USER MOD reduce.3.24.130724 H: found=0, std=0, add=135, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 135 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= -0.078 USER MOD Single : A 9 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 12 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -4.052 -7.727 4.145 1.00 25.11 O ATOM 2 C5' DG A 1 -4.386 -9.080 4.450 1.00 44.45 C ATOM 3 C4' DG A 1 -3.404 -10.019 3.788 1.00 11.40 C ATOM 4 O4' DG A 1 -3.862 -10.329 2.490 1.00 12.03 O ATOM 5 C3' DG A 1 -2.025 -9.415 3.533 1.00 12.30 C ATOM 6 O3' DG A 1 -1.023 -10.390 3.811 1.00 22.50 O ATOM 7 C2' DG A 1 -2.026 -9.022 2.082 1.00 14.14 C ATOM 8 C1' DG A 1 -2.891 -10.129 1.488 1.00 15.40 C ATOM 9 N9 DG A 1 -3.519 -9.763 0.201 1.00 64.05 N ATOM 10 C8 DG A 1 -4.820 -9.877 -0.138 1.00 60.03 C ATOM 11 N7 DG A 1 -5.066 -9.457 -1.374 1.00 14.42 N ATOM 12 C5 DG A 1 -3.841 -9.054 -1.835 1.00 2.23 C ATOM 13 C6 DG A 1 -3.440 -8.514 -3.075 1.00 70.33 C ATOM 14 O6 DG A 1 -4.183 -8.292 -4.030 1.00 54.43 O ATOM 15 N1 DG A 1 -2.122 -8.211 -3.230 1.00 74.34 N ATOM 16 C2 DG A 1 -1.282 -8.442 -2.195 1.00 73.11 C ATOM 17 N2 DG A 1 -0.034 -8.096 -2.501 1.00 34.22 N ATOM 18 N3 DG A 1 -1.552 -8.952 -0.980 1.00 52.11 N ATOM 19 C4 DG A 1 -2.881 -9.232 -0.890 1.00 31.33 C ATOM 0 H5' DG A 1 -5.398 -9.299 4.108 1.00 44.45 H new ATOM 0 H5'' DG A 1 -4.375 -9.231 5.529 1.00 44.45 H new ATOM 0 H4' DG A 1 -3.329 -10.862 4.475 1.00 11.40 H new ATOM 0 H3' DG A 1 -1.814 -8.554 4.168 1.00 12.30 H new ATOM 0 H2' DG A 1 -2.454 -8.032 1.922 1.00 14.14 H new ATOM 0 H2'' DG A 1 -1.023 -9.008 1.657 1.00 14.14 H new ATOM 0 HO5' DG A 1 -4.695 -7.126 4.577 1.00 25.11 H new ATOM 0 H1' DG A 1 -2.308 -11.016 1.243 1.00 15.40 H new ATOM 0 H8 DG A 1 -5.579 -10.267 0.524 1.00 60.03 H new ATOM 0 H1 DG A 1 -1.776 -7.819 -4.106 1.00 74.34 H new ATOM 0 H21 DG A 1 0.711 -8.214 -1.814 1.00 34.22 H new ATOM 0 H22 DG A 1 0.178 -7.712 -3.422 1.00 34.22 H new ATOM 32 P DG A 2 0.409 -9.930 4.358 1.00 51.11 P ATOM 33 OP1 DG A 2 1.051 -11.053 5.078 1.00 34.52 O ATOM 34 OP2 DG A 2 0.280 -8.642 5.075 1.00 10.42 O ATOM 35 O5' DG A 2 1.239 -9.665 3.015 1.00 70.15 O ATOM 36 C5' DG A 2 2.556 -10.194 2.876 1.00 1.12 C ATOM 37 C4' DG A 2 3.505 -9.108 2.424 1.00 25.11 C ATOM 38 O4' DG A 2 2.937 -8.318 1.445 1.00 53.32 O ATOM 39 C3' DG A 2 3.823 -8.064 3.490 1.00 60.32 C ATOM 40 O3' DG A 2 5.146 -7.572 3.292 1.00 31.54 O ATOM 41 C2' DG A 2 2.797 -6.981 3.300 1.00 52.44 C ATOM 42 C1' DG A 2 2.667 -6.976 1.781 1.00 34.33 C ATOM 43 N9 DG A 2 1.330 -6.564 1.306 1.00 54.10 N ATOM 44 C8 DG A 2 0.154 -6.687 1.960 1.00 4.24 C ATOM 45 N7 DG A 2 -0.873 -6.220 1.257 1.00 14.02 N ATOM 46 C5 DG A 2 -0.303 -5.777 0.095 1.00 54.05 C ATOM 47 C6 DG A 2 -0.866 -5.177 -1.051 1.00 74.53 C ATOM 48 O6 DG A 2 -2.060 -4.929 -1.215 1.00 43.14 O ATOM 49 N1 DG A 2 -0.018 -4.844 -2.063 1.00 73.43 N ATOM 50 C2 DG A 2 1.299 -5.104 -1.912 1.00 0.44 C ATOM 51 N2 DG A 2 1.993 -4.723 -2.983 1.00 72.42 N ATOM 52 N3 DG A 2 1.940 -5.669 -0.872 1.00 32.43 N ATOM 53 C4 DG A 2 1.039 -5.976 0.102 1.00 44.14 C ATOM 0 H5' DG A 2 2.554 -11.010 2.154 1.00 1.12 H new ATOM 0 H5'' DG A 2 2.892 -10.609 3.826 1.00 1.12 H new ATOM 0 H4' DG A 2 4.383 -9.677 2.119 1.00 25.11 H new ATOM 0 H3' DG A 2 3.784 -8.464 4.503 1.00 60.32 H new ATOM 0 H2' DG A 2 1.854 -7.213 3.795 1.00 52.44 H new ATOM 0 H2'' DG A 2 3.133 -6.020 3.689 1.00 52.44 H new ATOM 0 H1' DG A 2 3.337 -6.254 1.315 1.00 34.33 H new ATOM 0 H8 DG A 2 0.059 -7.118 2.946 1.00 4.24 H new ATOM 0 H1 DG A 2 -0.369 -4.408 -2.916 1.00 73.43 H new ATOM 0 H21 DG A 2 3.004 -4.858 -3.010 1.00 72.42 H new ATOM 0 H22 DG A 2 1.514 -4.296 -3.776 1.00 72.42 H new ATOM 65 P DC A 3 6.149 -7.449 4.533 1.00 54.00 P ATOM 66 OP1 DC A 3 7.273 -8.396 4.362 1.00 42.50 O ATOM 67 OP2 DC A 3 5.383 -7.518 5.799 1.00 65.41 O ATOM 68 O5' DC A 3 6.725 -5.965 4.385 1.00 65.52 O ATOM 69 C5' DC A 3 6.986 -5.428 3.090 1.00 15.24 C ATOM 70 C4' DC A 3 6.281 -4.100 2.928 1.00 30.12 C ATOM 71 O4' DC A 3 4.971 -4.220 2.480 1.00 42.41 O ATOM 72 C3' DC A 3 5.892 -3.426 4.241 1.00 3.43 C ATOM 73 O3' DC A 3 7.043 -2.818 4.821 1.00 61.34 O ATOM 74 C2' DC A 3 4.853 -2.405 3.872 1.00 34.20 C ATOM 75 C1' DC A 3 4.419 -2.923 2.504 1.00 73.31 C ATOM 76 N1 DC A 3 2.951 -2.964 2.327 1.00 43.54 N ATOM 77 C2 DC A 3 2.426 -2.436 1.150 1.00 61.21 C ATOM 78 O2 DC A 3 3.203 -1.962 0.315 1.00 64.04 O ATOM 79 N3 DC A 3 1.092 -2.461 0.968 1.00 24.21 N ATOM 80 C4 DC A 3 0.278 -2.970 1.868 1.00 1.20 C ATOM 81 N4 DC A 3 -1.035 -2.986 1.671 1.00 25.45 N ATOM 82 C5 DC A 3 0.798 -3.524 3.097 1.00 54.42 C ATOM 83 C6 DC A 3 2.126 -3.492 3.266 1.00 65.50 C ATOM 0 H5' DC A 3 6.647 -6.125 2.323 1.00 15.24 H new ATOM 0 H5'' DC A 3 8.059 -5.298 2.951 1.00 15.24 H new ATOM 0 H4' DC A 3 7.001 -3.585 2.293 1.00 30.12 H new ATOM 0 H3' DC A 3 5.501 -4.127 4.978 1.00 3.43 H new ATOM 0 H2' DC A 3 4.029 -2.378 4.585 1.00 34.20 H new ATOM 0 H2'' DC A 3 5.264 -1.397 3.821 1.00 34.20 H new ATOM 0 H1' DC A 3 4.756 -2.275 1.695 1.00 73.31 H new ATOM 0 H41 DC A 3 -1.652 -3.384 2.379 1.00 25.45 H new ATOM 0 H42 DC A 3 -1.426 -2.600 0.812 1.00 25.45 H new ATOM 0 H5 DC A 3 0.144 -3.945 3.846 1.00 54.42 H new ATOM 0 H6 DC A 3 2.551 -3.897 4.173 1.00 65.50 H new ATOM 95 P DC A 4 7.127 -2.614 6.407 1.00 75.34 P ATOM 96 OP1 DC A 4 7.942 -3.695 7.006 1.00 33.32 O ATOM 97 OP2 DC A 4 5.769 -2.399 6.954 1.00 41.02 O ATOM 98 O5' DC A 4 7.941 -1.244 6.550 1.00 75.04 O ATOM 99 C5' DC A 4 8.874 -0.859 5.544 1.00 51.22 C ATOM 100 C4' DC A 4 8.352 0.338 4.780 1.00 65.11 C ATOM 101 O4' DC A 4 7.008 0.028 4.397 1.00 11.43 O ATOM 102 C3' DC A 4 8.229 1.610 5.613 1.00 64.23 C ATOM 103 O3' DC A 4 8.832 2.696 4.913 1.00 73.15 O ATOM 104 C2' DC A 4 6.751 1.822 5.798 1.00 21.20 C ATOM 105 C1' DC A 4 6.213 1.185 4.519 1.00 70.24 C ATOM 106 N1 DC A 4 4.777 0.841 4.593 1.00 34.44 N ATOM 107 C2 DC A 4 4.013 1.007 3.439 1.00 31.44 C ATOM 108 O2 DC A 4 4.566 1.426 2.417 1.00 24.31 O ATOM 109 N3 DC A 4 2.703 0.701 3.480 1.00 11.14 N ATOM 110 C4 DC A 4 2.129 0.253 4.577 1.00 53.24 C ATOM 111 N4 DC A 4 0.835 -0.042 4.598 1.00 11.13 N ATOM 112 C5 DC A 4 2.899 0.074 5.787 1.00 4.40 C ATOM 113 C6 DC A 4 4.202 0.383 5.731 1.00 33.31 C ATOM 0 H5' DC A 4 9.046 -1.690 4.860 1.00 51.22 H new ATOM 0 H5'' DC A 4 9.834 -0.618 6.001 1.00 51.22 H new ATOM 0 H4' DC A 4 9.053 0.519 3.965 1.00 65.11 H new ATOM 0 H3' DC A 4 8.734 1.538 6.576 1.00 64.23 H new ATOM 0 H2' DC A 4 6.372 1.333 6.695 1.00 21.20 H new ATOM 0 H2'' DC A 4 6.491 2.878 5.876 1.00 21.20 H new ATOM 0 H1' DC A 4 6.271 1.862 3.667 1.00 70.24 H new ATOM 0 H41 DC A 4 0.405 -0.388 5.456 1.00 11.13 H new ATOM 0 H42 DC A 4 0.271 0.077 3.757 1.00 11.13 H new ATOM 0 H5 DC A 4 2.445 -0.292 6.696 1.00 4.40 H new ATOM 0 H6 DC A 4 4.809 0.264 6.616 1.00 33.31 H new ATOM 125 P DG A 5 9.226 4.034 5.698 1.00 24.41 P ATOM 126 OP1 DG A 5 10.590 3.900 6.256 1.00 53.44 O ATOM 127 OP2 DG A 5 8.137 4.405 6.631 1.00 30.25 O ATOM 128 O5' DG A 5 9.275 5.132 4.534 1.00 43.33 O ATOM 129 C5' DG A 5 8.309 5.102 3.486 1.00 75.53 C ATOM 130 C4' DG A 5 7.013 5.721 3.958 1.00 73.14 C ATOM 131 O4' DG A 5 6.382 4.855 4.775 1.00 1.55 O ATOM 132 C3' DG A 5 7.184 6.877 4.940 1.00 2.40 C ATOM 133 O3' DG A 5 7.305 8.099 4.217 1.00 4.34 O ATOM 134 C2' DG A 5 5.946 6.860 5.794 1.00 22.10 C ATOM 135 C1' DG A 5 5.294 5.561 5.323 1.00 60.53 C ATOM 136 N9 DG A 5 4.654 4.796 6.414 1.00 12.23 N ATOM 137 C8 DG A 5 5.201 4.431 7.591 1.00 23.14 C ATOM 138 N7 DG A 5 4.360 3.745 8.357 1.00 62.42 N ATOM 139 C5 DG A 5 3.214 3.679 7.611 1.00 3.00 C ATOM 140 C6 DG A 5 1.962 3.084 7.871 1.00 72.24 C ATOM 141 O6 DG A 5 1.663 2.475 8.898 1.00 74.12 O ATOM 142 N1 DG A 5 1.005 3.192 6.910 1.00 23.25 N ATOM 143 C2 DG A 5 1.307 3.856 5.772 1.00 34.04 C ATOM 144 N2 DG A 5 0.273 3.875 4.934 1.00 2.41 N ATOM 145 N3 DG A 5 2.458 4.457 5.419 1.00 44.13 N ATOM 146 C4 DG A 5 3.371 4.313 6.419 1.00 74.54 C ATOM 0 H5' DG A 5 8.136 4.073 3.169 1.00 75.53 H new ATOM 0 H5'' DG A 5 8.685 5.644 2.618 1.00 75.53 H new ATOM 0 H4' DG A 5 6.518 6.012 3.032 1.00 73.14 H new ATOM 0 H3' DG A 5 8.080 6.783 5.554 1.00 2.40 H new ATOM 0 H2' DG A 5 6.178 6.844 6.859 1.00 22.10 H new ATOM 0 H2'' DG A 5 5.311 7.729 5.619 1.00 22.10 H new ATOM 0 H1' DG A 5 4.478 5.741 4.623 1.00 60.53 H new ATOM 0 H8 DG A 5 6.214 4.671 7.880 1.00 23.14 H new ATOM 0 H1 DG A 5 0.081 2.781 7.045 1.00 23.25 H new ATOM 0 H21 DG A 5 0.356 4.343 4.032 1.00 2.41 H new ATOM 0 H22 DG A 5 -0.603 3.421 5.194 1.00 2.41 H new ATOM 158 P DC A 6 7.325 9.493 5.002 1.00 73.25 P ATOM 159 OP1 DC A 6 8.304 10.405 4.374 1.00 24.31 O ATOM 160 OP2 DC A 6 7.454 9.246 6.455 1.00 34.41 O ATOM 161 O5' DC A 6 5.860 10.078 4.730 1.00 65.54 O ATOM 162 C5' DC A 6 5.178 9.761 3.518 1.00 4.02 C ATOM 163 C4' DC A 6 3.709 10.092 3.646 1.00 11.43 C ATOM 164 O4' DC A 6 2.875 9.108 4.256 1.00 35.15 O ATOM 165 C3' DC A 6 3.414 11.355 4.449 1.00 14.25 C ATOM 166 O3' DC A 6 2.563 12.211 3.690 1.00 32.33 O ATOM 167 C2' DC A 6 2.739 10.879 5.705 1.00 3.42 C ATOM 168 C1' DC A 6 1.966 9.676 5.172 1.00 51.51 C ATOM 169 N1 DC A 6 1.591 8.705 6.223 1.00 33.33 N ATOM 170 C2 DC A 6 0.281 8.739 6.699 1.00 73.21 C ATOM 171 O2 DC A 6 -0.499 9.572 6.226 1.00 54.10 O ATOM 172 N3 DC A 6 -0.083 7.866 7.655 1.00 73.14 N ATOM 173 C4 DC A 6 0.762 6.983 8.148 1.00 21.33 C ATOM 174 N4 DC A 6 0.383 6.129 9.091 1.00 63.51 N ATOM 175 C5 DC A 6 2.125 6.927 7.672 1.00 64.40 C ATOM 176 C6 DC A 6 2.473 7.803 6.719 1.00 62.32 C ATOM 0 H5' DC A 6 5.301 8.703 3.288 1.00 4.02 H new ATOM 0 H5'' DC A 6 5.614 10.320 2.690 1.00 4.02 H new ATOM 0 H4' DC A 6 3.472 10.190 2.587 1.00 11.43 H new ATOM 0 H3' DC A 6 4.311 11.928 4.684 1.00 14.25 H new ATOM 0 H2' DC A 6 3.454 10.601 6.479 1.00 3.42 H new ATOM 0 H2'' DC A 6 2.082 11.636 6.134 1.00 3.42 H new ATOM 0 H1' DC A 6 1.010 9.965 4.735 1.00 51.51 H new ATOM 0 H41 DC A 6 1.049 5.451 9.463 1.00 63.51 H new ATOM 0 H42 DC A 6 -0.574 6.151 9.444 1.00 63.51 H new ATOM 0 H5 DC A 6 2.832 6.212 8.066 1.00 64.40 H new ATOM 0 H6 DC A 6 3.483 7.790 6.336 1.00 62.32 H new ATOM 188 P DA A 7 3.123 12.939 2.378 1.00 44.52 P ATOM 189 OP1 DA A 7 4.535 12.553 2.160 1.00 0.35 O ATOM 190 OP2 DA A 7 2.810 14.383 2.439 1.00 71.41 O ATOM 191 O5' DA A 7 2.247 12.291 1.206 1.00 52.50 O ATOM 192 C5' DA A 7 1.033 11.609 1.515 1.00 40.13 C ATOM 193 C4' DA A 7 0.622 10.728 0.358 1.00 12.32 C ATOM 194 O4' DA A 7 1.342 9.503 0.397 1.00 64.52 O ATOM 195 C3' DA A 7 -0.819 10.233 0.424 1.00 55.02 C ATOM 196 O3' DA A 7 -1.343 10.121 -0.898 1.00 35.31 O ATOM 197 C2' DA A 7 -0.750 8.895 1.104 1.00 63.55 C ATOM 198 C1' DA A 7 0.548 8.345 0.518 1.00 71.34 C ATOM 199 N9 DA A 7 1.201 7.335 1.377 1.00 70.40 N ATOM 200 C8 DA A 7 0.892 7.021 2.653 1.00 70.42 C ATOM 201 N7 DA A 7 1.673 6.066 3.149 1.00 72.33 N ATOM 202 C5 DA A 7 2.523 5.768 2.117 1.00 20.22 C ATOM 203 C6 DA A 7 3.581 4.840 2.017 1.00 63.21 C ATOM 204 N6 DA A 7 3.971 4.008 3.017 1.00 23.03 N ATOM 205 N1 DA A 7 4.250 4.781 0.835 1.00 1.34 N ATOM 206 C2 DA A 7 3.870 5.604 -0.167 1.00 72.34 C ATOM 207 N3 DA A 7 2.882 6.521 -0.182 1.00 23.53 N ATOM 208 C4 DA A 7 2.254 6.531 1.026 1.00 73.33 C ATOM 0 H5' DA A 7 0.246 12.332 1.729 1.00 40.13 H new ATOM 0 H5'' DA A 7 1.165 11.005 2.413 1.00 40.13 H new ATOM 0 H4' DA A 7 0.796 11.358 -0.515 1.00 12.32 H new ATOM 0 H3' DA A 7 -1.475 10.912 0.969 1.00 55.02 H new ATOM 0 H2' DA A 7 -0.708 8.984 2.190 1.00 63.55 H new ATOM 0 H2'' DA A 7 -1.609 8.267 0.869 1.00 63.55 H new ATOM 0 H1' DA A 7 0.383 7.814 -0.419 1.00 71.34 H new ATOM 0 H8 DA A 7 0.097 7.494 3.210 1.00 70.42 H new ATOM 0 H61 DA A 7 4.747 3.362 2.870 1.00 23.03 H new ATOM 0 H62 DA A 7 3.488 4.029 3.915 1.00 23.03 H new ATOM 0 H2 DA A 7 4.436 5.515 -1.082 1.00 72.34 H new ATOM 220 P DG A 8 -2.892 9.784 -1.120 1.00 25.21 P ATOM 221 OP1 DG A 8 -3.513 10.829 -1.965 1.00 43.41 O ATOM 222 OP2 DG A 8 -3.530 9.491 0.183 1.00 63.32 O ATOM 223 O5' DG A 8 -2.846 8.425 -1.964 1.00 31.34 O ATOM 224 C5' DG A 8 -1.688 7.597 -1.921 1.00 24.31 C ATOM 225 C4' DG A 8 -1.769 6.532 -2.991 1.00 63.14 C ATOM 226 O4' DG A 8 -0.833 5.627 -2.537 1.00 43.45 O ATOM 227 C3' DG A 8 -3.020 5.662 -2.921 1.00 21.41 C ATOM 228 O3' DG A 8 -3.961 6.105 -3.896 1.00 52.01 O ATOM 229 C2' DG A 8 -2.547 4.263 -3.207 1.00 51.11 C ATOM 230 C1' DG A 8 -1.200 4.266 -2.489 1.00 64.44 C ATOM 231 N9 DG A 8 -1.273 3.781 -1.095 1.00 54.13 N ATOM 232 C8 DG A 8 -2.336 3.829 -0.265 1.00 53.04 C ATOM 233 N7 DG A 8 -2.078 3.306 0.930 1.00 31.51 N ATOM 234 C5 DG A 8 -0.772 2.907 0.838 1.00 63.12 C ATOM 235 C6 DG A 8 0.082 2.282 1.771 1.00 71.22 C ATOM 236 O6 DG A 8 -0.227 1.965 2.919 1.00 63.14 O ATOM 237 N1 DG A 8 1.353 2.008 1.371 1.00 24.23 N ATOM 238 C2 DG A 8 1.722 2.344 0.114 1.00 43.33 C ATOM 239 N2 DG A 8 2.989 2.011 -0.125 1.00 53.25 N ATOM 240 N3 DG A 8 0.996 2.939 -0.852 1.00 65.21 N ATOM 241 C4 DG A 8 -0.259 3.187 -0.389 1.00 0.22 C ATOM 0 H5' DG A 8 -1.601 7.131 -0.939 1.00 24.31 H new ATOM 0 H5'' DG A 8 -0.793 8.202 -2.067 1.00 24.31 H new ATOM 0 H4' DG A 8 -1.690 7.004 -3.970 1.00 63.14 H new ATOM 0 H3' DG A 8 -3.519 5.713 -1.953 1.00 21.41 H new ATOM 0 H2' DG A 8 -3.225 3.508 -2.810 1.00 51.11 H new ATOM 0 H2'' DG A 8 -2.446 4.071 -4.275 1.00 51.11 H new ATOM 0 H1' DG A 8 -0.484 3.590 -2.957 1.00 64.44 H new ATOM 0 H8 DG A 8 -3.293 4.247 -0.541 1.00 53.04 H new ATOM 0 H1 DG A 8 2.013 1.559 2.005 1.00 24.23 H new ATOM 0 H21 DG A 8 3.404 2.206 -1.036 1.00 53.25 H new ATOM 0 H22 DG A 8 3.544 1.561 0.603 1.00 53.25 H new ATOM 253 P DT A 9 -5.312 6.825 -3.434 1.00 71.52 P ATOM 254 OP1 DT A 9 -5.717 7.825 -4.447 1.00 11.22 O ATOM 255 OP2 DT A 9 -5.176 7.291 -2.034 1.00 2.15 O ATOM 256 O5' DT A 9 -6.382 5.636 -3.457 1.00 31.22 O ATOM 257 C5' DT A 9 -6.062 4.378 -2.866 1.00 44.33 C ATOM 258 C4' DT A 9 -5.560 3.420 -3.921 1.00 2.33 C ATOM 259 O4' DT A 9 -5.089 2.230 -3.332 1.00 73.22 O ATOM 260 C3' DT A 9 -6.655 2.806 -4.788 1.00 54.31 C ATOM 261 O3' DT A 9 -6.089 2.342 -6.011 1.00 12.44 O ATOM 262 C2' DT A 9 -7.216 1.672 -3.974 1.00 21.22 C ATOM 263 C1' DT A 9 -5.940 1.106 -3.359 1.00 3.32 C ATOM 264 N1 DT A 9 -6.135 0.552 -2.002 1.00 2.04 N ATOM 265 C2 DT A 9 -5.556 -0.654 -1.753 1.00 74.22 C ATOM 266 O2 DT A 9 -4.904 -1.276 -2.579 1.00 31.41 O ATOM 267 N3 DT A 9 -5.736 -1.172 -0.491 1.00 0.41 N ATOM 268 C4 DT A 9 -6.453 -0.540 0.494 1.00 13.10 C ATOM 269 O4 DT A 9 -6.550 -1.096 1.586 1.00 32.35 O ATOM 270 C5 DT A 9 -7.038 0.717 0.182 1.00 3.14 C ATOM 271 C7 DT A 9 -7.838 1.457 1.225 1.00 45.35 C ATOM 272 C6 DT A 9 -6.849 1.200 -1.048 1.00 13.11 C ATOM 0 H5' DT A 9 -6.943 3.963 -2.377 1.00 44.33 H new ATOM 0 H5'' DT A 9 -5.303 4.512 -2.095 1.00 44.33 H new ATOM 0 H4' DT A 9 -4.844 4.033 -4.469 1.00 2.33 H new ATOM 0 H3' DT A 9 -7.436 3.519 -5.053 1.00 54.31 H new ATOM 0 H2' DT A 9 -7.922 2.015 -3.218 1.00 21.22 H new ATOM 0 H2'' DT A 9 -7.739 0.940 -4.590 1.00 21.22 H new ATOM 0 H1' DT A 9 -5.551 0.261 -3.927 1.00 3.32 H new ATOM 0 H3 DT A 9 -5.313 -2.075 -0.276 1.00 0.41 H new ATOM 0 H71 DT A 9 -7.754 2.530 1.054 1.00 45.35 H new ATOM 0 H72 DT A 9 -8.885 1.159 1.160 1.00 45.35 H new ATOM 0 H73 DT A 9 -7.454 1.217 2.216 1.00 45.35 H new ATOM 0 H6 DT A 9 -7.287 2.156 -1.296 1.00 13.11 H new ATOM 285 P DG A 10 -5.737 3.381 -7.175 1.00 22.11 P ATOM 286 OP1 DG A 10 -5.724 4.756 -6.628 1.00 64.03 O ATOM 287 OP2 DG A 10 -6.598 3.123 -8.352 1.00 33.11 O ATOM 288 O5' DG A 10 -4.235 2.990 -7.566 1.00 41.25 O ATOM 289 C5' DG A 10 -3.176 3.219 -6.641 1.00 64.33 C ATOM 290 C4' DG A 10 -1.874 2.688 -7.197 1.00 13.12 C ATOM 291 O4' DG A 10 -0.975 2.614 -6.161 1.00 71.53 O ATOM 292 C3' DG A 10 -1.936 1.235 -7.662 1.00 33.41 C ATOM 293 O3' DG A 10 -2.106 1.198 -9.078 1.00 33.12 O ATOM 294 C2' DG A 10 -0.622 0.631 -7.249 1.00 15.22 C ATOM 295 C1' DG A 10 -0.378 1.360 -5.931 1.00 3.01 C ATOM 296 N9 DG A 10 -0.982 0.685 -4.763 1.00 71.40 N ATOM 297 C8 DG A 10 -2.286 0.401 -4.566 1.00 55.33 C ATOM 298 N7 DG A 10 -2.509 -0.213 -3.409 1.00 11.20 N ATOM 299 C5 DG A 10 -1.263 -0.319 -2.849 1.00 21.14 C ATOM 300 C6 DG A 10 -0.833 -0.875 -1.625 1.00 33.32 C ATOM 301 O6 DG A 10 -1.562 -1.401 -0.787 1.00 61.31 O ATOM 302 N1 DG A 10 0.500 -0.827 -1.351 1.00 60.01 N ATOM 303 C2 DG A 10 1.326 -0.253 -2.256 1.00 53.24 C ATOM 304 N2 DG A 10 2.590 -0.283 -1.843 1.00 72.21 N ATOM 305 N3 DG A 10 1.026 0.304 -3.444 1.00 51.14 N ATOM 306 C4 DG A 10 -0.316 0.224 -3.659 1.00 3.32 C ATOM 0 H5' DG A 10 -3.400 2.732 -5.692 1.00 64.33 H new ATOM 0 H5'' DG A 10 -3.085 4.286 -6.438 1.00 64.33 H new ATOM 0 H4' DG A 10 -1.623 3.351 -8.025 1.00 13.12 H new ATOM 0 H3' DG A 10 -2.771 0.685 -7.228 1.00 33.41 H new ATOM 0 H2' DG A 10 -0.686 -0.449 -7.119 1.00 15.22 H new ATOM 0 H2'' DG A 10 0.167 0.818 -7.978 1.00 15.22 H new ATOM 0 H1' DG A 10 0.681 1.407 -5.678 1.00 3.01 H new ATOM 0 H8 DG A 10 -3.065 0.646 -5.273 1.00 55.33 H new ATOM 0 H1 DG A 10 0.868 -1.215 -0.482 1.00 60.01 H new ATOM 0 H21 DG A 10 3.326 0.115 -2.426 1.00 72.21 H new ATOM 0 H22 DG A 10 2.823 -0.704 -0.944 1.00 72.21 H new ATOM 318 P DC A 11 -2.911 -0.005 -9.756 1.00 52.13 P ATOM 319 OP1 DC A 11 -3.347 0.388 -11.115 1.00 33.25 O ATOM 320 OP2 DC A 11 -3.950 -0.497 -8.823 1.00 5.31 O ATOM 321 O5' DC A 11 -1.798 -1.146 -9.904 1.00 32.42 O ATOM 322 C5' DC A 11 -0.473 -0.800 -10.297 1.00 34.42 C ATOM 323 C4' DC A 11 0.505 -1.840 -9.802 1.00 51.41 C ATOM 324 O4' DC A 11 0.361 -1.976 -8.403 1.00 72.13 O ATOM 325 C3' DC A 11 0.221 -3.257 -10.293 1.00 44.41 C ATOM 326 O3' DC A 11 1.454 -3.942 -10.502 1.00 1.14 O ATOM 327 C2' DC A 11 -0.588 -3.902 -9.201 1.00 33.20 C ATOM 328 C1' DC A 11 0.058 -3.281 -7.964 1.00 53.32 C ATOM 329 N1 DC A 11 -0.833 -3.255 -6.785 1.00 5.13 N ATOM 330 C2 DC A 11 -0.376 -3.861 -5.617 1.00 43.54 C ATOM 331 O2 DC A 11 0.743 -4.386 -5.620 1.00 41.41 O ATOM 332 N3 DC A 11 -1.167 -3.850 -4.529 1.00 50.12 N ATOM 333 C4 DC A 11 -2.358 -3.285 -4.542 1.00 21.25 C ATOM 334 N4 DC A 11 -3.124 -3.286 -3.460 1.00 44.14 N ATOM 335 C5 DC A 11 -2.855 -2.652 -5.741 1.00 55.45 C ATOM 336 C6 DC A 11 -2.055 -2.670 -6.817 1.00 20.14 C ATOM 0 H5' DC A 11 -0.210 0.178 -9.894 1.00 34.42 H new ATOM 0 H5'' DC A 11 -0.416 -0.724 -11.383 1.00 34.42 H new ATOM 0 H4' DC A 11 1.475 -1.491 -10.156 1.00 51.41 H new ATOM 0 H3' DC A 11 -0.318 -3.277 -11.240 1.00 44.41 H new ATOM 0 H2' DC A 11 -1.649 -3.664 -9.277 1.00 33.20 H new ATOM 0 H2'' DC A 11 -0.503 -4.989 -9.210 1.00 33.20 H new ATOM 0 H1' DC A 11 0.920 -3.852 -7.620 1.00 53.32 H new ATOM 0 H41 DC A 11 -4.043 -2.845 -3.486 1.00 44.14 H new ATOM 0 H42 DC A 11 -2.794 -3.728 -2.602 1.00 44.14 H new ATOM 0 H5 DC A 11 -3.828 -2.185 -5.770 1.00 55.45 H new ATOM 0 H6 DC A 11 -2.393 -2.207 -7.732 1.00 20.14 H new ATOM 348 P DC A 12 1.537 -5.129 -11.573 1.00 53.22 P ATOM 349 OP1 DC A 12 2.352 -4.701 -12.731 1.00 12.13 O ATOM 350 OP2 DC A 12 0.178 -5.647 -11.849 1.00 4.44 O ATOM 351 O5' DC A 12 2.349 -6.264 -10.789 1.00 53.52 O ATOM 352 C5' DC A 12 3.574 -5.941 -10.137 1.00 60.10 C ATOM 353 C4' DC A 12 3.772 -6.830 -8.931 1.00 12.43 C ATOM 354 O4' DC A 12 2.690 -6.676 -8.040 1.00 1.40 O ATOM 355 C3' DC A 12 3.743 -8.325 -9.240 1.00 40.22 C ATOM 356 O3' DC A 12 4.729 -8.995 -8.440 1.00 41.53 O ATOM 357 C2' DC A 12 2.350 -8.775 -8.893 1.00 41.33 C ATOM 358 C1' DC A 12 2.058 -7.886 -7.687 1.00 74.15 C ATOM 359 N1 DC A 12 0.614 -7.684 -7.442 1.00 53.21 N ATOM 360 C2 DC A 12 0.164 -7.755 -6.126 1.00 51.43 C ATOM 361 O2 DC A 12 0.985 -7.984 -5.231 1.00 22.30 O ATOM 362 N3 DC A 12 -1.145 -7.573 -5.875 1.00 34.04 N ATOM 363 C4 DC A 12 -2.009 -7.331 -6.843 1.00 51.50 C ATOM 364 N4 DC A 12 -3.296 -7.154 -6.577 1.00 52.41 N ATOM 365 C5 DC A 12 -1.568 -7.251 -8.217 1.00 51.12 C ATOM 366 C6 DC A 12 -0.261 -7.434 -8.448 1.00 2.30 C ATOM 0 H5' DC A 12 3.567 -4.895 -9.830 1.00 60.10 H new ATOM 0 H5'' DC A 12 4.407 -6.064 -10.829 1.00 60.10 H new ATOM 0 H4' DC A 12 4.745 -6.531 -8.540 1.00 12.43 H new ATOM 0 H3' DC A 12 3.974 -8.549 -10.281 1.00 40.22 H new ATOM 0 H2' DC A 12 1.646 -8.610 -9.709 1.00 41.33 H new ATOM 0 H2'' DC A 12 2.307 -9.836 -8.645 1.00 41.33 H new ATOM 0 HO3' DC A 12 4.711 -9.955 -8.635 1.00 41.53 H new ATOM 0 H1' DC A 12 2.417 -8.325 -6.756 1.00 74.15 H new ATOM 0 H41 DC A 12 -3.953 -6.968 -7.335 1.00 52.41 H new ATOM 0 H42 DC A 12 -3.629 -7.204 -5.614 1.00 52.41 H new ATOM 0 H5 DC A 12 -2.261 -7.053 -9.021 1.00 51.12 H new ATOM 0 H6 DC A 12 0.106 -7.381 -9.462 1.00 2.30 H new TER 379 DC A 12