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 180:sc= -0.828 USER MOD Single : A 1 U O5' : rot 180:sc= -0.551 USER MOD Single : A 2 G O2' : rot 180:sc= -1.9! USER MOD Single : A 3 A O2' : rot -160:sc= -3.96! USER MOD Single : A 4 G O2' : rot 180:sc= -1.63! USER MOD Single : A 5 C O2' : rot -114:sc= 0.975 USER MOD Single : A 6 U O2' : rot 180:sc= -4.36! USER MOD Single : A 7 C O2' : rot -83:sc= 0.953 USER MOD Single : A 8 A O2' : rot -22:sc= -1.19 USER MOD Single : A 9 G O2' : rot 180:sc= -3.84! USER MOD Single : A 10 U O2' : rot -74:sc= 1.09 USER MOD Single : A 11 U O2' : rot -133:sc= -2.8 USER MOD Single : A 12 U O2' : rot -148:sc= -0.233 USER MOD Single : A 13 G O2' : rot -119:sc= 0.507 USER MOD Single : A 14 C O2' : rot -156:sc= -2.24! USER MOD Single : A 15 U O2' : rot 180:sc= -4.43! USER MOD Single : A 16 C O2' : rot -170:sc= -3.52! USER MOD Single : A 17 A O2' : rot -23:sc= 0.224 USER MOD Single : A 17 A O3' : rot 180:sc= 0.171 USER MOD ----------------------------------------------------------------- ATOM 1 O5' U A 1 15.020 27.858 16.612 1.00 0.45 O ATOM 2 C5' U A 1 13.960 28.760 16.985 1.00 0.39 C ATOM 3 C4' U A 1 13.558 28.576 18.450 1.00 0.30 C ATOM 4 O4' U A 1 12.757 27.400 18.617 1.00 0.32 O ATOM 5 C3' U A 1 14.769 28.452 19.366 1.00 0.24 C ATOM 6 O3' U A 1 15.268 29.734 19.795 1.00 0.24 O ATOM 7 C2' U A 1 14.177 27.653 20.529 1.00 0.25 C ATOM 8 O2' U A 1 13.478 28.481 21.467 1.00 0.31 O ATOM 9 C1' U A 1 13.198 26.722 19.790 1.00 0.27 C ATOM 10 N1 U A 1 13.863 25.449 19.457 1.00 0.26 N ATOM 11 C2 U A 1 13.950 24.504 20.462 1.00 0.25 C ATOM 12 O2 U A 1 13.465 24.685 21.575 1.00 0.28 O ATOM 13 N3 U A 1 14.623 23.333 20.149 1.00 0.27 N ATOM 14 C4 U A 1 15.207 23.031 18.938 1.00 0.29 C ATOM 15 O4 U A 1 15.770 21.952 18.766 1.00 0.35 O ATOM 16 C5 U A 1 15.063 24.071 17.948 1.00 0.32 C ATOM 17 C6 U A 1 14.413 25.224 18.228 1.00 0.30 C ATOM 0 H5' U A 1 13.094 28.591 16.345 1.00 0.39 H new ATOM 0 H5'' U A 1 14.281 29.789 16.821 1.00 0.39 H new ATOM 0 H4' U A 1 12.991 29.466 18.723 1.00 0.30 H new ATOM 0 H3' U A 1 15.634 27.987 18.893 1.00 0.24 H new ATOM 0 H2' U A 1 14.932 27.145 21.129 1.00 0.25 H new ATOM 0 HO2' U A 1 13.118 27.925 22.189 1.00 0.31 H new ATOM 0 HO5' U A 1 15.253 27.999 15.671 1.00 0.45 H new ATOM 0 H1' U A 1 12.340 26.483 20.418 1.00 0.27 H new ATOM 0 H3 U A 1 14.692 22.629 20.884 1.00 0.27 H new ATOM 0 H5 U A 1 15.483 23.926 16.963 1.00 0.32 H new ATOM 0 H6 U A 1 14.327 25.982 17.463 1.00 0.30 H new ATOM 29 P G A 2 16.825 29.893 20.200 1.00 0.25 P ATOM 30 OP1 G A 2 17.046 31.251 20.759 1.00 0.36 O ATOM 31 OP2 G A 2 17.641 29.451 19.065 1.00 0.29 O ATOM 32 O5' G A 2 16.979 28.827 21.412 1.00 0.27 O ATOM 33 C5' G A 2 16.318 29.061 22.660 1.00 0.24 C ATOM 34 C4' G A 2 16.294 27.836 23.562 1.00 0.23 C ATOM 35 O4' G A 2 15.705 26.717 22.897 1.00 0.28 O ATOM 36 C3' G A 2 17.696 27.415 23.968 1.00 0.21 C ATOM 37 O3' G A 2 18.222 28.174 25.068 1.00 0.23 O ATOM 38 C2' G A 2 17.453 25.960 24.357 1.00 0.24 C ATOM 39 O2' G A 2 16.981 25.840 25.711 1.00 0.31 O ATOM 40 C1' G A 2 16.366 25.544 23.364 1.00 0.25 C ATOM 41 N9 G A 2 16.947 24.764 22.267 1.00 0.25 N ATOM 42 C8 G A 2 17.293 25.167 21.012 1.00 0.27 C ATOM 43 N7 G A 2 17.749 24.232 20.246 1.00 0.29 N ATOM 44 C5 G A 2 17.686 23.097 21.067 1.00 0.28 C ATOM 45 C6 G A 2 18.049 21.748 20.783 1.00 0.32 C ATOM 46 O6 G A 2 18.479 21.278 19.731 1.00 0.36 O ATOM 47 N1 G A 2 17.827 20.926 21.869 1.00 0.34 N ATOM 48 C2 G A 2 17.336 21.332 23.083 1.00 0.33 C ATOM 49 N2 G A 2 17.195 20.397 24.014 1.00 0.40 N ATOM 50 N3 G A 2 17.007 22.605 23.360 1.00 0.30 N ATOM 51 C4 G A 2 17.205 23.420 22.301 1.00 0.27 C ATOM 0 H5' G A 2 15.295 29.383 22.467 1.00 0.24 H new ATOM 0 H5'' G A 2 16.817 29.878 23.181 1.00 0.24 H new ATOM 0 H4' G A 2 15.711 28.119 24.438 1.00 0.23 H new ATOM 0 H3' G A 2 18.439 27.569 23.186 1.00 0.21 H new ATOM 0 H2' G A 2 18.354 25.347 24.319 1.00 0.24 H new ATOM 0 HO2' G A 2 16.835 24.895 25.924 1.00 0.31 H new ATOM 0 H1' G A 2 15.632 24.902 23.851 1.00 0.25 H new ATOM 0 H8 G A 2 17.194 26.191 20.683 1.00 0.27 H new ATOM 0 H1 G A 2 18.046 19.936 21.760 1.00 0.34 H new ATOM 0 H21 G A 2 16.834 20.645 24.935 1.00 0.40 H new ATOM 0 H22 G A 2 17.448 19.430 23.808 1.00 0.40 H new ATOM 63 P A A 3 19.818 28.375 25.237 1.00 0.22 P ATOM 64 OP1 A A 3 20.095 29.081 26.507 1.00 0.31 O ATOM 65 OP2 A A 3 20.338 28.944 23.975 1.00 0.29 O ATOM 66 O5' A A 3 20.362 26.856 25.383 1.00 0.21 O ATOM 67 C5' A A 3 19.944 26.046 26.487 1.00 0.22 C ATOM 68 C4' A A 3 20.350 24.557 26.339 1.00 0.21 C ATOM 69 O4' A A 3 19.574 23.902 25.335 1.00 0.23 O ATOM 70 C3' A A 3 21.811 24.331 25.946 1.00 0.20 C ATOM 71 O3' A A 3 22.704 24.497 27.063 1.00 0.20 O ATOM 72 C2' A A 3 21.719 22.852 25.503 1.00 0.21 C ATOM 73 O2' A A 3 21.766 21.964 26.626 1.00 0.23 O ATOM 74 C1' A A 3 20.342 22.790 24.854 1.00 0.21 C ATOM 75 N9 A A 3 20.485 22.781 23.386 1.00 0.22 N ATOM 76 C8 A A 3 20.485 23.808 22.533 1.00 0.26 C ATOM 77 N7 A A 3 20.717 23.479 21.296 1.00 0.28 N ATOM 78 C5 A A 3 20.886 22.120 21.345 1.00 0.27 C ATOM 79 C6 A A 3 21.164 21.183 20.385 1.00 0.33 C ATOM 80 N6 A A 3 21.290 21.469 19.085 1.00 0.38 N ATOM 81 N1 A A 3 21.270 19.918 20.796 1.00 0.36 N ATOM 82 C2 A A 3 21.104 19.605 22.059 1.00 0.35 C ATOM 83 N3 A A 3 20.847 20.424 23.040 1.00 0.29 N ATOM 84 C4 A A 3 20.737 21.681 22.610 1.00 0.24 C ATOM 0 H5' A A 3 18.861 26.112 26.589 1.00 0.22 H new ATOM 0 H5'' A A 3 20.375 26.444 27.405 1.00 0.22 H new ATOM 0 H4' A A 3 20.177 24.149 27.335 1.00 0.21 H new ATOM 0 H3' A A 3 22.204 25.023 25.201 1.00 0.20 H new ATOM 0 H2' A A 3 22.540 22.553 24.851 1.00 0.21 H new ATOM 0 HO2' A A 3 22.017 21.066 26.323 1.00 0.23 H new ATOM 0 H1' A A 3 19.815 21.873 25.119 1.00 0.21 H new ATOM 0 H8 A A 3 20.307 24.827 22.844 1.00 0.26 H new ATOM 0 H61 A A 3 21.498 20.727 18.417 1.00 0.38 H new ATOM 0 H62 A A 3 21.178 22.430 18.761 1.00 0.38 H new ATOM 0 H2 A A 3 21.189 18.559 22.313 1.00 0.35 H new ATOM 96 P G A 4 24.293 24.231 26.919 1.00 0.22 P ATOM 97 OP1 G A 4 24.959 24.754 28.124 1.00 0.26 O ATOM 98 OP2 G A 4 24.730 24.721 25.598 1.00 0.24 O ATOM 99 O5' G A 4 24.398 22.619 26.911 1.00 0.23 O ATOM 100 C5' G A 4 23.911 21.840 28.010 1.00 0.23 C ATOM 101 C4' G A 4 23.803 20.355 27.667 1.00 0.21 C ATOM 102 O4' G A 4 23.153 20.157 26.406 1.00 0.22 O ATOM 103 C3' G A 4 25.177 19.713 27.582 1.00 0.19 C ATOM 104 O3' G A 4 25.610 19.226 28.852 1.00 0.22 O ATOM 105 C2' G A 4 24.919 18.578 26.594 1.00 0.20 C ATOM 106 O2' G A 4 24.344 17.431 27.225 1.00 0.24 O ATOM 107 C1' G A 4 23.934 19.236 25.645 1.00 0.20 C ATOM 108 N9 G A 4 24.659 19.923 24.565 1.00 0.20 N ATOM 109 C8 G A 4 24.881 21.260 24.395 1.00 0.21 C ATOM 110 N7 G A 4 25.545 21.577 23.327 1.00 0.22 N ATOM 111 C5 G A 4 25.790 20.337 22.727 1.00 0.21 C ATOM 112 C6 G A 4 26.483 20.034 21.528 1.00 0.22 C ATOM 113 O6 G A 4 26.987 20.812 20.715 1.00 0.27 O ATOM 114 N1 G A 4 26.515 18.657 21.300 1.00 0.22 N ATOM 115 C2 G A 4 25.947 17.709 22.113 1.00 0.21 C ATOM 116 N2 G A 4 26.082 16.447 21.717 1.00 0.24 N ATOM 117 N3 G A 4 25.290 17.985 23.237 1.00 0.21 N ATOM 118 C4 G A 4 25.252 19.321 23.481 1.00 0.20 C ATOM 0 H5' G A 4 22.932 22.213 28.311 1.00 0.23 H new ATOM 0 H5'' G A 4 24.576 21.966 28.864 1.00 0.23 H new ATOM 0 H4' G A 4 23.219 19.895 28.464 1.00 0.21 H new ATOM 0 H3' G A 4 25.970 20.395 27.275 1.00 0.19 H new ATOM 0 H2' G A 4 25.822 18.194 26.120 1.00 0.20 H new ATOM 0 HO2' G A 4 24.194 16.730 26.556 1.00 0.24 H new ATOM 0 H1' G A 4 23.284 18.494 25.181 1.00 0.20 H new ATOM 0 H8 G A 4 24.529 22.000 25.099 1.00 0.21 H new ATOM 0 H1 G A 4 26.999 18.330 20.463 1.00 0.22 H new ATOM 0 H21 G A 4 25.684 15.692 22.275 1.00 0.24 H new ATOM 0 H22 G A 4 26.584 16.234 20.855 1.00 0.24 H new ATOM 130 P C A 5 27.165 19.300 29.256 1.00 0.23 P ATOM 131 OP1 C A 5 27.300 18.834 30.649 1.00 0.32 O ATOM 132 OP2 C A 5 27.688 20.627 28.887 1.00 0.26 O ATOM 133 O5' C A 5 27.826 18.206 28.285 1.00 0.28 O ATOM 134 C5' C A 5 27.295 16.882 28.186 1.00 0.30 C ATOM 135 C4' C A 5 27.908 16.142 27.014 1.00 0.30 C ATOM 136 O4' C A 5 27.393 16.658 25.796 1.00 0.31 O ATOM 137 C3' C A 5 29.413 16.335 27.005 1.00 0.29 C ATOM 138 O3' C A 5 30.094 15.341 27.776 1.00 0.34 O ATOM 139 C2' C A 5 29.741 16.224 25.517 1.00 0.29 C ATOM 140 O2' C A 5 30.043 14.868 25.158 1.00 0.35 O ATOM 141 C1' C A 5 28.451 16.712 24.846 1.00 0.29 C ATOM 142 N1 C A 5 28.610 18.084 24.296 1.00 0.27 N ATOM 143 C2 C A 5 28.949 18.193 22.957 1.00 0.31 C ATOM 144 O2 C A 5 29.136 17.182 22.285 1.00 0.35 O ATOM 145 N3 C A 5 29.077 19.435 22.416 1.00 0.33 N ATOM 146 C4 C A 5 28.881 20.532 23.158 1.00 0.31 C ATOM 147 N4 C A 5 28.977 21.730 22.586 1.00 0.36 N ATOM 148 C5 C A 5 28.541 20.430 24.541 1.00 0.27 C ATOM 149 C6 C A 5 28.415 19.204 25.065 1.00 0.25 C ATOM 0 H5' C A 5 26.212 16.928 28.067 1.00 0.30 H new ATOM 0 H5'' C A 5 27.492 16.337 29.109 1.00 0.30 H new ATOM 0 H4' C A 5 27.665 15.084 27.112 1.00 0.30 H new ATOM 0 H3' C A 5 29.729 17.275 27.456 1.00 0.29 H new ATOM 0 H2' C A 5 30.618 16.799 25.220 1.00 0.29 H new ATOM 0 HO2' C A 5 30.984 14.802 24.894 1.00 0.35 H new ATOM 0 H1' C A 5 28.217 16.062 24.003 1.00 0.29 H new ATOM 0 H41 C A 5 28.830 22.573 23.141 1.00 0.36 H new ATOM 0 H42 C A 5 29.198 21.805 21.593 1.00 0.36 H new ATOM 0 H5 C A 5 28.390 21.313 25.145 1.00 0.27 H new ATOM 0 H6 C A 5 28.156 19.095 26.108 1.00 0.25 H new ATOM 161 P U A 6 31.612 15.608 28.256 1.00 0.33 P ATOM 162 OP1 U A 6 31.883 14.795 29.462 1.00 0.43 O ATOM 163 OP2 U A 6 31.831 17.068 28.315 1.00 0.33 O ATOM 164 O5' U A 6 32.461 15.020 27.019 1.00 0.33 O ATOM 165 C5' U A 6 32.625 13.613 26.838 1.00 0.38 C ATOM 166 C4' U A 6 33.258 13.272 25.490 1.00 0.31 C ATOM 167 O4' U A 6 32.518 13.850 24.414 1.00 0.32 O ATOM 168 C3' U A 6 34.684 13.781 25.400 1.00 0.26 C ATOM 169 O3' U A 6 35.626 12.833 25.932 1.00 0.28 O ATOM 170 C2' U A 6 34.846 13.960 23.892 1.00 0.24 C ATOM 171 O2' U A 6 35.258 12.747 23.253 1.00 0.30 O ATOM 172 C1' U A 6 33.445 14.363 23.457 1.00 0.27 C ATOM 173 N1 U A 6 33.341 15.829 23.356 1.00 0.26 N ATOM 174 C2 U A 6 33.696 16.413 22.148 1.00 0.34 C ATOM 175 O2 U A 6 34.075 15.754 21.180 1.00 0.48 O ATOM 176 N3 U A 6 33.560 17.788 22.084 1.00 0.37 N ATOM 177 C4 U A 6 33.104 18.608 23.100 1.00 0.36 C ATOM 178 O4 U A 6 33.001 19.812 22.929 1.00 0.44 O ATOM 179 C5 U A 6 32.765 17.913 24.315 1.00 0.40 C ATOM 180 C6 U A 6 32.891 16.572 24.409 1.00 0.35 C ATOM 0 H5' U A 6 31.654 13.123 26.915 1.00 0.38 H new ATOM 0 H5'' U A 6 33.247 13.216 27.640 1.00 0.38 H new ATOM 0 H4' U A 6 33.249 12.185 25.412 1.00 0.31 H new ATOM 0 H3' U A 6 34.869 14.687 25.977 1.00 0.26 H new ATOM 0 H2' U A 6 35.614 14.687 23.627 1.00 0.24 H new ATOM 0 HO2' U A 6 35.350 12.900 22.289 1.00 0.30 H new ATOM 0 H1' U A 6 33.222 13.952 22.473 1.00 0.27 H new ATOM 0 H3 U A 6 33.820 18.239 21.207 1.00 0.37 H new ATOM 0 H5 U A 6 32.404 18.474 25.165 1.00 0.40 H new ATOM 0 H6 U A 6 32.631 16.078 25.334 1.00 0.35 H new ATOM 191 P C A 7 37.132 13.290 26.305 1.00 0.28 P ATOM 192 OP1 C A 7 37.926 12.094 26.667 1.00 0.33 O ATOM 193 OP2 C A 7 37.056 14.421 27.253 1.00 0.39 O ATOM 194 O5' C A 7 37.667 13.860 24.903 1.00 0.26 O ATOM 195 C5' C A 7 37.929 12.991 23.804 1.00 0.27 C ATOM 196 C4' C A 7 38.396 13.765 22.611 1.00 0.24 C ATOM 197 O4' C A 7 37.379 14.624 22.152 1.00 0.26 O ATOM 198 C3' C A 7 39.589 14.598 23.018 1.00 0.24 C ATOM 199 O3' C A 7 40.796 13.896 22.780 1.00 0.26 O ATOM 200 C2' C A 7 39.454 15.837 22.152 1.00 0.25 C ATOM 201 O2' C A 7 40.233 15.711 20.960 1.00 0.31 O ATOM 202 C1' C A 7 37.955 15.886 21.860 1.00 0.24 C ATOM 203 N1 C A 7 37.287 16.949 22.636 1.00 0.22 N ATOM 204 C2 C A 7 36.885 18.082 21.965 1.00 0.25 C ATOM 205 O2 C A 7 37.078 18.183 20.757 1.00 0.29 O ATOM 206 N3 C A 7 36.302 19.076 22.671 1.00 0.27 N ATOM 207 C4 C A 7 36.122 18.978 23.988 1.00 0.27 C ATOM 208 N4 C A 7 35.582 19.992 24.644 1.00 0.33 N ATOM 209 C5 C A 7 36.530 17.815 24.696 1.00 0.25 C ATOM 210 C6 C A 7 37.105 16.828 23.989 1.00 0.23 C ATOM 0 H5' C A 7 37.026 12.435 23.551 1.00 0.27 H new ATOM 0 H5'' C A 7 38.685 12.259 24.086 1.00 0.27 H new ATOM 0 H4' C A 7 38.660 13.071 21.813 1.00 0.24 H new ATOM 0 H3' C A 7 39.617 14.841 24.080 1.00 0.24 H new ATOM 0 H2' C A 7 39.817 16.749 22.627 1.00 0.25 H new ATOM 0 HO2' C A 7 41.161 15.963 21.148 1.00 0.31 H new ATOM 0 H1' C A 7 37.815 16.117 20.804 1.00 0.24 H new ATOM 0 H41 C A 7 35.439 19.929 25.652 1.00 0.33 H new ATOM 0 H42 C A 7 35.309 20.837 24.142 1.00 0.33 H new ATOM 0 H5 C A 7 36.383 17.728 25.762 1.00 0.25 H new ATOM 0 H6 C A 7 37.428 15.929 24.493 1.00 0.23 H new ATOM 222 P A A 8 41.680 13.421 24.031 1.00 0.23 P ATOM 223 OP1 A A 8 42.793 12.601 23.528 1.00 0.33 O ATOM 224 OP2 A A 8 40.780 12.877 25.080 1.00 0.36 O ATOM 225 O5' A A 8 42.287 14.816 24.541 1.00 0.28 O ATOM 226 C5' A A 8 43.012 14.895 25.769 1.00 0.27 C ATOM 227 C4' A A 8 43.719 16.236 25.914 1.00 0.26 C ATOM 228 O4' A A 8 44.750 16.369 24.942 1.00 0.31 O ATOM 229 C3' A A 8 42.734 17.378 25.727 1.00 0.23 C ATOM 230 O3' A A 8 42.199 17.798 26.984 1.00 0.24 O ATOM 231 C2' A A 8 43.600 18.449 25.094 1.00 0.26 C ATOM 232 O2' A A 8 44.264 19.230 26.093 1.00 0.31 O ATOM 233 C1' A A 8 44.578 17.615 24.274 1.00 0.29 C ATOM 234 N9 A A 8 44.063 17.385 22.908 1.00 0.32 N ATOM 235 C8 A A 8 43.515 16.248 22.378 1.00 0.37 C ATOM 236 N7 A A 8 43.152 16.348 21.136 1.00 0.42 N ATOM 237 C5 A A 8 43.487 17.662 20.811 1.00 0.39 C ATOM 238 C6 A A 8 43.367 18.414 19.637 1.00 0.45 C ATOM 239 N6 A A 8 42.851 17.930 18.510 1.00 0.54 N ATOM 240 N1 A A 8 43.800 19.686 19.674 1.00 0.46 N ATOM 241 C2 A A 8 44.328 20.187 20.789 1.00 0.41 C ATOM 242 N3 A A 8 44.487 19.568 21.950 1.00 0.35 N ATOM 243 C4 A A 8 44.046 18.300 21.886 1.00 0.34 C ATOM 0 H5' A A 8 43.745 14.089 25.813 1.00 0.27 H new ATOM 0 H5'' A A 8 42.329 14.750 26.606 1.00 0.27 H new ATOM 0 H4' A A 8 44.150 16.276 26.915 1.00 0.26 H new ATOM 0 H3' A A 8 41.863 17.121 25.124 1.00 0.23 H new ATOM 0 H2' A A 8 43.050 19.178 24.499 1.00 0.26 H new ATOM 0 HO2' A A 8 43.778 19.158 26.941 1.00 0.31 H new ATOM 0 H1' A A 8 45.527 18.143 24.184 1.00 0.29 H new ATOM 0 H8 A A 8 43.394 15.339 22.949 1.00 0.37 H new ATOM 0 H61 A A 8 42.787 18.523 17.682 1.00 0.54 H new ATOM 0 H62 A A 8 42.519 16.966 18.474 1.00 0.54 H new ATOM 0 H2 A A 8 44.664 21.212 20.742 1.00 0.41 H new ATOM 255 P G A 9 40.950 18.810 27.056 1.00 0.25 P ATOM 256 OP1 G A 9 41.068 19.591 28.306 1.00 0.34 O ATOM 257 OP2 G A 9 39.711 18.049 26.796 1.00 0.27 O ATOM 258 O5' G A 9 41.211 19.793 25.804 1.00 0.26 O ATOM 259 C5' G A 9 41.848 21.053 26.005 1.00 0.24 C ATOM 260 C4' G A 9 41.841 21.920 24.772 1.00 0.21 C ATOM 261 O4' G A 9 42.439 21.269 23.677 1.00 0.24 O ATOM 262 C3' G A 9 40.432 22.283 24.337 1.00 0.20 C ATOM 263 O3' G A 9 39.838 23.297 25.150 1.00 0.21 O ATOM 264 C2' G A 9 40.745 22.801 22.932 1.00 0.21 C ATOM 265 O2' G A 9 41.266 24.136 22.966 1.00 0.24 O ATOM 266 C1' G A 9 41.832 21.813 22.507 1.00 0.22 C ATOM 267 N9 G A 9 41.253 20.779 21.649 1.00 0.21 N ATOM 268 C8 G A 9 40.716 19.572 21.987 1.00 0.22 C ATOM 269 N7 G A 9 40.216 18.904 20.986 1.00 0.23 N ATOM 270 C5 G A 9 40.453 19.727 19.885 1.00 0.20 C ATOM 271 C6 G A 9 40.126 19.513 18.508 1.00 0.21 C ATOM 272 O6 G A 9 39.535 18.561 17.996 1.00 0.25 O ATOM 273 N1 G A 9 40.537 20.590 17.729 1.00 0.22 N ATOM 274 C2 G A 9 41.186 21.717 18.218 1.00 0.23 C ATOM 275 N2 G A 9 41.516 22.622 17.310 1.00 0.30 N ATOM 276 N3 G A 9 41.489 21.919 19.500 1.00 0.22 N ATOM 277 C4 G A 9 41.094 20.877 20.279 1.00 0.19 C ATOM 0 H5' G A 9 42.878 20.887 26.320 1.00 0.24 H new ATOM 0 H5'' G A 9 41.348 21.581 26.817 1.00 0.24 H new ATOM 0 H4' G A 9 42.399 22.815 25.048 1.00 0.21 H new ATOM 0 H3' G A 9 39.710 21.468 24.400 1.00 0.20 H new ATOM 0 H2' G A 9 39.880 22.854 22.271 1.00 0.21 H new ATOM 0 HO2' G A 9 41.457 24.436 22.053 1.00 0.24 H new ATOM 0 H1' G A 9 42.605 22.315 21.926 1.00 0.22 H new ATOM 0 H8 G A 9 40.706 19.200 23.001 1.00 0.22 H new ATOM 0 H1 G A 9 40.348 20.549 16.727 1.00 0.22 H new ATOM 0 H21 G A 9 41.995 23.477 17.593 1.00 0.30 H new ATOM 0 H22 G A 9 41.291 22.464 16.328 1.00 0.30 H new ATOM 289 P U A 10 38.268 23.658 24.991 1.00 0.22 P ATOM 290 OP1 U A 10 37.876 24.562 26.091 1.00 0.31 O ATOM 291 OP2 U A 10 37.509 22.410 24.787 1.00 0.29 O ATOM 292 O5' U A 10 38.227 24.507 23.626 1.00 0.28 O ATOM 293 C5' U A 10 39.154 25.564 23.390 1.00 0.28 C ATOM 294 C4' U A 10 38.496 26.932 23.415 1.00 0.24 C ATOM 295 O4' U A 10 39.491 27.936 23.605 1.00 0.27 O ATOM 296 C3' U A 10 37.753 27.229 22.108 1.00 0.20 C ATOM 297 O3' U A 10 36.355 26.855 22.161 1.00 0.24 O ATOM 298 C2' U A 10 37.931 28.748 21.987 1.00 0.25 C ATOM 299 O2' U A 10 36.887 29.447 22.673 1.00 0.37 O ATOM 300 C1' U A 10 39.282 28.982 22.663 1.00 0.27 C ATOM 301 N1 U A 10 40.387 29.045 21.671 1.00 0.27 N ATOM 302 C2 U A 10 40.814 30.303 21.281 1.00 0.34 C ATOM 303 O2 U A 10 40.304 31.333 21.719 1.00 0.42 O ATOM 304 N3 U A 10 41.862 30.346 20.381 1.00 0.41 N ATOM 305 C4 U A 10 42.515 29.257 19.836 1.00 0.41 C ATOM 306 O4 U A 10 43.440 29.413 19.044 1.00 0.50 O ATOM 307 C5 U A 10 42.010 27.980 20.290 1.00 0.36 C ATOM 308 C6 U A 10 40.979 27.910 21.177 1.00 0.29 C ATOM 0 H5' U A 10 39.634 25.413 22.423 1.00 0.28 H new ATOM 0 H5'' U A 10 39.940 25.529 24.145 1.00 0.28 H new ATOM 0 H4' U A 10 37.777 26.936 24.234 1.00 0.24 H new ATOM 0 H3' U A 10 38.135 26.665 21.258 1.00 0.20 H new ATOM 0 H2' U A 10 37.891 29.107 20.958 1.00 0.25 H new ATOM 0 HO2' U A 10 36.058 29.389 22.153 1.00 0.37 H new ATOM 0 H1' U A 10 39.275 29.945 23.173 1.00 0.27 H new ATOM 0 H3 U A 10 42.184 31.270 20.092 1.00 0.41 H new ATOM 0 H5 U A 10 42.457 27.069 19.920 1.00 0.36 H new ATOM 0 H6 U A 10 40.621 26.943 21.498 1.00 0.29 H new ATOM 319 P U A 11 35.349 27.161 20.917 1.00 0.27 P ATOM 320 OP1 U A 11 35.267 28.625 20.717 1.00 0.34 O ATOM 321 OP2 U A 11 34.105 26.391 21.124 1.00 0.40 O ATOM 322 O5' U A 11 36.141 26.530 19.658 1.00 0.32 O ATOM 323 C5' U A 11 37.139 27.292 18.969 1.00 0.28 C ATOM 324 C4' U A 11 37.716 26.538 17.767 1.00 0.24 C ATOM 325 O4' U A 11 38.490 25.421 18.204 1.00 0.28 O ATOM 326 C3' U A 11 36.629 26.023 16.838 1.00 0.22 C ATOM 327 O3' U A 11 37.099 26.025 15.495 1.00 0.23 O ATOM 328 C2' U A 11 36.396 24.595 17.366 1.00 0.23 C ATOM 329 O2' U A 11 36.002 23.694 16.328 1.00 0.28 O ATOM 330 C1' U A 11 37.770 24.221 17.924 1.00 0.25 C ATOM 331 N1 U A 11 37.632 23.424 19.161 1.00 0.26 N ATOM 332 C2 U A 11 37.644 22.043 19.053 1.00 0.26 C ATOM 333 O2 U A 11 37.711 21.467 17.980 1.00 0.33 O ATOM 334 N3 U A 11 37.577 21.344 20.238 1.00 0.28 N ATOM 335 C4 U A 11 37.496 21.891 21.501 1.00 0.32 C ATOM 336 O4 U A 11 37.457 21.179 22.492 1.00 0.40 O ATOM 337 C5 U A 11 37.481 23.325 21.519 1.00 0.35 C ATOM 338 C6 U A 11 37.548 24.036 20.378 1.00 0.32 C ATOM 0 H5' U A 11 37.944 27.541 19.660 1.00 0.28 H new ATOM 0 H5'' U A 11 36.706 28.233 18.631 1.00 0.28 H new ATOM 0 H4' U A 11 38.338 27.250 17.224 1.00 0.24 H new ATOM 0 H3' U A 11 35.718 26.621 16.828 1.00 0.22 H new ATOM 0 H2' U A 11 35.591 24.540 18.098 1.00 0.23 H new ATOM 0 HO2' U A 11 35.228 23.171 16.625 1.00 0.28 H new ATOM 0 H1' U A 11 38.306 23.620 17.189 1.00 0.25 H new ATOM 0 H3 U A 11 37.588 20.326 20.175 1.00 0.28 H new ATOM 0 H5 U A 11 37.415 23.843 22.464 1.00 0.35 H new ATOM 0 H6 U A 11 37.535 25.115 20.427 1.00 0.32 H new ATOM 349 P U A 12 36.052 26.014 14.281 1.00 0.25 P ATOM 350 OP1 U A 12 36.640 26.731 13.136 1.00 0.30 O ATOM 351 OP2 U A 12 34.729 26.430 14.803 1.00 0.29 O ATOM 352 O5' U A 12 36.011 24.455 13.909 1.00 0.28 O ATOM 353 C5' U A 12 34.783 23.813 13.615 1.00 0.29 C ATOM 354 C4' U A 12 34.931 22.297 13.604 1.00 0.25 C ATOM 355 O4' U A 12 35.489 21.813 14.824 1.00 0.23 O ATOM 356 C3' U A 12 33.585 21.648 13.382 1.00 0.25 C ATOM 357 O3' U A 12 33.631 20.804 12.235 1.00 0.26 O ATOM 358 C2' U A 12 33.323 20.844 14.654 1.00 0.30 C ATOM 359 O2' U A 12 32.768 19.560 14.357 1.00 0.39 O ATOM 360 C1' U A 12 34.702 20.710 15.262 1.00 0.24 C ATOM 361 N1 U A 12 34.603 20.653 16.740 1.00 0.28 N ATOM 362 C2 U A 12 34.380 19.411 17.316 1.00 0.34 C ATOM 363 O2 U A 12 34.284 18.390 16.646 1.00 0.40 O ATOM 364 N3 U A 12 34.263 19.383 18.689 1.00 0.39 N ATOM 365 C4 U A 12 34.336 20.470 19.529 1.00 0.42 C ATOM 366 O4 U A 12 34.230 20.327 20.739 1.00 0.49 O ATOM 367 C5 U A 12 34.571 21.722 18.856 1.00 0.41 C ATOM 368 C6 U A 12 34.700 21.776 17.515 1.00 0.34 C ATOM 0 H5' U A 12 34.419 24.151 12.645 1.00 0.29 H new ATOM 0 H5'' U A 12 34.035 24.101 14.354 1.00 0.29 H new ATOM 0 H4' U A 12 35.609 22.040 12.791 1.00 0.25 H new ATOM 0 H3' U A 12 32.793 22.374 13.198 1.00 0.25 H new ATOM 0 H2' U A 12 32.602 21.322 15.317 1.00 0.30 H new ATOM 0 HO2' U A 12 32.167 19.288 15.082 1.00 0.39 H new ATOM 0 H1' U A 12 35.179 19.785 14.939 1.00 0.24 H new ATOM 0 H3 U A 12 34.108 18.473 19.122 1.00 0.39 H new ATOM 0 H5 U A 12 34.645 22.631 19.434 1.00 0.41 H new ATOM 0 H6 U A 12 34.884 22.729 17.041 1.00 0.34 H new ATOM 379 P G A 13 32.313 20.642 11.335 1.00 0.23 P ATOM 380 OP1 G A 13 32.702 20.037 10.057 1.00 0.28 O ATOM 381 OP2 G A 13 31.576 21.922 11.348 1.00 0.31 O ATOM 382 O5' G A 13 31.472 19.552 12.183 1.00 0.26 O ATOM 383 C5' G A 13 31.509 18.168 11.823 1.00 0.21 C ATOM 384 C4' G A 13 30.837 17.283 12.870 1.00 0.22 C ATOM 385 O4' G A 13 31.526 17.348 14.116 1.00 0.27 O ATOM 386 C3' G A 13 29.399 17.716 13.109 1.00 0.22 C ATOM 387 O3' G A 13 28.493 17.072 12.203 1.00 0.24 O ATOM 388 C2' G A 13 29.169 17.247 14.539 1.00 0.27 C ATOM 389 O2' G A 13 28.684 15.907 14.564 1.00 0.34 O ATOM 390 C1' G A 13 30.557 17.356 15.163 1.00 0.25 C ATOM 391 N9 G A 13 30.639 18.576 15.968 1.00 0.27 N ATOM 392 C8 G A 13 30.424 19.873 15.579 1.00 0.31 C ATOM 393 N7 G A 13 30.450 20.740 16.543 1.00 0.34 N ATOM 394 C5 G A 13 30.711 19.961 17.672 1.00 0.32 C ATOM 395 C6 G A 13 30.852 20.351 19.029 1.00 0.36 C ATOM 396 O6 G A 13 30.786 21.477 19.511 1.00 0.42 O ATOM 397 N1 G A 13 31.102 19.255 19.849 1.00 0.36 N ATOM 398 C2 G A 13 31.210 17.950 19.412 1.00 0.34 C ATOM 399 N2 G A 13 31.469 17.043 20.351 1.00 0.40 N ATOM 400 N3 G A 13 31.082 17.578 18.138 1.00 0.31 N ATOM 401 C4 G A 13 30.830 18.635 17.326 1.00 0.28 C ATOM 0 H5' G A 13 32.545 17.855 11.696 1.00 0.21 H new ATOM 0 H5'' G A 13 31.014 18.031 10.862 1.00 0.21 H new ATOM 0 H4' G A 13 30.862 16.264 12.483 1.00 0.22 H new ATOM 0 H3' G A 13 29.232 18.782 12.955 1.00 0.22 H new ATOM 0 H2' G A 13 28.419 17.831 15.073 1.00 0.27 H new ATOM 0 HO2' G A 13 27.799 15.887 14.985 1.00 0.34 H new ATOM 0 H1' G A 13 30.752 16.512 15.825 1.00 0.25 H new ATOM 0 H8 G A 13 30.247 20.151 14.550 1.00 0.31 H new ATOM 0 H1 G A 13 31.214 19.429 20.848 1.00 0.36 H new ATOM 0 H21 G A 13 31.562 16.059 20.098 1.00 0.40 H new ATOM 0 H22 G A 13 31.575 17.332 21.324 1.00 0.40 H new ATOM 413 P C A 14 26.931 17.491 12.143 1.00 0.21 P ATOM 414 OP1 C A 14 26.430 17.199 10.789 1.00 0.28 O ATOM 415 OP2 C A 14 26.789 18.855 12.686 1.00 0.22 O ATOM 416 O5' C A 14 26.229 16.471 13.176 1.00 0.22 O ATOM 417 C5' C A 14 26.336 15.061 12.997 1.00 0.24 C ATOM 418 C4' C A 14 26.035 14.303 14.275 1.00 0.25 C ATOM 419 O4' C A 14 26.829 14.799 15.342 1.00 0.28 O ATOM 420 C3' C A 14 24.581 14.414 14.660 1.00 0.22 C ATOM 421 O3' C A 14 23.814 13.347 14.101 1.00 0.21 O ATOM 422 C2' C A 14 24.673 14.311 16.171 1.00 0.29 C ATOM 423 O2' C A 14 24.692 12.947 16.600 1.00 0.36 O ATOM 424 C1' C A 14 25.995 14.994 16.466 1.00 0.29 C ATOM 425 N1 C A 14 25.813 16.432 16.740 1.00 0.28 N ATOM 426 C2 C A 14 25.511 16.801 18.040 1.00 0.31 C ATOM 427 O2 C A 14 25.374 15.940 18.912 1.00 0.35 O ATOM 428 N3 C A 14 25.363 18.126 18.312 1.00 0.34 N ATOM 429 C4 C A 14 25.523 19.049 17.356 1.00 0.33 C ATOM 430 N4 C A 14 25.401 20.331 17.670 1.00 0.38 N ATOM 431 C5 C A 14 25.843 18.675 16.026 1.00 0.31 C ATOM 432 C6 C A 14 25.989 17.370 15.763 1.00 0.29 C ATOM 0 H5' C A 14 27.342 14.814 12.657 1.00 0.24 H new ATOM 0 H5'' C A 14 25.647 14.741 12.215 1.00 0.24 H new ATOM 0 H4' C A 14 26.269 13.255 14.089 1.00 0.25 H new ATOM 0 H3' C A 14 24.085 15.318 14.305 1.00 0.22 H new ATOM 0 H2' C A 14 23.824 14.760 16.687 1.00 0.29 H new ATOM 0 HO2' C A 14 24.370 12.890 17.524 1.00 0.36 H new ATOM 0 H1' C A 14 26.445 14.564 17.361 1.00 0.29 H new ATOM 0 H41 C A 14 25.520 21.046 16.952 1.00 0.38 H new ATOM 0 H42 C A 14 25.188 20.603 18.630 1.00 0.38 H new ATOM 0 H5 C A 14 25.965 19.418 15.251 1.00 0.31 H new ATOM 0 H6 C A 14 26.250 17.055 14.764 1.00 0.29 H new ATOM 444 P U A 15 22.207 13.435 14.077 1.00 0.19 P ATOM 445 OP1 U A 15 21.670 12.223 13.416 1.00 0.27 O ATOM 446 OP2 U A 15 21.827 14.777 13.569 1.00 0.26 O ATOM 447 O5' U A 15 21.850 13.357 15.650 1.00 0.22 O ATOM 448 C5' U A 15 22.103 12.168 16.399 1.00 0.21 C ATOM 449 C4' U A 15 22.001 12.400 17.897 1.00 0.21 C ATOM 450 O4' U A 15 22.966 13.355 18.303 1.00 0.26 O ATOM 451 C3' U A 15 20.628 12.911 18.297 1.00 0.22 C ATOM 452 O3' U A 15 19.716 11.830 18.571 1.00 0.24 O ATOM 453 C2' U A 15 20.960 13.710 19.553 1.00 0.28 C ATOM 454 O2' U A 15 20.997 12.879 20.714 1.00 0.38 O ATOM 455 C1' U A 15 22.349 14.249 19.223 1.00 0.27 C ATOM 456 N1 U A 15 22.260 15.612 18.660 1.00 0.23 N ATOM 457 C2 U A 15 22.555 16.682 19.498 1.00 0.22 C ATOM 458 O2 U A 15 22.893 16.533 20.673 1.00 0.28 O ATOM 459 N3 U A 15 22.456 17.937 18.933 1.00 0.20 N ATOM 460 C4 U A 15 22.097 18.222 17.630 1.00 0.21 C ATOM 461 O4 U A 15 22.039 19.387 17.238 1.00 0.24 O ATOM 462 C5 U A 15 21.811 17.055 16.829 1.00 0.23 C ATOM 463 C6 U A 15 21.898 15.810 17.358 1.00 0.24 C ATOM 0 H5' U A 15 23.098 11.794 16.158 1.00 0.21 H new ATOM 0 H5'' U A 15 21.392 11.396 16.103 1.00 0.21 H new ATOM 0 H4' U A 15 22.175 11.441 18.385 1.00 0.21 H new ATOM 0 H3' U A 15 20.124 13.491 17.524 1.00 0.22 H new ATOM 0 H2' U A 15 20.225 14.480 19.785 1.00 0.28 H new ATOM 0 HO2' U A 15 21.214 13.424 21.499 1.00 0.38 H new ATOM 0 H1' U A 15 22.950 14.315 20.130 1.00 0.27 H new ATOM 0 H3 U A 15 22.669 18.732 19.536 1.00 0.20 H new ATOM 0 H5 U A 15 21.524 17.176 15.795 1.00 0.23 H new ATOM 0 H6 U A 15 21.676 14.955 16.736 1.00 0.24 H new ATOM 474 P C A 16 18.139 12.108 18.741 1.00 0.24 P ATOM 475 OP1 C A 16 17.427 10.813 18.766 1.00 0.31 O ATOM 476 OP2 C A 16 17.725 13.124 17.753 1.00 0.28 O ATOM 477 O5' C A 16 18.044 12.772 20.204 1.00 0.22 O ATOM 478 C5' C A 16 18.532 12.077 21.344 1.00 0.24 C ATOM 479 C4' C A 16 18.441 12.926 22.598 1.00 0.22 C ATOM 480 O4' C A 16 19.270 14.078 22.485 1.00 0.24 O ATOM 481 C3' C A 16 17.011 13.384 22.826 1.00 0.21 C ATOM 482 O3' C A 16 16.267 12.418 23.575 1.00 0.23 O ATOM 483 C2' C A 16 17.258 14.656 23.614 1.00 0.24 C ATOM 484 O2' C A 16 17.432 14.368 25.004 1.00 0.32 O ATOM 485 C1' C A 16 18.545 15.192 22.996 1.00 0.22 C ATOM 486 N1 C A 16 18.275 16.166 21.910 1.00 0.24 N ATOM 487 C2 C A 16 18.107 17.490 22.258 1.00 0.32 C ATOM 488 O2 C A 16 18.151 17.839 23.443 1.00 0.42 O ATOM 489 N3 C A 16 17.903 18.407 21.263 1.00 0.39 N ATOM 490 C4 C A 16 17.870 18.021 19.977 1.00 0.38 C ATOM 491 N4 C A 16 17.682 18.931 19.029 1.00 0.49 N ATOM 492 C5 C A 16 18.040 16.649 19.617 1.00 0.32 C ATOM 493 C6 C A 16 18.238 15.766 20.609 1.00 0.26 C ATOM 0 H5' C A 16 19.569 11.785 21.176 1.00 0.24 H new ATOM 0 H5'' C A 16 17.961 11.159 21.483 1.00 0.24 H new ATOM 0 H4' C A 16 18.773 12.314 23.437 1.00 0.22 H new ATOM 0 H3' C A 16 16.419 13.524 21.922 1.00 0.21 H new ATOM 0 H2' C A 16 16.432 15.365 23.566 1.00 0.24 H new ATOM 0 HO2' C A 16 17.431 15.205 25.514 1.00 0.32 H new ATOM 0 H1' C A 16 19.118 15.722 23.757 1.00 0.22 H new ATOM 0 H41 C A 16 17.655 18.649 18.049 1.00 0.49 H new ATOM 0 H42 C A 16 17.564 19.912 19.280 1.00 0.49 H new ATOM 0 H5 C A 16 18.010 16.333 18.585 1.00 0.32 H new ATOM 0 H6 C A 16 18.370 14.721 20.371 1.00 0.26 H new ATOM 505 P A A 17 14.653 12.414 23.543 1.00 0.23 P ATOM 506 OP1 A A 17 14.178 11.305 24.394 1.00 0.29 O ATOM 507 OP2 A A 17 14.195 12.487 22.130 1.00 0.27 O ATOM 508 O5' A A 17 14.315 13.800 24.263 1.00 0.26 O ATOM 509 C5' A A 17 14.768 14.054 25.593 1.00 0.30 C ATOM 510 C4' A A 17 14.751 15.536 25.929 1.00 0.31 C ATOM 511 O4' A A 17 15.497 16.297 24.991 1.00 0.30 O ATOM 512 C3' A A 17 13.355 16.097 25.929 1.00 0.38 C ATOM 513 O3' A A 17 12.661 15.754 27.130 1.00 0.51 O ATOM 514 C2' A A 17 13.667 17.577 25.885 1.00 0.40 C ATOM 515 O2' A A 17 13.943 18.085 27.204 1.00 0.51 O ATOM 516 C1' A A 17 14.911 17.595 24.990 1.00 0.32 C ATOM 517 N9 A A 17 14.555 18.009 23.634 1.00 0.29 N ATOM 518 C8 A A 17 14.440 17.255 22.501 1.00 0.30 C ATOM 519 N7 A A 17 14.117 17.921 21.428 1.00 0.30 N ATOM 520 C5 A A 17 14.005 19.225 21.887 1.00 0.30 C ATOM 521 C6 A A 17 13.666 20.429 21.257 1.00 0.36 C ATOM 522 N6 A A 17 13.369 20.505 19.960 1.00 0.39 N ATOM 523 N1 A A 17 13.631 21.539 22.007 1.00 0.45 N ATOM 524 C2 A A 17 13.910 21.472 23.310 1.00 0.48 C ATOM 525 N3 A A 17 14.238 20.393 24.000 1.00 0.42 N ATOM 526 C4 A A 17 14.266 19.294 23.223 1.00 0.32 C ATOM 0 H5' A A 17 15.780 13.668 25.711 1.00 0.30 H new ATOM 0 H5'' A A 17 14.137 13.515 26.300 1.00 0.30 H new ATOM 0 H4' A A 17 15.192 15.611 26.923 1.00 0.31 H new ATOM 0 H3' A A 17 12.713 15.735 25.126 1.00 0.38 H new ATOM 0 H2' A A 17 12.854 18.203 25.517 1.00 0.40 H new ATOM 0 HO2' A A 17 13.527 17.502 27.873 1.00 0.51 H new ATOM 0 HO3' A A 17 11.757 16.132 27.105 1.00 0.51 H new ATOM 0 H1' A A 17 15.634 18.314 25.375 1.00 0.32 H new ATOM 0 H8 A A 17 14.604 16.188 22.495 1.00 0.30 H new ATOM 0 H61 A A 17 13.128 21.404 19.544 1.00 0.39 H new ATOM 0 H62 A A 17 13.383 19.664 19.383 1.00 0.39 H new ATOM 0 H2 A A 17 13.863 22.400 23.861 1.00 0.48 H new TER 539 A A 17