USER MOD reduce.3.24.130724 H: found=0, std=0, add=247, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 247 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 DA O5' : rot 180:sc= 0 USER MOD Single : A 6 DT C7 :methyl -30:sc= -0.0826 (180deg=-0.533) USER MOD Single : A 12 DT C7 :methyl 150:sc= -0.043 (180deg=-0.043) USER MOD Single : A 18 DT C7 :methyl -30:sc= -0.195 (180deg=-3.75!) USER MOD Single : A 22 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 -6.100 12.888 -6.255 1.00 3.95 O ATOM 2 C5' DA A 1 -5.147 12.567 -5.239 1.00 3.53 C ATOM 3 C4' DA A 1 -5.554 11.312 -4.470 1.00 2.59 C ATOM 4 O4' DA A 1 -4.549 10.984 -3.510 1.00 2.60 O ATOM 5 C3' DA A 1 -6.880 11.443 -3.697 1.00 2.09 C ATOM 6 O3' DA A 1 -7.821 10.454 -4.169 1.00 1.93 O ATOM 7 C2' DA A 1 -6.504 11.172 -2.238 1.00 1.63 C ATOM 8 C1' DA A 1 -5.208 10.390 -2.404 1.00 1.94 C ATOM 9 N9 DA A 1 -4.301 10.439 -1.243 1.00 2.52 N ATOM 10 C8 DA A 1 -3.733 11.528 -0.633 1.00 3.21 C ATOM 11 N7 DA A 1 -2.961 11.223 0.374 1.00 3.78 N ATOM 12 C5 DA A 1 -3.023 9.833 0.434 1.00 3.48 C ATOM 13 C6 DA A 1 -2.425 8.887 1.284 1.00 3.93 C ATOM 14 N6 DA A 1 -1.609 9.215 2.284 1.00 4.72 N ATOM 15 N1 DA A 1 -2.703 7.593 1.063 1.00 3.67 N ATOM 16 C2 DA A 1 -3.517 7.269 0.065 1.00 3.04 C ATOM 17 N3 DA A 1 -4.136 8.060 -0.797 1.00 2.52 N ATOM 18 C4 DA A 1 -3.838 9.351 -0.549 1.00 2.74 C ATOM 0 H5' DA A 1 -5.054 13.405 -4.548 1.00 3.53 H new ATOM 0 H5'' DA A 1 -4.167 12.416 -5.692 1.00 3.53 H new ATOM 0 H4' DA A 1 -5.678 10.543 -5.232 1.00 2.59 H new ATOM 0 H3' DA A 1 -7.349 12.419 -3.825 1.00 2.09 H new ATOM 0 H2' DA A 1 -6.359 12.093 -1.673 1.00 1.63 H new ATOM 0 H2'' DA A 1 -7.268 10.595 -1.717 1.00 1.63 H new ATOM 0 HO5' DA A 1 -5.813 13.697 -6.729 1.00 3.95 H new ATOM 0 H1' DA A 1 -5.458 9.337 -2.531 1.00 1.94 H new ATOM 0 H8 DA A 1 -3.908 12.544 -0.956 1.00 3.21 H new ATOM 0 H61 DA A 1 -1.202 8.486 2.870 1.00 4.72 H new ATOM 0 H62 DA A 1 -1.391 10.195 2.463 1.00 4.72 H new ATOM 0 H2 DA A 1 -3.699 6.212 -0.061 1.00 3.04 H new ATOM 31 P DG A 2 -7.558 8.862 -4.012 1.00 1.35 P ATOM 32 OP1 DG A 2 -8.537 8.146 -4.858 1.00 1.98 O ATOM 33 OP2 DG A 2 -7.464 8.543 -2.569 1.00 1.12 O ATOM 34 O5' DG A 2 -6.096 8.671 -4.673 1.00 1.38 O ATOM 35 C5' DG A 2 -5.701 7.430 -5.277 1.00 1.19 C ATOM 36 C4' DG A 2 -4.759 6.631 -4.375 1.00 0.87 C ATOM 37 O4' DG A 2 -5.464 6.218 -3.201 1.00 0.82 O ATOM 38 C3' DG A 2 -4.187 5.365 -5.032 1.00 0.79 C ATOM 39 O3' DG A 2 -2.768 5.503 -5.192 1.00 0.84 O ATOM 40 C2' DG A 2 -4.475 4.251 -4.032 1.00 0.99 C ATOM 41 C1' DG A 2 -5.664 4.809 -3.270 1.00 0.79 C ATOM 42 N9 DG A 2 -6.975 4.566 -3.912 1.00 0.77 N ATOM 43 C8 DG A 2 -7.246 3.995 -5.129 1.00 0.99 C ATOM 44 N7 DG A 2 -8.517 3.920 -5.407 1.00 1.16 N ATOM 45 C5 DG A 2 -9.136 4.481 -4.294 1.00 1.02 C ATOM 46 C6 DG A 2 -10.518 4.676 -4.018 1.00 1.24 C ATOM 47 O6 DG A 2 -11.487 4.377 -4.714 1.00 1.54 O ATOM 48 N1 DG A 2 -10.710 5.278 -2.785 1.00 1.22 N ATOM 49 C2 DG A 2 -9.703 5.647 -1.921 1.00 1.07 C ATOM 50 N2 DG A 2 -10.080 6.216 -0.782 1.00 1.30 N ATOM 51 N3 DG A 2 -8.409 5.463 -2.174 1.00 0.87 N ATOM 52 C4 DG A 2 -8.200 4.879 -3.374 1.00 0.80 C ATOM 0 H5' DG A 2 -5.209 7.630 -6.229 1.00 1.19 H new ATOM 0 H5'' DG A 2 -6.587 6.834 -5.495 1.00 1.19 H new ATOM 0 H4' DG A 2 -3.926 7.298 -4.153 1.00 0.87 H new ATOM 0 H3' DG A 2 -4.619 5.174 -6.014 1.00 0.79 H new ATOM 0 H2' DG A 2 -4.713 3.310 -4.527 1.00 0.99 H new ATOM 0 H2'' DG A 2 -3.624 4.060 -3.378 1.00 0.99 H new ATOM 0 H1' DG A 2 -5.705 4.310 -2.302 1.00 0.79 H new ATOM 0 H8 DG A 2 -6.475 3.639 -5.797 1.00 0.99 H new ATOM 0 H1 DG A 2 -11.670 5.462 -2.495 1.00 1.22 H new ATOM 0 H21 DG A 2 -9.379 6.511 -0.102 1.00 1.30 H new ATOM 0 H22 DG A 2 -11.071 6.358 -0.587 1.00 1.30 H new ATOM 64 P DG A 3 -2.113 5.762 -6.644 1.00 0.62 P ATOM 65 OP1 DG A 3 -3.189 5.712 -7.659 1.00 0.62 O ATOM 66 OP2 DG A 3 -0.934 4.875 -6.789 1.00 0.77 O ATOM 67 O5' DG A 3 -1.589 7.286 -6.536 1.00 0.89 O ATOM 68 C5' DG A 3 -0.327 7.662 -7.108 1.00 0.79 C ATOM 69 C4' DG A 3 0.591 8.356 -6.093 1.00 0.63 C ATOM 70 O4' DG A 3 0.118 8.118 -4.762 1.00 0.62 O ATOM 71 C3' DG A 3 2.049 7.872 -6.151 1.00 0.69 C ATOM 72 O3' DG A 3 2.939 8.994 -6.247 1.00 0.81 O ATOM 73 C2' DG A 3 2.262 7.157 -4.823 1.00 0.66 C ATOM 74 C1' DG A 3 1.245 7.848 -3.933 1.00 0.61 C ATOM 75 N9 DG A 3 0.787 7.022 -2.804 1.00 0.56 N ATOM 76 C8 DG A 3 0.822 7.294 -1.462 1.00 0.60 C ATOM 77 N7 DG A 3 0.321 6.345 -0.720 1.00 0.60 N ATOM 78 C5 DG A 3 -0.070 5.375 -1.638 1.00 0.54 C ATOM 79 C6 DG A 3 -0.681 4.108 -1.427 1.00 0.57 C ATOM 80 O6 DG A 3 -1.012 3.589 -0.364 1.00 0.64 O ATOM 81 N1 DG A 3 -0.902 3.447 -2.628 1.00 0.57 N ATOM 82 C2 DG A 3 -0.578 3.943 -3.871 1.00 0.56 C ATOM 83 N2 DG A 3 -0.861 3.173 -4.911 1.00 0.62 N ATOM 84 N3 DG A 3 -0.009 5.127 -4.069 1.00 0.53 N ATOM 85 C4 DG A 3 0.214 5.785 -2.913 1.00 0.52 C ATOM 0 H5' DG A 3 -0.498 8.328 -7.954 1.00 0.79 H new ATOM 0 H5'' DG A 3 0.171 6.774 -7.497 1.00 0.79 H new ATOM 0 H4' DG A 3 0.568 9.414 -6.354 1.00 0.63 H new ATOM 0 H3' DG A 3 2.242 7.231 -7.012 1.00 0.69 H new ATOM 0 H2' DG A 3 2.076 6.086 -4.901 1.00 0.66 H new ATOM 0 H2'' DG A 3 3.280 7.278 -4.452 1.00 0.66 H new ATOM 0 H1' DG A 3 1.709 8.736 -3.502 1.00 0.61 H new ATOM 0 H8 DG A 3 1.227 8.209 -1.056 1.00 0.60 H new ATOM 0 H1 DG A 3 -1.337 2.525 -2.586 1.00 0.57 H new ATOM 0 H21 DG A 3 -0.642 3.491 -5.855 1.00 0.62 H new ATOM 0 H22 DG A 3 -1.297 2.262 -4.767 1.00 0.62 H new ATOM 97 P DG A 4 4.532 8.757 -6.386 1.00 0.98 P ATOM 98 OP1 DG A 4 5.131 9.955 -7.016 1.00 1.26 O ATOM 99 OP2 DG A 4 4.743 7.422 -6.990 1.00 1.06 O ATOM 100 O5' DG A 4 5.017 8.694 -4.841 1.00 0.85 O ATOM 101 C5' DG A 4 4.793 9.804 -3.953 1.00 0.88 C ATOM 102 C4' DG A 4 5.081 9.454 -2.483 1.00 0.74 C ATOM 103 O4' DG A 4 4.266 8.348 -2.074 1.00 0.63 O ATOM 104 C3' DG A 4 6.538 9.070 -2.192 1.00 0.67 C ATOM 105 O3' DG A 4 6.964 9.707 -0.972 1.00 0.70 O ATOM 106 C2' DG A 4 6.483 7.563 -1.999 1.00 0.54 C ATOM 107 C1' DG A 4 5.095 7.396 -1.409 1.00 0.48 C ATOM 108 N9 DG A 4 4.496 6.068 -1.622 1.00 0.42 N ATOM 109 C8 DG A 4 4.393 5.359 -2.788 1.00 0.44 C ATOM 110 N7 DG A 4 3.774 4.220 -2.660 1.00 0.43 N ATOM 111 C5 DG A 4 3.446 4.166 -1.310 1.00 0.38 C ATOM 112 C6 DG A 4 2.765 3.158 -0.579 1.00 0.38 C ATOM 113 O6 DG A 4 2.299 2.100 -0.990 1.00 0.42 O ATOM 114 N1 DG A 4 2.645 3.492 0.760 1.00 0.38 N ATOM 115 C2 DG A 4 3.118 4.653 1.331 1.00 0.39 C ATOM 116 N2 DG A 4 2.905 4.795 2.635 1.00 0.46 N ATOM 117 N3 DG A 4 3.757 5.604 0.647 1.00 0.39 N ATOM 118 C4 DG A 4 3.885 5.294 -0.665 1.00 0.38 C ATOM 0 H5' DG A 4 3.759 10.137 -4.047 1.00 0.88 H new ATOM 0 H5'' DG A 4 5.426 10.639 -4.254 1.00 0.88 H new ATOM 0 H4' DG A 4 4.858 10.367 -1.931 1.00 0.74 H new ATOM 0 H3' DG A 4 7.230 9.370 -2.979 1.00 0.67 H new ATOM 0 H2' DG A 4 6.599 7.023 -2.938 1.00 0.54 H new ATOM 0 H2'' DG A 4 7.263 7.205 -1.327 1.00 0.54 H new ATOM 0 H1' DG A 4 5.174 7.531 -0.330 1.00 0.48 H new ATOM 0 H8 DG A 4 4.789 5.712 -3.729 1.00 0.44 H new ATOM 0 H1 DG A 4 2.170 2.827 1.370 1.00 0.38 H new ATOM 0 H21 DG A 4 3.231 5.633 3.117 1.00 0.46 H new ATOM 0 H22 DG A 4 2.415 4.066 3.154 1.00 0.46 H new ATOM 130 P DC A 5 8.510 9.682 -0.501 1.00 0.67 P ATOM 131 OP1 DC A 5 8.931 11.076 -0.228 1.00 0.78 O ATOM 132 OP2 DC A 5 9.276 8.856 -1.461 1.00 0.69 O ATOM 133 O5' DC A 5 8.444 8.892 0.907 1.00 0.73 O ATOM 134 C5' DC A 5 8.164 9.588 2.133 1.00 0.66 C ATOM 135 C4' DC A 5 8.276 8.668 3.353 1.00 0.60 C ATOM 136 O4' DC A 5 7.339 7.592 3.231 1.00 0.58 O ATOM 137 C3' DC A 5 9.660 8.043 3.541 1.00 0.57 C ATOM 138 O3' DC A 5 9.985 7.991 4.937 1.00 0.69 O ATOM 139 C2' DC A 5 9.493 6.632 3.004 1.00 0.45 C ATOM 140 C1' DC A 5 8.035 6.350 3.349 1.00 0.45 C ATOM 141 N1 DC A 5 7.378 5.387 2.443 1.00 0.41 N ATOM 142 C2 DC A 5 6.747 4.281 3.004 1.00 0.50 C ATOM 143 O2 DC A 5 6.731 4.125 4.226 1.00 0.64 O ATOM 144 N3 DC A 5 6.151 3.387 2.165 1.00 0.50 N ATOM 145 C4 DC A 5 6.172 3.573 0.839 1.00 0.43 C ATOM 146 N4 DC A 5 5.590 2.681 0.043 1.00 0.49 N ATOM 147 C5 DC A 5 6.815 4.712 0.265 1.00 0.39 C ATOM 148 C6 DC A 5 7.401 5.586 1.097 1.00 0.38 C ATOM 0 H5' DC A 5 7.160 10.011 2.089 1.00 0.66 H new ATOM 0 H5'' DC A 5 8.857 10.422 2.243 1.00 0.66 H new ATOM 0 H4' DC A 5 8.075 9.304 4.215 1.00 0.60 H new ATOM 0 H3' DC A 5 10.451 8.602 3.042 1.00 0.57 H new ATOM 0 H2' DC A 5 9.680 6.576 1.932 1.00 0.45 H new ATOM 0 H2'' DC A 5 10.172 5.927 3.483 1.00 0.45 H new ATOM 0 H1' DC A 5 8.009 5.915 4.348 1.00 0.45 H new ATOM 0 H41 DC A 5 5.602 2.815 -0.968 1.00 0.49 H new ATOM 0 H42 DC A 5 5.132 1.862 0.443 1.00 0.49 H new ATOM 0 H5 DC A 5 6.829 4.865 -0.804 1.00 0.39 H new ATOM 0 H6 DC A 5 7.896 6.457 0.694 1.00 0.38 H new ATOM 160 P DT A 6 11.513 8.137 5.435 1.00 1.10 P ATOM 161 OP1 DT A 6 11.606 7.586 6.807 1.00 1.56 O ATOM 162 OP2 DT A 6 11.956 9.524 5.164 1.00 1.66 O ATOM 163 O5' DT A 6 12.310 7.145 4.441 1.00 0.88 O ATOM 164 C5' DT A 6 13.450 7.610 3.706 1.00 0.86 C ATOM 165 C4' DT A 6 14.200 6.462 3.028 1.00 0.65 C ATOM 166 O4' DT A 6 14.599 5.505 3.999 1.00 0.71 O ATOM 167 C3' DT A 6 13.382 5.703 1.982 1.00 0.64 C ATOM 168 O3' DT A 6 13.808 6.097 0.669 1.00 0.74 O ATOM 169 C2' DT A 6 13.724 4.224 2.210 1.00 0.79 C ATOM 170 C1' DT A 6 14.763 4.261 3.329 1.00 0.83 C ATOM 171 N1 DT A 6 14.593 3.189 4.328 1.00 1.04 N ATOM 172 C2 DT A 6 15.673 2.367 4.598 1.00 1.51 C ATOM 173 O2 DT A 6 16.762 2.511 4.049 1.00 1.73 O ATOM 174 N3 DT A 6 15.455 1.369 5.526 1.00 1.84 N ATOM 175 C4 DT A 6 14.271 1.124 6.196 1.00 1.81 C ATOM 176 O4 DT A 6 14.188 0.200 7.001 1.00 2.22 O ATOM 177 C5 DT A 6 13.200 2.032 5.851 1.00 1.38 C ATOM 178 C7 DT A 6 11.832 1.878 6.509 1.00 1.53 C ATOM 179 C6 DT A 6 13.390 3.013 4.950 1.00 0.99 C ATOM 0 H5' DT A 6 14.126 8.137 4.380 1.00 0.86 H new ATOM 0 H5'' DT A 6 13.127 8.328 2.952 1.00 0.86 H new ATOM 0 H4' DT A 6 15.043 6.937 2.526 1.00 0.65 H new ATOM 0 H3' DT A 6 12.313 5.898 2.065 1.00 0.64 H new ATOM 0 H2' DT A 6 12.844 3.650 2.499 1.00 0.79 H new ATOM 0 H2'' DT A 6 14.124 3.762 1.307 1.00 0.79 H new ATOM 0 H1' DT A 6 15.747 4.127 2.880 1.00 0.83 H new ATOM 0 H3 DT A 6 16.241 0.755 5.737 1.00 1.84 H new ATOM 0 H71 DT A 6 11.662 0.829 6.753 1.00 1.53 H new ATOM 0 H72 DT A 6 11.798 2.473 7.421 1.00 1.53 H new ATOM 0 H73 DT A 6 11.058 2.221 5.823 1.00 1.53 H new ATOM 0 H6 DT A 6 12.572 3.677 4.713 1.00 0.99 H new ATOM 192 P DA A 7 12.742 6.270 -0.528 1.00 0.82 P ATOM 193 OP1 DA A 7 13.490 6.421 -1.799 1.00 0.87 O ATOM 194 OP2 DA A 7 11.752 7.294 -0.128 1.00 0.99 O ATOM 195 O5' DA A 7 12.001 4.838 -0.545 1.00 0.89 O ATOM 196 C5' DA A 7 12.383 3.815 -1.473 1.00 0.83 C ATOM 197 C4' DA A 7 11.297 2.748 -1.599 1.00 0.58 C ATOM 198 O4' DA A 7 11.160 2.056 -0.353 1.00 0.61 O ATOM 199 C3' DA A 7 9.919 3.316 -1.962 1.00 0.48 C ATOM 200 O3' DA A 7 9.320 2.531 -3.000 1.00 0.64 O ATOM 201 C2' DA A 7 9.110 3.171 -0.686 1.00 0.59 C ATOM 202 C1' DA A 7 9.775 1.981 -0.026 1.00 0.35 C ATOM 203 N9 DA A 7 9.651 1.973 1.443 1.00 0.34 N ATOM 204 C8 DA A 7 9.918 2.982 2.331 1.00 0.48 C ATOM 205 N7 DA A 7 9.687 2.663 3.577 1.00 0.61 N ATOM 206 C5 DA A 7 9.235 1.347 3.504 1.00 0.49 C ATOM 207 C6 DA A 7 8.817 0.426 4.481 1.00 0.58 C ATOM 208 N6 DA A 7 8.787 0.702 5.782 1.00 0.78 N ATOM 209 N1 DA A 7 8.434 -0.790 4.060 1.00 0.57 N ATOM 210 C2 DA A 7 8.464 -1.064 2.761 1.00 0.56 C ATOM 211 N3 DA A 7 8.832 -0.290 1.753 1.00 0.48 N ATOM 212 C4 DA A 7 9.212 0.921 2.206 1.00 0.37 C ATOM 0 H5' DA A 7 13.314 3.353 -1.145 1.00 0.83 H new ATOM 0 H5'' DA A 7 12.574 4.260 -2.450 1.00 0.83 H new ATOM 0 H4' DA A 7 11.616 2.088 -2.406 1.00 0.58 H new ATOM 0 H3' DA A 7 9.973 4.344 -2.320 1.00 0.48 H new ATOM 0 H2' DA A 7 9.164 4.065 -0.065 1.00 0.59 H new ATOM 0 H2'' DA A 7 8.055 2.988 -0.890 1.00 0.59 H new ATOM 0 H1' DA A 7 9.287 1.075 -0.386 1.00 0.35 H new ATOM 0 H8 DA A 7 10.286 3.952 2.029 1.00 0.48 H new ATOM 0 H61 DA A 7 8.474 -0.006 6.446 1.00 0.78 H new ATOM 0 H62 DA A 7 9.077 1.621 6.115 1.00 0.78 H new ATOM 0 H2 DA A 7 8.143 -2.059 2.489 1.00 0.56 H new ATOM 224 P DG A 8 8.066 3.105 -3.836 1.00 0.77 P ATOM 225 OP1 DG A 8 8.571 4.127 -4.778 1.00 1.09 O ATOM 226 OP2 DG A 8 6.992 3.463 -2.881 1.00 1.16 O ATOM 227 O5' DG A 8 7.583 1.827 -4.686 1.00 0.56 O ATOM 228 C5' DG A 8 8.158 1.537 -5.966 1.00 0.46 C ATOM 229 C4' DG A 8 7.083 1.194 -6.997 1.00 0.43 C ATOM 230 O4' DG A 8 6.368 0.033 -6.568 1.00 0.45 O ATOM 231 C3' DG A 8 6.055 2.300 -7.207 1.00 0.48 C ATOM 232 O3' DG A 8 5.589 2.283 -8.564 1.00 0.54 O ATOM 233 C2' DG A 8 4.925 1.928 -6.262 1.00 0.55 C ATOM 234 C1' DG A 8 5.043 0.408 -6.166 1.00 0.49 C ATOM 235 N9 DG A 8 4.822 -0.104 -4.801 1.00 0.47 N ATOM 236 C8 DG A 8 5.232 0.437 -3.613 1.00 0.53 C ATOM 237 N7 DG A 8 4.817 -0.211 -2.562 1.00 0.53 N ATOM 238 C5 DG A 8 4.079 -1.263 -3.091 1.00 0.44 C ATOM 239 C6 DG A 8 3.377 -2.306 -2.429 1.00 0.42 C ATOM 240 O6 DG A 8 3.264 -2.506 -1.224 1.00 0.49 O ATOM 241 N1 DG A 8 2.765 -3.158 -3.336 1.00 0.40 N ATOM 242 C2 DG A 8 2.825 -3.027 -4.703 1.00 0.43 C ATOM 243 N2 DG A 8 2.181 -3.948 -5.411 1.00 0.53 N ATOM 244 N3 DG A 8 3.480 -2.049 -5.327 1.00 0.44 N ATOM 245 C4 DG A 8 4.081 -1.207 -4.461 1.00 0.43 C ATOM 0 H5' DG A 8 8.854 0.703 -5.873 1.00 0.46 H new ATOM 0 H5'' DG A 8 8.734 2.396 -6.311 1.00 0.46 H new ATOM 0 H4' DG A 8 7.612 1.039 -7.937 1.00 0.43 H new ATOM 0 H3' DG A 8 6.455 3.296 -7.018 1.00 0.48 H new ATOM 0 H2' DG A 8 5.040 2.404 -5.288 1.00 0.55 H new ATOM 0 H2'' DG A 8 3.955 2.233 -6.653 1.00 0.55 H new ATOM 0 H1' DG A 8 4.274 -0.019 -6.810 1.00 0.49 H new ATOM 0 H8 DG A 8 5.846 1.324 -3.552 1.00 0.53 H new ATOM 0 H1 DG A 8 2.230 -3.941 -2.960 1.00 0.40 H new ATOM 0 H21 DG A 8 2.188 -3.905 -6.430 1.00 0.53 H new ATOM 0 H22 DG A 8 1.679 -4.698 -4.936 1.00 0.53 H new ATOM 257 P DG A 9 4.340 3.194 -9.035 1.00 0.57 P ATOM 258 OP1 DG A 9 4.588 3.642 -10.426 1.00 0.65 O ATOM 259 OP2 DG A 9 4.059 4.192 -7.978 1.00 0.61 O ATOM 260 O5' DG A 9 3.122 2.126 -9.065 1.00 0.55 O ATOM 261 C5' DG A 9 3.112 1.074 -10.047 1.00 0.60 C ATOM 262 C4' DG A 9 1.945 0.089 -9.870 1.00 0.58 C ATOM 263 O4' DG A 9 1.973 -0.492 -8.558 1.00 0.59 O ATOM 264 C3' DG A 9 0.540 0.698 -10.052 1.00 0.59 C ATOM 265 O3' DG A 9 -0.185 -0.076 -11.031 1.00 0.64 O ATOM 266 C2' DG A 9 -0.110 0.534 -8.682 1.00 0.56 C ATOM 267 C1' DG A 9 0.619 -0.693 -8.181 1.00 0.51 C ATOM 268 N9 DG A 9 0.548 -0.907 -6.726 1.00 0.50 N ATOM 269 C8 DG A 9 0.007 -1.970 -6.060 1.00 0.56 C ATOM 270 N7 DG A 9 0.071 -1.872 -4.763 1.00 0.56 N ATOM 271 C5 DG A 9 0.704 -0.648 -4.555 1.00 0.48 C ATOM 272 C6 DG A 9 1.051 0.000 -3.342 1.00 0.46 C ATOM 273 O6 DG A 9 0.862 -0.386 -2.190 1.00 0.49 O ATOM 274 N1 DG A 9 1.676 1.216 -3.579 1.00 0.43 N ATOM 275 C2 DG A 9 1.932 1.745 -4.826 1.00 0.42 C ATOM 276 N2 DG A 9 2.529 2.931 -4.855 1.00 0.44 N ATOM 277 N3 DG A 9 1.609 1.135 -5.964 1.00 0.42 N ATOM 278 C4 DG A 9 1.000 -0.052 -5.753 1.00 0.45 C ATOM 0 H5' DG A 9 4.053 0.526 -9.992 1.00 0.60 H new ATOM 0 H5'' DG A 9 3.058 1.516 -11.042 1.00 0.60 H new ATOM 0 H4' DG A 9 2.099 -0.644 -10.662 1.00 0.58 H new ATOM 0 H3' DG A 9 0.557 1.734 -10.389 1.00 0.59 H new ATOM 0 H2' DG A 9 0.048 1.401 -8.041 1.00 0.56 H new ATOM 0 H2'' DG A 9 -1.187 0.379 -8.749 1.00 0.56 H new ATOM 0 H1' DG A 9 0.154 -1.580 -8.611 1.00 0.51 H new ATOM 0 H8 DG A 9 -0.435 -2.817 -6.564 1.00 0.56 H new ATOM 0 H1 DG A 9 1.969 1.761 -2.768 1.00 0.43 H new ATOM 0 H21 DG A 9 2.744 3.372 -5.749 1.00 0.44 H new ATOM 0 H22 DG A 9 2.773 3.401 -3.983 1.00 0.44 H new ATOM 290 P DG A 10 -1.775 0.127 -11.260 1.00 0.79 P ATOM 291 OP1 DG A 10 -2.157 -0.572 -12.509 1.00 0.95 O ATOM 292 OP2 DG A 10 -2.085 1.564 -11.097 1.00 0.85 O ATOM 293 O5' DG A 10 -2.429 -0.669 -10.017 1.00 0.88 O ATOM 294 C5' DG A 10 -2.542 -2.099 -10.029 1.00 0.82 C ATOM 295 C4' DG A 10 -3.517 -2.601 -8.960 1.00 0.76 C ATOM 296 O4' DG A 10 -3.026 -2.268 -7.653 1.00 0.72 O ATOM 297 C3' DG A 10 -4.926 -2.004 -9.074 1.00 0.76 C ATOM 298 O3' DG A 10 -5.901 -3.039 -8.884 1.00 0.85 O ATOM 299 C2' DG A 10 -4.993 -1.021 -7.917 1.00 0.72 C ATOM 300 C1' DG A 10 -4.108 -1.719 -6.902 1.00 0.69 C ATOM 301 N9 DG A 10 -3.550 -0.820 -5.881 1.00 0.64 N ATOM 302 C8 DG A 10 -2.925 0.381 -6.062 1.00 0.65 C ATOM 303 N7 DG A 10 -2.536 0.946 -4.958 1.00 0.64 N ATOM 304 C5 DG A 10 -2.933 0.058 -3.968 1.00 0.59 C ATOM 305 C6 DG A 10 -2.778 0.143 -2.559 1.00 0.58 C ATOM 306 O6 DG A 10 -2.242 1.038 -1.907 1.00 0.60 O ATOM 307 N1 DG A 10 -3.323 -0.962 -1.920 1.00 0.59 N ATOM 308 C2 DG A 10 -3.938 -2.019 -2.559 1.00 0.60 C ATOM 309 N2 DG A 10 -4.400 -2.989 -1.781 1.00 0.65 N ATOM 310 N3 DG A 10 -4.082 -2.099 -3.883 1.00 0.61 N ATOM 311 C4 DG A 10 -3.557 -1.029 -4.521 1.00 0.60 C ATOM 0 H5' DG A 10 -1.560 -2.543 -9.863 1.00 0.82 H new ATOM 0 H5'' DG A 10 -2.879 -2.429 -11.012 1.00 0.82 H new ATOM 0 H4' DG A 10 -3.586 -3.677 -9.117 1.00 0.76 H new ATOM 0 H3' DG A 10 -5.120 -1.541 -10.041 1.00 0.76 H new ATOM 0 H2' DG A 10 -4.613 -0.036 -8.189 1.00 0.72 H new ATOM 0 H2'' DG A 10 -6.010 -0.881 -7.552 1.00 0.72 H new ATOM 0 H1' DG A 10 -4.703 -2.457 -6.364 1.00 0.69 H new ATOM 0 H8 DG A 10 -2.768 0.822 -7.035 1.00 0.65 H new ATOM 0 H1 DG A 10 -3.265 -0.995 -0.902 1.00 0.59 H new ATOM 0 H21 DG A 10 -4.865 -3.797 -2.195 1.00 0.65 H new ATOM 0 H22 DG A 10 -4.291 -2.927 -0.769 1.00 0.65 H new ATOM 323 P DC A 11 -7.468 -2.760 -9.145 1.00 0.90 P ATOM 324 OP1 DC A 11 -7.804 -3.256 -10.499 1.00 1.23 O ATOM 325 OP2 DC A 11 -7.757 -1.353 -8.782 1.00 1.05 O ATOM 326 O5' DC A 11 -8.176 -3.718 -8.057 1.00 0.87 O ATOM 327 C5' DC A 11 -9.312 -3.271 -7.303 1.00 0.77 C ATOM 328 C4' DC A 11 -9.278 -3.805 -5.870 1.00 0.67 C ATOM 329 O4' DC A 11 -8.193 -3.195 -5.156 1.00 0.63 O ATOM 330 C3' DC A 11 -10.557 -3.535 -5.066 1.00 0.66 C ATOM 331 O3' DC A 11 -10.932 -4.723 -4.353 1.00 0.70 O ATOM 332 C2' DC A 11 -10.152 -2.453 -4.074 1.00 0.62 C ATOM 333 C1' DC A 11 -8.677 -2.753 -3.887 1.00 0.58 C ATOM 334 N1 DC A 11 -7.872 -1.586 -3.464 1.00 0.54 N ATOM 335 C2 DC A 11 -7.671 -1.414 -2.105 1.00 0.55 C ATOM 336 O2 DC A 11 -8.167 -2.203 -1.307 1.00 0.61 O ATOM 337 N3 DC A 11 -6.928 -0.352 -1.688 1.00 0.55 N ATOM 338 C4 DC A 11 -6.404 0.505 -2.572 1.00 0.54 C ATOM 339 N4 DC A 11 -5.681 1.533 -2.133 1.00 0.58 N ATOM 340 C5 DC A 11 -6.609 0.333 -3.978 1.00 0.54 C ATOM 341 C6 DC A 11 -7.346 -0.721 -4.378 1.00 0.54 C ATOM 0 H5' DC A 11 -10.228 -3.600 -7.794 1.00 0.77 H new ATOM 0 H5'' DC A 11 -9.333 -2.181 -7.286 1.00 0.77 H new ATOM 0 H4' DC A 11 -9.165 -4.885 -5.966 1.00 0.67 H new ATOM 0 H3' DC A 11 -11.399 -3.241 -5.693 1.00 0.66 H new ATOM 0 H2' DC A 11 -10.320 -1.451 -4.468 1.00 0.62 H new ATOM 0 H2'' DC A 11 -10.707 -2.525 -3.139 1.00 0.62 H new ATOM 0 H1' DC A 11 -8.579 -3.494 -3.093 1.00 0.58 H new ATOM 0 H41 DC A 11 -5.277 2.193 -2.797 1.00 0.58 H new ATOM 0 H42 DC A 11 -5.532 1.661 -1.132 1.00 0.58 H new ATOM 0 H5 DC A 11 -6.188 1.024 -4.693 1.00 0.54 H new ATOM 0 H6 DC A 11 -7.522 -0.883 -5.431 1.00 0.54 H new ATOM 353 P DT A 12 -12.483 -5.126 -4.182 1.00 0.82 P ATOM 354 OP1 DT A 12 -13.003 -5.506 -5.514 1.00 1.24 O ATOM 355 OP2 DT A 12 -13.156 -4.059 -3.406 1.00 0.79 O ATOM 356 O5' DT A 12 -12.406 -6.456 -3.273 1.00 0.93 O ATOM 357 C5' DT A 12 -13.348 -6.694 -2.217 1.00 0.81 C ATOM 358 C4' DT A 12 -12.819 -6.211 -0.866 1.00 0.66 C ATOM 359 O4' DT A 12 -11.519 -6.768 -0.648 1.00 0.69 O ATOM 360 C3' DT A 12 -12.696 -4.687 -0.751 1.00 0.88 C ATOM 361 O3' DT A 12 -13.298 -4.220 0.476 1.00 1.15 O ATOM 362 C2' DT A 12 -11.196 -4.415 -0.748 1.00 0.78 C ATOM 363 C1' DT A 12 -10.620 -5.733 -0.251 1.00 0.67 C ATOM 364 N1 DT A 12 -9.295 -6.058 -0.815 1.00 0.71 N ATOM 365 C2 DT A 12 -8.236 -6.172 0.064 1.00 0.86 C ATOM 366 O2 DT A 12 -8.368 -6.009 1.275 1.00 0.96 O ATOM 367 N3 DT A 12 -7.015 -6.482 -0.495 1.00 1.05 N ATOM 368 C4 DT A 12 -6.761 -6.686 -1.836 1.00 1.10 C ATOM 369 O4 DT A 12 -5.626 -6.949 -2.222 1.00 1.33 O ATOM 370 C5 DT A 12 -7.924 -6.548 -2.682 1.00 0.99 C ATOM 371 C7 DT A 12 -7.781 -6.743 -4.189 1.00 1.25 C ATOM 372 C6 DT A 12 -9.129 -6.245 -2.162 1.00 0.82 C ATOM 0 H5' DT A 12 -13.570 -7.760 -2.161 1.00 0.81 H new ATOM 0 H5'' DT A 12 -14.285 -6.185 -2.444 1.00 0.81 H new ATOM 0 H4' DT A 12 -13.547 -6.538 -0.123 1.00 0.66 H new ATOM 0 H3' DT A 12 -13.206 -4.171 -1.565 1.00 0.88 H new ATOM 0 H2' DT A 12 -10.828 -4.161 -1.742 1.00 0.78 H new ATOM 0 H2'' DT A 12 -10.936 -3.585 -0.091 1.00 0.78 H new ATOM 0 H1' DT A 12 -10.499 -5.646 0.829 1.00 0.67 H new ATOM 0 H3 DT A 12 -6.224 -6.569 0.143 1.00 1.05 H new ATOM 0 H71 DT A 12 -8.716 -7.129 -4.596 1.00 1.25 H new ATOM 0 H72 DT A 12 -7.547 -5.788 -4.659 1.00 1.25 H new ATOM 0 H73 DT A 12 -6.978 -7.452 -4.390 1.00 1.25 H new ATOM 0 H6 DT A 12 -9.980 -6.148 -2.819 1.00 0.82 H new ATOM 385 P DA A 13 -12.986 -4.888 1.919 1.00 1.03 P ATOM 386 OP1 DA A 13 -13.215 -6.347 1.822 1.00 1.33 O ATOM 387 OP2 DA A 13 -13.706 -4.106 2.949 1.00 1.29 O ATOM 388 O5' DA A 13 -11.403 -4.634 2.097 1.00 0.80 O ATOM 389 C5' DA A 13 -10.848 -4.122 3.318 1.00 0.75 C ATOM 390 C4' DA A 13 -10.831 -2.592 3.344 1.00 0.62 C ATOM 391 O4' DA A 13 -10.458 -2.098 2.060 1.00 0.68 O ATOM 392 C3' DA A 13 -12.181 -1.948 3.695 1.00 0.55 C ATOM 393 O3' DA A 13 -12.083 -1.268 4.957 1.00 0.77 O ATOM 394 C2' DA A 13 -12.434 -0.926 2.582 1.00 0.72 C ATOM 395 C1' DA A 13 -11.078 -0.832 1.894 1.00 0.69 C ATOM 396 N9 DA A 13 -11.149 -0.553 0.447 1.00 0.65 N ATOM 397 C8 DA A 13 -11.922 -1.160 -0.512 1.00 0.76 C ATOM 398 N7 DA A 13 -11.752 -0.677 -1.711 1.00 0.79 N ATOM 399 C5 DA A 13 -10.797 0.319 -1.535 1.00 0.63 C ATOM 400 C6 DA A 13 -10.183 1.210 -2.428 1.00 0.63 C ATOM 401 N6 DA A 13 -10.458 1.232 -3.730 1.00 0.78 N ATOM 402 N1 DA A 13 -9.282 2.068 -1.925 1.00 0.60 N ATOM 403 C2 DA A 13 -9.016 2.035 -0.624 1.00 0.63 C ATOM 404 N3 DA A 13 -9.523 1.249 0.314 1.00 0.63 N ATOM 405 C4 DA A 13 -10.424 0.401 -0.225 1.00 0.59 C ATOM 0 H5' DA A 13 -9.832 -4.498 3.440 1.00 0.75 H new ATOM 0 H5'' DA A 13 -11.428 -4.492 4.163 1.00 0.75 H new ATOM 0 H4' DA A 13 -10.119 -2.327 4.125 1.00 0.62 H new ATOM 0 H3' DA A 13 -12.980 -2.685 3.773 1.00 0.55 H new ATOM 0 H2' DA A 13 -13.213 -1.259 1.896 1.00 0.72 H new ATOM 0 H2'' DA A 13 -12.752 0.037 2.982 1.00 0.72 H new ATOM 0 H1' DA A 13 -10.533 -0.001 2.342 1.00 0.69 H new ATOM 0 H8 DA A 13 -12.608 -1.964 -0.293 1.00 0.76 H new ATOM 0 H61 DA A 13 -9.985 1.899 -4.340 1.00 0.78 H new ATOM 0 H62 DA A 13 -11.142 0.582 -4.118 1.00 0.78 H new ATOM 0 H2 DA A 13 -8.282 2.750 -0.283 1.00 0.63 H new ATOM 417 P DG A 14 -11.690 -2.067 6.306 1.00 0.98 P ATOM 418 OP1 DG A 14 -11.933 -3.510 6.078 1.00 1.55 O ATOM 419 OP2 DG A 14 -12.331 -1.386 7.453 1.00 1.25 O ATOM 420 O5' DG A 14 -10.089 -1.831 6.405 1.00 1.08 O ATOM 421 C5' DG A 14 -9.543 -0.748 7.179 1.00 0.94 C ATOM 422 C4' DG A 14 -8.007 -0.725 7.141 1.00 0.75 C ATOM 423 O4' DG A 14 -7.558 -0.336 5.841 1.00 0.71 O ATOM 424 C3' DG A 14 -7.369 0.267 8.133 1.00 0.73 C ATOM 425 O3' DG A 14 -6.610 -0.443 9.144 1.00 0.67 O ATOM 426 C2' DG A 14 -6.441 1.139 7.278 1.00 0.70 C ATOM 427 C1' DG A 14 -6.305 0.312 6.011 1.00 0.66 C ATOM 428 N9 DG A 14 -6.010 1.117 4.806 1.00 0.66 N ATOM 429 C8 DG A 14 -5.347 2.312 4.727 1.00 0.70 C ATOM 430 N7 DG A 14 -5.203 2.761 3.510 1.00 0.72 N ATOM 431 C5 DG A 14 -5.819 1.792 2.723 1.00 0.68 C ATOM 432 C6 DG A 14 -5.983 1.729 1.310 1.00 0.70 C ATOM 433 O6 DG A 14 -5.598 2.524 0.458 1.00 0.77 O ATOM 434 N1 DG A 14 -6.668 0.586 0.931 1.00 0.69 N ATOM 435 C2 DG A 14 -7.132 -0.376 1.794 1.00 0.69 C ATOM 436 N2 DG A 14 -7.767 -1.400 1.245 1.00 0.77 N ATOM 437 N3 DG A 14 -6.979 -0.324 3.114 1.00 0.69 N ATOM 438 C4 DG A 14 -6.317 0.783 3.510 1.00 0.66 C ATOM 0 H5' DG A 14 -9.878 -0.837 8.212 1.00 0.94 H new ATOM 0 H5'' DG A 14 -9.928 0.198 6.799 1.00 0.94 H new ATOM 0 H4' DG A 14 -7.702 -1.736 7.412 1.00 0.75 H new ATOM 0 H3' DG A 14 -8.117 0.858 8.661 1.00 0.73 H new ATOM 0 H2' DG A 14 -6.872 2.120 7.080 1.00 0.70 H new ATOM 0 H2'' DG A 14 -5.478 1.305 7.761 1.00 0.70 H new ATOM 0 H1' DG A 14 -5.466 -0.375 6.120 1.00 0.66 H new ATOM 0 H8 DG A 14 -4.976 2.837 5.595 1.00 0.70 H new ATOM 0 H1 DG A 14 -6.841 0.449 -0.065 1.00 0.69 H new ATOM 0 H21 DG A 14 -8.135 -2.147 1.834 1.00 0.77 H new ATOM 0 H22 DG A 14 -7.888 -1.442 0.233 1.00 0.77 H new ATOM 450 P DG A 15 -5.249 -1.273 8.829 1.00 0.59 P ATOM 451 OP1 DG A 15 -4.821 -1.931 10.085 1.00 0.70 O ATOM 452 OP2 DG A 15 -4.304 -0.392 8.104 1.00 0.57 O ATOM 453 O5' DG A 15 -5.739 -2.428 7.812 1.00 0.63 O ATOM 454 C5' DG A 15 -4.823 -3.444 7.379 1.00 0.55 C ATOM 455 C4' DG A 15 -5.467 -4.448 6.418 1.00 0.43 C ATOM 456 O4' DG A 15 -5.780 -3.804 5.169 1.00 0.41 O ATOM 457 C3' DG A 15 -4.556 -5.628 6.074 1.00 0.45 C ATOM 458 O3' DG A 15 -5.355 -6.803 5.830 1.00 0.44 O ATOM 459 C2' DG A 15 -3.901 -5.164 4.787 1.00 0.48 C ATOM 460 C1' DG A 15 -5.088 -4.501 4.122 1.00 0.41 C ATOM 461 N9 DG A 15 -4.743 -3.531 3.059 1.00 0.45 N ATOM 462 C8 DG A 15 -4.887 -3.661 1.697 1.00 0.48 C ATOM 463 N7 DG A 15 -4.486 -2.626 1.023 1.00 0.52 N ATOM 464 C5 DG A 15 -4.043 -1.740 1.994 1.00 0.51 C ATOM 465 C6 DG A 15 -3.496 -0.441 1.845 1.00 0.55 C ATOM 466 O6 DG A 15 -3.289 0.182 0.806 1.00 0.62 O ATOM 467 N1 DG A 15 -3.179 0.121 3.072 1.00 0.56 N ATOM 468 C2 DG A 15 -3.363 -0.491 4.293 1.00 0.55 C ATOM 469 N2 DG A 15 -2.997 0.211 5.363 1.00 0.61 N ATOM 470 N3 DG A 15 -3.874 -1.718 4.438 1.00 0.51 N ATOM 471 C4 DG A 15 -4.193 -2.281 3.247 1.00 0.48 C ATOM 0 H5' DG A 15 -4.438 -3.976 8.249 1.00 0.55 H new ATOM 0 H5'' DG A 15 -3.970 -2.974 6.889 1.00 0.55 H new ATOM 0 H4' DG A 15 -6.354 -4.816 6.934 1.00 0.43 H new ATOM 0 H3' DG A 15 -3.845 -5.888 6.859 1.00 0.45 H new ATOM 0 H2' DG A 15 -3.079 -4.470 4.963 1.00 0.48 H new ATOM 0 H2'' DG A 15 -3.501 -5.991 4.200 1.00 0.48 H new ATOM 0 H1' DG A 15 -5.676 -5.274 3.627 1.00 0.41 H new ATOM 0 H8 DG A 15 -5.297 -4.545 1.230 1.00 0.48 H new ATOM 0 H1 DG A 15 -2.779 1.059 3.071 1.00 0.56 H new ATOM 0 H21 DG A 15 -3.108 -0.186 6.296 1.00 0.61 H new ATOM 0 H22 DG A 15 -2.606 1.146 5.250 1.00 0.61 H new ATOM 483 P DG A 16 -4.671 -8.246 5.580 1.00 0.48 P ATOM 484 OP1 DG A 16 -5.728 -9.280 5.626 1.00 0.66 O ATOM 485 OP2 DG A 16 -3.490 -8.362 6.462 1.00 0.56 O ATOM 486 O5' DG A 16 -4.140 -8.139 4.057 1.00 0.49 O ATOM 487 C5' DG A 16 -5.014 -8.384 2.949 1.00 0.48 C ATOM 488 C4' DG A 16 -4.267 -8.341 1.616 1.00 0.38 C ATOM 489 O4' DG A 16 -3.808 -7.007 1.355 1.00 0.36 O ATOM 490 C3' DG A 16 -3.036 -9.258 1.559 1.00 0.38 C ATOM 491 O3' DG A 16 -3.067 -10.016 0.339 1.00 0.49 O ATOM 492 C2' DG A 16 -1.857 -8.290 1.537 1.00 0.41 C ATOM 493 C1' DG A 16 -2.478 -7.091 0.848 1.00 0.35 C ATOM 494 N9 DG A 16 -1.802 -5.808 1.125 1.00 0.38 N ATOM 495 C8 DG A 16 -1.426 -5.287 2.332 1.00 0.44 C ATOM 496 N7 DG A 16 -0.873 -4.107 2.253 1.00 0.49 N ATOM 497 C5 DG A 16 -0.878 -3.829 0.889 1.00 0.46 C ATOM 498 C6 DG A 16 -0.400 -2.687 0.187 1.00 0.52 C ATOM 499 O6 DG A 16 0.115 -1.669 0.646 1.00 0.58 O ATOM 500 N1 DG A 16 -0.590 -2.816 -1.182 1.00 0.52 N ATOM 501 C2 DG A 16 -1.169 -3.904 -1.801 1.00 0.49 C ATOM 502 N2 DG A 16 -1.258 -3.856 -3.125 1.00 0.56 N ATOM 503 N3 DG A 16 -1.623 -4.973 -1.145 1.00 0.42 N ATOM 504 C4 DG A 16 -1.444 -4.867 0.191 1.00 0.40 C ATOM 0 H5' DG A 16 -5.811 -7.640 2.943 1.00 0.48 H new ATOM 0 H5'' DG A 16 -5.488 -9.358 3.069 1.00 0.48 H new ATOM 0 H4' DG A 16 -4.986 -8.687 0.874 1.00 0.38 H new ATOM 0 H3' DG A 16 -2.986 -9.964 2.388 1.00 0.38 H new ATOM 0 H2' DG A 16 -1.501 -8.051 2.539 1.00 0.41 H new ATOM 0 H2'' DG A 16 -1.007 -8.689 0.984 1.00 0.41 H new ATOM 0 H1' DG A 16 -2.408 -7.239 -0.230 1.00 0.35 H new ATOM 0 H8 DG A 16 -1.573 -5.806 3.268 1.00 0.44 H new ATOM 0 H1 DG A 16 -0.278 -2.047 -1.775 1.00 0.52 H new ATOM 0 H21 DG A 16 -1.677 -4.633 -3.636 1.00 0.56 H new ATOM 0 H22 DG A 16 -0.907 -3.043 -3.631 1.00 0.56 H new ATOM 516 P DC A 17 -2.164 -11.343 0.156 1.00 0.71 P ATOM 517 OP1 DC A 17 -3.074 -12.502 0.009 1.00 1.05 O ATOM 518 OP2 DC A 17 -1.128 -11.350 1.214 1.00 1.01 O ATOM 519 O5' DC A 17 -1.436 -11.083 -1.264 1.00 0.67 O ATOM 520 C5' DC A 17 -2.131 -11.294 -2.502 1.00 0.62 C ATOM 521 C4' DC A 17 -1.462 -10.559 -3.669 1.00 0.52 C ATOM 522 O4' DC A 17 -1.277 -9.185 -3.319 1.00 0.48 O ATOM 523 C3' DC A 17 -0.091 -11.119 -4.080 1.00 0.59 C ATOM 524 O3' DC A 17 -0.076 -11.332 -5.504 1.00 0.65 O ATOM 525 C2' DC A 17 0.899 -10.018 -3.704 1.00 0.62 C ATOM 526 C1' DC A 17 0.025 -8.775 -3.732 1.00 0.46 C ATOM 527 N1 DC A 17 0.467 -7.705 -2.811 1.00 0.40 N ATOM 528 C2 DC A 17 0.995 -6.545 -3.365 1.00 0.41 C ATOM 529 O2 DC A 17 1.074 -6.421 -4.586 1.00 0.50 O ATOM 530 N3 DC A 17 1.414 -5.559 -2.523 1.00 0.40 N ATOM 531 C4 DC A 17 1.316 -5.705 -1.196 1.00 0.37 C ATOM 532 N4 DC A 17 1.734 -4.727 -0.398 1.00 0.42 N ATOM 533 C5 DC A 17 0.769 -6.893 -0.622 1.00 0.37 C ATOM 534 C6 DC A 17 0.361 -7.862 -1.460 1.00 0.40 C ATOM 0 H5' DC A 17 -3.161 -10.953 -2.402 1.00 0.62 H new ATOM 0 H5'' DC A 17 -2.168 -12.361 -2.719 1.00 0.62 H new ATOM 0 H4' DC A 17 -2.134 -10.693 -4.517 1.00 0.52 H new ATOM 0 H3' DC A 17 0.145 -12.068 -3.599 1.00 0.59 H new ATOM 0 H2' DC A 17 1.338 -10.184 -2.720 1.00 0.62 H new ATOM 0 H2'' DC A 17 1.723 -9.952 -4.414 1.00 0.62 H new ATOM 0 H1' DC A 17 0.067 -8.361 -4.740 1.00 0.46 H new ATOM 0 H41 DC A 17 1.663 -4.829 0.614 1.00 0.42 H new ATOM 0 H42 DC A 17 2.125 -3.874 -0.798 1.00 0.42 H new ATOM 0 H5 DC A 17 0.686 -7.009 0.449 1.00 0.37 H new ATOM 0 H6 DC A 17 -0.055 -8.775 -1.059 1.00 0.40 H new ATOM 546 P DT A 18 1.247 -11.856 -6.278 1.00 0.94 P ATOM 547 OP1 DT A 18 1.934 -10.684 -6.865 1.00 1.32 O ATOM 548 OP2 DT A 18 0.854 -12.988 -7.148 1.00 1.45 O ATOM 549 O5' DT A 18 2.169 -12.437 -5.090 1.00 0.83 O ATOM 550 C5' DT A 18 3.577 -12.627 -5.290 1.00 0.82 C ATOM 551 C4' DT A 18 4.319 -12.778 -3.965 1.00 0.77 C ATOM 552 O4' DT A 18 5.726 -12.834 -4.210 1.00 0.90 O ATOM 553 C3' DT A 18 4.062 -11.634 -2.989 1.00 0.65 C ATOM 554 O3' DT A 18 3.113 -12.067 -1.994 1.00 0.80 O ATOM 555 C2' DT A 18 5.418 -11.349 -2.350 1.00 0.70 C ATOM 556 C1' DT A 18 6.417 -11.915 -3.356 1.00 0.86 C ATOM 557 N1 DT A 18 7.044 -10.895 -4.221 1.00 0.93 N ATOM 558 C2 DT A 18 8.401 -11.005 -4.477 1.00 1.17 C ATOM 559 O2 DT A 18 9.089 -11.904 -4.002 1.00 1.33 O ATOM 560 N3 DT A 18 8.941 -10.038 -5.300 1.00 1.29 N ATOM 561 C4 DT A 18 8.258 -8.987 -5.881 1.00 1.21 C ATOM 562 O4 DT A 18 8.846 -8.181 -6.598 1.00 1.37 O ATOM 563 C5 DT A 18 6.848 -8.953 -5.559 1.00 1.00 C ATOM 564 C7 DT A 18 5.967 -7.852 -6.144 1.00 1.04 C ATOM 565 C6 DT A 18 6.299 -9.886 -4.756 1.00 0.87 C ATOM 0 H5' DT A 18 3.984 -11.779 -5.841 1.00 0.82 H new ATOM 0 H5'' DT A 18 3.741 -13.514 -5.902 1.00 0.82 H new ATOM 0 H4' DT A 18 3.945 -13.696 -3.512 1.00 0.77 H new ATOM 0 H3' DT A 18 3.652 -10.747 -3.471 1.00 0.65 H new ATOM 0 H2' DT A 18 5.570 -10.281 -2.192 1.00 0.70 H new ATOM 0 H2'' DT A 18 5.512 -11.832 -1.377 1.00 0.70 H new ATOM 0 H1' DT A 18 7.211 -12.383 -2.773 1.00 0.86 H new ATOM 0 H3 DT A 18 9.939 -10.106 -5.498 1.00 1.29 H new ATOM 0 H71 DT A 18 6.563 -6.952 -6.298 1.00 1.04 H new ATOM 0 H72 DT A 18 5.557 -8.183 -7.098 1.00 1.04 H new ATOM 0 H73 DT A 18 5.152 -7.634 -5.454 1.00 1.04 H new ATOM 0 H6 DT A 18 5.244 -9.833 -4.531 1.00 0.87 H new ATOM 578 P DA A 19 3.455 -13.222 -0.913 1.00 1.04 P ATOM 579 OP1 DA A 19 4.571 -14.050 -1.429 1.00 1.15 O ATOM 580 OP2 DA A 19 2.188 -13.871 -0.506 1.00 1.33 O ATOM 581 O5' DA A 19 4.004 -12.366 0.338 1.00 0.94 O ATOM 582 C5' DA A 19 3.138 -11.456 1.027 1.00 0.91 C ATOM 583 C4' DA A 19 3.912 -10.312 1.684 1.00 0.76 C ATOM 584 O4' DA A 19 4.743 -9.684 0.705 1.00 0.64 O ATOM 585 C3' DA A 19 3.011 -9.230 2.291 1.00 0.78 C ATOM 586 O3' DA A 19 3.405 -8.972 3.647 1.00 0.84 O ATOM 587 C2' DA A 19 3.254 -7.991 1.434 1.00 0.77 C ATOM 588 C1' DA A 19 4.616 -8.268 0.819 1.00 0.57 C ATOM 589 N9 DA A 19 4.784 -7.704 -0.535 1.00 0.72 N ATOM 590 C8 DA A 19 4.114 -8.034 -1.685 1.00 0.74 C ATOM 591 N7 DA A 19 4.495 -7.356 -2.733 1.00 1.03 N ATOM 592 C5 DA A 19 5.491 -6.517 -2.240 1.00 1.28 C ATOM 593 C6 DA A 19 6.299 -5.543 -2.850 1.00 1.74 C ATOM 594 N6 DA A 19 6.225 -5.239 -4.144 1.00 1.99 N ATOM 595 N1 DA A 19 7.180 -4.897 -2.070 1.00 1.98 N ATOM 596 C2 DA A 19 7.249 -5.202 -0.779 1.00 1.77 C ATOM 597 N3 DA A 19 6.548 -6.091 -0.092 1.00 1.34 N ATOM 598 C4 DA A 19 5.673 -6.723 -0.901 1.00 1.10 C ATOM 0 H5' DA A 19 2.576 -11.997 1.788 1.00 0.91 H new ATOM 0 H5'' DA A 19 2.412 -11.046 0.325 1.00 0.91 H new ATOM 0 H4' DA A 19 4.489 -10.759 2.493 1.00 0.76 H new ATOM 0 H3' DA A 19 1.961 -9.524 2.304 1.00 0.78 H new ATOM 0 H2' DA A 19 2.484 -7.869 0.672 1.00 0.77 H new ATOM 0 H2'' DA A 19 3.258 -7.080 2.032 1.00 0.77 H new ATOM 0 H1' DA A 19 5.366 -7.804 1.460 1.00 0.57 H new ATOM 0 H8 DA A 19 3.341 -8.787 -1.720 1.00 0.74 H new ATOM 0 H61 DA A 19 6.836 -4.522 -4.535 1.00 1.99 H new ATOM 0 H62 DA A 19 5.557 -5.723 -4.744 1.00 1.99 H new ATOM 0 H2 DA A 19 7.980 -4.647 -0.209 1.00 1.77 H new ATOM 610 P DG A 20 2.578 -7.929 4.562 1.00 1.05 P ATOM 611 OP1 DG A 20 2.515 -8.465 5.943 1.00 1.35 O ATOM 612 OP2 DG A 20 1.328 -7.578 3.852 1.00 1.29 O ATOM 613 O5' DG A 20 3.532 -6.628 4.563 1.00 0.87 O ATOM 614 C5' DG A 20 4.549 -6.476 5.560 1.00 0.84 C ATOM 615 C4' DG A 20 4.239 -5.334 6.528 1.00 0.65 C ATOM 616 O4' DG A 20 4.808 -4.121 6.033 1.00 0.63 O ATOM 617 C3' DG A 20 2.751 -5.080 6.747 1.00 0.62 C ATOM 618 O3' DG A 20 2.527 -4.688 8.109 1.00 0.65 O ATOM 619 C2' DG A 20 2.430 -3.930 5.805 1.00 0.65 C ATOM 620 C1' DG A 20 3.765 -3.201 5.693 1.00 0.61 C ATOM 621 N9 DG A 20 4.050 -2.705 4.339 1.00 0.59 N ATOM 622 C8 DG A 20 3.981 -3.381 3.150 1.00 0.69 C ATOM 623 N7 DG A 20 4.288 -2.656 2.110 1.00 0.69 N ATOM 624 C5 DG A 20 4.584 -1.408 2.654 1.00 0.59 C ATOM 625 C6 DG A 20 4.987 -0.208 2.012 1.00 0.58 C ATOM 626 O6 DG A 20 5.168 -0.006 0.814 1.00 0.66 O ATOM 627 N1 DG A 20 5.183 0.813 2.926 1.00 0.54 N ATOM 628 C2 DG A 20 5.019 0.701 4.285 1.00 0.52 C ATOM 629 N2 DG A 20 5.264 1.794 5.001 1.00 0.56 N ATOM 630 N3 DG A 20 4.640 -0.421 4.893 1.00 0.51 N ATOM 631 C4 DG A 20 4.441 -1.432 4.017 1.00 0.53 C ATOM 0 H5' DG A 20 5.507 -6.289 5.075 1.00 0.84 H new ATOM 0 H5'' DG A 20 4.651 -7.407 6.118 1.00 0.84 H new ATOM 0 H4' DG A 20 4.666 -5.641 7.483 1.00 0.65 H new ATOM 0 H3' DG A 20 2.132 -5.957 6.558 1.00 0.62 H new ATOM 0 H2' DG A 20 2.081 -4.287 4.836 1.00 0.65 H new ATOM 0 H2'' DG A 20 1.649 -3.284 6.207 1.00 0.65 H new ATOM 0 H1' DG A 20 3.713 -2.342 6.362 1.00 0.61 H new ATOM 0 H8 DG A 20 3.698 -4.421 3.080 1.00 0.69 H new ATOM 0 H1 DG A 20 5.472 1.721 2.561 1.00 0.54 H new ATOM 0 H21 DG A 20 5.160 1.773 6.015 1.00 0.56 H new ATOM 0 H22 DG A 20 5.556 2.653 4.536 1.00 0.56 H new ATOM 643 P DG A 21 1.116 -4.065 8.580 1.00 0.63 P ATOM 644 OP1 DG A 21 0.819 -4.547 9.948 1.00 0.95 O ATOM 645 OP2 DG A 21 0.124 -4.271 7.499 1.00 0.91 O ATOM 646 O5' DG A 21 1.447 -2.492 8.669 1.00 0.61 O ATOM 647 C5' DG A 21 0.400 -1.534 8.849 1.00 0.69 C ATOM 648 C4' DG A 21 0.947 -0.148 9.185 1.00 0.56 C ATOM 649 O4' DG A 21 1.802 0.305 8.125 1.00 0.53 O ATOM 650 C3' DG A 21 -0.143 0.908 9.372 1.00 0.59 C ATOM 651 O3' DG A 21 0.159 1.724 10.511 1.00 0.70 O ATOM 652 C2' DG A 21 -0.075 1.741 8.102 1.00 0.53 C ATOM 653 C1' DG A 21 1.391 1.615 7.727 1.00 0.47 C ATOM 654 N9 DG A 21 1.652 1.754 6.281 1.00 0.46 N ATOM 655 C8 DG A 21 2.279 2.772 5.614 1.00 0.48 C ATOM 656 N7 DG A 21 2.334 2.602 4.320 1.00 0.48 N ATOM 657 C5 DG A 21 1.699 1.380 4.118 1.00 0.47 C ATOM 658 C6 DG A 21 1.455 0.666 2.912 1.00 0.48 C ATOM 659 O6 DG A 21 1.746 0.987 1.762 1.00 0.53 O ATOM 660 N1 DG A 21 0.789 -0.528 3.154 1.00 0.48 N ATOM 661 C2 DG A 21 0.403 -0.977 4.398 1.00 0.46 C ATOM 662 N2 DG A 21 -0.224 -2.146 4.439 1.00 0.48 N ATOM 663 N3 DG A 21 0.628 -0.307 5.528 1.00 0.46 N ATOM 664 C4 DG A 21 1.279 0.856 5.313 1.00 0.45 C ATOM 0 H5' DG A 21 -0.262 -1.866 9.648 1.00 0.69 H new ATOM 0 H5'' DG A 21 -0.200 -1.477 7.941 1.00 0.69 H new ATOM 0 H4' DG A 21 1.483 -0.259 10.128 1.00 0.56 H new ATOM 0 H3' DG A 21 -1.129 0.474 9.538 1.00 0.59 H new ATOM 0 H2' DG A 21 -0.731 1.353 7.323 1.00 0.53 H new ATOM 0 H2'' DG A 21 -0.365 2.777 8.276 1.00 0.53 H new ATOM 0 H1' DG A 21 1.936 2.419 8.221 1.00 0.47 H new ATOM 0 H8 DG A 21 2.691 3.637 6.112 1.00 0.48 H new ATOM 0 H1 DG A 21 0.569 -1.117 2.351 1.00 0.48 H new ATOM 0 H21 DG A 21 -0.533 -2.528 5.333 1.00 0.48 H new ATOM 0 H22 DG A 21 -0.397 -2.662 3.577 1.00 0.48 H new ATOM 676 P DG A 22 -0.948 2.736 11.106 1.00 0.86 P ATOM 677 OP1 DG A 22 -0.554 3.107 12.485 1.00 1.06 O ATOM 678 OP2 DG A 22 -2.287 2.162 10.847 1.00 1.10 O ATOM 679 O5' DG A 22 -0.773 4.033 10.169 1.00 0.95 O ATOM 680 C5' DG A 22 0.440 4.796 10.193 1.00 0.85 C ATOM 681 C4' DG A 22 0.381 5.965 9.216 1.00 0.80 C ATOM 682 O4' DG A 22 0.326 5.465 7.871 1.00 0.79 O ATOM 683 C3' DG A 22 -0.840 6.866 9.409 1.00 0.83 C ATOM 684 O3' DG A 22 -0.509 8.243 9.188 1.00 1.07 O ATOM 685 C2' DG A 22 -1.804 6.355 8.354 1.00 0.79 C ATOM 686 C1' DG A 22 -0.836 6.002 7.239 1.00 0.76 C ATOM 687 N9 DG A 22 -1.335 4.995 6.285 1.00 0.64 N ATOM 688 C8 DG A 22 -2.060 3.857 6.529 1.00 0.61 C ATOM 689 N7 DG A 22 -2.324 3.158 5.458 1.00 0.56 N ATOM 690 C5 DG A 22 -1.733 3.890 4.432 1.00 0.52 C ATOM 691 C6 DG A 22 -1.688 3.631 3.036 1.00 0.51 C ATOM 692 O6 DG A 22 -2.160 2.679 2.419 1.00 0.59 O ATOM 693 N1 DG A 22 -0.995 4.622 2.359 1.00 0.52 N ATOM 694 C2 DG A 22 -0.414 5.724 2.943 1.00 0.57 C ATOM 695 N2 DG A 22 0.211 6.563 2.126 1.00 0.64 N ATOM 696 N3 DG A 22 -0.453 5.971 4.252 1.00 0.62 N ATOM 697 C4 DG A 22 -1.127 5.014 4.931 1.00 0.57 C ATOM 0 H5' DG A 22 1.282 4.151 9.941 1.00 0.85 H new ATOM 0 H5'' DG A 22 0.616 5.171 11.201 1.00 0.85 H new ATOM 0 H4' DG A 22 1.277 6.556 9.407 1.00 0.80 H new ATOM 0 H3' DG A 22 -1.248 6.830 10.419 1.00 0.83 H new ATOM 0 H2' DG A 22 -2.373 5.491 8.697 1.00 0.79 H new ATOM 0 H2'' DG A 22 -2.526 7.113 8.051 1.00 0.79 H new ATOM 0 HO3' DG A 22 -1.308 8.796 9.316 1.00 1.07 H new ATOM 0 H1' DG A 22 -0.658 6.907 6.659 1.00 0.76 H new ATOM 0 H8 DG A 22 -2.383 3.565 7.517 1.00 0.61 H new ATOM 0 H1 DG A 22 -0.909 4.527 1.347 1.00 0.52 H new ATOM 0 H21 DG A 22 0.661 7.398 2.500 1.00 0.64 H new ATOM 0 H22 DG A 22 0.241 6.372 1.124 1.00 0.64 H new TER 710 DG A 22