USER MOD reduce.3.24.130724 H: found=0, std=0, add=242, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 242 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 5 DT C7 :methyl 150:sc= -6.29! (180deg=-5.65!) USER MOD Set 1.2: A 6 DT C7 :methyl 150:sc= -3.29 (180deg=-2.7) USER MOD Single : A 1 DG O5' : rot 180:sc= 0 USER MOD Single : A 4 DT C7 :methyl -30:sc= -22.3! (180deg=-30.4!) USER MOD Single : A 7 DT C7 :methyl 150:sc= -3.08! (180deg=-3.08!) USER MOD Single : A 11 DT C7 :methyl -30:sc= -0.0615 (180deg=-0.638) USER MOD Single : A 15 DT C7 :methyl -30:sc= -0.515 (180deg=-3.01!) USER MOD Single : A 16 DT C7 :methyl -30:sc= 0 (180deg=-0.55) USER MOD Single : A 17 DT C7 :methyl 150:sc= -1.46 (180deg=-1.46) USER MOD Single : A 18 DT C7 :methyl 150:sc= -2.41! (180deg=-2.41!) USER MOD Single : A 21 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -3.918 -6.027 -7.222 1.00 0.68 O ATOM 2 C5' DG A 1 -3.927 -5.946 -5.796 1.00 0.44 C ATOM 3 C4' DG A 1 -5.361 -5.914 -5.249 1.00 0.33 C ATOM 4 O4' DG A 1 -5.340 -5.784 -3.818 1.00 0.29 O ATOM 5 C3' DG A 1 -6.211 -4.761 -5.780 1.00 0.28 C ATOM 6 O3' DG A 1 -7.581 -5.195 -5.868 1.00 0.28 O ATOM 7 C2' DG A 1 -6.057 -3.708 -4.694 1.00 0.22 C ATOM 8 C1' DG A 1 -6.019 -4.573 -3.447 1.00 0.19 C ATOM 9 N9 DG A 1 -5.291 -3.996 -2.300 1.00 0.19 N ATOM 10 C8 DG A 1 -5.776 -3.693 -1.055 1.00 0.20 C ATOM 11 N7 DG A 1 -4.864 -3.305 -0.210 1.00 0.21 N ATOM 12 C5 DG A 1 -3.687 -3.346 -0.948 1.00 0.19 C ATOM 13 C6 DG A 1 -2.362 -3.039 -0.553 1.00 0.20 C ATOM 14 O6 DG A 1 -1.959 -2.681 0.543 1.00 0.24 O ATOM 15 N1 DG A 1 -1.466 -3.218 -1.585 1.00 0.19 N ATOM 16 C2 DG A 1 -1.795 -3.632 -2.858 1.00 0.19 C ATOM 17 N2 DG A 1 -0.803 -3.712 -3.745 1.00 0.20 N ATOM 18 N3 DG A 1 -3.041 -3.921 -3.237 1.00 0.19 N ATOM 19 C4 DG A 1 -3.935 -3.761 -2.230 1.00 0.18 C ATOM 0 H5' DG A 1 -3.394 -5.051 -5.477 1.00 0.44 H new ATOM 0 H5'' DG A 1 -3.395 -6.800 -5.378 1.00 0.44 H new ATOM 0 H4' DG A 1 -5.807 -6.851 -5.581 1.00 0.33 H new ATOM 0 H3' DG A 1 -5.921 -4.402 -6.768 1.00 0.28 H new ATOM 0 H2' DG A 1 -5.146 -3.122 -4.816 1.00 0.22 H new ATOM 0 H2'' DG A 1 -6.890 -3.005 -4.682 1.00 0.22 H new ATOM 0 HO5' DG A 1 -2.992 -6.044 -7.543 1.00 0.68 H new ATOM 0 H1' DG A 1 -7.049 -4.702 -3.116 1.00 0.19 H new ATOM 0 H8 DG A 1 -6.822 -3.769 -0.797 1.00 0.20 H new ATOM 0 H1 DG A 1 -0.482 -3.029 -1.392 1.00 0.19 H new ATOM 0 H21 DG A 1 -0.996 -4.013 -4.700 1.00 0.20 H new ATOM 0 H22 DG A 1 0.149 -3.472 -3.468 1.00 0.20 H new ATOM 32 P DG A 2 -8.714 -4.281 -6.564 1.00 0.28 P ATOM 33 OP1 DG A 2 -9.943 -5.093 -6.712 1.00 0.36 O ATOM 34 OP2 DG A 2 -8.118 -3.622 -7.745 1.00 0.33 O ATOM 35 O5' DG A 2 -8.980 -3.153 -5.455 1.00 0.26 O ATOM 36 C5' DG A 2 -9.731 -3.440 -4.273 1.00 0.26 C ATOM 37 C4' DG A 2 -9.634 -2.288 -3.284 1.00 0.23 C ATOM 38 O4' DG A 2 -8.291 -2.206 -2.793 1.00 0.23 O ATOM 39 C3' DG A 2 -9.989 -0.930 -3.903 1.00 0.22 C ATOM 40 O3' DG A 2 -11.058 -0.296 -3.164 1.00 0.24 O ATOM 41 C2' DG A 2 -8.701 -0.109 -3.818 1.00 0.23 C ATOM 42 C1' DG A 2 -7.893 -0.841 -2.758 1.00 0.19 C ATOM 43 N9 DG A 2 -6.442 -0.794 -2.943 1.00 0.18 N ATOM 44 C8 DG A 2 -5.708 -0.844 -4.097 1.00 0.19 C ATOM 45 N7 DG A 2 -4.429 -0.683 -3.909 1.00 0.20 N ATOM 46 C5 DG A 2 -4.317 -0.523 -2.534 1.00 0.17 C ATOM 47 C6 DG A 2 -3.175 -0.309 -1.734 1.00 0.19 C ATOM 48 O6 DG A 2 -2.016 -0.205 -2.067 1.00 0.21 O ATOM 49 N1 DG A 2 -3.497 -0.204 -0.412 1.00 0.19 N ATOM 50 C2 DG A 2 -4.744 -0.292 0.120 1.00 0.18 C ATOM 51 N2 DG A 2 -4.824 -0.161 1.455 1.00 0.19 N ATOM 52 N3 DG A 2 -5.835 -0.494 -0.617 1.00 0.17 N ATOM 53 C4 DG A 2 -5.542 -0.597 -1.938 1.00 0.16 C ATOM 0 H5' DG A 2 -9.358 -4.355 -3.812 1.00 0.26 H new ATOM 0 H5'' DG A 2 -10.775 -3.617 -4.533 1.00 0.26 H new ATOM 0 H4' DG A 2 -10.352 -2.495 -2.490 1.00 0.23 H new ATOM 0 H3' DG A 2 -10.343 -1.025 -4.930 1.00 0.22 H new ATOM 0 H2' DG A 2 -8.178 -0.080 -4.774 1.00 0.23 H new ATOM 0 H2'' DG A 2 -8.900 0.924 -3.531 1.00 0.23 H new ATOM 0 H1' DG A 2 -8.094 -0.342 -1.810 1.00 0.19 H new ATOM 0 H8 DG A 2 -6.147 -1.002 -5.071 1.00 0.19 H new ATOM 0 H1 DG A 2 -2.728 -0.044 0.239 1.00 0.19 H new ATOM 0 H21 DG A 2 -5.730 -0.217 1.920 1.00 0.19 H new ATOM 0 H22 DG A 2 -3.978 -0.006 2.004 1.00 0.19 H new ATOM 65 P DG A 3 -11.075 -0.181 -1.547 1.00 0.23 P ATOM 66 OP1 DG A 3 -9.827 -0.752 -1.004 1.00 0.25 O ATOM 67 OP2 DG A 3 -12.375 -0.692 -1.063 1.00 0.32 O ATOM 68 O5' DG A 3 -11.046 1.407 -1.299 1.00 0.23 O ATOM 69 C5' DG A 3 -11.122 1.928 0.031 1.00 0.26 C ATOM 70 C4' DG A 3 -10.188 3.115 0.218 1.00 0.20 C ATOM 71 O4' DG A 3 -8.857 2.743 -0.160 1.00 0.18 O ATOM 72 C3' DG A 3 -10.563 4.351 -0.623 1.00 0.22 C ATOM 73 O3' DG A 3 -10.697 5.489 0.232 1.00 0.27 O ATOM 74 C2' DG A 3 -9.367 4.544 -1.545 1.00 0.22 C ATOM 75 C1' DG A 3 -8.262 3.900 -0.711 1.00 0.16 C ATOM 76 N9 DG A 3 -7.017 3.513 -1.423 1.00 0.15 N ATOM 77 C8 DG A 3 -6.804 3.167 -2.742 1.00 0.18 C ATOM 78 N7 DG A 3 -5.551 2.972 -3.038 1.00 0.17 N ATOM 79 C5 DG A 3 -4.884 3.197 -1.841 1.00 0.14 C ATOM 80 C6 DG A 3 -3.500 3.134 -1.548 1.00 0.14 C ATOM 81 O6 DG A 3 -2.575 2.872 -2.313 1.00 0.16 O ATOM 82 N1 DG A 3 -3.248 3.427 -0.215 1.00 0.13 N ATOM 83 C2 DG A 3 -4.202 3.737 0.717 1.00 0.13 C ATOM 84 N2 DG A 3 -3.771 3.923 1.961 1.00 0.15 N ATOM 85 N3 DG A 3 -5.502 3.803 0.445 1.00 0.13 N ATOM 86 C4 DG A 3 -5.771 3.521 -0.852 1.00 0.14 C ATOM 0 H5' DG A 3 -10.865 1.145 0.745 1.00 0.26 H new ATOM 0 H5'' DG A 3 -12.146 2.232 0.246 1.00 0.26 H new ATOM 0 H4' DG A 3 -10.269 3.383 1.271 1.00 0.20 H new ATOM 0 H3' DG A 3 -11.502 4.230 -1.163 1.00 0.22 H new ATOM 0 H2' DG A 3 -9.502 4.049 -2.507 1.00 0.22 H new ATOM 0 H2'' DG A 3 -9.170 5.596 -1.752 1.00 0.22 H new ATOM 0 H1' DG A 3 -7.915 4.643 0.007 1.00 0.16 H new ATOM 0 H8 DG A 3 -7.603 3.067 -3.462 1.00 0.18 H new ATOM 0 H1 DG A 3 -2.276 3.410 0.095 1.00 0.13 H new ATOM 0 H21 DG A 3 -4.433 4.156 2.701 1.00 0.15 H new ATOM 0 H22 DG A 3 -2.778 3.832 2.176 1.00 0.15 H new ATOM 98 P DT A 4 -12.007 5.675 1.152 1.00 0.34 P ATOM 99 OP1 DT A 4 -12.449 4.339 1.613 1.00 0.46 O ATOM 100 OP2 DT A 4 -12.957 6.557 0.437 1.00 0.45 O ATOM 101 O5' DT A 4 -11.427 6.478 2.421 1.00 0.36 O ATOM 102 C5' DT A 4 -10.513 5.858 3.334 1.00 0.34 C ATOM 103 C4' DT A 4 -9.239 6.686 3.503 1.00 0.30 C ATOM 104 O4' DT A 4 -8.431 6.124 4.547 1.00 0.31 O ATOM 105 C3' DT A 4 -8.370 6.747 2.241 1.00 0.25 C ATOM 106 O3' DT A 4 -8.240 8.104 1.800 1.00 0.30 O ATOM 107 C2' DT A 4 -7.005 6.211 2.676 1.00 0.24 C ATOM 108 C1' DT A 4 -7.331 5.433 3.952 1.00 0.27 C ATOM 109 N1 DT A 4 -7.712 4.017 3.706 1.00 0.27 N ATOM 110 C2 DT A 4 -8.826 3.491 4.363 1.00 0.36 C ATOM 111 O2 DT A 4 -9.401 4.071 5.280 1.00 0.42 O ATOM 112 N3 DT A 4 -9.224 2.232 3.964 1.00 0.40 N ATOM 113 C4 DT A 4 -8.632 1.462 2.985 1.00 0.35 C ATOM 114 O4 DT A 4 -9.073 0.348 2.716 1.00 0.43 O ATOM 115 C5 DT A 4 -7.487 2.081 2.363 1.00 0.25 C ATOM 116 C7 DT A 4 -6.855 1.427 1.150 1.00 0.22 C ATOM 117 C6 DT A 4 -7.053 3.295 2.744 1.00 0.22 C ATOM 0 H5' DT A 4 -10.255 4.863 2.972 1.00 0.34 H new ATOM 0 H5'' DT A 4 -10.996 5.730 4.303 1.00 0.34 H new ATOM 0 H4' DT A 4 -9.574 7.697 3.736 1.00 0.30 H new ATOM 0 H3' DT A 4 -8.798 6.174 1.419 1.00 0.25 H new ATOM 0 H2' DT A 4 -6.562 5.569 1.914 1.00 0.24 H new ATOM 0 H2'' DT A 4 -6.296 7.017 2.865 1.00 0.24 H new ATOM 0 H1' DT A 4 -6.446 5.390 4.587 1.00 0.27 H new ATOM 0 H3 DT A 4 -10.034 1.832 4.438 1.00 0.40 H new ATOM 0 H71 DT A 4 -6.993 0.347 1.206 1.00 0.22 H new ATOM 0 H72 DT A 4 -7.327 1.807 0.244 1.00 0.22 H new ATOM 0 H73 DT A 4 -5.790 1.656 1.127 1.00 0.22 H new ATOM 0 H6 DT A 4 -6.168 3.710 2.284 1.00 0.22 H new ATOM 130 P DT A 5 -8.965 8.597 0.445 1.00 0.28 P ATOM 131 OP1 DT A 5 -8.539 9.988 0.176 1.00 0.35 O ATOM 132 OP2 DT A 5 -10.403 8.276 0.546 1.00 0.35 O ATOM 133 O5' DT A 5 -8.325 7.636 -0.677 1.00 0.27 O ATOM 134 C5' DT A 5 -7.756 8.169 -1.879 1.00 0.33 C ATOM 135 C4' DT A 5 -6.243 8.317 -1.761 1.00 0.28 C ATOM 136 O4' DT A 5 -5.931 9.424 -0.923 1.00 0.31 O ATOM 137 C3' DT A 5 -5.569 7.108 -1.122 1.00 0.29 C ATOM 138 O3' DT A 5 -5.177 6.170 -2.144 1.00 0.44 O ATOM 139 C2' DT A 5 -4.352 7.695 -0.386 1.00 0.31 C ATOM 140 C1' DT A 5 -4.646 9.203 -0.334 1.00 0.33 C ATOM 141 N1 DT A 5 -4.684 9.738 1.039 1.00 0.35 N ATOM 142 C2 DT A 5 -3.877 10.818 1.344 1.00 0.46 C ATOM 143 O2 DT A 5 -3.149 11.356 0.512 1.00 0.53 O ATOM 144 N3 DT A 5 -3.922 11.250 2.656 1.00 0.52 N ATOM 145 C4 DT A 5 -4.686 10.702 3.671 1.00 0.48 C ATOM 146 O4 DT A 5 -4.648 11.175 4.806 1.00 0.56 O ATOM 147 C5 DT A 5 -5.495 9.575 3.254 1.00 0.37 C ATOM 148 C7 DT A 5 -6.335 8.807 4.280 1.00 0.35 C ATOM 149 C6 DT A 5 -5.471 9.147 1.980 1.00 0.32 C ATOM 0 H5' DT A 5 -8.202 9.140 -2.095 1.00 0.33 H new ATOM 0 H5'' DT A 5 -7.995 7.515 -2.717 1.00 0.33 H new ATOM 0 H4' DT A 5 -5.880 8.440 -2.781 1.00 0.28 H new ATOM 0 H3' DT A 5 -6.220 6.559 -0.441 1.00 0.29 H new ATOM 0 H2' DT A 5 -4.248 7.273 0.614 1.00 0.31 H new ATOM 0 H2'' DT A 5 -3.424 7.487 -0.918 1.00 0.31 H new ATOM 0 H1' DT A 5 -3.842 9.711 -0.867 1.00 0.33 H new ATOM 0 H3 DT A 5 -3.336 12.049 2.899 1.00 0.52 H new ATOM 0 H71 DT A 5 -7.221 8.399 3.793 1.00 0.35 H new ATOM 0 H72 DT A 5 -5.743 7.992 4.698 1.00 0.35 H new ATOM 0 H73 DT A 5 -6.639 9.482 5.080 1.00 0.35 H new ATOM 0 H6 DT A 5 -6.093 8.311 1.695 1.00 0.32 H new ATOM 162 P DT A 6 -3.829 6.335 -3.014 1.00 0.33 P ATOM 163 OP1 DT A 6 -3.552 7.779 -3.197 1.00 0.48 O ATOM 164 OP2 DT A 6 -3.930 5.449 -4.197 1.00 0.49 O ATOM 165 O5' DT A 6 -2.718 5.716 -2.026 1.00 0.26 O ATOM 166 C5' DT A 6 -1.317 5.762 -2.330 1.00 0.31 C ATOM 167 C4' DT A 6 -0.634 6.976 -1.674 1.00 0.18 C ATOM 168 O4' DT A 6 -1.149 7.142 -0.357 1.00 0.27 O ATOM 169 C3' DT A 6 0.888 6.828 -1.539 1.00 0.19 C ATOM 170 O3' DT A 6 1.559 7.758 -2.404 1.00 0.18 O ATOM 171 C2' DT A 6 1.190 7.152 -0.068 1.00 0.22 C ATOM 172 C1' DT A 6 -0.130 7.710 0.452 1.00 0.22 C ATOM 173 N1 DT A 6 -0.464 7.393 1.860 1.00 0.20 N ATOM 174 C2 DT A 6 0.548 7.407 2.804 1.00 0.20 C ATOM 175 O2 DT A 6 1.726 7.595 2.513 1.00 0.25 O ATOM 176 N3 DT A 6 0.155 7.198 4.110 1.00 0.20 N ATOM 177 C4 DT A 6 -1.134 6.983 4.552 1.00 0.20 C ATOM 178 O4 DT A 6 -1.371 6.851 5.750 1.00 0.22 O ATOM 179 C5 DT A 6 -2.118 6.973 3.502 1.00 0.23 C ATOM 180 C7 DT A 6 -3.580 6.715 3.848 1.00 0.34 C ATOM 181 C6 DT A 6 -1.765 7.171 2.221 1.00 0.24 C ATOM 0 H5' DT A 6 -1.180 5.807 -3.410 1.00 0.31 H new ATOM 0 H5'' DT A 6 -0.839 4.845 -1.986 1.00 0.31 H new ATOM 0 H4' DT A 6 -0.840 7.827 -2.324 1.00 0.18 H new ATOM 0 H3' DT A 6 1.230 5.831 -1.818 1.00 0.19 H new ATOM 0 H2' DT A 6 1.495 6.263 0.484 1.00 0.22 H new ATOM 0 H2'' DT A 6 1.997 7.878 0.025 1.00 0.22 H new ATOM 0 H1' DT A 6 -0.044 8.796 0.408 1.00 0.22 H new ATOM 0 H3 DT A 6 0.889 7.203 4.818 1.00 0.20 H new ATOM 0 H71 DT A 6 -4.220 7.236 3.136 1.00 0.34 H new ATOM 0 H72 DT A 6 -3.781 5.645 3.802 1.00 0.34 H new ATOM 0 H73 DT A 6 -3.786 7.080 4.854 1.00 0.34 H new ATOM 0 H6 DT A 6 -2.528 7.155 1.457 1.00 0.24 H new ATOM 194 P DT A 7 1.811 7.406 -3.964 1.00 0.20 P ATOM 195 OP1 DT A 7 2.143 8.657 -4.677 1.00 0.22 O ATOM 196 OP2 DT A 7 0.674 6.588 -4.438 1.00 0.28 O ATOM 197 O5' DT A 7 3.122 6.448 -3.938 1.00 0.27 O ATOM 198 C5' DT A 7 4.403 6.854 -3.405 1.00 0.29 C ATOM 199 C4' DT A 7 5.153 7.830 -4.328 1.00 0.29 C ATOM 200 O4' DT A 7 4.515 9.108 -4.342 1.00 0.22 O ATOM 201 C3' DT A 7 6.586 8.094 -3.902 1.00 0.38 C ATOM 202 O3' DT A 7 7.358 8.486 -5.045 1.00 0.40 O ATOM 203 C2' DT A 7 6.448 9.266 -2.946 1.00 0.40 C ATOM 204 C1' DT A 7 5.278 10.039 -3.549 1.00 0.30 C ATOM 205 N1 DT A 7 4.353 10.623 -2.556 1.00 0.34 N ATOM 206 C2 DT A 7 4.868 11.469 -1.588 1.00 0.51 C ATOM 207 O2 DT A 7 6.058 11.762 -1.531 1.00 0.62 O ATOM 208 N3 DT A 7 3.952 11.975 -0.684 1.00 0.58 N ATOM 209 C4 DT A 7 2.594 11.714 -0.664 1.00 0.50 C ATOM 210 O4 DT A 7 1.873 12.221 0.191 1.00 0.61 O ATOM 211 C5 DT A 7 2.157 10.823 -1.715 1.00 0.34 C ATOM 212 C7 DT A 7 0.690 10.426 -1.826 1.00 0.31 C ATOM 213 C6 DT A 7 3.027 10.323 -2.602 1.00 0.26 C ATOM 0 H5' DT A 7 5.019 5.970 -3.241 1.00 0.29 H new ATOM 0 H5'' DT A 7 4.254 7.323 -2.432 1.00 0.29 H new ATOM 0 H4' DT A 7 5.142 7.344 -5.303 1.00 0.29 H new ATOM 0 H3' DT A 7 7.079 7.229 -3.457 1.00 0.38 H new ATOM 0 H2' DT A 7 6.238 8.938 -1.928 1.00 0.40 H new ATOM 0 H2'' DT A 7 7.356 9.868 -2.906 1.00 0.40 H new ATOM 0 H1' DT A 7 5.704 10.868 -4.115 1.00 0.30 H new ATOM 0 H3 DT A 7 4.312 12.600 0.037 1.00 0.58 H new ATOM 0 H71 DT A 7 0.443 10.235 -2.870 1.00 0.31 H new ATOM 0 H72 DT A 7 0.512 9.524 -1.240 1.00 0.31 H new ATOM 0 H73 DT A 7 0.065 11.234 -1.447 1.00 0.31 H new ATOM 0 H6 DT A 7 2.665 9.663 -3.376 1.00 0.26 H new ATOM 226 P DG A 8 8.136 7.399 -5.941 1.00 0.49 P ATOM 227 OP1 DG A 8 9.137 6.728 -5.080 1.00 0.58 O ATOM 228 OP2 DG A 8 8.575 8.060 -7.184 1.00 0.65 O ATOM 229 O5' DG A 8 6.973 6.343 -6.329 1.00 0.41 O ATOM 230 C5' DG A 8 7.255 4.945 -6.447 1.00 0.38 C ATOM 231 C4' DG A 8 7.946 4.419 -5.193 1.00 0.26 C ATOM 232 O4' DG A 8 7.208 4.831 -4.033 1.00 0.22 O ATOM 233 C3' DG A 8 8.081 2.897 -5.121 1.00 0.22 C ATOM 234 O3' DG A 8 9.357 2.590 -4.537 1.00 0.19 O ATOM 235 C2' DG A 8 6.951 2.507 -4.181 1.00 0.21 C ATOM 236 C1' DG A 8 6.992 3.682 -3.225 1.00 0.18 C ATOM 237 N9 DG A 8 5.773 3.884 -2.441 1.00 0.16 N ATOM 238 C8 DG A 8 5.654 4.138 -1.105 1.00 0.16 C ATOM 239 N7 DG A 8 4.421 4.188 -0.683 1.00 0.15 N ATOM 240 C5 DG A 8 3.681 3.960 -1.840 1.00 0.14 C ATOM 241 C6 DG A 8 2.286 3.903 -2.028 1.00 0.14 C ATOM 242 O6 DG A 8 1.401 4.025 -1.196 1.00 0.15 O ATOM 243 N1 DG A 8 1.967 3.666 -3.345 1.00 0.15 N ATOM 244 C2 DG A 8 2.865 3.498 -4.368 1.00 0.15 C ATOM 245 N2 DG A 8 2.371 3.279 -5.590 1.00 0.17 N ATOM 246 N3 DG A 8 4.171 3.544 -4.197 1.00 0.15 N ATOM 247 C4 DG A 8 4.506 3.779 -2.914 1.00 0.14 C ATOM 0 H5' DG A 8 7.889 4.770 -7.316 1.00 0.38 H new ATOM 0 H5'' DG A 8 6.328 4.396 -6.613 1.00 0.38 H new ATOM 0 H4' DG A 8 8.953 4.835 -5.231 1.00 0.26 H new ATOM 0 H3' DG A 8 8.025 2.382 -6.080 1.00 0.22 H new ATOM 0 H2' DG A 8 5.993 2.419 -4.694 1.00 0.21 H new ATOM 0 H2'' DG A 8 7.133 1.556 -3.681 1.00 0.21 H new ATOM 0 H1' DG A 8 7.775 3.493 -2.491 1.00 0.18 H new ATOM 0 H8 DG A 8 6.505 4.284 -0.456 1.00 0.16 H new ATOM 0 H1 DG A 8 0.976 3.610 -3.581 1.00 0.15 H new ATOM 0 H21 DG A 8 3.003 3.149 -6.380 1.00 0.17 H new ATOM 0 H22 DG A 8 1.362 3.242 -5.733 1.00 0.17 H new ATOM 259 P DG A 9 9.637 1.191 -3.797 1.00 0.20 P ATOM 260 OP1 DG A 9 11.098 1.069 -3.587 1.00 0.25 O ATOM 261 OP2 DG A 9 8.905 0.125 -4.515 1.00 0.25 O ATOM 262 O5' DG A 9 8.937 1.402 -2.357 1.00 0.23 O ATOM 263 C5' DG A 9 9.501 2.306 -1.397 1.00 0.21 C ATOM 264 C4' DG A 9 8.894 2.126 -0.006 1.00 0.18 C ATOM 265 O4' DG A 9 7.464 2.306 0.001 1.00 0.19 O ATOM 266 C3' DG A 9 9.146 0.741 0.597 1.00 0.17 C ATOM 267 O3' DG A 9 10.114 0.864 1.648 1.00 0.18 O ATOM 268 C2' DG A 9 7.785 0.334 1.170 1.00 0.17 C ATOM 269 C1' DG A 9 7.049 1.656 1.196 1.00 0.18 C ATOM 270 N9 DG A 9 5.564 1.540 1.293 1.00 0.18 N ATOM 271 C8 DG A 9 4.810 1.623 2.438 1.00 0.20 C ATOM 272 N7 DG A 9 3.539 1.410 2.262 1.00 0.21 N ATOM 273 C5 DG A 9 3.423 1.167 0.898 1.00 0.19 C ATOM 274 C6 DG A 9 2.261 0.871 0.131 1.00 0.19 C ATOM 275 O6 DG A 9 1.101 0.765 0.529 1.00 0.21 O ATOM 276 N1 DG A 9 2.562 0.696 -1.213 1.00 0.18 N ATOM 277 C2 DG A 9 3.833 0.792 -1.749 1.00 0.17 C ATOM 278 N2 DG A 9 3.937 0.596 -3.060 1.00 0.19 N ATOM 279 N3 DG A 9 4.931 1.068 -1.028 1.00 0.17 N ATOM 280 C4 DG A 9 4.655 1.245 0.285 1.00 0.17 C ATOM 0 H5' DG A 9 9.343 3.332 -1.730 1.00 0.21 H new ATOM 0 H5'' DG A 9 10.579 2.151 -1.344 1.00 0.21 H new ATOM 0 H4' DG A 9 9.393 2.893 0.587 1.00 0.18 H new ATOM 0 H3' DG A 9 9.526 0.013 -0.120 1.00 0.17 H new ATOM 0 H2' DG A 9 7.281 -0.402 0.543 1.00 0.17 H new ATOM 0 H2'' DG A 9 7.875 -0.103 2.164 1.00 0.17 H new ATOM 0 H1' DG A 9 7.295 2.218 2.097 1.00 0.18 H new ATOM 0 H8 DG A 9 5.237 1.847 3.404 1.00 0.20 H new ATOM 0 H1 DG A 9 1.793 0.482 -1.848 1.00 0.18 H new ATOM 0 H21 DG A 9 4.849 0.654 -3.514 1.00 0.19 H new ATOM 0 H22 DG A 9 3.105 0.388 -3.612 1.00 0.19 H new ATOM 292 P DG A 10 10.735 -0.435 2.367 1.00 0.21 P ATOM 293 OP1 DG A 10 11.943 -0.017 3.112 1.00 0.28 O ATOM 294 OP2 DG A 10 10.827 -1.525 1.371 1.00 0.27 O ATOM 295 O5' DG A 10 9.593 -0.817 3.428 1.00 0.22 O ATOM 296 C5' DG A 10 9.285 0.093 4.482 1.00 0.23 C ATOM 297 C4' DG A 10 8.003 -0.291 5.207 1.00 0.23 C ATOM 298 O4' DG A 10 6.922 -0.330 4.278 1.00 0.21 O ATOM 299 C3' DG A 10 8.067 -1.654 5.902 1.00 0.26 C ATOM 300 O3' DG A 10 7.860 -1.468 7.308 1.00 0.31 O ATOM 301 C2' DG A 10 6.918 -2.465 5.294 1.00 0.28 C ATOM 302 C1' DG A 10 6.051 -1.393 4.645 1.00 0.23 C ATOM 303 N9 DG A 10 5.335 -1.809 3.427 1.00 0.21 N ATOM 304 C8 DG A 10 5.816 -1.986 2.156 1.00 0.20 C ATOM 305 N7 DG A 10 4.896 -2.249 1.269 1.00 0.18 N ATOM 306 C5 DG A 10 3.718 -2.254 2.014 1.00 0.18 C ATOM 307 C6 DG A 10 2.377 -2.481 1.603 1.00 0.19 C ATOM 308 O6 DG A 10 1.954 -2.720 0.482 1.00 0.22 O ATOM 309 N1 DG A 10 1.498 -2.396 2.667 1.00 0.20 N ATOM 310 C2 DG A 10 1.858 -2.128 3.965 1.00 0.21 C ATOM 311 N2 DG A 10 0.876 -2.085 4.851 1.00 0.23 N ATOM 312 N3 DG A 10 3.108 -1.914 4.357 1.00 0.22 N ATOM 313 C4 DG A 10 3.984 -1.990 3.333 1.00 0.19 C ATOM 0 H5' DG A 10 9.184 1.099 4.075 1.00 0.23 H new ATOM 0 H5'' DG A 10 10.111 0.118 5.193 1.00 0.23 H new ATOM 0 H4' DG A 10 7.859 0.468 5.976 1.00 0.23 H new ATOM 0 H3' DG A 10 9.025 -2.156 5.769 1.00 0.26 H new ATOM 0 H2' DG A 10 7.277 -3.190 4.564 1.00 0.28 H new ATOM 0 H2'' DG A 10 6.370 -3.022 6.054 1.00 0.28 H new ATOM 0 H1' DG A 10 5.283 -1.130 5.373 1.00 0.23 H new ATOM 0 H8 DG A 10 6.865 -1.914 1.910 1.00 0.20 H new ATOM 0 H1 DG A 10 0.507 -2.543 2.473 1.00 0.20 H new ATOM 0 H21 DG A 10 1.081 -1.890 5.831 1.00 0.23 H new ATOM 0 H22 DG A 10 -0.086 -2.247 4.554 1.00 0.23 H new ATOM 325 P DT A 11 8.931 -0.630 8.177 1.00 0.35 P ATOM 326 OP1 DT A 11 10.290 -1.027 7.749 1.00 0.40 O ATOM 327 OP2 DT A 11 8.547 -0.724 9.600 1.00 0.43 O ATOM 328 O5' DT A 11 8.674 0.886 7.696 1.00 0.36 O ATOM 329 C5' DT A 11 7.901 1.786 8.499 1.00 0.48 C ATOM 330 C4' DT A 11 7.891 3.195 7.913 1.00 0.48 C ATOM 331 O4' DT A 11 9.242 3.626 7.683 1.00 0.53 O ATOM 332 C3' DT A 11 7.141 3.313 6.584 1.00 0.37 C ATOM 333 O3' DT A 11 6.425 4.549 6.562 1.00 0.43 O ATOM 334 C2' DT A 11 8.251 3.338 5.548 1.00 0.39 C ATOM 335 C1' DT A 11 9.377 4.029 6.318 1.00 0.52 C ATOM 336 N1 DT A 11 10.730 3.640 5.869 1.00 0.59 N ATOM 337 C2 DT A 11 11.458 4.566 5.146 1.00 0.76 C ATOM 338 O2 DT A 11 11.022 5.683 4.881 1.00 0.85 O ATOM 339 N3 DT A 11 12.712 4.163 4.734 1.00 0.87 N ATOM 340 C4 DT A 11 13.293 2.934 4.978 1.00 0.82 C ATOM 341 O4 DT A 11 14.423 2.686 4.563 1.00 0.95 O ATOM 342 C5 DT A 11 12.462 2.029 5.740 1.00 0.65 C ATOM 343 C7 DT A 11 12.980 0.633 6.080 1.00 0.66 C ATOM 344 C6 DT A 11 11.234 2.399 6.155 1.00 0.55 C ATOM 0 H5' DT A 11 8.309 1.815 9.509 1.00 0.48 H new ATOM 0 H5'' DT A 11 6.878 1.417 8.578 1.00 0.48 H new ATOM 0 H4' DT A 11 7.372 3.815 8.644 1.00 0.48 H new ATOM 0 H3' DT A 11 6.423 2.511 6.414 1.00 0.37 H new ATOM 0 H2' DT A 11 8.531 2.336 5.224 1.00 0.39 H new ATOM 0 H2'' DT A 11 7.965 3.893 4.655 1.00 0.39 H new ATOM 0 H1' DT A 11 9.286 5.103 6.159 1.00 0.52 H new ATOM 0 H3 DT A 11 13.261 4.836 4.199 1.00 0.87 H new ATOM 0 H71 DT A 11 13.661 0.297 5.298 1.00 0.66 H new ATOM 0 H72 DT A 11 13.508 0.663 7.033 1.00 0.66 H new ATOM 0 H73 DT A 11 12.141 -0.059 6.152 1.00 0.66 H new ATOM 0 H6 DT A 11 10.636 1.703 6.724 1.00 0.55 H new ATOM 357 P DG A 12 5.389 4.903 5.381 1.00 0.26 P ATOM 358 OP1 DG A 12 4.469 3.762 5.206 1.00 0.36 O ATOM 359 OP2 DG A 12 6.176 5.392 4.225 1.00 0.49 O ATOM 360 O5' DG A 12 4.578 6.150 6.030 1.00 0.28 O ATOM 361 C5' DG A 12 3.163 6.325 5.840 1.00 0.24 C ATOM 362 C4' DG A 12 2.345 5.887 7.049 1.00 0.19 C ATOM 363 O4' DG A 12 1.009 5.750 6.664 1.00 0.17 O ATOM 364 C3' DG A 12 2.752 4.556 7.662 1.00 0.21 C ATOM 365 O3' DG A 12 2.288 4.507 9.023 1.00 0.25 O ATOM 366 C2' DG A 12 1.979 3.586 6.800 1.00 0.17 C ATOM 367 C1' DG A 12 0.704 4.380 6.581 1.00 0.15 C ATOM 368 N9 DG A 12 0.088 4.238 5.300 1.00 0.13 N ATOM 369 C8 DG A 12 -1.217 4.203 5.064 1.00 0.15 C ATOM 370 N7 DG A 12 -1.534 4.127 3.798 1.00 0.16 N ATOM 371 C5 DG A 12 -0.291 4.132 3.166 1.00 0.14 C ATOM 372 C6 DG A 12 0.042 4.083 1.795 1.00 0.14 C ATOM 373 O6 DG A 12 -0.702 3.996 0.837 1.00 0.17 O ATOM 374 N1 DG A 12 1.409 4.125 1.604 1.00 0.13 N ATOM 375 C2 DG A 12 2.344 4.199 2.603 1.00 0.13 C ATOM 376 N2 DG A 12 3.609 4.242 2.225 1.00 0.17 N ATOM 377 N3 DG A 12 2.038 4.239 3.888 1.00 0.13 N ATOM 378 C4 DG A 12 0.708 4.203 4.092 1.00 0.13 C ATOM 0 H5' DG A 12 2.845 5.755 4.967 1.00 0.24 H new ATOM 0 H5'' DG A 12 2.957 7.374 5.628 1.00 0.24 H new ATOM 0 H4' DG A 12 2.516 6.659 7.799 1.00 0.19 H new ATOM 0 H3' DG A 12 3.824 4.362 7.689 1.00 0.21 H new ATOM 0 H2' DG A 12 2.493 3.358 5.866 1.00 0.17 H new ATOM 0 H2'' DG A 12 1.797 2.636 7.303 1.00 0.17 H new ATOM 0 H1' DG A 12 0.021 3.996 7.338 1.00 0.15 H new ATOM 0 H8 DG A 12 -1.955 4.235 5.852 1.00 0.15 H new ATOM 0 H1 DG A 12 1.750 4.099 0.643 1.00 0.13 H new ATOM 0 H21 DG A 12 4.349 4.298 2.925 1.00 0.17 H new ATOM 0 H22 DG A 12 3.846 4.220 1.233 1.00 0.17 H new ATOM 390 P DG A 13 2.079 3.109 9.801 1.00 0.29 P ATOM 391 OP1 DG A 13 1.911 3.403 11.241 1.00 0.38 O ATOM 392 OP2 DG A 13 3.136 2.169 9.361 1.00 0.36 O ATOM 393 O5' DG A 13 0.660 2.578 9.225 1.00 0.30 O ATOM 394 C5' DG A 13 -0.578 3.185 9.627 1.00 0.24 C ATOM 395 C4' DG A 13 -1.796 2.331 9.252 1.00 0.21 C ATOM 396 O4' DG A 13 -2.082 2.416 7.850 1.00 0.21 O ATOM 397 C3' DG A 13 -1.641 0.836 9.568 1.00 0.22 C ATOM 398 O3' DG A 13 -2.460 0.496 10.699 1.00 0.30 O ATOM 399 C2' DG A 13 -2.171 0.130 8.313 1.00 0.18 C ATOM 400 C1' DG A 13 -2.850 1.258 7.553 1.00 0.18 C ATOM 401 N9 DG A 13 -2.929 1.070 6.077 1.00 0.16 N ATOM 402 C8 DG A 13 -4.045 0.831 5.309 1.00 0.17 C ATOM 403 N7 DG A 13 -3.805 0.700 4.036 1.00 0.17 N ATOM 404 C5 DG A 13 -2.434 0.870 3.947 1.00 0.16 C ATOM 405 C6 DG A 13 -1.607 0.843 2.812 1.00 0.16 C ATOM 406 O6 DG A 13 -1.914 0.676 1.665 1.00 0.20 O ATOM 407 N1 DG A 13 -0.303 1.057 3.119 1.00 0.15 N ATOM 408 C2 DG A 13 0.190 1.271 4.382 1.00 0.16 C ATOM 409 N2 DG A 13 1.500 1.471 4.483 1.00 0.18 N ATOM 410 N3 DG A 13 -0.579 1.300 5.476 1.00 0.16 N ATOM 411 C4 DG A 13 -1.883 1.093 5.183 1.00 0.16 C ATOM 0 H5' DG A 13 -0.667 4.166 9.160 1.00 0.24 H new ATOM 0 H5'' DG A 13 -0.568 3.345 10.705 1.00 0.24 H new ATOM 0 H4' DG A 13 -2.599 2.744 9.862 1.00 0.21 H new ATOM 0 H3' DG A 13 -0.615 0.557 9.807 1.00 0.22 H new ATOM 0 H2' DG A 13 -1.366 -0.322 7.733 1.00 0.18 H new ATOM 0 H2'' DG A 13 -2.870 -0.668 8.563 1.00 0.18 H new ATOM 0 H1' DG A 13 -3.892 1.317 7.867 1.00 0.18 H new ATOM 0 H8 DG A 13 -5.038 0.758 5.727 1.00 0.17 H new ATOM 0 H1 DG A 13 0.365 1.059 2.349 1.00 0.15 H new ATOM 0 H21 DG A 13 1.922 1.635 5.397 1.00 0.18 H new ATOM 0 H22 DG A 13 2.083 1.460 3.646 1.00 0.18 H new ATOM 423 P DG A 14 -2.078 -0.740 11.666 1.00 0.38 P ATOM 424 OP1 DG A 14 -2.645 -0.464 13.005 1.00 0.52 O ATOM 425 OP2 DG A 14 -0.630 -1.015 11.524 1.00 0.47 O ATOM 426 O5' DG A 14 -2.886 -1.962 11.016 1.00 0.33 O ATOM 427 C5' DG A 14 -4.296 -2.084 11.206 1.00 0.32 C ATOM 428 C4' DG A 14 -4.931 -2.873 10.074 1.00 0.26 C ATOM 429 O4' DG A 14 -4.705 -2.191 8.847 1.00 0.23 O ATOM 430 C3' DG A 14 -4.343 -4.269 9.903 1.00 0.24 C ATOM 431 O3' DG A 14 -5.133 -5.222 10.622 1.00 0.30 O ATOM 432 C2' DG A 14 -4.434 -4.542 8.399 1.00 0.21 C ATOM 433 C1' DG A 14 -4.687 -3.148 7.786 1.00 0.20 C ATOM 434 N9 DG A 14 -3.632 -2.757 6.843 1.00 0.18 N ATOM 435 C8 DG A 14 -2.320 -2.467 7.093 1.00 0.18 C ATOM 436 N7 DG A 14 -1.616 -2.250 6.028 1.00 0.17 N ATOM 437 C5 DG A 14 -2.522 -2.404 4.996 1.00 0.15 C ATOM 438 C6 DG A 14 -2.327 -2.296 3.603 1.00 0.14 C ATOM 439 O6 DG A 14 -1.294 -2.023 3.003 1.00 0.16 O ATOM 440 N1 DG A 14 -3.497 -2.542 2.908 1.00 0.13 N ATOM 441 C2 DG A 14 -4.705 -2.844 3.483 1.00 0.14 C ATOM 442 N2 DG A 14 -5.717 -3.051 2.650 1.00 0.15 N ATOM 443 N3 DG A 14 -4.894 -2.940 4.797 1.00 0.15 N ATOM 444 C4 DG A 14 -3.761 -2.712 5.486 1.00 0.15 C ATOM 0 H5' DG A 14 -4.746 -1.093 11.261 1.00 0.32 H new ATOM 0 H5'' DG A 14 -4.497 -2.578 12.156 1.00 0.32 H new ATOM 0 H4' DG A 14 -5.987 -2.964 10.326 1.00 0.26 H new ATOM 0 H3' DG A 14 -3.323 -4.342 10.279 1.00 0.24 H new ATOM 0 H2' DG A 14 -3.515 -4.986 8.017 1.00 0.21 H new ATOM 0 H2'' DG A 14 -5.243 -5.234 8.166 1.00 0.21 H new ATOM 0 H1' DG A 14 -5.633 -3.184 7.245 1.00 0.20 H new ATOM 0 H8 DG A 14 -1.907 -2.423 8.090 1.00 0.18 H new ATOM 0 H1 DG A 14 -3.459 -2.495 1.890 1.00 0.13 H new ATOM 0 H21 DG A 14 -6.641 -3.279 3.017 1.00 0.15 H new ATOM 0 H22 DG A 14 -5.571 -2.982 1.643 1.00 0.15 H new ATOM 456 P DT A 15 -4.685 -6.769 10.668 1.00 0.32 P ATOM 457 OP1 DT A 15 -5.491 -7.461 11.697 1.00 0.45 O ATOM 458 OP2 DT A 15 -3.205 -6.826 10.724 1.00 0.35 O ATOM 459 O5' DT A 15 -5.157 -7.297 9.228 1.00 0.31 O ATOM 460 C5' DT A 15 -4.428 -8.311 8.533 1.00 0.31 C ATOM 461 C4' DT A 15 -4.785 -8.311 7.051 1.00 0.29 C ATOM 462 O4' DT A 15 -4.396 -7.080 6.460 1.00 0.30 O ATOM 463 C3' DT A 15 -4.079 -9.373 6.224 1.00 0.27 C ATOM 464 O3' DT A 15 -4.843 -10.588 6.199 1.00 0.32 O ATOM 465 C2' DT A 15 -4.072 -8.768 4.821 1.00 0.27 C ATOM 466 C1' DT A 15 -4.378 -7.301 5.054 1.00 0.27 C ATOM 467 N1 DT A 15 -3.402 -6.405 4.422 1.00 0.25 N ATOM 468 C2 DT A 15 -3.762 -5.857 3.215 1.00 0.27 C ATOM 469 O2 DT A 15 -4.896 -5.971 2.762 1.00 0.34 O ATOM 470 N3 DT A 15 -2.793 -5.137 2.561 1.00 0.26 N ATOM 471 C4 DT A 15 -1.511 -4.907 3.007 1.00 0.23 C ATOM 472 O4 DT A 15 -0.708 -4.291 2.312 1.00 0.26 O ATOM 473 C5 DT A 15 -1.227 -5.491 4.294 1.00 0.20 C ATOM 474 C7 DT A 15 0.118 -5.215 4.948 1.00 0.22 C ATOM 475 C6 DT A 15 -2.158 -6.215 4.951 1.00 0.22 C ATOM 0 H5' DT A 15 -4.650 -9.287 8.966 1.00 0.31 H new ATOM 0 H5'' DT A 15 -3.358 -8.144 8.654 1.00 0.31 H new ATOM 0 H4' DT A 15 -5.859 -8.497 7.038 1.00 0.29 H new ATOM 0 H3' DT A 15 -3.092 -9.620 6.614 1.00 0.27 H new ATOM 0 H2' DT A 15 -3.107 -8.902 4.333 1.00 0.27 H new ATOM 0 H2'' DT A 15 -4.820 -9.235 4.181 1.00 0.27 H new ATOM 0 H1' DT A 15 -5.342 -7.073 4.599 1.00 0.27 H new ATOM 0 H3 DT A 15 -3.047 -4.734 1.659 1.00 0.26 H new ATOM 0 H71 DT A 15 0.873 -5.061 4.177 1.00 0.22 H new ATOM 0 H72 DT A 15 0.045 -4.321 5.567 1.00 0.22 H new ATOM 0 H73 DT A 15 0.402 -6.065 5.569 1.00 0.22 H new ATOM 0 H6 DT A 15 -1.915 -6.650 5.909 1.00 0.22 H new ATOM 488 P DT A 16 -4.344 -11.885 5.362 1.00 0.32 P ATOM 489 OP1 DT A 16 -5.517 -12.465 4.673 1.00 0.42 O ATOM 490 OP2 DT A 16 -3.536 -12.733 6.269 1.00 0.40 O ATOM 491 O5' DT A 16 -3.349 -11.270 4.242 1.00 0.29 O ATOM 492 C5' DT A 16 -3.780 -10.999 2.894 1.00 0.29 C ATOM 493 C4' DT A 16 -2.612 -11.104 1.920 1.00 0.33 C ATOM 494 O4' DT A 16 -1.474 -10.396 2.429 1.00 0.38 O ATOM 495 C3' DT A 16 -2.168 -12.546 1.647 1.00 0.40 C ATOM 496 O3' DT A 16 -1.805 -12.701 0.270 1.00 0.42 O ATOM 497 C2' DT A 16 -0.902 -12.707 2.501 1.00 0.47 C ATOM 498 C1' DT A 16 -0.353 -11.286 2.519 1.00 0.47 C ATOM 499 N1 DT A 16 0.375 -10.932 3.749 1.00 0.52 N ATOM 500 C2 DT A 16 1.683 -10.506 3.619 1.00 0.71 C ATOM 501 O2 DT A 16 2.244 -10.431 2.529 1.00 0.84 O ATOM 502 N3 DT A 16 2.327 -10.162 4.789 1.00 0.79 N ATOM 503 C4 DT A 16 1.785 -10.205 6.060 1.00 0.69 C ATOM 504 O4 DT A 16 2.454 -9.871 7.034 1.00 0.80 O ATOM 505 C5 DT A 16 0.413 -10.662 6.101 1.00 0.48 C ATOM 506 C7 DT A 16 -0.311 -10.757 7.443 1.00 0.42 C ATOM 507 C6 DT A 16 -0.237 -11.004 4.971 1.00 0.41 C ATOM 0 H5' DT A 16 -4.215 -10.001 2.840 1.00 0.29 H new ATOM 0 H5'' DT A 16 -4.561 -11.703 2.609 1.00 0.29 H new ATOM 0 H4' DT A 16 -2.975 -10.672 0.987 1.00 0.33 H new ATOM 0 H3' DT A 16 -2.952 -13.269 1.873 1.00 0.40 H new ATOM 0 H2' DT A 16 -1.129 -13.070 3.503 1.00 0.47 H new ATOM 0 H2'' DT A 16 -0.198 -13.412 2.059 1.00 0.47 H new ATOM 0 H1' DT A 16 0.352 -11.208 1.691 1.00 0.47 H new ATOM 0 H3 DT A 16 3.294 -9.846 4.709 1.00 0.79 H new ATOM 0 H71 DT A 16 0.410 -10.972 8.231 1.00 0.42 H new ATOM 0 H72 DT A 16 -0.809 -9.811 7.655 1.00 0.42 H new ATOM 0 H73 DT A 16 -1.051 -11.556 7.401 1.00 0.42 H new ATOM 0 H6 DT A 16 -1.261 -11.342 5.031 1.00 0.41 H new ATOM 520 P DT A 17 -2.769 -12.242 -0.937 1.00 0.37 P ATOM 521 OP1 DT A 17 -3.778 -11.289 -0.417 1.00 0.38 O ATOM 522 OP2 DT A 17 -3.204 -13.454 -1.664 1.00 0.52 O ATOM 523 O5' DT A 17 -1.737 -11.424 -1.879 1.00 0.41 O ATOM 524 C5' DT A 17 -0.456 -10.990 -1.376 1.00 0.37 C ATOM 525 C4' DT A 17 0.415 -10.366 -2.476 1.00 0.36 C ATOM 526 O4' DT A 17 -0.323 -9.350 -3.149 1.00 0.35 O ATOM 527 C3' DT A 17 1.700 -9.714 -1.953 1.00 0.39 C ATOM 528 O3' DT A 17 2.804 -9.827 -2.863 1.00 0.37 O ATOM 529 C2' DT A 17 1.358 -8.243 -1.819 1.00 0.45 C ATOM 530 C1' DT A 17 0.059 -8.069 -2.634 1.00 0.36 C ATOM 531 N1 DT A 17 -1.049 -7.539 -1.813 1.00 0.29 N ATOM 532 C2 DT A 17 -0.830 -6.324 -1.187 1.00 0.28 C ATOM 533 O2 DT A 17 0.207 -5.682 -1.334 1.00 0.35 O ATOM 534 N3 DT A 17 -1.849 -5.860 -0.401 1.00 0.25 N ATOM 535 C4 DT A 17 -3.059 -6.474 -0.186 1.00 0.22 C ATOM 536 O4 DT A 17 -3.912 -5.930 0.498 1.00 0.25 O ATOM 537 C5 DT A 17 -3.214 -7.735 -0.865 1.00 0.22 C ATOM 538 C7 DT A 17 -4.499 -8.535 -0.648 1.00 0.24 C ATOM 539 C6 DT A 17 -2.228 -8.226 -1.648 1.00 0.26 C ATOM 0 H5' DT A 17 0.068 -11.840 -0.938 1.00 0.37 H new ATOM 0 H5'' DT A 17 -0.608 -10.263 -0.578 1.00 0.37 H new ATOM 0 H4' DT A 17 0.693 -11.189 -3.134 1.00 0.36 H new ATOM 0 H3' DT A 17 2.007 -10.201 -1.027 1.00 0.39 H new ATOM 0 H2' DT A 17 1.212 -7.964 -0.776 1.00 0.45 H new ATOM 0 H2'' DT A 17 2.158 -7.613 -2.209 1.00 0.45 H new ATOM 0 H1' DT A 17 0.252 -7.354 -3.433 1.00 0.36 H new ATOM 0 H3 DT A 17 -1.695 -4.970 0.072 1.00 0.25 H new ATOM 0 H71 DT A 17 -4.721 -9.117 -1.542 1.00 0.24 H new ATOM 0 H72 DT A 17 -4.370 -9.208 0.200 1.00 0.24 H new ATOM 0 H73 DT A 17 -5.324 -7.851 -0.447 1.00 0.24 H new ATOM 0 H6 DT A 17 -2.368 -9.171 -2.151 1.00 0.26 H new ATOM 552 P DT A 18 4.284 -9.394 -2.340 1.00 0.38 P ATOM 553 OP1 DT A 18 5.298 -10.059 -3.183 1.00 0.39 O ATOM 554 OP2 DT A 18 4.311 -9.620 -0.878 1.00 0.48 O ATOM 555 O5' DT A 18 4.343 -7.784 -2.576 1.00 0.37 O ATOM 556 C5' DT A 18 4.206 -7.155 -3.869 1.00 0.31 C ATOM 557 C4' DT A 18 5.295 -7.602 -4.848 1.00 0.30 C ATOM 558 O4' DT A 18 5.052 -8.950 -5.263 1.00 0.36 O ATOM 559 C3' DT A 18 5.371 -6.757 -6.126 1.00 0.32 C ATOM 560 O3' DT A 18 6.736 -6.628 -6.577 1.00 0.35 O ATOM 561 C2' DT A 18 4.596 -7.593 -7.132 1.00 0.37 C ATOM 562 C1' DT A 18 4.964 -8.998 -6.686 1.00 0.38 C ATOM 563 N1 DT A 18 3.979 -10.041 -7.028 1.00 0.49 N ATOM 564 C2 DT A 18 3.889 -10.435 -8.352 1.00 0.65 C ATOM 565 O2 DT A 18 4.585 -9.941 -9.234 1.00 0.71 O ATOM 566 N3 DT A 18 2.967 -11.424 -8.626 1.00 0.75 N ATOM 567 C4 DT A 18 2.138 -12.044 -7.709 1.00 0.71 C ATOM 568 O4 DT A 18 1.355 -12.918 -8.071 1.00 0.81 O ATOM 569 C5 DT A 18 2.300 -11.566 -6.353 1.00 0.57 C ATOM 570 C7 DT A 18 1.426 -12.131 -5.235 1.00 0.57 C ATOM 571 C6 DT A 18 3.192 -10.607 -6.058 1.00 0.47 C ATOM 0 H5' DT A 18 4.248 -6.072 -3.751 1.00 0.31 H new ATOM 0 H5'' DT A 18 3.227 -7.392 -4.285 1.00 0.31 H new ATOM 0 H4' DT A 18 6.232 -7.490 -4.303 1.00 0.30 H new ATOM 0 H3' DT A 18 4.985 -5.747 -5.985 1.00 0.32 H new ATOM 0 H2' DT A 18 3.523 -7.411 -7.079 1.00 0.37 H new ATOM 0 H2'' DT A 18 4.903 -7.392 -8.158 1.00 0.37 H new ATOM 0 H1' DT A 18 5.886 -9.271 -7.199 1.00 0.38 H new ATOM 0 H3 DT A 18 2.889 -11.727 -9.597 1.00 0.75 H new ATOM 0 H71 DT A 18 1.976 -12.103 -4.294 1.00 0.57 H new ATOM 0 H72 DT A 18 0.520 -11.532 -5.144 1.00 0.57 H new ATOM 0 H73 DT A 18 1.158 -13.162 -5.468 1.00 0.57 H new ATOM 0 H6 DT A 18 3.292 -10.274 -5.035 1.00 0.47 H new ATOM 584 P DG A 19 7.974 -6.408 -5.559 1.00 0.36 P ATOM 585 OP1 DG A 19 9.165 -6.038 -6.356 1.00 0.42 O ATOM 586 OP2 DG A 19 8.035 -7.569 -4.640 1.00 0.48 O ATOM 587 O5' DG A 19 7.533 -5.113 -4.702 1.00 0.34 O ATOM 588 C5' DG A 19 7.747 -3.787 -5.207 1.00 0.29 C ATOM 589 C4' DG A 19 7.061 -3.592 -6.553 1.00 0.19 C ATOM 590 O4' DG A 19 5.723 -4.070 -6.457 1.00 0.17 O ATOM 591 C3' DG A 19 7.023 -2.154 -7.048 1.00 0.20 C ATOM 592 O3' DG A 19 7.317 -2.143 -8.457 1.00 0.24 O ATOM 593 C2' DG A 19 5.593 -1.719 -6.796 1.00 0.17 C ATOM 594 C1' DG A 19 4.818 -3.029 -6.780 1.00 0.15 C ATOM 595 N9 DG A 19 3.728 -3.077 -5.799 1.00 0.16 N ATOM 596 C8 DG A 19 2.398 -3.252 -6.038 1.00 0.18 C ATOM 597 N7 DG A 19 1.657 -3.229 -4.964 1.00 0.18 N ATOM 598 C5 DG A 19 2.574 -3.027 -3.937 1.00 0.17 C ATOM 599 C6 DG A 19 2.361 -2.913 -2.543 1.00 0.17 C ATOM 600 O6 DG A 19 1.304 -2.956 -1.936 1.00 0.20 O ATOM 601 N1 DG A 19 3.544 -2.720 -1.859 1.00 0.18 N ATOM 602 C2 DG A 19 4.784 -2.640 -2.433 1.00 0.18 C ATOM 603 N2 DG A 19 5.803 -2.453 -1.600 1.00 0.22 N ATOM 604 N3 DG A 19 4.998 -2.742 -3.747 1.00 0.17 N ATOM 605 C4 DG A 19 3.846 -2.934 -4.437 1.00 0.17 C ATOM 0 H5' DG A 19 8.816 -3.603 -5.311 1.00 0.29 H new ATOM 0 H5'' DG A 19 7.366 -3.057 -4.493 1.00 0.29 H new ATOM 0 H4' DG A 19 7.656 -4.149 -7.277 1.00 0.19 H new ATOM 0 H3' DG A 19 7.742 -1.499 -6.557 1.00 0.20 H new ATOM 0 H2' DG A 19 5.497 -1.185 -5.851 1.00 0.17 H new ATOM 0 H2'' DG A 19 5.234 -1.050 -7.578 1.00 0.17 H new ATOM 0 H1' DG A 19 4.367 -3.133 -7.767 1.00 0.15 H new ATOM 0 H8 DG A 19 1.993 -3.397 -7.029 1.00 0.18 H new ATOM 0 H1 DG A 19 3.490 -2.630 -0.844 1.00 0.18 H new ATOM 0 H21 DG A 19 6.753 -2.385 -1.964 1.00 0.22 H new ATOM 0 H22 DG A 19 5.634 -2.378 -0.597 1.00 0.22 H new ATOM 617 P DG A 20 7.243 -0.785 -9.327 1.00 0.25 P ATOM 618 OP1 DG A 20 7.933 -1.021 -10.615 1.00 0.32 O ATOM 619 OP2 DG A 20 7.660 0.343 -8.463 1.00 0.28 O ATOM 620 O5' DG A 20 5.662 -0.647 -9.617 1.00 0.23 O ATOM 621 C5' DG A 20 4.922 -1.704 -10.254 1.00 0.22 C ATOM 622 C4' DG A 20 3.422 -1.423 -10.242 1.00 0.22 C ATOM 623 O4' DG A 20 2.886 -1.593 -8.930 1.00 0.21 O ATOM 624 C3' DG A 20 3.083 -0.003 -10.672 1.00 0.22 C ATOM 625 O3' DG A 20 2.620 -0.012 -12.028 1.00 0.30 O ATOM 626 C2' DG A 20 1.951 0.434 -9.744 1.00 0.21 C ATOM 627 C1' DG A 20 1.728 -0.761 -8.815 1.00 0.19 C ATOM 628 N9 DG A 20 1.601 -0.399 -7.396 1.00 0.18 N ATOM 629 C8 DG A 20 2.586 -0.020 -6.555 1.00 0.17 C ATOM 630 N7 DG A 20 2.235 0.096 -5.320 1.00 0.17 N ATOM 631 C5 DG A 20 0.896 -0.209 -5.341 1.00 0.16 C ATOM 632 C6 DG A 20 -0.018 -0.235 -4.280 1.00 0.17 C ATOM 633 O6 DG A 20 0.209 -0.005 -3.086 1.00 0.18 O ATOM 634 N1 DG A 20 -1.290 -0.574 -4.729 1.00 0.17 N ATOM 635 C2 DG A 20 -1.622 -0.851 -6.037 1.00 0.18 C ATOM 636 N2 DG A 20 -2.905 -1.091 -6.286 1.00 0.21 N ATOM 637 N3 DG A 20 -0.748 -0.839 -7.037 1.00 0.18 N ATOM 638 C4 DG A 20 0.486 -0.507 -6.615 1.00 0.17 C ATOM 0 H5' DG A 20 5.121 -2.647 -9.744 1.00 0.22 H new ATOM 0 H5'' DG A 20 5.263 -1.820 -11.283 1.00 0.22 H new ATOM 0 H4' DG A 20 2.990 -2.131 -10.949 1.00 0.22 H new ATOM 0 H3' DG A 20 3.943 0.665 -10.614 1.00 0.22 H new ATOM 0 H2' DG A 20 2.222 1.328 -9.182 1.00 0.21 H new ATOM 0 H2'' DG A 20 1.048 0.673 -10.306 1.00 0.21 H new ATOM 0 H1' DG A 20 0.795 -1.240 -9.113 1.00 0.19 H new ATOM 0 H8 DG A 20 3.594 0.172 -6.892 1.00 0.17 H new ATOM 0 H1 DG A 20 -2.036 -0.621 -4.035 1.00 0.17 H new ATOM 0 H21 DG A 20 -3.209 -1.302 -7.236 1.00 0.21 H new ATOM 0 H22 DG A 20 -3.586 -1.064 -5.527 1.00 0.21 H new ATOM 650 P DG A 21 2.560 1.353 -12.884 1.00 0.39 P ATOM 651 OP1 DG A 21 2.417 0.991 -14.313 1.00 0.54 O ATOM 652 OP2 DG A 21 3.678 2.223 -12.455 1.00 0.52 O ATOM 653 O5' DG A 21 1.183 2.023 -12.395 1.00 0.33 O ATOM 654 C5' DG A 21 -0.026 1.834 -13.136 1.00 0.41 C ATOM 655 C4' DG A 21 -1.187 2.577 -12.489 1.00 0.37 C ATOM 656 O4' DG A 21 -1.460 2.014 -11.210 1.00 0.30 O ATOM 657 C3' DG A 21 -0.918 4.055 -12.258 1.00 0.41 C ATOM 658 O3' DG A 21 -1.242 4.839 -13.411 1.00 0.54 O ATOM 659 C2' DG A 21 -1.830 4.381 -11.087 1.00 0.36 C ATOM 660 C1' DG A 21 -1.940 3.046 -10.345 1.00 0.27 C ATOM 661 N9 DG A 21 -1.164 2.979 -9.094 1.00 0.21 N ATOM 662 C8 DG A 21 0.194 2.942 -8.911 1.00 0.21 C ATOM 663 N7 DG A 21 0.558 2.819 -7.665 1.00 0.19 N ATOM 664 C5 DG A 21 -0.649 2.777 -6.981 1.00 0.17 C ATOM 665 C6 DG A 21 -0.900 2.651 -5.602 1.00 0.16 C ATOM 666 O6 DG A 21 -0.110 2.512 -4.707 1.00 0.18 O ATOM 667 N1 DG A 21 -2.237 2.655 -5.319 1.00 0.17 N ATOM 668 C2 DG A 21 -3.236 2.771 -6.251 1.00 0.20 C ATOM 669 N2 DG A 21 -4.480 2.792 -5.798 1.00 0.23 N ATOM 670 N3 DG A 21 -3.014 2.882 -7.556 1.00 0.21 N ATOM 671 C4 DG A 21 -1.700 2.878 -7.846 1.00 0.19 C ATOM 0 H5' DG A 21 -0.258 0.771 -13.194 1.00 0.41 H new ATOM 0 H5'' DG A 21 0.111 2.187 -14.158 1.00 0.41 H new ATOM 0 H4' DG A 21 -2.020 2.478 -13.185 1.00 0.37 H new ATOM 0 H3' DG A 21 0.132 4.275 -12.063 1.00 0.41 H new ATOM 0 H2' DG A 21 -1.408 5.160 -10.453 1.00 0.36 H new ATOM 0 H2'' DG A 21 -2.804 4.736 -11.423 1.00 0.36 H new ATOM 0 HO3' DG A 21 -1.058 5.784 -13.226 1.00 0.54 H new ATOM 0 H1' DG A 21 -2.989 2.929 -10.075 1.00 0.27 H new ATOM 0 H8 DG A 21 0.899 3.009 -9.726 1.00 0.21 H new ATOM 0 H1 DG A 21 -2.512 2.565 -4.341 1.00 0.17 H new ATOM 0 H21 DG A 21 -5.259 2.877 -6.451 1.00 0.23 H new ATOM 0 H22 DG A 21 -4.659 2.723 -4.796 1.00 0.23 H new TER 684 DG A 21