 5.504 1.00 0.00 H new ATOM 0 H73 DT A 5 -4.960 2.124 5.189 1.00 0.00 H new ATOM 0 H6 DT A 5 -8.209 3.603 4.534 1.00 0.00 H new ATOM 161 P DT A 6 -13.814 5.911 2.691 1.00 0.00 P ATOM 162 OP1 DT A 6 -13.243 7.189 3.169 1.00 0.00 O ATOM 163 OP2 DT A 6 -14.894 5.246 3.457 1.00 0.00 O ATOM 164 O5' DT A 6 -14.324 6.123 1.180 1.00 0.00 O ATOM 165 C5' DT A 6 -15.295 5.242 0.596 1.00 0.00 C ATOM 166 C4' DT A 6 -14.700 4.400 -0.549 1.00 0.00 C ATOM 167 O4' DT A 6 -13.969 5.242 -1.477 1.00 0.00 O ATOM 168 C3' DT A 6 -13.739 3.325 -0.035 1.00 0.00 C ATOM 169 O3' DT A 6 -14.103 2.048 -0.579 1.00 0.00 O ATOM 170 C2' DT A 6 -12.366 3.734 -0.526 1.00 0.00 C ATOM 171 C1' DT A 6 -12.605 4.781 -1.618 1.00 0.00 C ATOM 172 N1 DT A 6 -11.661 5.924 -1.523 1.00 0.00 N ATOM 173 C2 DT A 6 -10.798 6.117 -2.589 1.00 0.00 C ATOM 174 O2 DT A 6 -10.737 5.332 -3.532 1.00 0.00 O ATOM 175 N3 DT A 6 -9.995 7.238 -2.530 1.00 0.00 N ATOM 176 C4 DT A 6 -9.971 8.171 -1.514 1.00 0.00 C ATOM 177 O4 DT A 6 -9.224 9.146 -1.580 1.00 0.00 O ATOM 178 C5 DT A 6 -10.896 7.891 -0.437 1.00 0.00 C ATOM 179 C7 DT A 6 -10.971 8.849 0.748 1.00 0.00 C ATOM 180 C6 DT A 6 -11.695 6.802 -0.467 1.00 0.00 C ATOM 0 H5' DT A 6 -16.133 5.827 0.217 1.00 0.00 H new ATOM 0 H5'' DT A 6 -15.691 4.579 1.365 1.00 0.00 H new ATOM 0 H4' DT A 6 -15.543 3.920 -1.046 1.00 0.00 H new ATOM 0 H3' DT A 6 -13.765 3.239 1.051 1.00 0.00 H new ATOM 0 H2' DT A 6 -11.768 4.147 0.286 1.00 0.00 H new ATOM 0 H2'' DT A 6 -11.821 2.876 -0.920 1.00 0.00 H new ATOM 0 H1' DT A 6 -12.436 4.329 -2.595 1.00 0.00 H new ATOM 0 H3 DT A 6 -9.359 7.391 -3.312 1.00 0.00 H new ATOM 0 H71 DT A 6 -11.980 8.838 1.161 1.00 0.00 H new ATOM 0 H72 DT A 6 -10.262 8.536 1.514 1.00 0.00 H new ATOM 0 H73 DT A 6 -10.725 9.858 0.416 1.00 0.00 H new ATOM 0 H6 DT A 6 -12.372 6.618 0.354 1.00 0.00 H new ATOM 193 P DT A 7 -14.312 0.754 0.361 1.00 0.00 P ATOM 194 OP1 DT A 7 -15.663 0.212 0.107 1.00 0.00 O ATOM 195 OP2 DT A 7 -13.904 1.099 1.739 1.00 0.00 O ATOM 196 O5' DT A 7 -13.232 -0.285 -0.228 1.00 0.00 O ATOM 197 C5' DT A 7 -12.951 -0.334 -1.631 1.00 0.00 C ATOM 198 C4' DT A 7 -11.575 -0.956 -1.897 1.00 0.00 C ATOM 199 O4' DT A 7 -10.565 -0.360 -1.041 1.00 0.00 O ATOM 200 C3' DT A 7 -11.604 -2.454 -1.600 1.00 0.00 C ATOM 201 O3' DT A 7 -10.975 -3.195 -2.650 1.00 0.00 O ATOM 202 C2' DT A 7 -10.800 -2.605 -0.332 1.00 0.00 C ATOM 203 C1' DT A 7 -9.884 -1.402 -0.311 1.00 0.00 C ATOM 204 N1 DT A 7 -9.581 -1.000 1.073 1.00 0.00 N ATOM 205 C2 DT A 7 -8.318 -1.289 1.561 1.00 0.00 C ATOM 206 O2 DT A 7 -7.450 -1.818 0.874 1.00 0.00 O ATOM 207 N3 DT A 7 -8.081 -0.945 2.872 1.00 0.00 N ATOM 208 C4 DT A 7 -8.981 -0.340 3.728 1.00 0.00 C ATOM 209 O4 DT A 7 -8.656 -0.069 4.879 1.00 0.00 O ATOM 210 C5 DT A 7 -10.277 -0.074 3.138 1.00 0.00 C ATOM 211 C7 DT A 7 -11.374 0.558 3.997 1.00 0.00 C ATOM 212 C6 DT A 7 -10.533 -0.403 1.851 1.00 0.00 C ATOM 0 H5' DT A 7 -12.985 0.673 -2.047 1.00 0.00 H new ATOM 0 H5'' DT A 7 -13.721 -0.915 -2.139 1.00 0.00 H new ATOM 0 H4' DT A 7 -11.333 -0.776 -2.945 1.00 0.00 H new ATOM 0 H3' DT A 7 -12.624 -2.827 -1.509 1.00 0.00 H new ATOM 0 H2' DT A 7 -11.446 -2.626 0.546 1.00 0.00 H new ATOM 0 H2'' DT A 7 -10.232 -3.535 -0.332 1.00 0.00 H new ATOM 0 H1' DT A 7 -8.922 -1.622 -0.774 1.00 0.00 H new ATOM 0 H3 DT A 7 -7.156 -1.156 3.246 1.00 0.00 H new ATOM 0 H71 DT A 7 -12.030 1.157 3.366 1.00 0.00 H new ATOM 0 H72 DT A 7 -11.954 -0.227 4.482 1.00 0.00 H new ATOM 0 H73 DT A 7 -10.920 1.195 4.756 1.00 0.00 H new ATOM 0 H6 DT A 7 -11.505 -0.190 1.432 1.00 0.00 H new ATOM 225 P DT A 8 -11.483 -3.130 -4.178 1.00 0.00 P ATOM 226 OP1 DT A 8 -11.652 -1.712 -4.564 1.00 0.00 O ATOM 227 OP2 DT A 8 -12.599 -4.087 -4.350 1.00 0.00 O ATOM 228 O5' DT A 8 -10.202 -3.712 -4.961 1.00 0.00 O ATOM 229 C5' DT A 8 -9.080 -4.215 -4.223 1.00 0.00 C ATOM 230 C4' DT A 8 -8.573 -5.527 -4.791 1.00 0.00 C ATOM 231 O4' DT A 8 -9.656 -6.487 -4.910 1.00 0.00 O ATOM 232 C3' DT A 8 -7.981 -5.319 -6.177 1.00 0.00 C ATOM 233 O3' DT A 8 -6.726 -5.996 -6.291 1.00 0.00 O ATOM 234 C2' DT A 8 -8.984 -5.924 -7.127 1.00 0.00 C ATOM 235 C1' DT A 8 -9.784 -6.909 -6.287 1.00 0.00 C ATOM 236 N1 DT A 8 -11.204 -6.969 -6.718 1.00 0.00 N ATOM 237 C2 DT A 8 -11.668 -8.179 -7.212 1.00 0.00 C ATOM 238 O2 DT A 8 -10.950 -9.174 -7.297 1.00 0.00 O ATOM 239 N3 DT A 8 -12.990 -8.208 -7.611 1.00 0.00 N ATOM 240 C4 DT A 8 -13.880 -7.151 -7.563 1.00 0.00 C ATOM 241 O4 DT A 8 -15.039 -7.292 -7.950 1.00 0.00 O ATOM 242 C5 DT A 8 -13.314 -5.931 -7.035 1.00 0.00 C ATOM 243 C7 DT A 8 -14.187 -4.683 -6.924 1.00 0.00 C ATOM 244 C6 DT A 8 -12.027 -5.874 -6.637 1.00 0.00 C ATOM 0 H5' DT A 8 -9.365 -4.356 -3.180 1.00 0.00 H new ATOM 0 H5'' DT A 8 -8.277 -3.479 -4.237 1.00 0.00 H new ATOM 0 H4' DT A 8 -7.811 -5.903 -4.109 1.00 0.00 H new ATOM 0 H3' DT A 8 -7.797 -4.265 -6.387 1.00 0.00 H new ATOM 0 H2' DT A 8 -9.630 -5.159 -7.558 1.00 0.00 H new ATOM 0 H2'' DT A 8 -8.487 -6.427 -7.957 1.00 0.00 H new ATOM 0 H1' DT A 8 -9.399 -7.921 -6.411 1.00 0.00 H new ATOM 0 H3 DT A 8 -13.343 -9.093 -7.976 1.00 0.00 H new ATOM 0 H71 DT A 8 -14.944 -4.697 -7.709 1.00 0.00 H new ATOM 0 H72 DT A 8 -14.675 -4.666 -5.950 1.00 0.00 H new ATOM 0 H73 DT A 8 -13.566 -3.794 -7.035 1.00 0.00 H new ATOM 0 H6 DT A 8 -11.635 -4.947 -6.246 1.00 0.00 H new ATOM 257 P DA A 9 -5.511 -5.343 -7.114 1.00 0.00 P ATOM 258 OP1 DA A 9 -6.060 -4.334 -8.044 1.00 0.00 O ATOM 259 OP2 DA A 9 -4.659 -6.436 -7.633 1.00 0.00 O ATOM 260 O5' DA A 9 -4.693 -4.580 -5.961 1.00 0.00 O ATOM 261 C5' DA A 9 -5.185 -3.363 -5.394 1.00 0.00 C ATOM 262 C4' DA A 9 -4.628 -3.152 -3.983 1.00 0.00 C ATOM 263 O4' DA A 9 -4.804 -1.783 -3.554 1.00 0.00 O ATOM 264 C3' DA A 9 -5.319 -4.056 -2.952 1.00 0.00 C ATOM 265 O3' DA A 9 -4.353 -4.889 -2.300 1.00 0.00 O ATOM 266 C2' DA A 9 -5.962 -3.113 -1.967 1.00 0.00 C ATOM 267 C1' DA A 9 -5.267 -1.780 -2.192 1.00 0.00 C ATOM 268 N9 DA A 9 -6.159 -0.649 -1.928 1.00 0.00 N ATOM 269 C8 DA A 9 -6.147 0.195 -0.881 1.00 0.00 C ATOM 270 N7 DA A 9 -6.999 1.160 -0.877 1.00 0.00 N ATOM 271 C5 DA A 9 -7.679 0.934 -2.082 1.00 0.00 C ATOM 272 C6 DA A 9 -8.734 1.599 -2.718 1.00 0.00 C ATOM 273 N6 DA A 9 -9.295 2.707 -2.231 1.00 0.00 N ATOM 274 N1 DA A 9 -9.161 1.099 -3.895 1.00 0.00 N ATOM 275 C2 DA A 9 -8.583 0.011 -4.417 1.00 0.00 C ATOM 276 N3 DA A 9 -7.578 -0.688 -3.900 1.00 0.00 N ATOM 277 C4 DA A 9 -7.172 -0.171 -2.725 1.00 0.00 C ATOM 0 H5' DA A 9 -6.274 -3.388 -5.359 1.00 0.00 H new ATOM 0 H5'' DA A 9 -4.905 -2.522 -6.029 1.00 0.00 H new ATOM 0 H4' DA A 9 -3.568 -3.402 -4.036 1.00 0.00 H new ATOM 0 H3' DA A 9 -6.052 -4.720 -3.411 1.00 0.00 H new ATOM 0 H2' DA A 9 -7.035 -3.033 -2.139 1.00 0.00 H new ATOM 0 H2'' DA A 9 -5.829 -3.460 -0.942 1.00 0.00 H new ATOM 0 H1' DA A 9 -4.434 -1.661 -1.500 1.00 0.00 H new ATOM 0 H8 DA A 9 -5.445 0.067 -0.070 1.00 0.00 H new ATOM 0 H61 DA A 9 -10.062 3.154 -2.734 1.00 0.00 H new ATOM 0 H62 DA A 9 -8.957 3.108 -1.356 1.00 0.00 H new ATOM 0 H2 DA A 9 -8.976 -0.337 -5.361 1.00 0.00 H new ATOM 289 P DA A 10 -4.773 -6.060 -1.266 1.00 0.00 P ATOM 290 OP1 DA A 10 -5.331 -7.186 -2.048 1.00 0.00 O ATOM 291 OP2 DA A 10 -5.563 -5.458 -0.167 1.00 0.00 O ATOM 292 O5' DA A 10 -3.343 -6.496 -0.686 1.00 0.00 O ATOM 293 C5' DA A 10 -2.175 -6.243 -1.467 1.00 0.00 C ATOM 294 C4' DA A 10 -1.007 -5.708 -0.615 1.00 0.00 C ATOM 295 O4' DA A 10 -1.188 -4.321 -0.254 1.00 0.00 O ATOM 296 C3' DA A 10 -0.759 -6.491 0.687 1.00 0.00 C ATOM 297 O3' DA A 10 0.614 -6.931 0.749 1.00 0.00 O ATOM 298 C2' DA A 10 -1.027 -5.483 1.792 1.00 0.00 C ATOM 299 C1' DA A 10 -0.838 -4.146 1.133 1.00 0.00 C ATOM 300 N9 DA A 10 -1.652 -3.105 1.733 1.00 0.00 N ATOM 301 C8 DA A 10 -2.472 -2.241 1.132 1.00 0.00 C ATOM 302 N7 DA A 10 -2.980 -1.295 1.850 1.00 0.00 N ATOM 303 C5 DA A 10 -2.420 -1.579 3.100 1.00 0.00 C ATOM 304 C6 DA A 10 -2.522 -0.970 4.351 1.00 0.00 C ATOM 305 N6 DA A 10 -3.247 0.127 4.565 1.00 0.00 N ATOM 306 N1 DA A 10 -1.832 -1.525 5.367 1.00 0.00 N ATOM 307 C2 DA A 10 -1.085 -2.616 5.156 1.00 0.00 C ATOM 308 N3 DA A 10 -0.917 -3.259 4.019 1.00 0.00 N ATOM 309 C4 DA A 10 -1.615 -2.687 3.028 1.00 0.00 C ATOM 0 H5' DA A 10 -2.412 -5.521 -2.248 1.00 0.00 H new ATOM 0 H5'' DA A 10 -1.867 -7.162 -1.965 1.00 0.00 H new ATOM 0 H4' DA A 10 -0.142 -5.833 -1.266 1.00 0.00 H new ATOM 0 H3' DA A 10 -1.387 -7.378 0.764 1.00 0.00 H new ATOM 0 H2' DA A 10 -2.036 -5.590 2.191 1.00 0.00 H new ATOM 0 H2'' DA A 10 -0.338 -5.616 2.626 1.00 0.00 H new ATOM 0 H1' DA A 10 0.195 -3.819 1.256 1.00 0.00 H new ATOM 0 H8 DA A 10 -2.703 -2.330 0.081 1.00 0.00 H new ATOM 0 H61 DA A 10 -3.290 0.536 5.499 1.00 0.00 H new ATOM 0 H62 DA A 10 -3.759 0.558 3.795 1.00 0.00 H new ATOM 0 H2 DA A 10 -0.562 -3.013 6.014 1.00 0.00 H new ATOM 321 P DG A 11 1.155 -8.184 -0.122 1.00 0.00 P ATOM 322 OP1 DG A 11 0.009 -8.774 -0.848 1.00 0.00 O ATOM 323 OP2 DG A 11 1.977 -9.034 0.763 1.00 0.00 O ATOM 324 O5' DG A 11 2.125 -7.498 -1.206 1.00 0.00 O ATOM 325 C5' DG A 11 1.558 -6.655 -2.204 1.00 0.00 C ATOM 326 C4' DG A 11 2.338 -6.637 -3.492 1.00 0.00 C ATOM 327 O4' DG A 11 1.598 -5.894 -4.472 1.00 0.00 O ATOM 328 C3' DG A 11 3.669 -5.943 -3.296 1.00 0.00 C ATOM 329 O3' DG A 11 4.684 -6.623 -4.042 1.00 0.00 O ATOM 330 C2' DG A 11 3.435 -4.533 -3.783 1.00 0.00 C ATOM 331 C1' DG A 11 2.150 -4.568 -4.589 1.00 0.00 C ATOM 332 N9 DG A 11 1.191 -3.551 -4.131 1.00 0.00 N ATOM 333 C8 DG A 11 0.248 -2.945 -4.860 1.00 0.00 C ATOM 334 N7 DG A 11 -0.520 -2.088 -4.277 1.00 0.00 N ATOM 335 C5 DG A 11 -0.027 -2.115 -2.968 1.00 0.00 C ATOM 336 C6 DG A 11 -0.451 -1.385 -1.827 1.00 0.00 C ATOM 337 O6 DG A 11 -1.372 -0.569 -1.749 1.00 0.00 O ATOM 338 N1 DG A 11 0.311 -1.698 -0.705 1.00 0.00 N ATOM 339 C2 DG A 11 1.355 -2.609 -0.685 1.00 0.00 C ATOM 340 N2 DG A 11 1.973 -2.789 0.486 1.00 0.00 N ATOM 341 N3 DG A 11 1.758 -3.303 -1.759 1.00 0.00 N ATOM 342 C4 DG A 11 1.028 -3.011 -2.864 1.00 0.00 C ATOM 0 H5' DG A 11 1.492 -5.639 -1.815 1.00 0.00 H new ATOM 0 H5'' DG A 11 0.540 -6.984 -2.410 1.00 0.00 H new ATOM 0 H4' DG A 11 2.503 -7.665 -3.814 1.00 0.00 H new ATOM 0 H3' DG A 11 4.014 -5.943 -2.262 1.00 0.00 H new ATOM 0 H2' DG A 11 3.349 -3.841 -2.945 1.00 0.00 H new ATOM 0 H2'' DG A 11 4.269 -4.190 -4.395 1.00 0.00 H new ATOM 0 H1' DG A 11 2.362 -4.336 -5.633 1.00 0.00 H new ATOM 0 H8 DG A 11 0.132 -3.167 -5.910 1.00 0.00 H new ATOM 0 H1 DG A 11 0.084 -1.221 0.168 1.00 0.00 H new ATOM 0 H21 DG A 11 2.748 -3.448 0.558 1.00 0.00 H new ATOM 0 H22 DG A 11 1.669 -2.267 1.308 1.00 0.00 H new ATOM 354 P DG A 12 6.031 -5.887 -4.509 1.00 0.00 P ATOM 355 OP1 DG A 12 6.831 -6.859 -5.279 1.00 0.00 O ATOM 356 OP2 DG A 12 6.626 -5.197 -3.342 1.00 0.00 O ATOM 357 O5' DG A 12 5.472 -4.773 -5.523 1.00 0.00 O ATOM 358 C5' DG A 12 4.754 -5.158 -6.699 1.00 0.00 C ATOM 359 C4' DG A 12 4.289 -3.938 -7.486 1.00 0.00 C ATOM 360 O4' DG A 12 3.401 -3.115 -6.695 1.00 0.00 O ATOM 361 C3' DG A 12 5.477 -3.089 -7.895 1.00 0.00 C ATOM 362 O3' DG A 12 5.540 -2.959 -9.318 1.00 0.00 O ATOM 363 C2' DG A 12 5.262 -1.754 -7.241 1.00 0.00 C ATOM 364 C1' DG A 12 3.813 -1.741 -6.800 1.00 0.00 C ATOM 365 N9 DG A 12 3.619 -1.020 -5.520 1.00 0.00 N ATOM 366 C8 DG A 12 4.294 -1.111 -4.343 1.00 0.00 C ATOM 367 N7 DG A 12 3.903 -0.357 -3.367 1.00 0.00 N ATOM 368 C5 DG A 12 2.838 0.333 -3.953 1.00 0.00 C ATOM 369 C6 DG A 12 1.983 1.324 -3.402 1.00 0.00 C ATOM 370 O6 DG A 12 1.991 1.782 -2.263 1.00 0.00 O ATOM 371 N1 DG A 12 1.045 1.768 -4.327 1.00 0.00 N ATOM 372 C2 DG A 12 0.938 1.309 -5.628 1.00 0.00 C ATOM 373 N2 DG A 12 -0.017 1.859 -6.383 1.00 0.00 N ATOM 374 N3 DG A 12 1.735 0.372 -6.149 1.00 0.00 N ATOM 375 C4 DG A 12 2.658 -0.068 -5.266 1.00 0.00 C ATOM 0 H5' DG A 12 3.892 -5.764 -6.420 1.00 0.00 H new ATOM 0 H5'' DG A 12 5.390 -5.780 -7.329 1.00 0.00 H new ATOM 0 H4' DG A 12 3.762 -4.303 -8.367 1.00 0.00 H new ATOM 0 H3' DG A 12 6.421 -3.538 -7.585 1.00 0.00 H new ATOM 0 H2' DG A 12 5.931 -1.623 -6.391 1.00 0.00 H new ATOM 0 H2'' DG A 12 5.467 -0.940 -7.936 1.00 0.00 H new ATOM 0 HO3' DG A 12 6.312 -2.407 -9.562 1.00 0.00 H new ATOM 0 H1' DG A 12 3.205 -1.203 -7.528 1.00 0.00 H new ATOM 0 H8 DG A 12 5.127 -1.789 -4.227 1.00 0.00 H new ATOM 0 H1 DG A 12 0.387 2.486 -4.024 1.00 0.00 H new ATOM 0 H21 DG A 12 -0.140 1.558 -7.350 1.00 0.00 H new ATOM 0 H22 DG A 12 -0.623 2.580 -5.993 1.00 0.00 H new TER 388 DG A 12 ATOM 389 O5' DA B 1 -12.122 0.615 7.573 1.00 0.00 O ATOM 390 C5' DA B 1 -11.711 -0.737 7.340 1.00 0.00 C ATOM 391 C4' DA B 1 -10.485 -1.109 8.188 1.00 0.00 C ATOM 392 O4' DA B 1 -10.090 -2.485 7.956 1.00 0.00 O ATOM 393 C3' DA B 1 -9.288 -0.216 7.861 1.00 0.00 C ATOM 394 O3' DA B 1 -8.844 0.490 9.033 1.00 0.00 O ATOM 395 C2' DA B 1 -8.212 -1.145 7.349 1.00 0.00 C ATOM 396 C1' DA B 1 -8.686 -2.555 7.620 1.00 0.00 C ATOM 397 N9 DA B 1 -8.447 -3.403 6.447 1.00 0.00 N ATOM 398 C8 DA B 1 -7.414 -4.234 6.220 1.00 0.00 C ATOM 399 N7 DA B 1 -7.378 -4.853 5.091 1.00 0.00 N ATOM 400 C5 DA B 1 -8.541 -4.379 4.478 1.00 0.00 C ATOM 401 C6 DA B 1 -9.122 -4.634 3.237 1.00 0.00 C ATOM 402 N6 DA B 1 -8.572 -5.445 2.336 1.00 0.00 N ATOM 403 N1 DA B 1 -10.273 -4.002 2.947 1.00 0.00 N ATOM 404 C2 DA B 1 -10.821 -3.164 3.827 1.00 0.00 C ATOM 405 N3 DA B 1 -10.355 -2.846 5.033 1.00 0.00 N ATOM 406 C4 DA B 1 -9.202 -3.494 5.298 1.00 0.00 C ATOM 0 H5' DA B 1 -11.478 -0.870 6.284 1.00 0.00 H new ATOM 0 H5'' DA B 1 -12.534 -1.413 7.572 1.00 0.00 H new ATOM 0 H4' DA B 1 -10.775 -0.971 9.230 1.00 0.00 H new ATOM 0 H3' DA B 1 -9.543 0.543 7.122 1.00 0.00 H new ATOM 0 H2' DA B 1 -8.044 -0.992 6.283 1.00 0.00 H new ATOM 0 H2'' DA B 1 -7.264 -0.953 7.852 1.00 0.00 H new ATOM 0 HO5' DA B 1 -12.903 0.820 7.017 1.00 0.00 H new ATOM 0 H1' DA B 1 -8.137 -3.002 8.448 1.00 0.00 H new ATOM 0 H8 DA B 1 -6.640 -4.377 6.960 1.00 0.00 H new ATOM 0 H61 DA B 1 -9.035 -5.601 1.440 1.00 0.00 H new ATOM 0 H62 DA B 1 -7.688 -5.910 2.541 1.00 0.00 H new ATOM 0 H2 DA B 1 -11.745 -2.691 3.529 1.00 0.00 H new ATOM 419 P DA B 2 -7.523 1.423 8.998 1.00 0.00 P ATOM 420 OP1 DA B 2 -7.408 2.126 10.293 1.00 0.00 O ATOM 421 OP2 DA B 2 -7.530 2.199 7.739 1.00 0.00 O ATOM 422 O5' DA B 2 -6.337 0.342 8.908 1.00 0.00 O ATOM 423 C5' DA B 2 -5.960 -0.456 10.035 1.00 0.00 C ATOM 424 C4' DA B 2 -4.771 -1.351 9.676 1.00 0.00 C ATOM 425 O4' DA B 2 -5.128 -2.249 8.592 1.00 0.00 O ATOM 426 C3' DA B 2 -3.546 -0.540 9.218 1.00 0.00 C ATOM 427 O3' DA B 2 -2.406 -0.856 10.031 1.00 0.00 O ATOM 428 C2' DA B 2 -3.315 -0.944 7.790 1.00 0.00 C ATOM 429 C1' DA B 2 -4.100 -2.220 7.580 1.00 0.00 C ATOM 430 N9 DA B 2 -4.663 -2.286 6.213 1.00 0.00 N ATOM 431 C8 DA B 2 -5.358 -1.363 5.499 1.00 0.00 C ATOM 432 N7 DA B 2 -5.706 -1.678 4.294 1.00 0.00 N ATOM 433 C5 DA B 2 -5.179 -2.968 4.178 1.00 0.00 C ATOM 434 C6 DA B 2 -5.179 -3.904 3.138 1.00 0.00 C ATOM 435 N6 DA B 2 -5.761 -3.684 1.959 1.00 0.00 N ATOM 436 N1 DA B 2 -4.566 -5.079 3.363 1.00 0.00 N ATOM 437 C2 DA B 2 -3.987 -5.322 4.541 1.00 0.00 C ATOM 438 N3 DA B 2 -3.928 -4.511 5.589 1.00 0.00 N ATOM 439 C4 DA B 2 -4.546 -3.343 5.340 1.00 0.00 C ATOM 0 H5' DA B 2 -6.803 -1.069 10.354 1.00 0.00 H new ATOM 0 H5'' DA B 2 -5.699 0.188 10.875 1.00 0.00 H new ATOM 0 H4' DA B 2 -4.518 -1.903 10.581 1.00 0.00 H new ATOM 0 H3' DA B 2 -3.707 0.534 9.310 1.00 0.00 H new ATOM 0 H2' DA B 2 -3.650 -0.164 7.106 1.00 0.00 H new ATOM 0 H2'' DA B 2 -2.254 -1.103 7.597 1.00 0.00 H new ATOM 0 H1' DA B 2 -3.456 -3.094 7.674 1.00 0.00 H new ATOM 0 H8 DA B 2 -5.611 -0.402 5.922 1.00 0.00 H new ATOM 0 H61 DA B 2 -5.732 -4.401 1.234 1.00 0.00 H new ATOM 0 H62 DA B 2 -6.236 -2.799 1.782 1.00 0.00 H new ATOM 0 H2 DA B 2 -3.514 -6.286 4.653 1.00 0.00 H new ATOM 451 P DG B 3 -1.640 0.287 10.878 1.00 0.00 P ATOM 452 OP1 DG B 3 -1.444 -0.213 12.257 1.00 0.00 O ATOM 453 OP2 DG B 3 -2.330 1.576 10.650 1.00 0.00 O ATOM 454 O5' DG B 3 -0.203 0.352 10.157 1.00 0.00 O ATOM 455 C5' DG B 3 0.008 -0.399 8.966 1.00 0.00 C ATOM 456 C4' DG B 3 1.461 -0.804 8.783 1.00 0.00 C ATOM 457 O4' DG B 3 1.633 -1.525 7.535 1.00 0.00 O ATOM 458 C3' DG B 3 2.351 0.422 8.746 1.00 0.00 C ATOM 459 O3' DG B 3 3.515 0.210 9.558 1.00 0.00 O ATOM 460 C2' DG B 3 2.709 0.579 7.285 1.00 0.00 C ATOM 461 C1' DG B 3 2.532 -0.802 6.672 1.00 0.00 C ATOM 462 N9 DG B 3 2.008 -0.748 5.291 1.00 0.00 N ATOM 463 C8 DG B 3 2.341 -1.522 4.230 1.00 0.00 C ATOM 464 N7 DG B 3 1.729 -1.310 3.112 1.00 0.00 N ATOM 465 C5 DG B 3 0.874 -0.256 3.458 1.00 0.00 C ATOM 466 C6 DG B 3 -0.070 0.444 2.664 1.00 0.00 C ATOM 467 O6 DG B 3 -0.344 0.264 1.478 1.00 0.00 O ATOM 468 N1 DG B 3 -0.722 1.433 3.394 1.00 0.00 N ATOM 469 C2 DG B 3 -0.493 1.716 4.730 1.00 0.00 C ATOM 470 N2 DG B 3 -1.217 2.698 5.267 1.00 0.00 N ATOM 471 N3 DG B 3 0.395 1.061 5.481 1.00 0.00 N ATOM 472 C4 DG B 3 1.040 0.094 4.792 1.00 0.00 C ATOM 0 H5' DG B 3 -0.312 0.191 8.107 1.00 0.00 H new ATOM 0 H5'' DG B 3 -0.615 -1.293 8.989 1.00 0.00 H new ATOM 0 H4' DG B 3 1.737 -1.441 9.623 1.00 0.00 H new ATOM 0 H3' DG B 3 1.868 1.316 9.140 1.00 0.00 H new ATOM 0 H2' DG B 3 2.063 1.310 6.799 1.00 0.00 H new ATOM 0 H2'' DG B 3 3.734 0.932 7.168 1.00 0.00 H new ATOM 0 H1' DG B 3 3.499 -1.299 6.596 1.00 0.00 H new ATOM 0 H8 DG B 3 3.094 -2.292 4.316 1.00 0.00 H new ATOM 0 H1 DG B 3 -1.423 1.993 2.908 1.00 0.00 H new ATOM 0 H21 DG B 3 -1.089 2.948 6.247 1.00 0.00 H new ATOM 0 H22 DG B 3 -1.899 3.199 4.697 1.00 0.00 H new ATOM 484 P DG B 4 4.772 1.214 9.506 1.00 0.00 P ATOM 485 OP1 DG B 4 5.730 0.804 10.559 1.00 0.00 O ATOM 486 OP2 DG B 4 4.261 2.601 9.473 1.00 0.00 O ATOM 487 O5' DG B 4 5.413 0.868 8.073 1.00 0.00 O ATOM 488 C5' DG B 4 6.091 -0.378 7.878 1.00 0.00 C ATOM 489 C4' DG B 4 6.462 -0.601 6.420 1.00 0.00 C ATOM 490 O4' DG B 4 5.308 -0.552 5.559 1.00 0.00 O ATOM 491 C3' DG B 4 7.424 0.469 5.939 1.00 0.00 C ATOM 492 O3' DG B 4 8.776 0.001 5.943 1.00 0.00 O ATOM 493 C2' DG B 4 6.971 0.800 4.542 1.00 0.00 C ATOM 494 C1' DG B 4 5.730 -0.037 4.287 1.00 0.00 C ATOM 495 N9 DG B 4 4.686 0.782 3.659 1.00 0.00 N ATOM 496 C8 DG B 4 4.071 1.892 4.124 1.00 0.00 C ATOM 497 N7 DG B 4 3.219 2.474 3.350 1.00 0.00 N ATOM 498 C5 DG B 4 3.263 1.656 2.221 1.00 0.00 C ATOM 499 C6 DG B 4 2.556 1.760 0.999 1.00 0.00 C ATOM 500 O6 DG B 4 1.717 2.602 0.678 1.00 0.00 O ATOM 501 N1 DG B 4 2.904 0.736 0.121 1.00 0.00 N ATOM 502 C2 DG B 4 3.816 -0.269 0.391 1.00 0.00 C ATOM 503 N2 DG B 4 4.039 -1.162 -0.575 1.00 0.00 N ATOM 504 N3 DG B 4 4.477 -0.371 1.543 1.00 0.00 N ATOM 505 C4 DG B 4 4.159 0.617 2.405 1.00 0.00 C ATOM 0 H5' DG B 4 5.455 -1.195 8.219 1.00 0.00 H new ATOM 0 H5'' DG B 4 6.993 -0.400 8.489 1.00 0.00 H new ATOM 0 H4' DG B 4 6.920 -1.589 6.371 1.00 0.00 H new ATOM 0 H3' DG B 4 7.413 1.342 6.592 1.00 0.00 H new ATOM 0 H2' DG B 4 6.749 1.863 4.447 1.00 0.00 H new ATOM 0 H2'' DG B 4 7.751 0.571 3.816 1.00 0.00 H new ATOM 0 H1' DG B 4 5.936 -0.859 3.601 1.00 0.00 H new ATOM 0 H8 DG B 4 4.285 2.278 5.109 1.00 0.00 H new ATOM 0 H1 DG B 4 2.451 0.726 -0.793 1.00 0.00 H new ATOM 0 H21 DG B 4 4.703 -1.922 -0.424 1.00 0.00 H new ATOM 0 H22 DG B 4 3.546 -1.085 -1.465 1.00 0.00 H new ATOM 517 P DT B 5 9.994 1.042 5.761 1.00 0.00 P ATOM 518 OP1 DT B 5 11.211 0.432 6.342 1.00 0.00 O ATOM 519 OP2 DT B 5 9.540 2.372 6.230 1.00 0.00 O ATOM 520 O5' DT B 5 10.171 1.102 4.161 1.00 0.00 O ATOM 521 C5' DT B 5 10.760 0.001 3.465 1.00 0.00 C ATOM 522 C4' DT B 5 10.415 0.009 1.981 1.00 0.00 C ATOM 523 O4' DT B 5 8.999 0.230 1.782 1.00 0.00 O ATOM 524 C3' DT B 5 11.169 1.111 1.238 1.00 0.00 C ATOM 525 O3' DT B 5 12.043 0.572 0.235 1.00 0.00 O ATOM 526 C2' DT B 5 10.090 1.928 0.567 1.00 0.00 C ATOM 527 C1' DT B 5 8.835 1.070 0.635 1.00 0.00 C ATOM 528 N1 DT B 5 7.621 1.902 0.719 1.00 0.00 N ATOM 529 C2 DT B 5 6.674 1.725 -0.270 1.00 0.00 C ATOM 530 O2 DT B 5 6.807 0.884 -1.160 1.00 0.00 O ATOM 531 N3 DT B 5 5.561 2.538 -0.199 1.00 0.00 N ATOM 532 C4 DT B 5 5.310 3.494 0.770 1.00 0.00 C ATOM 533 O4 DT B 5 4.275 4.157 0.743 1.00 0.00 O ATOM 534 C5 DT B 5 6.355 3.608 1.766 1.00 0.00 C ATOM 535 C7 DT B 5 6.209 4.620 2.898 1.00 0.00 C ATOM 536 C6 DT B 5 7.455 2.829 1.712 1.00 0.00 C ATOM 0 H5' DT B 5 10.419 -0.933 3.911 1.00 0.00 H new ATOM 0 H5'' DT B 5 11.843 0.035 3.585 1.00 0.00 H new ATOM 0 H4' DT B 5 10.705 -0.965 1.588 1.00 0.00 H new ATOM 0 H3' DT B 5 11.792 1.689 1.921 1.00 0.00 H new ATOM 0 H2' DT B 5 9.943 2.880 1.077 1.00 0.00 H new ATOM 0 H2'' DT B 5 10.355 2.157 -0.465 1.00 0.00 H new ATOM 0 H1' DT B 5 8.707 0.471 -0.266 1.00 0.00 H new ATOM 0 H3 DT B 5 4.858 2.424 -0.929 1.00 0.00 H new ATOM 0 H71 DT B 5 6.726 4.252 3.784 1.00 0.00 H new ATOM 0 H72 DT B 5 6.644 5.572 2.593 1.00 0.00 H new ATOM 0 H73 DT B 5 5.152 4.761 3.126 1.00 0.00 H new ATOM 0 H6 DT B 5 8.219 2.939 2.467 1.00 0.00 H new ATOM 549 P DT B 6 13.322 -0.327 0.611 1.00 0.00 P ATOM 550 OP1 DT B 6 12.974 -1.181 1.768 1.00 0.00 O ATOM 551 OP2 DT B 6 14.513 0.550 0.666 1.00 0.00 O ATOM 552 O5' DT B 6 13.449 -1.270 -0.687 1.00 0.00 O ATOM 553 C5' DT B 6 14.182 -0.842 -1.844 1.00 0.00 C ATOM 554 C4' DT B 6 13.265 -0.614 -3.061 1.00 0.00 C ATOM 555 O4' DT B 6 12.381 -1.747 -3.256 1.00 0.00 O ATOM 556 C3' DT B 6 12.397 0.637 -2.902 1.00 0.00 C ATOM 557 O3' DT B 6 12.527 1.470 -4.062 1.00 0.00 O ATOM 558 C2' DT B 6 10.974 0.133 -2.774 1.00 0.00 C ATOM 559 C1' DT B 6 10.998 -1.321 -3.252 1.00 0.00 C ATOM 560 N1 DT B 6 10.185 -2.216 -2.388 1.00 0.00 N ATOM 561 C2 DT B 6 9.096 -2.838 -2.976 1.00 0.00 C ATOM 562 O2 DT B 6 8.749 -2.598 -4.129 1.00 0.00 O ATOM 563 N3 DT B 6 8.409 -3.740 -2.187 1.00 0.00 N ATOM 564 C4 DT B 6 8.702 -4.068 -0.881 1.00 0.00 C ATOM 565 O4 DT B 6 8.026 -4.905 -0.281 1.00 0.00 O ATOM 566 C5 DT B 6 9.847 -3.369 -0.340 1.00 0.00 C ATOM 567 C7 DT B 6 10.281 -3.645 1.096 1.00 0.00 C ATOM 568 C6 DT B 6 10.540 -2.482 -1.087 1.00 0.00 C ATOM 0 H5' DT B 6 14.934 -1.590 -2.093 1.00 0.00 H new ATOM 0 H5'' DT B 6 14.714 0.081 -1.614 1.00 0.00 H new ATOM 0 H4' DT B 6 13.923 -0.487 -3.921 1.00 0.00 H new ATOM 0 H3' DT B 6 12.691 1.231 -2.037 1.00 0.00 H new ATOM 0 H2' DT B 6 10.628 0.199 -1.743 1.00 0.00 H new ATOM 0 H2'' DT B 6 10.292 0.731 -3.378 1.00 0.00 H new ATOM 0 H1' DT B 6 10.559 -1.381 -4.248 1.00 0.00 H new ATOM 0 H3 DT B 6 7.608 -4.208 -2.612 1.00 0.00 H new ATOM 0 H71 DT B 6 11.358 -3.504 1.184 1.00 0.00 H new ATOM 0 H72 DT B 6 9.769 -2.958 1.769 1.00 0.00 H new ATOM 0 H73 DT B 6 10.027 -4.671 1.362 1.00 0.00 H new ATOM 0 H6 DT B 6 11.388 -1.973 -0.654 1.00 0.00 H new ATOM 581 P DT B 7 12.882 3.040 -3.943 1.00 0.00 P ATOM 582 OP1 DT B 7 14.087 3.306 -4.755 1.00 0.00 O ATOM 583 OP2 DT B 7 12.855 3.424 -2.516 1.00 0.00 O ATOM 584 O5' DT B 7 11.623 3.739 -4.664 1.00 0.00 O ATOM 585 C5' DT B 7 10.996 3.129 -5.798 1.00 0.00 C ATOM 586 C4' DT B 7 9.559 3.635 -5.974 1.00 0.00 C ATOM 587 O4' DT B 7 8.838 3.590 -4.714 1.00 0.00 O ATOM 588 C3' DT B 7 9.563 5.088 -6.447 1.00 0.00 C ATOM 589 O3' DT B 7 8.645 5.276 -7.527 1.00 0.00 O ATOM 590 C2' DT B 7 9.097 5.879 -5.251 1.00 0.00 C ATOM 591 C1' DT B 7 8.295 4.896 -4.428 1.00 0.00 C ATOM 592 N1 DT B 7 8.377 5.226 -2.995 1.00 0.00 N ATOM 593 C2 DT B 7 7.261 5.795 -2.404 1.00 0.00 C ATOM 594 O2 DT B 7 6.216 5.986 -3.018 1.00 0.00 O ATOM 595 N3 DT B 7 7.384 6.135 -1.078 1.00 0.00 N ATOM 596 C4 DT B 7 8.508 5.958 -0.294 1.00 0.00 C ATOM 597 O4 DT B 7 8.500 6.293 0.886 1.00 0.00 O ATOM 598 C5 DT B 7 9.628 5.357 -0.988 1.00 0.00 C ATOM 599 C7 DT B 7 10.944 5.144 -0.239 1.00 0.00 C ATOM 600 C6 DT B 7 9.531 5.013 -2.292 1.00 0.00 C ATOM 0 H5' DT B 7 10.991 2.046 -5.676 1.00 0.00 H new ATOM 0 H5'' DT B 7 11.574 3.345 -6.697 1.00 0.00 H new ATOM 0 H4' DT B 7 9.075 2.991 -6.708 1.00 0.00 H new ATOM 0 H3' DT B 7 10.547 5.392 -6.805 1.00 0.00 H new ATOM 0 H2' DT B 7 9.940 6.274 -4.685 1.00 0.00 H new ATOM 0 H2'' DT B 7 8.489 6.732 -5.553 1.00 0.00 H new ATOM 0 H1' DT B 7 7.236 4.930 -4.682 1.00 0.00 H new ATOM 0 H3 DT B 7 6.570 6.557 -0.631 1.00 0.00 H new ATOM 0 H71 DT B 7 11.458 4.274 -0.647 1.00 0.00 H new ATOM 0 H72 DT B 7 11.575 6.025 -0.354 1.00 0.00 H new ATOM 0 H73 DT B 7 10.738 4.981 0.819 1.00 0.00 H new ATOM 0 H6 DT B 7 10.379 4.563 -2.787 1.00 0.00 H new ATOM 613 P DT B 8 8.756 4.454 -8.910 1.00 0.00 P ATOM 614 OP1 DT B 8 8.914 3.017 -8.598 1.00 0.00 O ATOM 615 OP2 DT B 8 9.728 5.136 -9.793 1.00 0.00 O ATOM 616 O5' DT B 8 7.284 4.673 -9.525 1.00 0.00 O ATOM 617 C5' DT B 8 6.352 5.540 -8.864 1.00 0.00 C ATOM 618 C4' DT B 8 5.635 6.451 -9.842 1.00 0.00 C ATOM 619 O4' DT B 8 6.589 7.163 -10.673 1.00 0.00 O ATOM 620 C3' DT B 8 4.728 5.643 -10.759 1.00 0.00 C ATOM 621 O3' DT B 8 3.444 6.263 -10.864 1.00 0.00 O ATOM 622 C2' DT B 8 5.419 5.653 -12.100 1.00 0.00 C ATOM 623 C1' DT B 8 6.338 6.866 -12.065 1.00 0.00 C ATOM 624 N1 DT B 8 7.597 6.619 -12.814 1.00 0.00 N ATOM 625 C2 DT B 8 7.842 7.411 -13.925 1.00 0.00 C ATOM 626 O2 DT B 8 7.063 8.289 -14.292 1.00 0.00 O ATOM 627 N3 DT B 8 9.017 7.158 -14.606 1.00 0.00 N ATOM 628 C4 DT B 8 9.958 6.199 -14.284 1.00 0.00 C ATOM 629 O4 DT B 8 10.970 6.062 -14.968 1.00 0.00 O ATOM 630 C5 DT B 8 9.623 5.419 -13.113 1.00 0.00 C ATOM 631 C7 DT B 8 10.575 4.322 -12.642 1.00 0.00 C ATOM 632 C6 DT B 8 8.483 5.644 -12.428 1.00 0.00 C ATOM 0 H5' DT B 8 6.879 6.144 -8.125 1.00 0.00 H new ATOM 0 H5'' DT B 8 5.620 4.941 -8.323 1.00 0.00 H new ATOM 0 H4' DT B 8 5.046 7.158 -9.257 1.00 0.00 H new ATOM 0 H3' DT B 8 4.566 4.632 -10.385 1.00 0.00 H new ATOM 0 H2' DT B 8 5.984 4.735 -12.259 1.00 0.00 H new ATOM 0 H2'' DT B 8 4.698 5.728 -12.914 1.00 0.00 H new ATOM 0 H1' DT B 8 5.868 7.719 -12.556 1.00 0.00 H new ATOM 0 H3 DT B 8 9.208 7.735 -15.425 1.00 0.00 H new ATOM 0 H71 DT B 8 11.108 3.910 -13.499 1.00 0.00 H new ATOM 0 H72 DT B 8 11.292 4.741 -11.936 1.00 0.00 H new ATOM 0 H73 DT B 8 10.006 3.531 -12.154 1.00 0.00 H new ATOM 0 H6 DT B 8 8.263 5.044 -11.557 1.00 0.00 H new ATOM 645 P DA B 9 2.105 5.378 -10.938 1.00 0.00 P ATOM 646 OP1 DA B 9 2.469 4.012 -11.376 1.00 0.00 O ATOM 647 OP2 DA B 9 1.082 6.142 -11.683 1.00 0.00 O ATOM 648 O5' DA B 9 1.655 5.314 -9.399 1.00 0.00 O ATOM 649 C5' DA B 9 2.352 4.488 -8.462 1.00 0.00 C ATOM 650 C4' DA B 9 2.182 5.014 -7.034 1.00 0.00 C ATOM 651 O4' DA B 9 2.551 4.010 -6.061 1.00 0.00 O ATOM 652 C3' DA B 9 3.051 6.254 -6.773 1.00 0.00 C ATOM 653 O3' DA B 9 2.226 7.360 -6.380 1.00 0.00 O ATOM 654 C2' DA B 9 3.980 5.858 -5.653 1.00 0.00 C ATOM 655 C1' DA B 9 3.339 4.629 -5.032 1.00 0.00 C ATOM 656 N9 DA B 9 4.341 3.706 -4.491 1.00 0.00 N ATOM 657 C8 DA B 9 4.647 3.469 -3.204 1.00 0.00 C ATOM 658 N7 DA B 9 5.534 2.569 -2.953 1.00 0.00 N ATOM 659 C5 DA B 9 5.874 2.147 -4.246 1.00 0.00 C ATOM 660 C6 DA B 9 6.775 1.191 -4.727 1.00 0.00 C ATOM 661 N6 DA B 9 7.512 0.417 -3.929 1.00 0.00 N ATOM 662 N1 DA B 9 6.860 1.038 -6.064 1.00 0.00 N ATOM 663 C2 DA B 9 6.100 1.779 -6.879 1.00 0.00 C ATOM 664 N3 DA B 9 5.214 2.704 -6.526 1.00 0.00 N ATOM 665 C4 DA B 9 5.150 2.840 -5.189 1.00 0.00 C ATOM 0 H5' DA B 9 3.411 4.456 -8.718 1.00 0.00 H new ATOM 0 H5'' DA B 9 1.978 3.466 -8.524 1.00 0.00 H new ATOM 0 H4' DA B 9 1.129 5.275 -6.932 1.00 0.00 H new ATOM 0 H3' DA B 9 3.601 6.567 -7.661 1.00 0.00 H new ATOM 0 H2' DA B 9 4.979 5.636 -6.028 1.00 0.00 H new ATOM 0 H2'' DA B 9 4.084 6.661 -4.923 1.00 0.00 H new ATOM 0 H1' DA B 9 2.715 4.911 -4.184 1.00 0.00 H new ATOM 0 H8 DA B 9 4.165 4.015 -2.406 1.00 0.00 H new ATOM 0 H61 DA B 9 8.155 -0.265 -4.332 1.00 0.00 H new ATOM 0 H62 DA B 9 7.433 0.507 -2.916 1.00 0.00 H new ATOM 0 H2 DA B 9 6.220 1.606 -7.938 1.00 0.00 H new ATOM 677 P DA B 10 2.815 8.851 -6.176 1.00 0.00 P ATOM 678 OP1 DA B 10 3.085 9.426 -7.512 1.00 0.00 O ATOM 679 OP2 DA B 10 3.895 8.798 -5.162 1.00 0.00 O ATOM 680 O5' DA B 10 1.552 9.604 -5.537 1.00 0.00 O ATOM 681 C5' DA B 10 0.244 9.086 -5.780 1.00 0.00 C ATOM 682 C4' DA B 10 -0.635 9.102 -4.514 1.00 0.00 C ATOM 683 O4' DA B 10 -0.278 8.048 -3.592 1.00 0.00 O ATOM 684 C3' DA B 10 -0.598 10.425 -3.731 1.00 0.00 C ATOM 685 O3' DA B 10 -1.937 10.931 -3.544 1.00 0.00 O ATOM 686 C2' DA B 10 0.004 10.055 -2.385 1.00 0.00 C ATOM 687 C1' DA B 10 -0.257 8.580 -2.253 1.00 0.00 C ATOM 688 N9 DA B 10 0.748 7.904 -1.455 1.00 0.00 N ATOM 689 C8 DA B 10 1.446 6.805 -1.752 1.00 0.00 C ATOM 690 N7 DA B 10 2.178 6.287 -0.824 1.00 0.00 N ATOM 691 C5 DA B 10 1.932 7.172 0.234 1.00 0.00 C ATOM 692 C6 DA B 10 2.385 7.230 1.551 1.00 0.00 C ATOM 693 N6 DA B 10 3.210 6.324 2.074 1.00 0.00 N ATOM 694 N1 DA B 10 1.938 8.248 2.313 1.00 0.00 N ATOM 695 C2 DA B 10 1.093 9.151 1.803 1.00 0.00 C ATOM 696 N3 DA B 10 0.603 9.180 0.579 1.00 0.00 N ATOM 697 C4 DA B 10 1.065 8.159 -0.155 1.00 0.00 C ATOM 0 H5' DA B 10 0.323 8.064 -6.152 1.00 0.00 H new ATOM 0 H5'' DA B 10 -0.238 9.673 -6.562 1.00 0.00 H new ATOM 0 H4' DA B 10 -1.642 8.958 -4.904 1.00 0.00 H new ATOM 0 H3' DA B 10 -0.029 11.197 -4.249 1.00 0.00 H new ATOM 0 H2' DA B 10 1.071 10.274 -2.353 1.00 0.00 H new ATOM 0 H2'' DA B 10 -0.461 10.615 -1.574 1.00 0.00 H new ATOM 0 H1' DA B 10 -1.202 8.418 -1.735 1.00 0.00 H new ATOM 0 H8 DA B 10 1.399 6.364 -2.737 1.00 0.00 H new ATOM 0 H61 DA B 10 3.513 6.410 3.044 1.00 0.00 H new ATOM 0 H62 DA B 10 3.538 5.544 1.504 1.00 0.00 H new ATOM 0 H2 DA B 10 0.778 9.943 2.466 1.00 0.00 H new ATOM 709 P DG B 11 -2.761 11.647 -4.740 1.00 0.00 P ATOM 710 OP1 DG B 11 -1.874 11.740 -5.921 1.00 0.00 O ATOM 711 OP2 DG B 11 -3.387 12.868 -4.195 1.00 0.00 O ATOM 712 O5' DG B 11 -3.924 10.590 -5.081 1.00 0.00 O ATOM 713 C5' DG B 11 -3.573 9.337 -5.658 1.00 0.00 C ATOM 714 C4' DG B 11 -4.648 8.757 -6.538 1.00 0.00 C ATOM 715 O4' DG B 11 -4.132 7.588 -7.193 1.00 0.00 O ATOM 716 C3' DG B 11 -5.839 8.330 -5.707 1.00 0.00 C ATOM 717 O3' DG B 11 -7.051 8.634 -6.405 1.00 0.00 O ATOM 718 C2' DG B 11 -5.644 6.846 -5.501 1.00 0.00 C ATOM 719 C1' DG B 11 -4.607 6.408 -6.519 1.00 0.00 C ATOM 720 N9 DG B 11 -3.499 5.673 -5.887 1.00 0.00 N ATOM 721 C8 DG B 11 -2.733 4.733 -6.447 1.00 0.00 C ATOM 722 N7 DG B 11 -1.788 4.211 -5.740 1.00 0.00 N ATOM 723 C5 DG B 11 -1.937 4.892 -4.529 1.00 0.00 C ATOM 724 C6 DG B 11 -1.194 4.771 -3.324 1.00 0.00 C ATOM 725 O6 DG B 11 -0.232 4.034 -3.101 1.00 0.00 O ATOM 726 N1 DG B 11 -1.668 5.632 -2.340 1.00 0.00 N ATOM 727 C2 DG B 11 -2.731 6.509 -2.497 1.00 0.00 C ATOM 728 N2 DG B 11 -3.045 7.266 -1.441 1.00 0.00 N ATOM 729 N3 DG B 11 -3.436 6.629 -3.632 1.00 0.00 N ATOM 730 C4 DG B 11 -2.988 5.797 -4.604 1.00 0.00 C ATOM 0 H5' DG B 11 -3.347 8.630 -4.860 1.00 0.00 H new ATOM 0 H5'' DG B 11 -2.662 9.459 -6.244 1.00 0.00 H new ATOM 0 H4' DG B 11 -4.953 9.515 -7.260 1.00 0.00 H new ATOM 0 H3' DG B 11 -5.912 8.848 -4.751 1.00 0.00 H new ATOM 0 H2' DG B 11 -5.306 6.635 -4.486 1.00 0.00 H new ATOM 0 H2'' DG B 11 -6.581 6.307 -5.643 1.00 0.00 H new ATOM 0 H1' DG B 11 -5.058 5.719 -7.233 1.00 0.00 H new ATOM 0 H8 DG B 11 -2.900 4.418 -7.466 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.198 5.617 -1.435 1.00 0.00 H new ATOM 0 H21 DG B 11 -3.818 7.929 -1.500 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.511 7.181 -0.576 1.00 0.00 H new ATOM 742 P DG B 12 -8.421 7.854 -6.107 1.00 0.00 P ATOM 743 OP1 DG B 12 -9.451 8.390 -7.019 1.00 0.00 O ATOM 744 OP2 DG B 12 -8.658 7.847 -4.645 1.00 0.00 O ATOM 745 O5' DG B 12 -8.064 6.357 -6.567 1.00 0.00 O ATOM 746 C5' DG B 12 -7.690 6.084 -7.922 1.00 0.00 C ATOM 747 C4' DG B 12 -7.360 4.609 -8.118 1.00 0.00 C ATOM 748 O4' DG B 12 -6.250 4.209 -7.281 1.00 0.00 O ATOM 749 C3' DG B 12 -8.555 3.748 -7.757 1.00 0.00 C ATOM 750 O3' DG B 12 -8.964 2.958 -8.876 1.00 0.00 O ATOM 751 C2' DG B 12 -8.096 2.879 -6.621 1.00 0.00 C ATOM 752 C1' DG B 12 -6.585 2.983 -6.609 1.00 0.00 C ATOM 753 N9 DG B 12 -6.028 2.952 -5.234 1.00 0.00 N ATOM 754 C8 DG B 12 -6.391 3.639 -4.119 1.00 0.00 C ATOM 755 N7 DG B 12 -5.719 3.420 -3.035 1.00 0.00 N ATOM 756 C5 DG B 12 -4.792 2.465 -3.465 1.00 0.00 C ATOM 757 C6 DG B 12 -3.763 1.805 -2.742 1.00 0.00 C ATOM 758 O6 DG B 12 -3.454 1.950 -1.562 1.00 0.00 O ATOM 759 N1 DG B 12 -3.062 0.913 -3.544 1.00 0.00 N ATOM 760 C2 DG B 12 -3.315 0.685 -4.885 1.00 0.00 C ATOM 761 N2 DG B 12 -2.547 -0.220 -5.497 1.00 0.00 N ATOM 762 N3 DG B 12 -4.276 1.308 -5.572 1.00 0.00 N ATOM 763 C4 DG B 12 -4.975 2.176 -4.808 1.00 0.00 C ATOM 0 H5' DG B 12 -6.826 6.691 -8.193 1.00 0.00 H new ATOM 0 H5'' DG B 12 -8.502 6.369 -8.590 1.00 0.00 H new ATOM 0 H4' DG B 12 -7.097 4.472 -9.167 1.00 0.00 H new ATOM 0 H3' DG B 12 -9.418 4.350 -7.474 1.00 0.00 H new ATOM 0 H2' DG B 12 -8.519 3.216 -5.675 1.00 0.00 H new ATOM 0 H2'' DG B 12 -8.416 1.847 -6.764 1.00 0.00 H new ATOM 0 HO3' DG B 12 -9.735 2.408 -8.624 1.00 0.00 H new ATOM 0 H1' DG B 12 -6.147 2.124 -7.117 1.00 0.00 H new ATOM 0 H8 DG B 12 -7.211 4.342 -4.137 1.00 0.00 H new ATOM 0 H1 DG B 12 -2.303 0.386 -3.111 1.00 0.00 H new ATOM 0 H21 DG B 12 -2.691 -0.426 -6.485 1.00 0.00 H new ATOM 0 H22 DG B 12 -1.816 -0.705 -4.976 1.00 0.00 H new TER 776 DG B 12