USER MOD reduce.3.24.130724 H: found=0, std=0, add=183, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 183 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 U O2' : rot 3:sc= -5.01! USER MOD Single : A 1 U O5' : rot 180:sc= -0.268 USER MOD Single : A 2 G O2' : rot -136:sc= 0.333 USER MOD Single : A 3 A O2' : rot -20:sc= 0.0166 USER MOD Single : A 4 G O2' : rot 180:sc= -0.999 USER MOD Single : A 5 C O2' : rot 180:sc= -0.147 USER MOD Single : A 6 U O2' : rot -149:sc= -1.99! USER MOD Single : A 7 C O2' : rot -165:sc= 0.739 USER MOD Single : A 8 A O2' : rot -15:sc= 0.0872 USER MOD Single : A 9 G O2' : rot -28:sc= 0.147 USER MOD Single : A 10 U O2' : rot 180:sc= -0.317 USER MOD Single : A 11 U O2' : rot -144:sc= -1.38! USER MOD Single : A 12 U O2' : rot -77:sc= 0.315 USER MOD Single : A 13 G O2' : rot 180:sc= -1.9! USER MOD Single : A 14 C O2' : rot -123:sc= 0.673 USER MOD Single : A 15 U O2' : rot -150:sc= -2.17! USER MOD Single : A 16 C O2' : rot -130:sc= 1.08 USER MOD Single : A 17 A O2' : rot -23:sc= 0.127 USER MOD Single : A 17 A O3' : rot 180:sc= 0.13 USER MOD ----------------------------------------------------------------- ATOM 1 O5' U A 1 14.557 28.686 16.932 1.00 0.36 O ATOM 2 C5' U A 1 13.932 29.823 17.526 1.00 0.33 C ATOM 3 C4' U A 1 13.794 29.697 19.034 1.00 0.26 C ATOM 4 O4' U A 1 12.679 28.885 19.381 1.00 0.30 O ATOM 5 C3' U A 1 15.037 29.054 19.628 1.00 0.25 C ATOM 6 O3' U A 1 16.047 30.021 19.966 1.00 0.28 O ATOM 7 C2' U A 1 14.476 28.391 20.886 1.00 0.31 C ATOM 8 O2' U A 1 14.465 29.298 22.016 1.00 0.45 O ATOM 9 C1' U A 1 13.052 28.044 20.475 1.00 0.29 C ATOM 10 N1 U A 1 12.918 26.611 20.121 1.00 0.30 N ATOM 11 C2 U A 1 12.796 25.705 21.173 1.00 0.36 C ATOM 12 O2 U A 1 12.838 26.063 22.349 1.00 0.56 O ATOM 13 N3 U A 1 12.641 24.382 20.825 1.00 0.37 N ATOM 14 C4 U A 1 12.597 23.875 19.537 1.00 0.43 C ATOM 15 O4 U A 1 12.450 22.665 19.351 1.00 0.52 O ATOM 16 C5 U A 1 12.740 24.882 18.496 1.00 0.55 C ATOM 17 C6 U A 1 12.894 26.195 18.813 1.00 0.46 C ATOM 0 H5' U A 1 12.945 29.961 17.085 1.00 0.33 H new ATOM 0 H5'' U A 1 14.513 30.715 17.292 1.00 0.33 H new ATOM 0 H4' U A 1 13.656 30.703 19.429 1.00 0.26 H new ATOM 0 H3' U A 1 15.535 28.371 18.939 1.00 0.25 H new ATOM 0 H2' U A 1 15.069 27.535 21.208 1.00 0.31 H new ATOM 0 HO2' U A 1 14.786 30.179 21.731 1.00 0.45 H new ATOM 0 HO5' U A 1 14.620 28.816 15.963 1.00 0.36 H new ATOM 0 H1' U A 1 12.382 28.217 21.317 1.00 0.29 H new ATOM 0 H3 U A 1 12.550 23.712 21.588 1.00 0.37 H new ATOM 0 H5 U A 1 12.724 24.582 17.459 1.00 0.55 H new ATOM 0 H6 U A 1 12.999 26.923 18.022 1.00 0.46 H new ATOM 29 P G A 2 17.597 29.591 20.041 1.00 0.30 P ATOM 30 OP1 G A 2 18.376 30.716 20.595 1.00 0.39 O ATOM 31 OP2 G A 2 17.976 29.015 18.740 1.00 0.39 O ATOM 32 O5' G A 2 17.558 28.412 21.154 1.00 0.27 O ATOM 33 C5' G A 2 17.077 28.691 22.466 1.00 0.24 C ATOM 34 C4' G A 2 17.023 27.450 23.340 1.00 0.22 C ATOM 35 O4' G A 2 16.212 26.430 22.756 1.00 0.25 O ATOM 36 C3' G A 2 18.416 26.878 23.560 1.00 0.23 C ATOM 37 O3' G A 2 19.079 27.514 24.675 1.00 0.22 O ATOM 38 C2' G A 2 18.100 25.413 23.831 1.00 0.30 C ATOM 39 O2' G A 2 17.818 25.169 25.223 1.00 0.37 O ATOM 40 C1' G A 2 16.875 25.182 22.960 1.00 0.28 C ATOM 41 N9 G A 2 17.266 24.564 21.680 1.00 0.28 N ATOM 42 C8 G A 2 17.345 25.130 20.444 1.00 0.32 C ATOM 43 N7 G A 2 17.779 24.340 19.509 1.00 0.34 N ATOM 44 C5 G A 2 18.016 23.145 20.182 1.00 0.30 C ATOM 45 C6 G A 2 18.505 21.905 19.686 1.00 0.34 C ATOM 46 O6 G A 2 18.823 21.611 18.535 1.00 0.40 O ATOM 47 N1 G A 2 18.597 20.956 20.694 1.00 0.37 N ATOM 48 C2 G A 2 18.259 21.173 22.010 1.00 0.36 C ATOM 49 N2 G A 2 18.427 20.149 22.834 1.00 0.45 N ATOM 50 N3 G A 2 17.795 22.331 22.481 1.00 0.31 N ATOM 51 C4 G A 2 17.703 23.268 21.516 1.00 0.28 C ATOM 0 H5' G A 2 16.081 29.128 22.399 1.00 0.24 H new ATOM 0 H5'' G A 2 17.721 29.435 22.935 1.00 0.24 H new ATOM 0 H4' G A 2 16.589 27.759 24.291 1.00 0.22 H new ATOM 0 H3' G A 2 19.103 27.029 22.727 1.00 0.23 H new ATOM 0 H2' G A 2 18.930 24.743 23.606 1.00 0.30 H new ATOM 0 HO2' G A 2 18.275 24.352 25.511 1.00 0.37 H new ATOM 0 H1' G A 2 16.189 24.496 23.456 1.00 0.28 H new ATOM 0 H8 G A 2 17.068 26.157 20.256 1.00 0.32 H new ATOM 0 H1 G A 2 18.940 20.029 20.441 1.00 0.37 H new ATOM 0 H21 G A 2 18.195 20.246 23.822 1.00 0.45 H new ATOM 0 H22 G A 2 18.789 19.263 22.480 1.00 0.45 H new ATOM 63 P A A 3 20.702 27.529 24.799 1.00 0.24 P ATOM 64 OP1 A A 3 21.112 28.777 25.482 1.00 0.35 O ATOM 65 OP2 A A 3 21.272 27.218 23.478 1.00 0.30 O ATOM 66 O5' A A 3 20.991 26.295 25.779 1.00 0.24 O ATOM 67 C5' A A 3 20.167 26.043 26.910 1.00 0.22 C ATOM 68 C4' A A 3 20.243 24.592 27.361 1.00 0.20 C ATOM 69 O4' A A 3 19.438 23.757 26.510 1.00 0.22 O ATOM 70 C3' A A 3 21.665 24.037 27.299 1.00 0.20 C ATOM 71 O3' A A 3 22.476 24.430 28.409 1.00 0.22 O ATOM 72 C2' A A 3 21.320 22.542 27.328 1.00 0.22 C ATOM 73 O2' A A 3 20.868 22.125 28.632 1.00 0.29 O ATOM 74 C1' A A 3 20.181 22.528 26.307 1.00 0.21 C ATOM 75 N9 A A 3 20.693 22.440 24.932 1.00 0.22 N ATOM 76 C8 A A 3 20.978 23.450 24.049 1.00 0.21 C ATOM 77 N7 A A 3 21.405 23.038 22.879 1.00 0.23 N ATOM 78 C5 A A 3 21.422 21.631 23.020 1.00 0.25 C ATOM 79 C6 A A 3 21.776 20.602 22.143 1.00 0.30 C ATOM 80 N6 A A 3 22.216 20.828 20.912 1.00 0.33 N ATOM 81 N1 A A 3 21.655 19.323 22.584 1.00 0.34 N ATOM 82 C2 A A 3 21.236 19.076 23.834 1.00 0.32 C ATOM 83 N3 A A 3 20.855 19.994 24.729 1.00 0.29 N ATOM 84 C4 A A 3 20.984 21.269 24.262 1.00 0.25 C ATOM 0 H5' A A 3 19.134 26.294 26.669 1.00 0.22 H new ATOM 0 H5'' A A 3 20.469 26.694 27.731 1.00 0.22 H new ATOM 0 H4' A A 3 19.887 24.581 28.391 1.00 0.20 H new ATOM 0 H3' A A 3 22.261 24.377 26.452 1.00 0.20 H new ATOM 0 H2' A A 3 22.150 21.869 27.111 1.00 0.22 H new ATOM 0 HO2' A A 3 21.168 22.772 29.304 1.00 0.29 H new ATOM 0 H1' A A 3 19.544 21.654 26.447 1.00 0.21 H new ATOM 0 H8 A A 3 20.861 24.495 24.296 1.00 0.21 H new ATOM 0 H61 A A 3 22.463 20.045 20.307 1.00 0.33 H new ATOM 0 H62 A A 3 22.307 21.785 20.571 1.00 0.33 H new ATOM 0 H2 A A 3 21.203 18.043 24.146 1.00 0.32 H new ATOM 96 P G A 4 24.077 24.486 28.173 1.00 0.22 P ATOM 97 OP1 G A 4 24.721 24.929 29.424 1.00 0.30 O ATOM 98 OP2 G A 4 24.331 25.236 26.926 1.00 0.27 O ATOM 99 O5' G A 4 24.440 22.925 27.916 1.00 0.20 O ATOM 100 C5' G A 4 24.173 21.964 28.941 1.00 0.23 C ATOM 101 C4' G A 4 24.010 20.529 28.413 1.00 0.21 C ATOM 102 O4' G A 4 23.171 20.483 27.250 1.00 0.21 O ATOM 103 C3' G A 4 25.341 19.922 28.010 1.00 0.19 C ATOM 104 O3' G A 4 26.053 19.366 29.124 1.00 0.22 O ATOM 105 C2' G A 4 24.882 18.848 27.042 1.00 0.20 C ATOM 106 O2' G A 4 24.396 17.690 27.748 1.00 0.24 O ATOM 107 C1' G A 4 23.773 19.584 26.315 1.00 0.19 C ATOM 108 N9 G A 4 24.308 20.319 25.161 1.00 0.17 N ATOM 109 C8 G A 4 24.465 21.659 25.021 1.00 0.20 C ATOM 110 N7 G A 4 24.954 22.037 23.881 1.00 0.23 N ATOM 111 C5 G A 4 25.173 20.838 23.214 1.00 0.19 C ATOM 112 C6 G A 4 25.701 20.610 21.919 1.00 0.22 C ATOM 113 O6 G A 4 26.098 21.431 21.105 1.00 0.29 O ATOM 114 N1 G A 4 25.755 19.258 21.620 1.00 0.21 N ATOM 115 C2 G A 4 25.341 18.245 22.462 1.00 0.20 C ATOM 116 N2 G A 4 25.472 17.003 22.008 1.00 0.25 N ATOM 117 N3 G A 4 24.828 18.459 23.678 1.00 0.19 N ATOM 118 C4 G A 4 24.778 19.769 23.988 1.00 0.16 C ATOM 0 H5' G A 4 23.265 22.253 29.470 1.00 0.23 H new ATOM 0 H5'' G A 4 24.986 21.985 29.667 1.00 0.23 H new ATOM 0 H4' G A 4 23.564 19.968 29.234 1.00 0.21 H new ATOM 0 H3' G A 4 26.047 20.640 27.593 1.00 0.19 H new ATOM 0 H2' G A 4 25.657 18.454 26.385 1.00 0.20 H new ATOM 0 HO2' G A 4 24.104 17.012 27.103 1.00 0.24 H new ATOM 0 H1' G A 4 23.034 18.879 25.934 1.00 0.19 H new ATOM 0 H8 G A 4 24.202 22.359 25.801 1.00 0.20 H new ATOM 0 H1 G A 4 26.129 18.991 20.709 1.00 0.21 H new ATOM 0 H21 G A 4 25.182 16.215 22.587 1.00 0.25 H new ATOM 0 H22 G A 4 25.862 16.838 21.080 1.00 0.25 H new ATOM 130 P C A 5 27.654 19.410 29.126 1.00 0.23 P ATOM 131 OP1 C A 5 28.146 18.930 30.432 1.00 0.31 O ATOM 132 OP2 C A 5 28.076 20.744 28.649 1.00 0.27 O ATOM 133 O5' C A 5 28.036 18.324 28.002 1.00 0.21 O ATOM 134 C5' C A 5 27.546 16.990 28.092 1.00 0.20 C ATOM 135 C4' C A 5 27.935 16.186 26.864 1.00 0.21 C ATOM 136 O4' C A 5 27.218 16.661 25.727 1.00 0.23 O ATOM 137 C3' C A 5 29.416 16.331 26.586 1.00 0.23 C ATOM 138 O3' C A 5 30.191 15.354 27.309 1.00 0.31 O ATOM 139 C2' C A 5 29.470 16.132 25.067 1.00 0.23 C ATOM 140 O2' C A 5 29.665 14.754 24.726 1.00 0.31 O ATOM 141 C1' C A 5 28.097 16.630 24.605 1.00 0.22 C ATOM 142 N1 C A 5 28.204 17.961 23.958 1.00 0.22 N ATOM 143 C2 C A 5 28.437 17.991 22.593 1.00 0.26 C ATOM 144 O2 C A 5 28.515 16.946 21.955 1.00 0.30 O ATOM 145 N3 C A 5 28.571 19.204 21.984 1.00 0.29 N ATOM 146 C4 C A 5 28.472 20.340 22.685 1.00 0.29 C ATOM 147 N4 C A 5 28.596 21.510 22.061 1.00 0.36 N ATOM 148 C5 C A 5 28.230 20.313 24.096 1.00 0.26 C ATOM 149 C6 C A 5 28.101 19.116 24.683 1.00 0.23 C ATOM 0 H5' C A 5 26.461 17.003 28.194 1.00 0.20 H new ATOM 0 H5'' C A 5 27.945 16.511 28.986 1.00 0.20 H new ATOM 0 H4' C A 5 27.696 15.139 27.052 1.00 0.21 H new ATOM 0 H3' C A 5 29.842 17.281 26.908 1.00 0.23 H new ATOM 0 H2' C A 5 30.299 16.660 24.596 1.00 0.23 H new ATOM 0 HO2' C A 5 29.694 14.659 23.751 1.00 0.31 H new ATOM 0 H1' C A 5 27.693 15.949 23.856 1.00 0.22 H new ATOM 0 H41 C A 5 28.522 22.380 22.589 1.00 0.36 H new ATOM 0 H42 C A 5 28.765 21.536 21.055 1.00 0.36 H new ATOM 0 H5 C A 5 28.154 21.226 24.667 1.00 0.26 H new ATOM 0 H6 C A 5 27.913 19.062 25.745 1.00 0.23 H new ATOM 161 P U A 6 31.806 15.418 27.311 1.00 0.39 P ATOM 162 OP1 U A 6 32.322 14.542 28.381 1.00 0.53 O ATOM 163 OP2 U A 6 32.225 16.835 27.272 1.00 0.42 O ATOM 164 O5' U A 6 32.165 14.746 25.896 1.00 0.39 O ATOM 165 C5' U A 6 32.133 13.325 25.750 1.00 0.41 C ATOM 166 C4' U A 6 32.860 12.874 24.495 1.00 0.34 C ATOM 167 O4' U A 6 32.244 13.415 23.332 1.00 0.33 O ATOM 168 C3' U A 6 34.293 13.361 24.525 1.00 0.28 C ATOM 169 O3' U A 6 35.157 12.449 25.228 1.00 0.31 O ATOM 170 C2' U A 6 34.619 13.435 23.035 1.00 0.29 C ATOM 171 O2' U A 6 35.047 12.160 22.543 1.00 0.40 O ATOM 172 C1' U A 6 33.276 13.840 22.435 1.00 0.28 C ATOM 173 N1 U A 6 33.219 15.304 22.210 1.00 0.26 N ATOM 174 C2 U A 6 33.653 15.774 20.981 1.00 0.31 C ATOM 175 O2 U A 6 34.099 15.018 20.109 1.00 0.39 O ATOM 176 N3 U A 6 33.576 17.139 20.795 1.00 0.37 N ATOM 177 C4 U A 6 33.115 18.059 21.710 1.00 0.39 C ATOM 178 O4 U A 6 33.073 19.248 21.417 1.00 0.51 O ATOM 179 C5 U A 6 32.685 17.486 22.966 1.00 0.36 C ATOM 180 C6 U A 6 32.749 16.150 23.173 1.00 0.30 C ATOM 0 H5' U A 6 31.098 12.986 25.713 1.00 0.41 H new ATOM 0 H5'' U A 6 32.590 12.859 26.623 1.00 0.41 H new ATOM 0 H4' U A 6 32.822 11.785 24.464 1.00 0.34 H new ATOM 0 H3' U A 6 34.431 14.305 25.053 1.00 0.28 H new ATOM 0 H2' U A 6 35.430 14.122 22.791 1.00 0.29 H new ATOM 0 HO2' U A 6 35.685 12.289 21.811 1.00 0.40 H new ATOM 0 H1' U A 6 33.141 13.364 21.464 1.00 0.28 H new ATOM 0 H3 U A 6 33.890 17.501 19.895 1.00 0.37 H new ATOM 0 H5 U A 6 32.309 18.131 23.747 1.00 0.36 H new ATOM 0 H6 U A 6 32.422 15.745 24.119 1.00 0.30 H new ATOM 191 P C A 7 36.418 13.022 26.071 1.00 0.33 P ATOM 192 OP1 C A 7 37.200 11.869 26.550 1.00 0.42 O ATOM 193 OP2 C A 7 35.923 14.029 27.035 1.00 0.36 O ATOM 194 O5' C A 7 37.258 13.767 24.915 1.00 0.34 O ATOM 195 C5' C A 7 37.713 13.058 23.760 1.00 0.34 C ATOM 196 C4' C A 7 38.261 13.994 22.716 1.00 0.31 C ATOM 197 O4' C A 7 37.276 14.926 22.299 1.00 0.33 O ATOM 198 C3' C A 7 39.415 14.766 23.314 1.00 0.30 C ATOM 199 O3' C A 7 40.648 14.068 23.156 1.00 0.32 O ATOM 200 C2' C A 7 39.378 16.078 22.548 1.00 0.32 C ATOM 201 O2' C A 7 40.198 16.024 21.377 1.00 0.39 O ATOM 202 C1' C A 7 37.900 16.207 22.187 1.00 0.31 C ATOM 203 N1 C A 7 37.235 17.219 23.045 1.00 0.30 N ATOM 204 C2 C A 7 37.446 18.556 22.730 1.00 0.34 C ATOM 205 O2 C A 7 38.126 18.857 21.753 1.00 0.40 O ATOM 206 N3 C A 7 36.857 19.511 23.499 1.00 0.36 N ATOM 207 C4 C A 7 36.084 19.171 24.533 1.00 0.34 C ATOM 208 N4 C A 7 35.506 20.127 25.257 1.00 0.41 N ATOM 209 C5 C A 7 35.861 17.791 24.867 1.00 0.32 C ATOM 210 C6 C A 7 36.453 16.855 24.101 1.00 0.31 C ATOM 0 H5' C A 7 36.889 12.483 23.337 1.00 0.34 H new ATOM 0 H5'' C A 7 38.484 12.344 24.051 1.00 0.34 H new ATOM 0 H4' C A 7 38.580 13.404 21.857 1.00 0.31 H new ATOM 0 H3' C A 7 39.333 14.912 24.391 1.00 0.30 H new ATOM 0 H2' C A 7 39.762 16.924 23.119 1.00 0.32 H new ATOM 0 HO2' C A 7 40.351 16.932 21.043 1.00 0.39 H new ATOM 0 H1' C A 7 37.804 16.552 21.157 1.00 0.31 H new ATOM 0 H41 C A 7 34.913 19.879 26.049 1.00 0.41 H new ATOM 0 H42 C A 7 35.656 21.108 25.019 1.00 0.41 H new ATOM 0 H5 C A 7 35.239 17.514 25.705 1.00 0.32 H new ATOM 0 H6 C A 7 36.307 15.809 24.325 1.00 0.31 H new ATOM 222 P A A 8 41.509 13.675 24.465 1.00 0.29 P ATOM 223 OP1 A A 8 42.543 12.702 24.072 1.00 0.45 O ATOM 224 OP2 A A 8 40.569 13.335 25.562 1.00 0.41 O ATOM 225 O5' A A 8 42.217 15.075 24.818 1.00 0.40 O ATOM 226 C5' A A 8 42.469 15.452 26.170 1.00 0.27 C ATOM 227 C4' A A 8 43.048 16.858 26.246 1.00 0.26 C ATOM 228 O4' A A 8 44.237 16.963 25.457 1.00 0.29 O ATOM 229 C3' A A 8 42.050 17.882 25.727 1.00 0.24 C ATOM 230 O3' A A 8 41.210 18.396 26.774 1.00 0.26 O ATOM 231 C2' A A 8 43.000 18.961 25.197 1.00 0.25 C ATOM 232 O2' A A 8 43.447 19.825 26.275 1.00 0.29 O ATOM 233 C1' A A 8 44.126 18.115 24.628 1.00 0.26 C ATOM 234 N9 A A 8 43.833 17.737 23.234 1.00 0.28 N ATOM 235 C8 A A 8 43.387 16.554 22.735 1.00 0.32 C ATOM 236 N7 A A 8 43.230 16.543 21.443 1.00 0.34 N ATOM 237 C5 A A 8 43.596 17.832 21.055 1.00 0.30 C ATOM 238 C6 A A 8 43.663 18.493 19.810 1.00 0.33 C ATOM 239 N6 A A 8 43.335 17.906 18.667 1.00 0.39 N ATOM 240 N1 A A 8 44.085 19.757 19.802 1.00 0.32 N ATOM 241 C2 A A 8 44.429 20.363 20.936 1.00 0.29 C ATOM 242 N3 A A 8 44.410 19.841 22.159 1.00 0.26 N ATOM 243 C4 A A 8 43.977 18.560 22.151 1.00 0.27 C ATOM 0 H5' A A 8 43.162 14.744 26.625 1.00 0.27 H new ATOM 0 H5'' A A 8 41.543 15.405 26.743 1.00 0.27 H new ATOM 0 H4' A A 8 43.276 17.055 27.294 1.00 0.26 H new ATOM 0 H3' A A 8 41.348 17.488 24.992 1.00 0.24 H new ATOM 0 H2' A A 8 42.561 19.642 24.467 1.00 0.25 H new ATOM 0 HO2' A A 8 42.872 19.695 27.058 1.00 0.29 H new ATOM 0 H1' A A 8 45.065 18.669 24.616 1.00 0.26 H new ATOM 0 H8 A A 8 43.180 15.696 23.358 1.00 0.32 H new ATOM 0 H61 A A 8 43.399 18.424 17.791 1.00 0.39 H new ATOM 0 H62 A A 8 43.018 16.936 18.664 1.00 0.39 H new ATOM 0 H2 A A 8 44.759 21.388 20.854 1.00 0.29 H new ATOM 255 P G A 9 39.653 18.757 26.487 1.00 0.28 P ATOM 256 OP1 G A 9 39.043 19.181 27.764 1.00 0.38 O ATOM 257 OP2 G A 9 39.055 17.640 25.740 1.00 0.32 O ATOM 258 O5' G A 9 39.769 20.043 25.506 1.00 0.26 O ATOM 259 C5' G A 9 40.432 21.231 25.955 1.00 0.31 C ATOM 260 C4' G A 9 41.018 22.048 24.813 1.00 0.25 C ATOM 261 O4' G A 9 41.822 21.246 23.948 1.00 0.25 O ATOM 262 C3' G A 9 39.931 22.638 23.944 1.00 0.24 C ATOM 263 O3' G A 9 39.332 23.810 24.522 1.00 0.26 O ATOM 264 C2' G A 9 40.752 22.993 22.707 1.00 0.26 C ATOM 265 O2' G A 9 41.442 24.253 22.886 1.00 0.31 O ATOM 266 C1' G A 9 41.742 21.823 22.652 1.00 0.23 C ATOM 267 N9 G A 9 41.341 20.830 21.641 1.00 0.25 N ATOM 268 C8 G A 9 40.725 19.633 21.797 1.00 0.27 C ATOM 269 N7 G A 9 40.480 18.989 20.692 1.00 0.30 N ATOM 270 C5 G A 9 41.017 19.823 19.721 1.00 0.29 C ATOM 271 C6 G A 9 41.041 19.657 18.293 1.00 0.33 C ATOM 272 O6 G A 9 40.625 18.706 17.629 1.00 0.39 O ATOM 273 N1 G A 9 41.645 20.729 17.663 1.00 0.35 N ATOM 274 C2 G A 9 42.145 21.846 18.320 1.00 0.35 C ATOM 275 N2 G A 9 42.697 22.769 17.541 1.00 0.42 N ATOM 276 N3 G A 9 42.132 22.004 19.644 1.00 0.31 N ATOM 277 C4 G A 9 41.546 20.957 20.280 1.00 0.27 C ATOM 0 H5' G A 9 41.229 20.957 26.646 1.00 0.31 H new ATOM 0 H5'' G A 9 39.726 21.847 26.511 1.00 0.31 H new ATOM 0 H4' G A 9 41.614 22.828 25.287 1.00 0.25 H new ATOM 0 H3' G A 9 39.083 21.974 23.776 1.00 0.24 H new ATOM 0 H2' G A 9 40.162 23.119 21.800 1.00 0.26 H new ATOM 0 HO2' G A 9 40.938 24.816 23.510 1.00 0.31 H new ATOM 0 H1' G A 9 42.726 22.185 22.353 1.00 0.23 H new ATOM 0 H8 G A 9 40.457 19.242 22.767 1.00 0.27 H new ATOM 0 H1 G A 9 41.729 20.698 16.647 1.00 0.35 H new ATOM 0 H21 G A 9 43.086 23.617 17.952 1.00 0.42 H new ATOM 0 H22 G A 9 42.732 22.629 16.531 1.00 0.42 H new ATOM 289 P U A 10 37.730 23.892 24.717 1.00 0.22 P ATOM 290 OP1 U A 10 37.392 25.237 25.238 1.00 0.24 O ATOM 291 OP2 U A 10 37.294 22.700 25.470 1.00 0.30 O ATOM 292 O5' U A 10 37.180 23.754 23.199 1.00 0.22 O ATOM 293 C5' U A 10 37.702 24.567 22.137 1.00 0.23 C ATOM 294 C4' U A 10 36.834 25.794 21.858 1.00 0.22 C ATOM 295 O4' U A 10 36.681 26.570 23.036 1.00 0.25 O ATOM 296 C3' U A 10 37.456 26.679 20.785 1.00 0.21 C ATOM 297 O3' U A 10 37.067 26.281 19.459 1.00 0.24 O ATOM 298 C2' U A 10 36.877 28.042 21.156 1.00 0.24 C ATOM 299 O2' U A 10 35.600 28.261 20.521 1.00 0.30 O ATOM 300 C1' U A 10 36.727 27.944 22.671 1.00 0.23 C ATOM 301 N1 U A 10 37.836 28.643 23.357 1.00 0.26 N ATOM 302 C2 U A 10 37.587 29.926 23.820 1.00 0.30 C ATOM 303 O2 U A 10 36.478 30.458 23.728 1.00 0.40 O ATOM 304 N3 U A 10 38.645 30.569 24.415 1.00 0.32 N ATOM 305 C4 U A 10 39.921 30.057 24.596 1.00 0.32 C ATOM 306 O4 U A 10 40.798 30.740 25.133 1.00 0.39 O ATOM 307 C5 U A 10 40.093 28.712 24.093 1.00 0.36 C ATOM 308 C6 U A 10 39.066 28.058 23.501 1.00 0.32 C ATOM 0 H5' U A 10 37.780 23.968 21.230 1.00 0.23 H new ATOM 0 H5'' U A 10 38.711 24.890 22.394 1.00 0.23 H new ATOM 0 H4' U A 10 35.865 25.431 21.514 1.00 0.22 H new ATOM 0 H3' U A 10 38.545 26.643 20.759 1.00 0.21 H new ATOM 0 H2' U A 10 37.502 28.875 20.835 1.00 0.24 H new ATOM 0 HO2' U A 10 35.254 29.141 20.778 1.00 0.30 H new ATOM 0 H1' U A 10 35.802 28.431 22.980 1.00 0.23 H new ATOM 0 H3 U A 10 38.476 31.515 24.757 1.00 0.32 H new ATOM 0 H5 U A 10 41.051 28.224 24.191 1.00 0.36 H new ATOM 0 H6 U A 10 39.220 27.054 23.135 1.00 0.32 H new ATOM 319 P U A 11 37.276 27.296 18.209 1.00 0.21 P ATOM 320 OP1 U A 11 38.372 28.229 18.531 1.00 0.28 O ATOM 321 OP2 U A 11 35.952 27.847 17.844 1.00 0.34 O ATOM 322 O5' U A 11 37.764 26.325 17.022 1.00 0.26 O ATOM 323 C5' U A 11 38.731 26.782 16.073 1.00 0.24 C ATOM 324 C4' U A 11 39.028 25.716 15.022 1.00 0.21 C ATOM 325 O4' U A 11 39.833 24.691 15.587 1.00 0.21 O ATOM 326 C3' U A 11 37.734 25.095 14.490 1.00 0.20 C ATOM 327 O3' U A 11 37.791 24.865 13.080 1.00 0.23 O ATOM 328 C2' U A 11 37.628 23.757 15.262 1.00 0.20 C ATOM 329 O2' U A 11 37.214 22.700 14.391 1.00 0.24 O ATOM 330 C1' U A 11 39.057 23.513 15.770 1.00 0.20 C ATOM 331 N1 U A 11 39.004 23.129 17.193 1.00 0.20 N ATOM 332 C2 U A 11 38.580 21.850 17.486 1.00 0.25 C ATOM 333 O2 U A 11 38.264 21.044 16.614 1.00 0.33 O ATOM 334 N3 U A 11 38.508 21.523 18.822 1.00 0.27 N ATOM 335 C4 U A 11 38.812 22.348 19.879 1.00 0.25 C ATOM 336 O4 U A 11 38.703 21.950 21.040 1.00 0.31 O ATOM 337 C5 U A 11 39.245 23.670 19.485 1.00 0.24 C ATOM 338 C6 U A 11 39.328 24.016 18.181 1.00 0.22 C ATOM 0 H5' U A 11 39.652 27.051 16.591 1.00 0.24 H new ATOM 0 H5'' U A 11 38.365 27.685 15.584 1.00 0.24 H new ATOM 0 H4' U A 11 39.556 26.195 14.197 1.00 0.21 H new ATOM 0 H3' U A 11 36.873 25.748 14.638 1.00 0.20 H new ATOM 0 H2' U A 11 36.893 23.792 16.066 1.00 0.20 H new ATOM 0 HO2' U A 11 36.629 22.084 14.880 1.00 0.24 H new ATOM 0 H1' U A 11 39.525 22.705 15.208 1.00 0.20 H new ATOM 0 H3 U A 11 38.199 20.578 19.049 1.00 0.27 H new ATOM 0 H5 U A 11 39.506 24.392 20.244 1.00 0.24 H new ATOM 0 H6 U A 11 39.656 25.010 17.915 1.00 0.22 H new ATOM 349 P U A 12 36.427 24.551 12.275 1.00 0.23 P ATOM 350 OP1 U A 12 36.458 23.138 11.833 1.00 0.30 O ATOM 351 OP2 U A 12 36.218 25.618 11.274 1.00 0.31 O ATOM 352 O5' U A 12 35.298 24.724 13.432 1.00 0.25 O ATOM 353 C5' U A 12 34.145 23.881 13.496 1.00 0.25 C ATOM 354 C4' U A 12 34.518 22.424 13.743 1.00 0.22 C ATOM 355 O4' U A 12 35.101 22.228 15.031 1.00 0.26 O ATOM 356 C3' U A 12 33.293 21.543 13.626 1.00 0.20 C ATOM 357 O3' U A 12 33.435 20.635 12.550 1.00 0.22 O ATOM 358 C2' U A 12 33.175 20.798 14.961 1.00 0.24 C ATOM 359 O2' U A 12 32.955 19.389 14.782 1.00 0.35 O ATOM 360 C1' U A 12 34.512 21.071 15.632 1.00 0.23 C ATOM 361 N1 U A 12 34.271 21.262 17.082 1.00 0.24 N ATOM 362 C2 U A 12 33.827 20.166 17.812 1.00 0.30 C ATOM 363 O2 U A 12 33.750 19.036 17.327 1.00 0.36 O ATOM 364 N3 U A 12 33.471 20.414 19.121 1.00 0.35 N ATOM 365 C4 U A 12 33.518 21.647 19.766 1.00 0.36 C ATOM 366 O4 U A 12 33.138 21.757 20.932 1.00 0.48 O ATOM 367 C5 U A 12 34.005 22.721 18.940 1.00 0.29 C ATOM 368 C6 U A 12 34.363 22.502 17.650 1.00 0.24 C ATOM 0 H5' U A 12 33.586 23.959 12.564 1.00 0.25 H new ATOM 0 H5'' U A 12 33.486 24.227 14.293 1.00 0.25 H new ATOM 0 H4' U A 12 35.255 22.154 12.986 1.00 0.22 H new ATOM 0 H3' U A 12 32.397 22.130 13.424 1.00 0.20 H new ATOM 0 H2' U A 12 32.321 21.133 15.550 1.00 0.24 H new ATOM 0 HO2' U A 12 32.021 19.233 14.531 1.00 0.35 H new ATOM 0 H1' U A 12 35.204 20.239 15.504 1.00 0.23 H new ATOM 0 H3 U A 12 33.142 19.619 19.669 1.00 0.35 H new ATOM 0 H5 U A 12 34.086 23.715 19.353 1.00 0.29 H new ATOM 0 H6 U A 12 34.730 23.327 17.057 1.00 0.24 H new ATOM 379 P G A 13 32.197 20.494 11.532 1.00 0.19 P ATOM 380 OP1 G A 13 32.720 20.080 10.217 1.00 0.28 O ATOM 381 OP2 G A 13 31.346 21.711 11.619 1.00 0.28 O ATOM 382 O5' G A 13 31.387 19.270 12.173 1.00 0.19 O ATOM 383 C5' G A 13 31.819 17.934 11.950 1.00 0.21 C ATOM 384 C4' G A 13 31.256 16.985 12.977 1.00 0.20 C ATOM 385 O4' G A 13 31.851 17.188 14.252 1.00 0.25 O ATOM 386 C3' G A 13 29.761 17.196 13.156 1.00 0.19 C ATOM 387 O3' G A 13 28.967 16.575 12.147 1.00 0.19 O ATOM 388 C2' G A 13 29.584 16.532 14.505 1.00 0.23 C ATOM 389 O2' G A 13 29.606 15.098 14.383 1.00 0.28 O ATOM 390 C1' G A 13 30.821 17.037 15.233 1.00 0.23 C ATOM 391 N9 G A 13 30.559 18.316 15.945 1.00 0.23 N ATOM 392 C8 G A 13 30.333 19.568 15.443 1.00 0.26 C ATOM 393 N7 G A 13 30.161 20.494 16.336 1.00 0.27 N ATOM 394 C5 G A 13 30.271 19.810 17.540 1.00 0.24 C ATOM 395 C6 G A 13 30.179 20.284 18.876 1.00 0.27 C ATOM 396 O6 G A 13 29.981 21.430 19.275 1.00 0.31 O ATOM 397 N1 G A 13 30.357 19.253 19.792 1.00 0.27 N ATOM 398 C2 G A 13 30.595 17.937 19.459 1.00 0.26 C ATOM 399 N2 G A 13 30.771 17.094 20.466 1.00 0.31 N ATOM 400 N3 G A 13 30.681 17.496 18.214 1.00 0.23 N ATOM 401 C4 G A 13 30.510 18.473 17.311 1.00 0.22 C ATOM 0 H5' G A 13 32.908 17.895 11.977 1.00 0.21 H new ATOM 0 H5'' G A 13 31.513 17.615 10.954 1.00 0.21 H new ATOM 0 H4' G A 13 31.467 15.981 12.610 1.00 0.20 H new ATOM 0 H3' G A 13 29.443 18.236 13.088 1.00 0.19 H new ATOM 0 H2' G A 13 28.640 16.757 15.002 1.00 0.23 H new ATOM 0 HO2' G A 13 29.491 14.693 15.268 1.00 0.28 H new ATOM 0 H1' G A 13 31.123 16.326 16.002 1.00 0.23 H new ATOM 0 H8 G A 13 30.300 19.771 14.383 1.00 0.26 H new ATOM 0 H1 G A 13 30.308 19.488 20.783 1.00 0.27 H new ATOM 0 H21 G A 13 30.951 16.107 20.280 1.00 0.31 H new ATOM 0 H22 G A 13 30.727 17.432 21.427 1.00 0.31 H new ATOM 413 P C A 14 27.415 17.003 11.967 1.00 0.20 P ATOM 414 OP1 C A 14 26.881 16.260 10.808 1.00 0.27 O ATOM 415 OP2 C A 14 27.286 18.476 12.002 1.00 0.25 O ATOM 416 O5' C A 14 26.735 16.406 13.308 1.00 0.27 O ATOM 417 C5' C A 14 26.820 15.017 13.618 1.00 0.27 C ATOM 418 C4' C A 14 26.543 14.755 15.091 1.00 0.28 C ATOM 419 O4' C A 14 27.400 15.515 15.924 1.00 0.29 O ATOM 420 C3' C A 14 25.125 15.102 15.469 1.00 0.29 C ATOM 421 O3' C A 14 24.207 14.067 15.080 1.00 0.33 O ATOM 422 C2' C A 14 25.270 15.211 16.984 1.00 0.29 C ATOM 423 O2' C A 14 25.074 13.932 17.614 1.00 0.35 O ATOM 424 C1' C A 14 26.714 15.700 17.160 1.00 0.28 C ATOM 425 N1 C A 14 26.772 17.113 17.604 1.00 0.26 N ATOM 426 C2 C A 14 26.828 17.350 18.972 1.00 0.28 C ATOM 427 O2 C A 14 26.730 16.417 19.761 1.00 0.34 O ATOM 428 N3 C A 14 26.964 18.628 19.406 1.00 0.29 N ATOM 429 C4 C A 14 27.042 19.638 18.539 1.00 0.29 C ATOM 430 N4 C A 14 27.197 20.878 19.006 1.00 0.35 N ATOM 431 C5 C A 14 26.991 19.414 17.135 1.00 0.29 C ATOM 432 C6 C A 14 26.852 18.145 16.712 1.00 0.27 C ATOM 0 H5' C A 14 27.813 14.646 13.362 1.00 0.27 H new ATOM 0 H5'' C A 14 26.106 14.463 13.009 1.00 0.27 H new ATOM 0 H4' C A 14 26.717 13.689 15.238 1.00 0.28 H new ATOM 0 H3' C A 14 24.722 15.995 14.990 1.00 0.29 H new ATOM 0 H2' C A 14 24.536 15.875 17.440 1.00 0.29 H new ATOM 0 HO2' C A 14 24.352 13.999 18.273 1.00 0.35 H new ATOM 0 H1' C A 14 27.198 15.119 17.945 1.00 0.28 H new ATOM 0 H41 C A 14 27.259 21.663 18.358 1.00 0.35 H new ATOM 0 H42 C A 14 27.254 21.041 20.011 1.00 0.35 H new ATOM 0 H5 C A 14 27.061 20.233 16.435 1.00 0.29 H new ATOM 0 H6 C A 14 26.803 17.939 15.653 1.00 0.27 H new ATOM 444 P U A 15 22.613 14.261 15.255 1.00 0.29 P ATOM 445 OP1 U A 15 21.926 13.430 14.238 1.00 0.42 O ATOM 446 OP2 U A 15 22.307 15.703 15.321 1.00 0.34 O ATOM 447 O5' U A 15 22.345 13.619 16.708 1.00 0.23 O ATOM 448 C5' U A 15 22.756 12.284 17.012 1.00 0.23 C ATOM 449 C4' U A 15 22.530 11.961 18.478 1.00 0.21 C ATOM 450 O4' U A 15 23.355 12.784 19.286 1.00 0.22 O ATOM 451 C3' U A 15 21.082 12.217 18.862 1.00 0.22 C ATOM 452 O3' U A 15 20.267 11.045 18.713 1.00 0.25 O ATOM 453 C2' U A 15 21.217 12.647 20.316 1.00 0.27 C ATOM 454 O2' U A 15 21.259 11.511 21.210 1.00 0.35 O ATOM 455 C1' U A 15 22.542 13.395 20.282 1.00 0.24 C ATOM 456 N1 U A 15 22.349 14.840 19.987 1.00 0.23 N ATOM 457 C2 U A 15 22.109 15.694 21.046 1.00 0.27 C ATOM 458 O2 U A 15 22.027 15.295 22.206 1.00 0.32 O ATOM 459 N3 U A 15 21.974 17.039 20.729 1.00 0.31 N ATOM 460 C4 U A 15 22.056 17.592 19.470 1.00 0.31 C ATOM 461 O4 U A 15 21.930 18.802 19.313 1.00 0.39 O ATOM 462 C5 U A 15 22.306 16.633 18.420 1.00 0.28 C ATOM 463 C6 U A 15 22.440 15.316 18.701 1.00 0.26 C ATOM 0 H5' U A 15 23.811 12.161 16.768 1.00 0.23 H new ATOM 0 H5'' U A 15 22.201 11.580 16.392 1.00 0.23 H new ATOM 0 H4' U A 15 22.773 10.910 18.635 1.00 0.21 H new ATOM 0 H3' U A 15 20.584 12.955 18.233 1.00 0.22 H new ATOM 0 H2' U A 15 20.381 13.241 20.686 1.00 0.27 H new ATOM 0 HO2' U A 15 20.877 11.762 22.077 1.00 0.35 H new ATOM 0 H1' U A 15 23.021 13.338 21.259 1.00 0.24 H new ATOM 0 H3 U A 15 21.797 17.679 21.503 1.00 0.31 H new ATOM 0 H5 U A 15 22.387 16.971 17.397 1.00 0.28 H new ATOM 0 H6 U A 15 22.623 14.622 17.894 1.00 0.26 H new ATOM 474 P C A 16 18.712 11.210 18.369 1.00 0.23 P ATOM 475 OP1 C A 16 18.072 9.881 18.345 1.00 0.27 O ATOM 476 OP2 C A 16 18.586 12.093 17.195 1.00 0.28 O ATOM 477 O5' C A 16 18.182 12.023 19.666 1.00 0.25 O ATOM 478 C5' C A 16 18.295 11.464 20.975 1.00 0.26 C ATOM 479 C4' C A 16 18.115 12.517 22.061 1.00 0.25 C ATOM 480 O4' C A 16 19.196 13.458 22.075 1.00 0.26 O ATOM 481 C3' C A 16 16.844 13.311 21.855 1.00 0.26 C ATOM 482 O3' C A 16 15.700 12.637 22.331 1.00 0.32 O ATOM 483 C2' C A 16 17.151 14.546 22.677 1.00 0.28 C ATOM 484 O2' C A 16 16.857 14.365 24.071 1.00 0.32 O ATOM 485 C1' C A 16 18.637 14.732 22.415 1.00 0.26 C ATOM 486 N1 C A 16 18.826 15.724 21.335 1.00 0.29 N ATOM 487 C2 C A 16 18.795 17.067 21.689 1.00 0.36 C ATOM 488 O2 C A 16 18.712 17.386 22.873 1.00 0.41 O ATOM 489 N3 C A 16 18.883 17.999 20.703 1.00 0.43 N ATOM 490 C4 C A 16 18.999 17.631 19.427 1.00 0.41 C ATOM 491 N4 C A 16 19.079 18.569 18.480 1.00 0.50 N ATOM 492 C5 C A 16 19.035 16.251 19.054 1.00 0.34 C ATOM 493 C6 C A 16 18.950 15.337 20.031 1.00 0.29 C ATOM 0 H5' C A 16 19.272 10.992 21.085 1.00 0.26 H new ATOM 0 H5'' C A 16 17.547 10.681 21.101 1.00 0.26 H new ATOM 0 H4' C A 16 18.079 11.968 23.002 1.00 0.25 H new ATOM 0 H3' C A 16 16.605 13.504 20.809 1.00 0.26 H new ATOM 0 H2' C A 16 16.548 15.413 22.406 1.00 0.28 H new ATOM 0 HO2' C A 16 16.315 15.116 24.391 1.00 0.32 H new ATOM 0 H1' C A 16 19.148 15.111 23.300 1.00 0.26 H new ATOM 0 H41 C A 16 19.168 18.299 17.501 1.00 0.50 H new ATOM 0 H42 C A 16 19.051 19.556 18.736 1.00 0.50 H new ATOM 0 H5 C A 16 19.128 15.955 18.020 1.00 0.34 H new ATOM 0 H6 C A 16 18.980 14.286 19.785 1.00 0.29 H new ATOM 505 P A A 17 14.251 13.158 21.885 1.00 0.36 P ATOM 506 OP1 A A 17 13.274 12.103 22.168 1.00 0.46 O ATOM 507 OP2 A A 17 14.357 13.694 20.506 1.00 0.42 O ATOM 508 O5' A A 17 13.996 14.408 22.879 1.00 0.36 O ATOM 509 C5' A A 17 13.819 14.201 24.278 1.00 0.34 C ATOM 510 C4' A A 17 13.873 15.509 25.077 1.00 0.34 C ATOM 511 O4' A A 17 15.022 16.281 24.734 1.00 0.36 O ATOM 512 C3' A A 17 12.653 16.365 24.828 1.00 0.37 C ATOM 513 O3' A A 17 11.489 15.894 25.561 1.00 0.41 O ATOM 514 C2' A A 17 13.183 17.681 25.363 1.00 0.41 C ATOM 515 O2' A A 17 13.084 17.721 26.806 1.00 0.49 O ATOM 516 C1' A A 17 14.628 17.652 24.873 1.00 0.36 C ATOM 517 N9 A A 17 14.775 18.398 23.612 1.00 0.33 N ATOM 518 C8 A A 17 15.058 17.941 22.379 1.00 0.38 C ATOM 519 N7 A A 17 15.141 18.858 21.469 1.00 0.40 N ATOM 520 C5 A A 17 14.893 20.031 22.172 1.00 0.34 C ATOM 521 C6 A A 17 14.822 21.382 21.790 1.00 0.38 C ATOM 522 N6 A A 17 15.042 21.798 20.545 1.00 0.46 N ATOM 523 N1 A A 17 14.539 22.279 22.741 1.00 0.37 N ATOM 524 C2 A A 17 14.339 21.878 24.001 1.00 0.37 C ATOM 525 N3 A A 17 14.388 20.635 24.467 1.00 0.35 N ATOM 526 C4 A A 17 14.667 19.757 23.484 1.00 0.31 C ATOM 0 H5' A A 17 14.592 13.524 24.642 1.00 0.34 H new ATOM 0 H5'' A A 17 12.860 13.713 24.451 1.00 0.34 H new ATOM 0 H4' A A 17 13.915 15.220 26.127 1.00 0.34 H new ATOM 0 H3' A A 17 12.294 16.388 23.799 1.00 0.37 H new ATOM 0 H2' A A 17 12.639 18.565 25.030 1.00 0.41 H new ATOM 0 HO2' A A 17 12.396 17.090 27.104 1.00 0.49 H new ATOM 0 HO3' A A 17 10.725 16.478 25.372 1.00 0.41 H new ATOM 0 H1' A A 17 15.281 18.144 25.594 1.00 0.36 H new ATOM 0 H8 A A 17 15.204 16.893 22.165 1.00 0.38 H new ATOM 0 H61 A A 17 14.978 22.791 20.320 1.00 0.46 H new ATOM 0 H62 A A 17 15.275 21.124 19.816 1.00 0.46 H new ATOM 0 H2 A A 17 14.112 22.651 24.720 1.00 0.37 H new TER 539 A A 17