USER MOD reduce.3.24.130724 H: found=0, std=0, add=245, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 245 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=-0.00196 USER MOD Single : A 15 DT C7 :methyl -30:sc= -0.973 (180deg=-2.36!) USER MOD Single : A 22 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 9.026 -5.800 5.424 1.00 0.00 O ATOM 2 C5' DG A 1 8.835 -4.400 5.212 1.00 0.00 C ATOM 3 C4' DG A 1 8.350 -3.706 6.481 1.00 0.00 C ATOM 4 O4' DG A 1 8.055 -2.343 6.187 1.00 0.00 O ATOM 5 C3' DG A 1 7.084 -4.311 7.071 1.00 0.00 C ATOM 6 O3' DG A 1 7.071 -4.107 8.488 1.00 0.00 O ATOM 7 C2' DG A 1 5.978 -3.503 6.419 1.00 0.00 C ATOM 8 C1' DG A 1 6.642 -2.137 6.284 1.00 0.00 C ATOM 9 N9 DG A 1 6.235 -1.364 5.098 1.00 0.00 N ATOM 10 C8 DG A 1 5.916 -0.039 5.030 1.00 0.00 C ATOM 11 N7 DG A 1 5.610 0.375 3.833 1.00 0.00 N ATOM 12 C5 DG A 1 5.736 -0.764 3.044 1.00 0.00 C ATOM 13 C6 DG A 1 5.532 -0.930 1.647 1.00 0.00 C ATOM 14 O6 DG A 1 5.194 -0.086 0.820 1.00 0.00 O ATOM 15 N1 DG A 1 5.767 -2.239 1.250 1.00 0.00 N ATOM 16 C2 DG A 1 6.152 -3.263 2.090 1.00 0.00 C ATOM 17 N2 DG A 1 6.330 -4.456 1.523 1.00 0.00 N ATOM 18 N3 DG A 1 6.345 -3.108 3.403 1.00 0.00 N ATOM 19 C4 DG A 1 6.119 -1.837 3.809 1.00 0.00 C ATOM 0 H5' DG A 1 8.110 -4.247 4.412 1.00 0.00 H new ATOM 0 H5'' DG A 1 9.772 -3.949 4.884 1.00 0.00 H new ATOM 0 H4' DG A 1 9.155 -3.822 7.207 1.00 0.00 H new ATOM 0 H3' DG A 1 6.990 -5.383 6.899 1.00 0.00 H new ATOM 0 H2' DG A 1 5.684 -3.914 5.453 1.00 0.00 H new ATOM 0 H2'' DG A 1 5.080 -3.464 7.035 1.00 0.00 H new ATOM 0 HO5' DG A 1 9.335 -6.218 4.593 1.00 0.00 H new ATOM 0 H1' DG A 1 6.335 -1.563 7.158 1.00 0.00 H new ATOM 0 H8 DG A 1 5.917 0.610 5.893 1.00 0.00 H new ATOM 0 H1 DG A 1 5.646 -2.461 0.262 1.00 0.00 H new ATOM 0 H21 DG A 1 6.615 -5.253 2.092 1.00 0.00 H new ATOM 0 H22 DG A 1 6.181 -4.571 0.521 1.00 0.00 H new ATOM 32 P DG A 2 5.752 -4.437 9.351 1.00 0.00 P ATOM 33 OP1 DG A 2 6.141 -4.522 10.777 1.00 0.00 O ATOM 34 OP2 DG A 2 5.049 -5.569 8.709 1.00 0.00 O ATOM 35 O5' DG A 2 4.861 -3.111 9.151 1.00 0.00 O ATOM 36 C5' DG A 2 3.480 -3.101 9.521 1.00 0.00 C ATOM 37 C4' DG A 2 2.843 -1.736 9.279 1.00 0.00 C ATOM 38 O4' DG A 2 2.987 -1.376 7.901 1.00 0.00 O ATOM 39 C3' DG A 2 1.348 -1.683 9.609 1.00 0.00 C ATOM 40 O3' DG A 2 1.062 -0.492 10.350 1.00 0.00 O ATOM 41 C2' DG A 2 0.671 -1.620 8.248 1.00 0.00 C ATOM 42 C1' DG A 2 1.728 -0.911 7.421 1.00 0.00 C ATOM 43 N9 DG A 2 1.660 -1.205 5.980 1.00 0.00 N ATOM 44 C8 DG A 2 1.802 -2.411 5.351 1.00 0.00 C ATOM 45 N7 DG A 2 1.683 -2.350 4.054 1.00 0.00 N ATOM 46 C5 DG A 2 1.444 -1.002 3.804 1.00 0.00 C ATOM 47 C6 DG A 2 1.230 -0.329 2.570 1.00 0.00 C ATOM 48 O6 DG A 2 1.209 -0.803 1.437 1.00 0.00 O ATOM 49 N1 DG A 2 1.027 1.031 2.761 1.00 0.00 N ATOM 50 C2 DG A 2 1.028 1.668 3.984 1.00 0.00 C ATOM 51 N2 DG A 2 0.815 2.984 3.966 1.00 0.00 N ATOM 52 N3 DG A 2 1.228 1.037 5.146 1.00 0.00 N ATOM 53 C4 DG A 2 1.429 -0.292 4.979 1.00 0.00 C ATOM 0 H5' DG A 2 3.383 -3.367 10.574 1.00 0.00 H new ATOM 0 H5'' DG A 2 2.944 -3.859 8.950 1.00 0.00 H new ATOM 0 H4' DG A 2 3.361 -1.047 9.946 1.00 0.00 H new ATOM 0 H3' DG A 2 1.013 -2.530 10.207 1.00 0.00 H new ATOM 0 H2' DG A 2 0.440 -2.611 7.858 1.00 0.00 H new ATOM 0 H2'' DG A 2 -0.266 -1.064 8.281 1.00 0.00 H new ATOM 0 H1' DG A 2 1.576 0.163 7.526 1.00 0.00 H new ATOM 0 H8 DG A 2 1.995 -3.332 5.881 1.00 0.00 H new ATOM 0 H1 DG A 2 0.865 1.603 1.933 1.00 0.00 H new ATOM 0 H21 DG A 2 0.804 3.511 4.839 1.00 0.00 H new ATOM 0 H22 DG A 2 0.663 3.464 3.079 1.00 0.00 H new ATOM 65 P DG A 3 -0.381 -0.284 11.036 1.00 0.00 P ATOM 66 OP1 DG A 3 -0.177 -0.080 12.488 1.00 0.00 O ATOM 67 OP2 DG A 3 -1.278 -1.362 10.562 1.00 0.00 O ATOM 68 O5' DG A 3 -0.883 1.106 10.398 1.00 0.00 O ATOM 69 C5' DG A 3 -1.113 1.218 8.991 1.00 0.00 C ATOM 70 C4' DG A 3 -1.836 2.515 8.639 1.00 0.00 C ATOM 71 O4' DG A 3 -1.924 2.642 7.217 1.00 0.00 O ATOM 72 C3' DG A 3 -3.258 2.591 9.183 1.00 0.00 C ATOM 73 O3' DG A 3 -3.577 3.948 9.509 1.00 0.00 O ATOM 74 C2' DG A 3 -4.109 2.122 8.015 1.00 0.00 C ATOM 75 C1' DG A 3 -3.301 2.623 6.824 1.00 0.00 C ATOM 76 N9 DG A 3 -3.406 1.770 5.625 1.00 0.00 N ATOM 77 C8 DG A 3 -3.395 0.401 5.543 1.00 0.00 C ATOM 78 N7 DG A 3 -3.497 -0.057 4.327 1.00 0.00 N ATOM 79 C5 DG A 3 -3.583 1.089 3.543 1.00 0.00 C ATOM 80 C6 DG A 3 -3.710 1.220 2.134 1.00 0.00 C ATOM 81 O6 DG A 3 -3.773 0.331 1.288 1.00 0.00 O ATOM 82 N1 DG A 3 -3.764 2.553 1.749 1.00 0.00 N ATOM 83 C2 DG A 3 -3.702 3.628 2.611 1.00 0.00 C ATOM 84 N2 DG A 3 -3.769 4.837 2.053 1.00 0.00 N ATOM 85 N3 DG A 3 -3.582 3.507 3.937 1.00 0.00 N ATOM 86 C4 DG A 3 -3.528 2.213 4.330 1.00 0.00 C ATOM 0 H5' DG A 3 -1.704 0.368 8.650 1.00 0.00 H new ATOM 0 H5'' DG A 3 -0.161 1.177 8.462 1.00 0.00 H new ATOM 0 H4' DG A 3 -1.251 3.314 9.096 1.00 0.00 H new ATOM 0 H3' DG A 3 -3.409 1.999 10.086 1.00 0.00 H new ATOM 0 H2' DG A 3 -4.227 1.038 8.003 1.00 0.00 H new ATOM 0 H2'' DG A 3 -5.111 2.551 8.040 1.00 0.00 H new ATOM 0 H1' DG A 3 -3.696 3.603 6.557 1.00 0.00 H new ATOM 0 H8 DG A 3 -3.310 -0.240 6.408 1.00 0.00 H new ATOM 0 H1 DG A 3 -3.857 2.752 0.753 1.00 0.00 H new ATOM 0 H21 DG A 3 -3.728 5.672 2.638 1.00 0.00 H new ATOM 0 H22 DG A 3 -3.861 4.927 1.041 1.00 0.00 H new ATOM 98 P DC A 4 -4.820 4.282 10.478 1.00 0.00 P ATOM 99 OP1 DC A 4 -4.577 5.601 11.103 1.00 0.00 O ATOM 100 OP2 DC A 4 -5.074 3.098 11.329 1.00 0.00 O ATOM 101 O5' DC A 4 -6.048 4.433 9.447 1.00 0.00 O ATOM 102 C5' DC A 4 -6.502 5.729 9.047 1.00 0.00 C ATOM 103 C4' DC A 4 -7.817 5.651 8.276 1.00 0.00 C ATOM 104 O4' DC A 4 -7.609 4.979 7.020 1.00 0.00 O ATOM 105 C3' DC A 4 -8.922 4.870 9.004 1.00 0.00 C ATOM 106 O3' DC A 4 -10.194 5.483 8.726 1.00 0.00 O ATOM 107 C2' DC A 4 -8.845 3.516 8.335 1.00 0.00 C ATOM 108 C1' DC A 4 -8.622 3.985 6.914 1.00 0.00 C ATOM 109 N1 DC A 4 -8.189 2.947 5.953 1.00 0.00 N ATOM 110 C2 DC A 4 -8.021 3.350 4.639 1.00 0.00 C ATOM 111 O2 DC A 4 -8.176 4.530 4.333 1.00 0.00 O ATOM 112 N3 DC A 4 -7.690 2.412 3.713 1.00 0.00 N ATOM 113 C4 DC A 4 -7.529 1.130 4.060 1.00 0.00 C ATOM 114 N4 DC A 4 -7.216 0.238 3.122 1.00 0.00 N ATOM 115 C5 DC A 4 -7.694 0.706 5.415 1.00 0.00 C ATOM 116 C6 DC A 4 -8.021 1.641 6.326 1.00 0.00 C ATOM 0 H5' DC A 4 -5.743 6.205 8.426 1.00 0.00 H new ATOM 0 H5'' DC A 4 -6.633 6.357 9.928 1.00 0.00 H new ATOM 0 H4' DC A 4 -8.138 6.686 8.157 1.00 0.00 H new ATOM 0 H3' DC A 4 -8.811 4.832 10.088 1.00 0.00 H new ATOM 0 H2' DC A 4 -8.027 2.903 8.712 1.00 0.00 H new ATOM 0 H2'' DC A 4 -9.759 2.934 8.451 1.00 0.00 H new ATOM 0 H1' DC A 4 -9.573 4.332 6.510 1.00 0.00 H new ATOM 0 H41 DC A 4 -7.090 -0.743 3.373 1.00 0.00 H new ATOM 0 H42 DC A 4 -7.102 0.536 2.153 1.00 0.00 H new ATOM 0 H5 DC A 4 -7.561 -0.328 5.698 1.00 0.00 H new ATOM 0 H6 DC A 4 -8.152 1.358 7.360 1.00 0.00 H new ATOM 128 P DC A 5 -11.566 4.957 9.402 1.00 0.00 P ATOM 129 OP1 DC A 5 -12.304 6.135 9.909 1.00 0.00 O ATOM 130 OP2 DC A 5 -11.246 3.845 10.325 1.00 0.00 O ATOM 131 O5' DC A 5 -12.389 4.360 8.144 1.00 0.00 O ATOM 132 C5' DC A 5 -12.066 3.082 7.580 1.00 0.00 C ATOM 133 C4' DC A 5 -12.948 2.748 6.381 1.00 0.00 C ATOM 134 O4' DC A 5 -12.939 3.831 5.460 1.00 0.00 O ATOM 135 C3' DC A 5 -12.487 1.511 5.603 1.00 0.00 C ATOM 136 O3' DC A 5 -13.397 0.433 5.837 1.00 0.00 O ATOM 137 C2' DC A 5 -12.544 1.924 4.126 1.00 0.00 C ATOM 138 C1' DC A 5 -13.212 3.293 4.175 1.00 0.00 C ATOM 139 N1 DC A 5 -12.711 4.251 3.170 1.00 0.00 N ATOM 140 C2 DC A 5 -13.643 4.849 2.337 1.00 0.00 C ATOM 141 O2 DC A 5 -14.835 4.571 2.448 1.00 0.00 O ATOM 142 N3 DC A 5 -13.201 5.739 1.407 1.00 0.00 N ATOM 143 C4 DC A 5 -11.897 6.030 1.298 1.00 0.00 C ATOM 144 N4 DC A 5 -11.498 6.906 0.376 1.00 0.00 N ATOM 145 C5 DC A 5 -10.932 5.415 2.156 1.00 0.00 C ATOM 146 C6 DC A 5 -11.379 4.536 3.073 1.00 0.00 C ATOM 0 H5' DC A 5 -12.181 2.310 8.341 1.00 0.00 H new ATOM 0 H5'' DC A 5 -11.020 3.075 7.274 1.00 0.00 H new ATOM 0 H4' DC A 5 -13.938 2.554 6.794 1.00 0.00 H new ATOM 0 H3' DC A 5 -11.491 1.181 5.900 1.00 0.00 H new ATOM 0 H2' DC A 5 -11.549 1.977 3.684 1.00 0.00 H new ATOM 0 H2'' DC A 5 -13.120 1.215 3.531 1.00 0.00 H new ATOM 0 H1' DC A 5 -14.272 3.151 3.965 1.00 0.00 H new ATOM 0 H41 DC A 5 -10.508 7.135 0.284 1.00 0.00 H new ATOM 0 H42 DC A 5 -12.182 7.348 -0.238 1.00 0.00 H new ATOM 0 H5 DC A 5 -9.881 5.648 2.071 1.00 0.00 H new ATOM 0 H6 DC A 5 -10.678 4.052 3.737 1.00 0.00 H new ATOM 158 P DA A 6 -12.955 -1.086 5.536 1.00 0.00 P ATOM 159 OP1 DA A 6 -14.011 -1.986 6.050 1.00 0.00 O ATOM 160 OP2 DA A 6 -11.555 -1.259 5.986 1.00 0.00 O ATOM 161 O5' DA A 6 -12.977 -1.151 3.927 1.00 0.00 O ATOM 162 C5' DA A 6 -14.221 -1.156 3.222 1.00 0.00 C ATOM 163 C4' DA A 6 -14.027 -1.427 1.732 1.00 0.00 C ATOM 164 O4' DA A 6 -15.304 -1.437 1.081 1.00 0.00 O ATOM 165 C3' DA A 6 -13.178 -0.379 1.012 1.00 0.00 C ATOM 166 O3' DA A 6 -12.425 -1.005 -0.032 1.00 0.00 O ATOM 167 C2' DA A 6 -14.214 0.541 0.400 1.00 0.00 C ATOM 168 C1' DA A 6 -15.280 -0.471 0.027 1.00 0.00 C ATOM 169 N9 DA A 6 -16.636 0.093 -0.109 1.00 0.00 N ATOM 170 C8 DA A 6 -17.239 1.072 0.639 1.00 0.00 C ATOM 171 N7 DA A 6 -18.457 1.348 0.262 1.00 0.00 N ATOM 172 C5 DA A 6 -18.676 0.491 -0.813 1.00 0.00 C ATOM 173 C6 DA A 6 -19.780 0.289 -1.657 1.00 0.00 C ATOM 174 N6 DA A 6 -20.921 0.970 -1.542 1.00 0.00 N ATOM 175 N1 DA A 6 -19.658 -0.640 -2.620 1.00 0.00 N ATOM 176 C2 DA A 6 -18.519 -1.314 -2.729 1.00 0.00 C ATOM 177 N3 DA A 6 -17.418 -1.216 -2.001 1.00 0.00 N ATOM 178 C4 DA A 6 -17.571 -0.277 -1.045 1.00 0.00 C ATOM 0 H5' DA A 6 -14.718 -0.195 3.355 1.00 0.00 H new ATOM 0 H5'' DA A 6 -14.877 -1.916 3.647 1.00 0.00 H new ATOM 0 H4' DA A 6 -13.509 -2.385 1.675 1.00 0.00 H new ATOM 0 H3' DA A 6 -12.472 0.131 1.668 1.00 0.00 H new ATOM 0 H2' DA A 6 -14.577 1.287 1.106 1.00 0.00 H new ATOM 0 H2'' DA A 6 -13.832 1.081 -0.466 1.00 0.00 H new ATOM 0 H1' DA A 6 -15.024 -0.881 -0.950 1.00 0.00 H new ATOM 0 H8 DA A 6 -16.750 1.569 1.464 1.00 0.00 H new ATOM 0 H61 DA A 6 -21.693 0.784 -2.182 1.00 0.00 H new ATOM 0 H62 DA A 6 -21.022 1.677 -0.814 1.00 0.00 H new ATOM 0 H2 DA A 6 -18.487 -2.045 -3.523 1.00 0.00 H new ATOM 190 P DC A 7 -11.910 -0.144 -1.292 1.00 0.00 P ATOM 191 OP1 DC A 7 -11.942 1.288 -0.918 1.00 0.00 O ATOM 192 OP2 DC A 7 -12.634 -0.608 -2.496 1.00 0.00 O ATOM 193 O5' DC A 7 -10.370 -0.594 -1.426 1.00 0.00 O ATOM 194 C5' DC A 7 -10.034 -1.909 -1.874 1.00 0.00 C ATOM 195 C4' DC A 7 -9.285 -2.690 -0.799 1.00 0.00 C ATOM 196 O4' DC A 7 -8.107 -1.989 -0.431 1.00 0.00 O ATOM 197 C3' DC A 7 -10.066 -2.876 0.487 1.00 0.00 C ATOM 198 O3' DC A 7 -9.569 -4.024 1.186 1.00 0.00 O ATOM 199 C2' DC A 7 -9.751 -1.609 1.277 1.00 0.00 C ATOM 200 C1' DC A 7 -8.416 -1.146 0.686 1.00 0.00 C ATOM 201 N1 DC A 7 -8.439 0.245 0.196 1.00 0.00 N ATOM 202 C2 DC A 7 -8.856 1.231 1.076 1.00 0.00 C ATOM 203 O2 DC A 7 -9.217 0.932 2.209 1.00 0.00 O ATOM 204 N3 DC A 7 -8.879 2.519 0.639 1.00 0.00 N ATOM 205 C4 DC A 7 -8.513 2.826 -0.610 1.00 0.00 C ATOM 206 N4 DC A 7 -8.549 4.097 -1.009 1.00 0.00 N ATOM 207 C5 DC A 7 -8.086 1.809 -1.520 1.00 0.00 C ATOM 208 C6 DC A 7 -8.065 0.540 -1.076 1.00 0.00 C ATOM 0 H5' DC A 7 -9.420 -1.843 -2.772 1.00 0.00 H new ATOM 0 H5'' DC A 7 -10.943 -2.445 -2.148 1.00 0.00 H new ATOM 0 H4' DC A 7 -9.090 -3.666 -1.244 1.00 0.00 H new ATOM 0 H3' DC A 7 -11.134 -3.028 0.330 1.00 0.00 H new ATOM 0 H2' DC A 7 -10.528 -0.855 1.154 1.00 0.00 H new ATOM 0 H2'' DC A 7 -9.669 -1.811 2.345 1.00 0.00 H new ATOM 0 H1' DC A 7 -7.677 -1.204 1.485 1.00 0.00 H new ATOM 0 H41 DC A 7 -8.272 4.341 -1.960 1.00 0.00 H new ATOM 0 H42 DC A 7 -8.854 4.826 -0.364 1.00 0.00 H new ATOM 0 H5 DC A 7 -7.790 2.052 -2.530 1.00 0.00 H new ATOM 0 H6 DC A 7 -7.748 -0.253 -1.737 1.00 0.00 H new ATOM 220 P DC A 8 -10.357 -4.616 2.461 1.00 0.00 P ATOM 221 OP1 DC A 8 -11.423 -3.659 2.835 1.00 0.00 O ATOM 222 OP2 DC A 8 -9.358 -5.038 3.468 1.00 0.00 O ATOM 223 O5' DC A 8 -11.059 -5.935 1.859 1.00 0.00 O ATOM 224 C5' DC A 8 -11.543 -6.965 2.727 1.00 0.00 C ATOM 225 C4' DC A 8 -10.492 -8.049 2.956 1.00 0.00 C ATOM 226 O4' DC A 8 -10.082 -8.589 1.694 1.00 0.00 O ATOM 227 C3' DC A 8 -9.231 -7.552 3.667 1.00 0.00 C ATOM 228 O3' DC A 8 -8.811 -8.527 4.629 1.00 0.00 O ATOM 229 C2' DC A 8 -8.201 -7.444 2.553 1.00 0.00 C ATOM 230 C1' DC A 8 -8.657 -8.550 1.617 1.00 0.00 C ATOM 231 N1 DC A 8 -8.287 -8.338 0.205 1.00 0.00 N ATOM 232 C2 DC A 8 -7.552 -9.333 -0.420 1.00 0.00 C ATOM 233 O2 DC A 8 -7.232 -10.343 0.202 1.00 0.00 O ATOM 234 N3 DC A 8 -7.203 -9.156 -1.723 1.00 0.00 N ATOM 235 C4 DC A 8 -7.560 -8.048 -2.387 1.00 0.00 C ATOM 236 N4 DC A 8 -7.202 -7.907 -3.663 1.00 0.00 N ATOM 237 C5 DC A 8 -8.319 -7.019 -1.746 1.00 0.00 C ATOM 238 C6 DC A 8 -8.660 -7.204 -0.457 1.00 0.00 C ATOM 0 H5' DC A 8 -12.439 -7.412 2.297 1.00 0.00 H new ATOM 0 H5'' DC A 8 -11.831 -6.529 3.684 1.00 0.00 H new ATOM 0 H4' DC A 8 -10.969 -8.792 3.596 1.00 0.00 H new ATOM 0 H3' DC A 8 -9.379 -6.611 4.196 1.00 0.00 H new ATOM 0 H2' DC A 8 -8.217 -6.466 2.072 1.00 0.00 H new ATOM 0 H2'' DC A 8 -7.186 -7.605 2.915 1.00 0.00 H new ATOM 0 H1' DC A 8 -8.169 -9.473 1.931 1.00 0.00 H new ATOM 0 H41 DC A 8 -7.468 -7.068 -4.178 1.00 0.00 H new ATOM 0 H42 DC A 8 -6.662 -8.638 -4.125 1.00 0.00 H new ATOM 0 H5 DC A 8 -8.608 -6.125 -2.278 1.00 0.00 H new ATOM 0 H6 DC A 8 -9.234 -6.448 0.058 1.00 0.00 H new ATOM 250 P DG A 9 -7.438 -8.334 5.449 1.00 0.00 P ATOM 251 OP1 DG A 9 -7.437 -9.285 6.583 1.00 0.00 O ATOM 252 OP2 DG A 9 -7.247 -6.887 5.699 1.00 0.00 O ATOM 253 O5' DG A 9 -6.326 -8.813 4.388 1.00 0.00 O ATOM 254 C5' DG A 9 -4.932 -8.670 4.675 1.00 0.00 C ATOM 255 C4' DG A 9 -4.078 -9.025 3.461 1.00 0.00 C ATOM 256 O4' DG A 9 -4.430 -8.178 2.364 1.00 0.00 O ATOM 257 C3' DG A 9 -2.564 -8.859 3.683 1.00 0.00 C ATOM 258 O3' DG A 9 -1.884 -10.057 3.277 1.00 0.00 O ATOM 259 C2' DG A 9 -2.180 -7.714 2.760 1.00 0.00 C ATOM 260 C1' DG A 9 -3.227 -7.871 1.681 1.00 0.00 C ATOM 261 N9 DG A 9 -3.445 -6.682 0.838 1.00 0.00 N ATOM 262 C8 DG A 9 -3.598 -6.640 -0.516 1.00 0.00 C ATOM 263 N7 DG A 9 -3.731 -5.439 -1.000 1.00 0.00 N ATOM 264 C5 DG A 9 -3.663 -4.618 0.117 1.00 0.00 C ATOM 265 C6 DG A 9 -3.745 -3.204 0.209 1.00 0.00 C ATOM 266 O6 DG A 9 -3.899 -2.389 -0.699 1.00 0.00 O ATOM 267 N1 DG A 9 -3.629 -2.772 1.522 1.00 0.00 N ATOM 268 C2 DG A 9 -3.458 -3.597 2.614 1.00 0.00 C ATOM 269 N2 DG A 9 -3.370 -2.996 3.801 1.00 0.00 N ATOM 270 N3 DG A 9 -3.381 -4.929 2.529 1.00 0.00 N ATOM 271 C4 DG A 9 -3.490 -5.369 1.254 1.00 0.00 C ATOM 0 H5' DG A 9 -4.663 -9.313 5.513 1.00 0.00 H new ATOM 0 H5'' DG A 9 -4.725 -7.645 4.981 1.00 0.00 H new ATOM 0 H4' DG A 9 -4.279 -10.078 3.266 1.00 0.00 H new ATOM 0 H3' DG A 9 -2.305 -8.669 4.724 1.00 0.00 H new ATOM 0 H2' DG A 9 -2.237 -6.745 3.255 1.00 0.00 H new ATOM 0 H2'' DG A 9 -1.166 -7.815 2.373 1.00 0.00 H new ATOM 0 H1' DG A 9 -2.889 -8.642 0.988 1.00 0.00 H new ATOM 0 H8 DG A 9 -3.608 -7.526 -1.133 1.00 0.00 H new ATOM 0 H1 DG A 9 -3.674 -1.767 1.693 1.00 0.00 H new ATOM 0 H21 DG A 9 -3.243 -3.553 4.646 1.00 0.00 H new ATOM 0 H22 DG A 9 -3.430 -1.980 3.864 1.00 0.00 H new ATOM 283 P DG A 10 -0.316 -10.270 3.596 1.00 0.00 P ATOM 284 OP1 DG A 10 -0.158 -11.574 4.277 1.00 0.00 O ATOM 285 OP2 DG A 10 0.202 -9.040 4.237 1.00 0.00 O ATOM 286 O5' DG A 10 0.341 -10.390 2.126 1.00 0.00 O ATOM 287 C5' DG A 10 0.234 -9.317 1.187 1.00 0.00 C ATOM 288 C4' DG A 10 0.958 -9.625 -0.121 1.00 0.00 C ATOM 289 O4' DG A 10 0.677 -8.592 -1.067 1.00 0.00 O ATOM 290 C3' DG A 10 2.480 -9.713 0.011 1.00 0.00 C ATOM 291 O3' DG A 10 2.966 -10.805 -0.777 1.00 0.00 O ATOM 292 C2' DG A 10 2.979 -8.399 -0.563 1.00 0.00 C ATOM 293 C1' DG A 10 1.909 -8.106 -1.595 1.00 0.00 C ATOM 294 N9 DG A 10 1.726 -6.680 -1.911 1.00 0.00 N ATOM 295 C8 DG A 10 1.582 -6.110 -3.139 1.00 0.00 C ATOM 296 N7 DG A 10 1.417 -4.818 -3.113 1.00 0.00 N ATOM 297 C5 DG A 10 1.455 -4.505 -1.758 1.00 0.00 C ATOM 298 C6 DG A 10 1.330 -3.246 -1.111 1.00 0.00 C ATOM 299 O6 DG A 10 1.155 -2.141 -1.620 1.00 0.00 O ATOM 300 N1 DG A 10 1.426 -3.371 0.268 1.00 0.00 N ATOM 301 C2 DG A 10 1.618 -4.557 0.944 1.00 0.00 C ATOM 302 N2 DG A 10 1.688 -4.476 2.272 1.00 0.00 N ATOM 303 N3 DG A 10 1.734 -5.742 0.337 1.00 0.00 N ATOM 304 C4 DG A 10 1.644 -5.641 -1.010 1.00 0.00 C ATOM 0 H5' DG A 10 0.649 -8.409 1.625 1.00 0.00 H new ATOM 0 H5'' DG A 10 -0.818 -9.120 0.981 1.00 0.00 H new ATOM 0 H4' DG A 10 0.593 -10.602 -0.438 1.00 0.00 H new ATOM 0 H3' DG A 10 2.810 -9.875 1.037 1.00 0.00 H new ATOM 0 H2' DG A 10 3.046 -7.618 0.194 1.00 0.00 H new ATOM 0 H2'' DG A 10 3.968 -8.494 -1.011 1.00 0.00 H new ATOM 0 H1' DG A 10 2.222 -8.587 -2.522 1.00 0.00 H new ATOM 0 H8 DG A 10 1.603 -6.680 -4.056 1.00 0.00 H new ATOM 0 H1 DG A 10 1.348 -2.520 0.824 1.00 0.00 H new ATOM 0 H21 DG A 10 1.829 -5.320 2.828 1.00 0.00 H new ATOM 0 H22 DG A 10 1.601 -3.570 2.733 1.00 0.00 H new ATOM 316 P DG A 11 4.548 -11.065 -0.932 1.00 0.00 P ATOM 317 OP1 DG A 11 4.743 -12.435 -1.458 1.00 0.00 O ATOM 318 OP2 DG A 11 5.209 -10.658 0.328 1.00 0.00 O ATOM 319 O5' DG A 11 4.968 -10.019 -2.082 1.00 0.00 O ATOM 320 C5' DG A 11 4.556 -10.223 -3.437 1.00 0.00 C ATOM 321 C4' DG A 11 5.238 -9.241 -4.386 1.00 0.00 C ATOM 322 O4' DG A 11 4.894 -7.901 -4.021 1.00 0.00 O ATOM 323 C3' DG A 11 6.769 -9.334 -4.380 1.00 0.00 C ATOM 324 O3' DG A 11 7.243 -9.474 -5.722 1.00 0.00 O ATOM 325 C2' DG A 11 7.232 -7.997 -3.811 1.00 0.00 C ATOM 326 C1' DG A 11 6.060 -7.096 -4.153 1.00 0.00 C ATOM 327 N9 DG A 11 5.911 -5.931 -3.262 1.00 0.00 N ATOM 328 C8 DG A 11 6.047 -5.873 -1.901 1.00 0.00 C ATOM 329 N7 DG A 11 5.858 -4.684 -1.400 1.00 0.00 N ATOM 330 C5 DG A 11 5.574 -3.895 -2.509 1.00 0.00 C ATOM 331 C6 DG A 11 5.281 -2.506 -2.587 1.00 0.00 C ATOM 332 O6 DG A 11 5.214 -1.689 -1.671 1.00 0.00 O ATOM 333 N1 DG A 11 5.054 -2.106 -3.896 1.00 0.00 N ATOM 334 C2 DG A 11 5.103 -2.935 -4.997 1.00 0.00 C ATOM 335 N2 DG A 11 4.855 -2.365 -6.177 1.00 0.00 N ATOM 336 N3 DG A 11 5.380 -4.241 -4.927 1.00 0.00 N ATOM 337 C4 DG A 11 5.604 -4.649 -3.655 1.00 0.00 C ATOM 0 H5' DG A 11 3.474 -10.109 -3.510 1.00 0.00 H new ATOM 0 H5'' DG A 11 4.790 -11.244 -3.739 1.00 0.00 H new ATOM 0 H4' DG A 11 4.886 -9.504 -5.383 1.00 0.00 H new ATOM 0 H3' DG A 11 7.136 -10.183 -3.804 1.00 0.00 H new ATOM 0 H2' DG A 11 7.409 -8.048 -2.737 1.00 0.00 H new ATOM 0 H2'' DG A 11 8.159 -7.655 -4.271 1.00 0.00 H new ATOM 0 H1' DG A 11 6.221 -6.695 -5.154 1.00 0.00 H new ATOM 0 H8 DG A 11 6.289 -6.735 -1.297 1.00 0.00 H new ATOM 0 H1 DG A 11 4.834 -1.123 -4.056 1.00 0.00 H new ATOM 0 H21 DG A 11 4.876 -2.926 -7.029 1.00 0.00 H new ATOM 0 H22 DG A 11 4.644 -1.368 -6.228 1.00 0.00 H new ATOM 349 P DC A 12 8.666 -10.167 -6.018 1.00 0.00 P ATOM 350 OP1 DC A 12 8.962 -10.019 -7.460 1.00 0.00 O ATOM 351 OP2 DC A 12 8.664 -11.511 -5.399 1.00 0.00 O ATOM 352 O5' DC A 12 9.691 -9.235 -5.196 1.00 0.00 O ATOM 353 C5' DC A 12 11.057 -9.627 -5.039 1.00 0.00 C ATOM 354 C4' DC A 12 11.822 -8.659 -4.140 1.00 0.00 C ATOM 355 O4' DC A 12 11.827 -7.360 -4.726 1.00 0.00 O ATOM 356 C3' DC A 12 11.228 -8.511 -2.734 1.00 0.00 C ATOM 357 O3' DC A 12 12.164 -9.002 -1.770 1.00 0.00 O ATOM 358 C2' DC A 12 11.033 -7.004 -2.542 1.00 0.00 C ATOM 359 C1' DC A 12 11.876 -6.419 -3.665 1.00 0.00 C ATOM 360 N1 DC A 12 11.390 -5.125 -4.183 1.00 0.00 N ATOM 361 C2 DC A 12 12.283 -4.066 -4.192 1.00 0.00 C ATOM 362 O2 DC A 12 13.429 -4.224 -3.777 1.00 0.00 O ATOM 363 N3 DC A 12 11.856 -2.865 -4.669 1.00 0.00 N ATOM 364 C4 DC A 12 10.604 -2.709 -5.118 1.00 0.00 C ATOM 365 N4 DC A 12 10.217 -1.520 -5.579 1.00 0.00 N ATOM 366 C5 DC A 12 9.678 -3.800 -5.110 1.00 0.00 C ATOM 367 C6 DC A 12 10.111 -4.984 -4.637 1.00 0.00 C ATOM 0 H5' DC A 12 11.537 -9.673 -6.016 1.00 0.00 H new ATOM 0 H5'' DC A 12 11.101 -10.630 -4.615 1.00 0.00 H new ATOM 0 H4' DC A 12 12.822 -9.082 -4.046 1.00 0.00 H new ATOM 0 H3' DC A 12 10.297 -9.065 -2.614 1.00 0.00 H new ATOM 0 H2' DC A 12 9.985 -6.716 -2.628 1.00 0.00 H new ATOM 0 H2'' DC A 12 11.375 -6.672 -1.562 1.00 0.00 H new ATOM 0 H1' DC A 12 12.876 -6.233 -3.273 1.00 0.00 H new ATOM 0 H41 DC A 12 9.265 -1.392 -5.923 1.00 0.00 H new ATOM 0 H42 DC A 12 10.872 -0.738 -5.588 1.00 0.00 H new ATOM 0 H5 DC A 12 8.667 -3.678 -5.471 1.00 0.00 H new ATOM 0 H6 DC A 12 9.440 -5.830 -4.617 1.00 0.00 H new ATOM 379 P DA A 13 11.835 -8.920 -0.196 1.00 0.00 P ATOM 380 OP1 DA A 13 12.672 -9.919 0.505 1.00 0.00 O ATOM 381 OP2 DA A 13 10.365 -8.942 -0.028 1.00 0.00 O ATOM 382 O5' DA A 13 12.365 -7.452 0.200 1.00 0.00 O ATOM 383 C5' DA A 13 13.764 -7.210 0.374 1.00 0.00 C ATOM 384 C4' DA A 13 14.037 -5.779 0.830 1.00 0.00 C ATOM 385 O4' DA A 13 13.575 -4.863 -0.160 1.00 0.00 O ATOM 386 C3' DA A 13 13.348 -5.404 2.149 1.00 0.00 C ATOM 387 O3' DA A 13 14.340 -5.023 3.108 1.00 0.00 O ATOM 388 C2' DA A 13 12.473 -4.199 1.806 1.00 0.00 C ATOM 389 C1' DA A 13 13.101 -3.705 0.514 1.00 0.00 C ATOM 390 N9 DA A 13 12.168 -3.008 -0.390 1.00 0.00 N ATOM 391 C8 DA A 13 10.867 -3.318 -0.689 1.00 0.00 C ATOM 392 N7 DA A 13 10.310 -2.500 -1.539 1.00 0.00 N ATOM 393 C5 DA A 13 11.316 -1.581 -1.823 1.00 0.00 C ATOM 394 C6 DA A 13 11.364 -0.454 -2.659 1.00 0.00 C ATOM 395 N6 DA A 13 10.330 -0.046 -3.395 1.00 0.00 N ATOM 396 N1 DA A 13 12.520 0.231 -2.705 1.00 0.00 N ATOM 397 C2 DA A 13 13.546 -0.181 -1.970 1.00 0.00 C ATOM 398 N3 DA A 13 13.624 -1.217 -1.151 1.00 0.00 N ATOM 399 C4 DA A 13 12.451 -1.884 -1.127 1.00 0.00 C ATOM 0 H5' DA A 13 14.285 -7.399 -0.564 1.00 0.00 H new ATOM 0 H5'' DA A 13 14.166 -7.909 1.108 1.00 0.00 H new ATOM 0 H4' DA A 13 15.115 -5.722 0.981 1.00 0.00 H new ATOM 0 H3' DA A 13 12.770 -6.227 2.569 1.00 0.00 H new ATOM 0 H2' DA A 13 11.429 -4.480 1.670 1.00 0.00 H new ATOM 0 H2'' DA A 13 12.500 -3.440 2.588 1.00 0.00 H new ATOM 0 H1' DA A 13 13.874 -2.981 0.771 1.00 0.00 H new ATOM 0 H8 DA A 13 10.350 -4.163 -0.260 1.00 0.00 H new ATOM 0 H61 DA A 13 10.419 0.781 -3.986 1.00 0.00 H new ATOM 0 H62 DA A 13 9.450 -0.560 -3.367 1.00 0.00 H new ATOM 0 H2 DA A 13 14.444 0.414 -2.052 1.00 0.00 H new ATOM 411 P DG A 14 13.938 -4.782 4.649 1.00 0.00 P ATOM 412 OP1 DG A 14 15.175 -4.819 5.461 1.00 0.00 O ATOM 413 OP2 DG A 14 12.812 -5.683 4.980 1.00 0.00 O ATOM 414 O5' DG A 14 13.386 -3.269 4.642 1.00 0.00 O ATOM 415 C5' DG A 14 14.276 -2.173 4.410 1.00 0.00 C ATOM 416 C4' DG A 14 13.762 -0.886 5.051 1.00 0.00 C ATOM 417 O4' DG A 14 14.681 0.177 4.794 1.00 0.00 O ATOM 418 C3' DG A 14 12.390 -0.434 4.533 1.00 0.00 C ATOM 419 O3' DG A 14 11.502 -0.258 5.642 1.00 0.00 O ATOM 420 C2' DG A 14 12.654 0.913 3.866 1.00 0.00 C ATOM 421 C1' DG A 14 13.926 1.359 4.563 1.00 0.00 C ATOM 422 N9 DG A 14 14.764 2.285 3.776 1.00 0.00 N ATOM 423 C8 DG A 14 15.031 2.272 2.431 1.00 0.00 C ATOM 424 N7 DG A 14 15.822 3.232 2.040 1.00 0.00 N ATOM 425 C5 DG A 14 16.101 3.933 3.209 1.00 0.00 C ATOM 426 C6 DG A 14 16.912 5.084 3.408 1.00 0.00 C ATOM 427 O6 DG A 14 17.554 5.718 2.574 1.00 0.00 O ATOM 428 N1 DG A 14 16.925 5.472 4.741 1.00 0.00 N ATOM 429 C2 DG A 14 16.244 4.835 5.757 1.00 0.00 C ATOM 430 N2 DG A 14 16.379 5.357 6.977 1.00 0.00 N ATOM 431 N3 DG A 14 15.482 3.754 5.572 1.00 0.00 N ATOM 432 C4 DG A 14 15.457 3.361 4.277 1.00 0.00 C ATOM 0 H5' DG A 14 14.397 -2.023 3.337 1.00 0.00 H new ATOM 0 H5'' DG A 14 15.261 -2.412 4.811 1.00 0.00 H new ATOM 0 H4' DG A 14 13.665 -1.108 6.114 1.00 0.00 H new ATOM 0 H3' DG A 14 11.938 -1.153 3.850 1.00 0.00 H new ATOM 0 H2' DG A 14 12.790 0.816 2.789 1.00 0.00 H new ATOM 0 H2'' DG A 14 11.834 1.614 4.022 1.00 0.00 H new ATOM 0 H1' DG A 14 13.643 1.901 5.465 1.00 0.00 H new ATOM 0 H8 DG A 14 14.623 1.534 1.757 1.00 0.00 H new ATOM 0 H1 DG A 14 17.481 6.291 4.988 1.00 0.00 H new ATOM 0 H21 DG A 14 15.900 4.931 7.770 1.00 0.00 H new ATOM 0 H22 DG A 14 16.961 6.183 7.117 1.00 0.00 H new ATOM 444 P DT A 15 9.938 0.039 5.401 1.00 0.00 P ATOM 445 OP1 DT A 15 9.243 -0.059 6.704 1.00 0.00 O ATOM 446 OP2 DT A 15 9.481 -0.783 4.258 1.00 0.00 O ATOM 447 O5' DT A 15 9.935 1.582 4.943 1.00 0.00 O ATOM 448 C5' DT A 15 10.325 2.612 5.856 1.00 0.00 C ATOM 449 C4' DT A 15 9.859 3.986 5.384 1.00 0.00 C ATOM 450 O4' DT A 15 10.412 4.263 4.093 1.00 0.00 O ATOM 451 C3' DT A 15 8.337 4.116 5.263 1.00 0.00 C ATOM 452 O3' DT A 15 7.912 5.329 5.895 1.00 0.00 O ATOM 453 C2' DT A 15 8.084 4.201 3.764 1.00 0.00 C ATOM 454 C1' DT A 15 9.383 4.814 3.276 1.00 0.00 C ATOM 455 N1 DT A 15 9.710 4.511 1.869 1.00 0.00 N ATOM 456 C2 DT A 15 9.933 5.581 1.023 1.00 0.00 C ATOM 457 O2 DT A 15 9.863 6.746 1.410 1.00 0.00 O ATOM 458 N3 DT A 15 10.239 5.265 -0.287 1.00 0.00 N ATOM 459 C4 DT A 15 10.340 3.990 -0.816 1.00 0.00 C ATOM 460 O4 DT A 15 10.619 3.823 -2.001 1.00 0.00 O ATOM 461 C5 DT A 15 10.092 2.936 0.142 1.00 0.00 C ATOM 462 C7 DT A 15 10.171 1.481 -0.306 1.00 0.00 C ATOM 463 C6 DT A 15 9.792 3.219 1.426 1.00 0.00 C ATOM 0 H5' DT A 15 11.410 2.612 5.964 1.00 0.00 H new ATOM 0 H5'' DT A 15 9.907 2.404 6.841 1.00 0.00 H new ATOM 0 H4' DT A 15 10.200 4.690 6.143 1.00 0.00 H new ATOM 0 H3' DT A 15 7.802 3.290 5.732 1.00 0.00 H new ATOM 0 H2' DT A 15 7.900 3.222 3.322 1.00 0.00 H new ATOM 0 H2'' DT A 15 7.221 4.824 3.528 1.00 0.00 H new ATOM 0 H1' DT A 15 9.288 5.898 3.339 1.00 0.00 H new ATOM 0 H3 DT A 15 10.406 6.044 -0.924 1.00 0.00 H new ATOM 0 H71 DT A 15 9.892 1.408 -1.357 1.00 0.00 H new ATOM 0 H72 DT A 15 11.189 1.115 -0.175 1.00 0.00 H new ATOM 0 H73 DT A 15 9.489 0.878 0.293 1.00 0.00 H new ATOM 0 H6 DT A 15 9.613 2.410 2.118 1.00 0.00 H new ATOM 476 P DG A 16 6.372 5.537 6.318 1.00 0.00 P ATOM 477 OP1 DG A 16 6.322 5.787 7.776 1.00 0.00 O ATOM 478 OP2 DG A 16 5.578 4.434 5.732 1.00 0.00 O ATOM 479 O5' DG A 16 5.974 6.901 5.560 1.00 0.00 O ATOM 480 C5' DG A 16 5.681 6.899 4.160 1.00 0.00 C ATOM 481 C4' DG A 16 5.021 8.200 3.720 1.00 0.00 C ATOM 482 O4' DG A 16 4.990 8.255 2.306 1.00 0.00 O ATOM 483 C3' DG A 16 3.578 8.341 4.161 1.00 0.00 C ATOM 484 O3' DG A 16 3.194 9.721 4.130 1.00 0.00 O ATOM 485 C2' DG A 16 2.834 7.565 3.100 1.00 0.00 C ATOM 486 C1' DG A 16 3.688 7.842 1.870 1.00 0.00 C ATOM 487 N9 DG A 16 3.868 6.681 0.989 1.00 0.00 N ATOM 488 C8 DG A 16 3.737 6.631 -0.362 1.00 0.00 C ATOM 489 N7 DG A 16 3.952 5.454 -0.878 1.00 0.00 N ATOM 490 C5 DG A 16 4.253 4.660 0.223 1.00 0.00 C ATOM 491 C6 DG A 16 4.579 3.278 0.288 1.00 0.00 C ATOM 492 O6 DG A 16 4.664 2.471 -0.635 1.00 0.00 O ATOM 493 N1 DG A 16 4.814 2.872 1.594 1.00 0.00 N ATOM 494 C2 DG A 16 4.745 3.690 2.702 1.00 0.00 C ATOM 495 N2 DG A 16 5.005 3.116 3.876 1.00 0.00 N ATOM 496 N3 DG A 16 4.438 4.990 2.643 1.00 0.00 N ATOM 497 C4 DG A 16 4.205 5.404 1.375 1.00 0.00 C ATOM 0 H5' DG A 16 5.024 6.061 3.927 1.00 0.00 H new ATOM 0 H5'' DG A 16 6.602 6.749 3.596 1.00 0.00 H new ATOM 0 H4' DG A 16 5.614 8.991 4.179 1.00 0.00 H new ATOM 0 H3' DG A 16 3.387 7.986 5.174 1.00 0.00 H new ATOM 0 H2' DG A 16 2.780 6.501 3.331 1.00 0.00 H new ATOM 0 H2'' DG A 16 1.810 7.917 2.976 1.00 0.00 H new ATOM 0 H1' DG A 16 3.163 8.607 1.298 1.00 0.00 H new ATOM 0 H8 DG A 16 3.477 7.493 -0.958 1.00 0.00 H new ATOM 0 H1 DG A 16 5.056 1.893 1.746 1.00 0.00 H new ATOM 0 H21 DG A 16 4.970 3.669 4.733 1.00 0.00 H new ATOM 0 H22 DG A 16 5.239 2.124 3.918 1.00 0.00 H new ATOM 509 P DG A 17 1.684 10.166 4.476 1.00 0.00 P ATOM 510 OP1 DG A 17 1.691 11.609 4.806 1.00 0.00 O ATOM 511 OP2 DG A 17 1.124 9.192 5.439 1.00 0.00 O ATOM 512 O5' DG A 17 0.927 9.976 3.068 1.00 0.00 O ATOM 513 C5' DG A 17 1.285 10.775 1.937 1.00 0.00 C ATOM 514 C4' DG A 17 0.584 10.297 0.668 1.00 0.00 C ATOM 515 O4' DG A 17 0.917 8.928 0.424 1.00 0.00 O ATOM 516 C3' DG A 17 -0.944 10.390 0.728 1.00 0.00 C ATOM 517 O3' DG A 17 -1.418 11.098 -0.423 1.00 0.00 O ATOM 518 C2' DG A 17 -1.423 8.942 0.680 1.00 0.00 C ATOM 519 C1' DG A 17 -0.259 8.253 -0.009 1.00 0.00 C ATOM 520 N9 DG A 17 -0.107 6.825 0.333 1.00 0.00 N ATOM 521 C8 DG A 17 0.059 6.251 1.566 1.00 0.00 C ATOM 522 N7 DG A 17 0.189 4.954 1.533 1.00 0.00 N ATOM 523 C5 DG A 17 0.103 4.643 0.180 1.00 0.00 C ATOM 524 C6 DG A 17 0.176 3.381 -0.471 1.00 0.00 C ATOM 525 O6 DG A 17 0.337 2.272 0.033 1.00 0.00 O ATOM 526 N1 DG A 17 0.041 3.510 -1.847 1.00 0.00 N ATOM 527 C2 DG A 17 -0.141 4.702 -2.516 1.00 0.00 C ATOM 528 N2 DG A 17 -0.252 4.624 -3.842 1.00 0.00 N ATOM 529 N3 DG A 17 -0.209 5.889 -1.906 1.00 0.00 N ATOM 530 C4 DG A 17 -0.080 5.783 -0.563 1.00 0.00 C ATOM 0 H5' DG A 17 2.365 10.739 1.793 1.00 0.00 H new ATOM 0 H5'' DG A 17 1.023 11.816 2.128 1.00 0.00 H new ATOM 0 H4' DG A 17 0.930 10.959 -0.126 1.00 0.00 H new ATOM 0 H3' DG A 17 -1.302 10.913 1.615 1.00 0.00 H new ATOM 0 H2' DG A 17 -1.606 8.538 1.676 1.00 0.00 H new ATOM 0 H2'' DG A 17 -2.351 8.837 0.118 1.00 0.00 H new ATOM 0 H1' DG A 17 -0.435 8.296 -1.084 1.00 0.00 H new ATOM 0 H8 DG A 17 0.080 6.822 2.483 1.00 0.00 H new ATOM 0 H1 DG A 17 0.079 2.658 -2.406 1.00 0.00 H new ATOM 0 H21 DG A 17 -0.388 5.471 -4.393 1.00 0.00 H new ATOM 0 H22 DG A 17 -0.201 3.717 -4.306 1.00 0.00 H new ATOM 542 P DG A 18 -2.982 11.093 -0.806 1.00 0.00 P ATOM 543 OP1 DG A 18 -3.346 12.444 -1.287 1.00 0.00 O ATOM 544 OP2 DG A 18 -3.731 10.481 0.314 1.00 0.00 O ATOM 545 O5' DG A 18 -3.032 10.081 -2.058 1.00 0.00 O ATOM 546 C5' DG A 18 -4.260 9.841 -2.749 1.00 0.00 C ATOM 547 C4' DG A 18 -4.058 8.919 -3.949 1.00 0.00 C ATOM 548 O4' DG A 18 -3.480 7.683 -3.511 1.00 0.00 O ATOM 549 C3' DG A 18 -5.351 8.574 -4.688 1.00 0.00 C ATOM 550 O3' DG A 18 -5.104 8.548 -6.098 1.00 0.00 O ATOM 551 C2' DG A 18 -5.683 7.174 -4.200 1.00 0.00 C ATOM 552 C1' DG A 18 -4.293 6.605 -3.980 1.00 0.00 C ATOM 553 N9 DG A 18 -4.229 5.526 -2.977 1.00 0.00 N ATOM 554 C8 DG A 18 -4.138 5.626 -1.614 1.00 0.00 C ATOM 555 N7 DG A 18 -4.079 4.476 -1.002 1.00 0.00 N ATOM 556 C5 DG A 18 -4.135 3.545 -2.034 1.00 0.00 C ATOM 557 C6 DG A 18 -4.108 2.125 -1.980 1.00 0.00 C ATOM 558 O6 DG A 18 -4.029 1.400 -0.991 1.00 0.00 O ATOM 559 N1 DG A 18 -4.186 1.567 -3.250 1.00 0.00 N ATOM 560 C2 DG A 18 -4.279 2.282 -4.425 1.00 0.00 C ATOM 561 N2 DG A 18 -4.347 1.568 -5.548 1.00 0.00 N ATOM 562 N3 DG A 18 -4.303 3.617 -4.477 1.00 0.00 N ATOM 563 C4 DG A 18 -4.227 4.179 -3.247 1.00 0.00 C ATOM 0 H5' DG A 18 -4.681 10.789 -3.084 1.00 0.00 H new ATOM 0 H5'' DG A 18 -4.982 9.396 -2.065 1.00 0.00 H new ATOM 0 H4' DG A 18 -3.410 9.465 -4.635 1.00 0.00 H new ATOM 0 H3' DG A 18 -6.153 9.290 -4.507 1.00 0.00 H new ATOM 0 H2' DG A 18 -6.273 7.186 -3.284 1.00 0.00 H new ATOM 0 H2'' DG A 18 -6.250 6.604 -4.937 1.00 0.00 H new ATOM 0 H1' DG A 18 -3.961 6.171 -4.923 1.00 0.00 H new ATOM 0 H8 DG A 18 -4.117 6.572 -1.093 1.00 0.00 H new ATOM 0 H1 DG A 18 -4.173 0.549 -3.318 1.00 0.00 H new ATOM 0 H21 DG A 18 -4.417 2.040 -6.449 1.00 0.00 H new ATOM 0 H22 DG A 18 -4.329 0.549 -5.506 1.00 0.00 H new ATOM 575 P DC A 19 -4.766 9.906 -6.896 1.00 0.00 P ATOM 576 OP1 DC A 19 -5.669 10.969 -6.401 1.00 0.00 O ATOM 577 OP2 DC A 19 -4.717 9.594 -8.342 1.00 0.00 O ATOM 578 O5' DC A 19 -3.272 10.245 -6.402 1.00 0.00 O ATOM 579 C5' DC A 19 -2.141 9.619 -7.016 1.00 0.00 C ATOM 580 C4' DC A 19 -2.163 8.104 -6.831 1.00 0.00 C ATOM 581 O4' DC A 19 -3.283 7.551 -7.502 1.00 0.00 O ATOM 582 C3' DC A 19 -0.950 7.389 -7.404 1.00 0.00 C ATOM 583 O3' DC A 19 0.059 7.279 -6.396 1.00 0.00 O ATOM 584 C2' DC A 19 -1.476 6.000 -7.769 1.00 0.00 C ATOM 585 C1' DC A 19 -3.000 6.174 -7.761 1.00 0.00 C ATOM 586 N1 DC A 19 -3.651 5.819 -9.037 1.00 0.00 N ATOM 587 C2 DC A 19 -4.777 5.012 -8.975 1.00 0.00 C ATOM 588 O2 DC A 19 -5.193 4.620 -7.887 1.00 0.00 O ATOM 589 N3 DC A 19 -5.395 4.676 -10.140 1.00 0.00 N ATOM 590 C4 DC A 19 -4.928 5.112 -11.317 1.00 0.00 C ATOM 591 N4 DC A 19 -5.558 4.764 -12.440 1.00 0.00 N ATOM 592 C5 DC A 19 -3.767 5.945 -11.386 1.00 0.00 C ATOM 593 C6 DC A 19 -3.162 6.273 -10.228 1.00 0.00 C ATOM 0 H5' DC A 19 -1.224 10.024 -6.588 1.00 0.00 H new ATOM 0 H5'' DC A 19 -2.128 9.855 -8.080 1.00 0.00 H new ATOM 0 H4' DC A 19 -2.188 7.957 -5.751 1.00 0.00 H new ATOM 0 H3' DC A 19 -0.509 7.909 -8.255 1.00 0.00 H new ATOM 0 H2' DC A 19 -1.115 5.679 -8.746 1.00 0.00 H new ATOM 0 H2'' DC A 19 -1.155 5.248 -7.048 1.00 0.00 H new ATOM 0 H1' DC A 19 -3.392 5.500 -6.999 1.00 0.00 H new ATOM 0 H41 DC A 19 -5.211 5.091 -13.342 1.00 0.00 H new ATOM 0 H42 DC A 19 -6.387 4.171 -12.397 1.00 0.00 H new ATOM 0 H5 DC A 19 -3.389 6.299 -12.334 1.00 0.00 H new ATOM 0 H6 DC A 19 -2.283 6.900 -10.242 1.00 0.00 H new ATOM 605 P DG A 20 1.230 8.378 -6.292 1.00 0.00 P ATOM 606 OP1 DG A 20 1.931 8.189 -5.002 1.00 0.00 O ATOM 607 OP2 DG A 20 0.658 9.699 -6.634 1.00 0.00 O ATOM 608 O5' DG A 20 2.227 7.938 -7.477 1.00 0.00 O ATOM 609 C5' DG A 20 3.069 6.792 -7.326 1.00 0.00 C ATOM 610 C4' DG A 20 3.182 6.001 -8.627 1.00 0.00 C ATOM 611 O4' DG A 20 3.995 4.841 -8.415 1.00 0.00 O ATOM 612 C3' DG A 20 1.842 5.510 -9.164 1.00 0.00 C ATOM 613 O3' DG A 20 1.877 5.488 -10.595 1.00 0.00 O ATOM 614 C2' DG A 20 1.750 4.092 -8.629 1.00 0.00 C ATOM 615 C1' DG A 20 3.210 3.668 -8.662 1.00 0.00 C ATOM 616 N9 DG A 20 3.570 2.666 -7.641 1.00 0.00 N ATOM 617 C8 DG A 20 3.839 1.332 -7.802 1.00 0.00 C ATOM 618 N7 DG A 20 4.123 0.712 -6.690 1.00 0.00 N ATOM 619 C5 DG A 20 4.036 1.707 -5.721 1.00 0.00 C ATOM 620 C6 DG A 20 4.241 1.632 -4.316 1.00 0.00 C ATOM 621 O6 DG A 20 4.545 0.650 -3.642 1.00 0.00 O ATOM 622 N1 DG A 20 4.054 2.866 -3.708 1.00 0.00 N ATOM 623 C2 DG A 20 3.713 4.029 -4.366 1.00 0.00 C ATOM 624 N2 DG A 20 3.578 5.118 -3.610 1.00 0.00 N ATOM 625 N3 DG A 20 3.520 4.101 -5.686 1.00 0.00 N ATOM 626 C4 DG A 20 3.698 2.907 -6.295 1.00 0.00 C ATOM 0 H5' DG A 20 2.671 6.148 -6.542 1.00 0.00 H new ATOM 0 H5'' DG A 20 4.061 7.109 -7.005 1.00 0.00 H new ATOM 0 H4' DG A 20 3.614 6.689 -9.354 1.00 0.00 H new ATOM 0 H3' DG A 20 1.000 6.137 -8.869 1.00 0.00 H new ATOM 0 H2' DG A 20 1.335 4.058 -7.622 1.00 0.00 H new ATOM 0 H2'' DG A 20 1.123 3.456 -9.254 1.00 0.00 H new ATOM 0 H1' DG A 20 3.394 3.210 -9.634 1.00 0.00 H new ATOM 0 H8 DG A 20 3.818 0.839 -8.763 1.00 0.00 H new ATOM 0 H1 DG A 20 4.178 2.916 -2.697 1.00 0.00 H new ATOM 0 H21 DG A 20 3.327 6.009 -4.039 1.00 0.00 H new ATOM 0 H22 DG A 20 3.726 5.061 -2.602 1.00 0.00 H new ATOM 638 P DG A 21 0.521 5.293 -11.440 1.00 0.00 P ATOM 639 OP1 DG A 21 0.870 5.279 -12.878 1.00 0.00 O ATOM 640 OP2 DG A 21 -0.483 6.254 -10.933 1.00 0.00 O ATOM 641 O5' DG A 21 0.055 3.810 -11.020 1.00 0.00 O ATOM 642 C5' DG A 21 0.595 2.663 -11.682 1.00 0.00 C ATOM 643 C4' DG A 21 0.050 1.367 -11.089 1.00 0.00 C ATOM 644 O4' DG A 21 0.519 1.216 -9.747 1.00 0.00 O ATOM 645 C3' DG A 21 -1.482 1.305 -11.041 1.00 0.00 C ATOM 646 O3' DG A 21 -1.935 0.137 -11.734 1.00 0.00 O ATOM 647 C2' DG A 21 -1.819 1.186 -9.557 1.00 0.00 C ATOM 648 C1' DG A 21 -0.528 0.624 -8.990 1.00 0.00 C ATOM 649 N9 DG A 21 -0.307 0.948 -7.569 1.00 0.00 N ATOM 650 C8 DG A 21 -0.390 2.164 -6.948 1.00 0.00 C ATOM 651 N7 DG A 21 -0.158 2.122 -5.666 1.00 0.00 N ATOM 652 C5 DG A 21 0.098 0.777 -5.418 1.00 0.00 C ATOM 653 C6 DG A 21 0.415 0.121 -4.197 1.00 0.00 C ATOM 654 O6 DG A 21 0.530 0.611 -3.076 1.00 0.00 O ATOM 655 N1 DG A 21 0.598 -1.242 -4.385 1.00 0.00 N ATOM 656 C2 DG A 21 0.490 -1.896 -5.594 1.00 0.00 C ATOM 657 N2 DG A 21 0.702 -3.212 -5.576 1.00 0.00 N ATOM 658 N3 DG A 21 0.192 -1.281 -6.743 1.00 0.00 N ATOM 659 C4 DG A 21 0.010 0.050 -6.578 1.00 0.00 C ATOM 0 H5' DG A 21 1.682 2.673 -11.601 1.00 0.00 H new ATOM 0 H5'' DG A 21 0.354 2.708 -12.744 1.00 0.00 H new ATOM 0 H4' DG A 21 0.404 0.572 -11.746 1.00 0.00 H new ATOM 0 H3' DG A 21 -1.951 2.172 -11.505 1.00 0.00 H new ATOM 0 H2' DG A 21 -2.073 2.150 -9.117 1.00 0.00 H new ATOM 0 H2'' DG A 21 -2.666 0.522 -9.382 1.00 0.00 H new ATOM 0 H1' DG A 21 -0.567 -0.464 -9.052 1.00 0.00 H new ATOM 0 H8 DG A 21 -0.627 3.078 -7.473 1.00 0.00 H new ATOM 0 H1 DG A 21 0.830 -1.803 -3.565 1.00 0.00 H new ATOM 0 H21 DG A 21 0.636 -3.751 -6.439 1.00 0.00 H new ATOM 0 H22 DG A 21 0.930 -3.680 -4.699 1.00 0.00 H new ATOM 671 P DG A 22 -3.509 -0.183 -11.851 1.00 0.00 P ATOM 672 OP1 DG A 22 -3.819 -0.467 -13.270 1.00 0.00 O ATOM 673 OP2 DG A 22 -4.251 0.875 -11.131 1.00 0.00 O ATOM 674 O5' DG A 22 -3.653 -1.554 -11.020 1.00 0.00 O ATOM 675 C5' DG A 22 -2.998 -2.742 -11.472 1.00 0.00 C ATOM 676 C4' DG A 22 -3.466 -3.975 -10.703 1.00 0.00 C ATOM 677 O4' DG A 22 -3.213 -3.795 -9.305 1.00 0.00 O ATOM 678 C3' DG A 22 -4.957 -4.273 -10.854 1.00 0.00 C ATOM 679 O3' DG A 22 -5.201 -5.683 -10.905 1.00 0.00 O ATOM 680 C2' DG A 22 -5.551 -3.659 -9.601 1.00 0.00 C ATOM 681 C1' DG A 22 -4.446 -3.932 -8.597 1.00 0.00 C ATOM 682 N9 DG A 22 -4.415 -2.994 -7.464 1.00 0.00 N ATOM 683 C8 DG A 22 -4.426 -1.628 -7.492 1.00 0.00 C ATOM 684 N7 DG A 22 -4.396 -1.074 -6.311 1.00 0.00 N ATOM 685 C5 DG A 22 -4.361 -2.157 -5.436 1.00 0.00 C ATOM 686 C6 DG A 22 -4.319 -2.182 -4.014 1.00 0.00 C ATOM 687 O6 DG A 22 -4.302 -1.231 -3.235 1.00 0.00 O ATOM 688 N1 DG A 22 -4.295 -3.483 -3.527 1.00 0.00 N ATOM 689 C2 DG A 22 -4.307 -4.620 -4.311 1.00 0.00 C ATOM 690 N2 DG A 22 -4.275 -5.786 -3.667 1.00 0.00 N ATOM 691 N3 DG A 22 -4.347 -4.597 -5.646 1.00 0.00 N ATOM 692 C4 DG A 22 -4.372 -3.337 -6.136 1.00 0.00 C ATOM 0 H5' DG A 22 -1.920 -2.629 -11.357 1.00 0.00 H new ATOM 0 H5'' DG A 22 -3.192 -2.882 -12.536 1.00 0.00 H new ATOM 0 H4' DG A 22 -2.908 -4.811 -11.126 1.00 0.00 H new ATOM 0 H3' DG A 22 -5.385 -3.875 -11.774 1.00 0.00 H new ATOM 0 H2' DG A 22 -5.749 -2.594 -9.717 1.00 0.00 H new ATOM 0 H2'' DG A 22 -6.492 -4.129 -9.317 1.00 0.00 H new ATOM 0 HO3' DG A 22 -6.163 -5.845 -11.000 1.00 0.00 H new ATOM 0 H1' DG A 22 -4.616 -4.923 -8.177 1.00 0.00 H new ATOM 0 H8 DG A 22 -4.457 -1.058 -8.409 1.00 0.00 H new ATOM 0 H1 DG A 22 -4.266 -3.608 -2.515 1.00 0.00 H new ATOM 0 H21 DG A 22 -4.282 -6.660 -4.193 1.00 0.00 H new ATOM 0 H22 DG A 22 -4.244 -5.805 -2.648 1.00 0.00 H new TER 705 DG A 22