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= -0.815 USER MOD Single : A 1 U O5' : rot 38:sc= 0.132 USER MOD Single : A 2 G O2' : rot 180:sc= -5.11! USER MOD Single : A 3 A O2' : rot -163:sc= -1.42! USER MOD Single : A 4 G O2' : rot 180:sc= -2.94! USER MOD Single : A 5 C O2' : rot -100:sc= 1.11 USER MOD Single : A 6 U O2' : rot -18:sc= 0.0973 USER MOD Single : A 7 C O2' : rot -84:sc= 0.502 USER MOD Single : A 8 A O2' : rot -17:sc= -0.919 USER MOD Single : A 9 G O2' : rot -15:sc= 0.111 USER MOD Single : A 10 U O2' : rot -91:sc= 1.17 USER MOD Single : A 11 U O2' : rot -116:sc= 0.266 USER MOD Single : A 12 U O2' : rot -139:sc= -1.38! USER MOD Single : A 13 G O2' : rot 180:sc= -2.75! USER MOD Single : A 14 C O2' : rot -127:sc= -0.329 USER MOD Single : A 15 U O2' : rot 180:sc= -4.15! USER MOD Single : A 16 C O2' : rot -18:sc= 0.228 USER MOD Single : A 17 A O2' : rot -18:sc= 0.134 USER MOD Single : A 17 A O3' : rot 180:sc= 0.161 USER MOD ----------------------------------------------------------------- ATOM 1 O5' U A 1 15.590 29.521 17.080 1.00 0.36 O ATOM 2 C5' U A 1 15.025 30.543 17.904 1.00 0.26 C ATOM 3 C4' U A 1 14.593 30.029 19.285 1.00 0.21 C ATOM 4 O4' U A 1 13.448 29.176 19.186 1.00 0.22 O ATOM 5 C3' U A 1 15.700 29.237 19.961 1.00 0.22 C ATOM 6 O3' U A 1 16.636 30.098 20.637 1.00 0.26 O ATOM 7 C2' U A 1 14.879 28.391 20.932 1.00 0.24 C ATOM 8 O2' U A 1 14.551 29.121 22.117 1.00 0.30 O ATOM 9 C1' U A 1 13.635 28.093 20.100 1.00 0.22 C ATOM 10 N1 U A 1 13.767 26.824 19.353 1.00 0.24 N ATOM 11 C2 U A 1 14.061 25.674 20.063 1.00 0.29 C ATOM 12 O2 U A 1 14.226 25.682 21.287 1.00 0.36 O ATOM 13 N3 U A 1 14.141 24.511 19.320 1.00 0.32 N ATOM 14 C4 U A 1 13.957 24.396 17.957 1.00 0.31 C ATOM 15 O4 U A 1 14.047 23.305 17.396 1.00 0.38 O ATOM 16 C5 U A 1 13.671 25.646 17.298 1.00 0.31 C ATOM 17 C6 U A 1 13.587 26.798 17.998 1.00 0.28 C ATOM 0 H5' U A 1 14.162 30.975 17.397 1.00 0.26 H new ATOM 0 H5'' U A 1 15.754 31.343 18.032 1.00 0.26 H new ATOM 0 H4' U A 1 14.356 30.913 19.877 1.00 0.21 H new ATOM 0 H3' U A 1 16.330 28.659 19.285 1.00 0.22 H new ATOM 0 H2' U A 1 15.397 27.502 21.292 1.00 0.24 H new ATOM 0 HO2' U A 1 14.025 28.552 22.717 1.00 0.30 H new ATOM 0 HO5' U A 1 15.107 28.681 17.224 1.00 0.36 H new ATOM 0 H1' U A 1 12.777 27.988 20.764 1.00 0.22 H new ATOM 0 H3 U A 1 14.357 23.654 19.829 1.00 0.32 H new ATOM 0 H5 U A 1 13.522 25.661 16.228 1.00 0.31 H new ATOM 0 H6 U A 1 13.373 27.719 17.476 1.00 0.28 H new ATOM 29 P G A 2 18.188 29.657 20.798 1.00 0.29 P ATOM 30 OP1 G A 2 18.981 30.855 21.169 1.00 0.39 O ATOM 31 OP2 G A 2 18.585 28.864 19.623 1.00 0.33 O ATOM 32 O5' G A 2 18.114 28.678 22.073 1.00 0.28 O ATOM 33 C5' G A 2 17.481 29.106 23.280 1.00 0.28 C ATOM 34 C4' G A 2 17.182 27.930 24.189 1.00 0.26 C ATOM 35 O4' G A 2 16.368 26.970 23.506 1.00 0.29 O ATOM 36 C3' G A 2 18.474 27.241 24.609 1.00 0.22 C ATOM 37 O3' G A 2 18.965 27.753 25.850 1.00 0.20 O ATOM 38 C2' G A 2 18.030 25.789 24.758 1.00 0.25 C ATOM 39 O2' G A 2 17.575 25.521 26.084 1.00 0.28 O ATOM 40 C1' G A 2 16.893 25.674 23.751 1.00 0.28 C ATOM 41 N9 G A 2 17.381 25.036 22.515 1.00 0.27 N ATOM 42 C8 G A 2 17.723 25.596 21.317 1.00 0.29 C ATOM 43 N7 G A 2 18.140 24.758 20.422 1.00 0.30 N ATOM 44 C5 G A 2 18.080 23.544 21.079 1.00 0.28 C ATOM 45 C6 G A 2 18.404 22.234 20.631 1.00 0.30 C ATOM 46 O6 G A 2 18.851 21.886 19.540 1.00 0.36 O ATOM 47 N1 G A 2 18.208 21.300 21.632 1.00 0.30 N ATOM 48 C2 G A 2 17.733 21.562 22.887 1.00 0.30 C ATOM 49 N2 G A 2 17.623 20.522 23.715 1.00 0.34 N ATOM 50 N3 G A 2 17.419 22.777 23.313 1.00 0.28 N ATOM 51 C4 G A 2 17.613 23.710 22.367 1.00 0.27 C ATOM 0 H5' G A 2 16.555 29.630 23.042 1.00 0.28 H new ATOM 0 H5'' G A 2 18.125 29.816 23.799 1.00 0.28 H new ATOM 0 H4' G A 2 16.659 28.310 25.067 1.00 0.26 H new ATOM 0 H3' G A 2 19.290 27.386 23.901 1.00 0.22 H new ATOM 0 H2' G A 2 18.834 25.074 24.581 1.00 0.25 H new ATOM 0 HO2' G A 2 17.296 24.584 26.151 1.00 0.28 H new ATOM 0 H1' G A 2 16.094 25.047 24.146 1.00 0.28 H new ATOM 0 H8 G A 2 17.651 26.657 21.130 1.00 0.29 H new ATOM 0 H1 G A 2 18.438 20.330 21.415 1.00 0.30 H new ATOM 0 H21 G A 2 17.274 20.660 24.663 1.00 0.34 H new ATOM 0 H22 G A 2 17.888 19.589 23.400 1.00 0.34 H new ATOM 63 P A A 3 20.530 27.672 26.201 1.00 0.21 P ATOM 64 OP1 A A 3 20.744 28.304 27.512 1.00 0.29 O ATOM 65 OP2 A A 3 21.300 28.168 25.039 1.00 0.29 O ATOM 66 O5' A A 3 20.789 26.082 26.333 1.00 0.23 O ATOM 67 C5' A A 3 20.058 25.286 27.269 1.00 0.23 C ATOM 68 C4' A A 3 20.455 23.798 27.202 1.00 0.22 C ATOM 69 O4' A A 3 19.729 23.106 26.196 1.00 0.25 O ATOM 70 C3' A A 3 21.936 23.585 26.893 1.00 0.25 C ATOM 71 O3' A A 3 22.772 23.762 28.049 1.00 0.26 O ATOM 72 C2' A A 3 21.908 22.110 26.446 1.00 0.29 C ATOM 73 O2' A A 3 21.919 21.216 27.587 1.00 0.35 O ATOM 74 C1' A A 3 20.571 22.048 25.714 1.00 0.27 C ATOM 75 N9 A A 3 20.755 22.118 24.257 1.00 0.28 N ATOM 76 C8 A A 3 20.900 23.216 23.458 1.00 0.31 C ATOM 77 N7 A A 3 21.163 22.905 22.217 1.00 0.33 N ATOM 78 C5 A A 3 21.176 21.499 22.209 1.00 0.33 C ATOM 79 C6 A A 3 21.409 20.546 21.211 1.00 0.38 C ATOM 80 N6 A A 3 21.680 20.889 19.948 1.00 0.42 N ATOM 81 N1 A A 3 21.355 19.247 21.556 1.00 0.42 N ATOM 82 C2 A A 3 21.085 18.888 22.807 1.00 0.39 C ATOM 83 N3 A A 3 20.863 19.723 23.823 1.00 0.34 N ATOM 84 C4 A A 3 20.932 21.020 23.436 1.00 0.30 C ATOM 0 H5' A A 3 18.991 25.385 27.072 1.00 0.23 H new ATOM 0 H5'' A A 3 20.232 25.662 28.277 1.00 0.23 H new ATOM 0 H4' A A 3 20.225 23.410 28.194 1.00 0.22 H new ATOM 0 H3' A A 3 22.347 24.288 26.168 1.00 0.25 H new ATOM 0 H2' A A 3 22.765 21.808 25.844 1.00 0.29 H new ATOM 0 HO2' A A 3 22.177 20.317 27.295 1.00 0.35 H new ATOM 0 H1' A A 3 20.090 21.091 25.917 1.00 0.27 H new ATOM 0 H8 A A 3 20.807 24.232 23.814 1.00 0.31 H new ATOM 0 H61 A A 3 21.844 20.166 19.247 1.00 0.42 H new ATOM 0 H62 A A 3 21.722 21.874 19.685 1.00 0.42 H new ATOM 0 H2 A A 3 21.042 17.830 23.019 1.00 0.39 H new ATOM 96 P G A 4 24.375 23.783 27.898 1.00 0.25 P ATOM 97 OP1 G A 4 24.952 24.274 29.161 1.00 0.32 O ATOM 98 OP2 G A 4 24.716 24.482 26.647 1.00 0.31 O ATOM 99 O5' G A 4 24.755 22.218 27.724 1.00 0.26 O ATOM 100 C5' G A 4 24.408 21.285 28.742 1.00 0.27 C ATOM 101 C4' G A 4 24.430 19.844 28.255 1.00 0.25 C ATOM 102 O4' G A 4 23.679 19.709 27.042 1.00 0.27 O ATOM 103 C3' G A 4 25.862 19.402 27.966 1.00 0.23 C ATOM 104 O3' G A 4 26.499 18.870 29.136 1.00 0.25 O ATOM 105 C2' G A 4 25.604 18.313 26.918 1.00 0.25 C ATOM 106 O2' G A 4 25.254 17.054 27.530 1.00 0.31 O ATOM 107 C1' G A 4 24.427 18.891 26.141 1.00 0.26 C ATOM 108 N9 G A 4 24.894 19.675 24.982 1.00 0.26 N ATOM 109 C8 G A 4 25.091 21.019 24.897 1.00 0.29 C ATOM 110 N7 G A 4 25.495 21.438 23.735 1.00 0.30 N ATOM 111 C5 G A 4 25.573 20.267 22.984 1.00 0.27 C ATOM 112 C6 G A 4 25.961 20.073 21.631 1.00 0.30 C ATOM 113 O6 G A 4 26.277 20.925 20.794 1.00 0.36 O ATOM 114 N1 G A 4 25.905 18.736 21.274 1.00 0.33 N ATOM 115 C2 G A 4 25.534 17.706 22.116 1.00 0.32 C ATOM 116 N2 G A 4 25.540 16.486 21.599 1.00 0.38 N ATOM 117 N3 G A 4 25.164 17.884 23.380 1.00 0.27 N ATOM 118 C4 G A 4 25.212 19.180 23.749 1.00 0.25 C ATOM 0 H5' G A 4 23.413 21.520 29.120 1.00 0.27 H new ATOM 0 H5'' G A 4 25.100 21.392 29.577 1.00 0.27 H new ATOM 0 H4' G A 4 23.992 19.227 29.039 1.00 0.25 H new ATOM 0 H3' G A 4 26.530 20.200 27.642 1.00 0.23 H new ATOM 0 H2' G A 4 26.475 18.090 26.303 1.00 0.25 H new ATOM 0 HO2' G A 4 25.095 16.384 26.833 1.00 0.31 H new ATOM 0 H1' G A 4 23.802 18.089 25.748 1.00 0.26 H new ATOM 0 H8 G A 4 24.925 21.685 25.730 1.00 0.29 H new ATOM 0 H1 G A 4 26.157 18.493 20.316 1.00 0.33 H new ATOM 0 H21 G A 4 25.275 15.687 22.175 1.00 0.38 H new ATOM 0 H22 G A 4 25.810 16.346 20.625 1.00 0.38 H new ATOM 130 P C A 5 28.095 18.977 29.310 1.00 0.22 P ATOM 131 OP1 C A 5 28.466 18.303 30.575 1.00 0.29 O ATOM 132 OP2 C A 5 28.503 20.381 29.088 1.00 0.28 O ATOM 133 O5' C A 5 28.622 18.072 28.086 1.00 0.23 O ATOM 134 C5' C A 5 28.184 16.713 27.976 1.00 0.21 C ATOM 135 C4' C A 5 28.684 16.059 26.701 1.00 0.23 C ATOM 136 O4' C A 5 27.993 16.577 25.580 1.00 0.25 O ATOM 137 C3' C A 5 30.154 16.327 26.498 1.00 0.25 C ATOM 138 O3' C A 5 30.974 15.383 27.198 1.00 0.32 O ATOM 139 C2' C A 5 30.286 16.204 24.988 1.00 0.33 C ATOM 140 O2' C A 5 30.586 14.854 24.602 1.00 0.43 O ATOM 141 C1' C A 5 28.904 16.632 24.494 1.00 0.30 C ATOM 142 N1 C A 5 28.956 17.991 23.907 1.00 0.29 N ATOM 143 C2 C A 5 29.170 18.095 22.541 1.00 0.42 C ATOM 144 O2 C A 5 29.292 17.086 21.858 1.00 0.53 O ATOM 145 N3 C A 5 29.219 19.334 21.986 1.00 0.44 N ATOM 146 C4 C A 5 29.061 20.426 22.737 1.00 0.35 C ATOM 147 N4 C A 5 29.122 21.622 22.158 1.00 0.42 N ATOM 148 C5 C A 5 28.839 20.325 24.142 1.00 0.25 C ATOM 149 C6 C A 5 28.801 19.105 24.681 1.00 0.23 C ATOM 0 H5' C A 5 27.095 16.680 27.998 1.00 0.21 H new ATOM 0 H5'' C A 5 28.538 16.147 28.837 1.00 0.21 H new ATOM 0 H4' C A 5 28.511 14.987 26.796 1.00 0.23 H new ATOM 0 H3' C A 5 30.486 17.290 26.886 1.00 0.25 H new ATOM 0 H2' C A 5 31.096 16.804 24.573 1.00 0.33 H new ATOM 0 HO2' C A 5 31.545 14.772 24.416 1.00 0.43 H new ATOM 0 H1' C A 5 28.568 15.954 23.710 1.00 0.30 H new ATOM 0 H41 C A 5 29.003 22.466 22.718 1.00 0.42 H new ATOM 0 H42 C A 5 29.287 21.695 21.154 1.00 0.42 H new ATOM 0 H5 C A 5 28.706 21.207 24.750 1.00 0.25 H new ATOM 0 H6 C A 5 28.645 18.997 25.744 1.00 0.23 H new ATOM 161 P U A 6 32.465 15.806 27.634 1.00 0.30 P ATOM 162 OP1 U A 6 32.697 15.339 29.020 1.00 0.45 O ATOM 163 OP2 U A 6 32.670 17.232 27.309 1.00 0.35 O ATOM 164 O5' U A 6 33.353 14.913 26.630 1.00 0.24 O ATOM 165 C5' U A 6 33.353 13.486 26.744 1.00 0.27 C ATOM 166 C4' U A 6 33.758 12.803 25.442 1.00 0.23 C ATOM 167 O4' U A 6 32.916 13.220 24.365 1.00 0.29 O ATOM 168 C3' U A 6 35.190 13.146 25.068 1.00 0.23 C ATOM 169 O3' U A 6 36.139 12.274 25.696 1.00 0.24 O ATOM 170 C2' U A 6 35.144 12.943 23.557 1.00 0.30 C ATOM 171 O2' U A 6 35.248 11.560 23.194 1.00 0.40 O ATOM 172 C1' U A 6 33.757 13.490 23.237 1.00 0.28 C ATOM 173 N1 U A 6 33.798 14.944 22.961 1.00 0.28 N ATOM 174 C2 U A 6 34.142 15.344 21.684 1.00 0.31 C ATOM 175 O2 U A 6 34.391 14.547 20.795 1.00 0.38 O ATOM 176 N3 U A 6 34.177 16.706 21.467 1.00 0.35 N ATOM 177 C4 U A 6 33.914 17.690 22.398 1.00 0.41 C ATOM 178 O4 U A 6 34.018 18.871 22.099 1.00 0.53 O ATOM 179 C5 U A 6 33.568 17.181 23.705 1.00 0.41 C ATOM 180 C6 U A 6 33.519 15.852 23.942 1.00 0.34 C ATOM 0 H5' U A 6 32.359 13.147 27.036 1.00 0.27 H new ATOM 0 H5'' U A 6 34.038 13.187 27.537 1.00 0.27 H new ATOM 0 H4' U A 6 33.660 11.730 25.604 1.00 0.23 H new ATOM 0 H3' U A 6 35.509 14.140 25.383 1.00 0.23 H new ATOM 0 H2' U A 6 35.963 13.423 23.021 1.00 0.30 H new ATOM 0 HO2' U A 6 35.614 11.051 23.947 1.00 0.40 H new ATOM 0 H1' U A 6 33.369 13.008 22.339 1.00 0.28 H new ATOM 0 H3 U A 6 34.421 17.016 20.526 1.00 0.35 H new ATOM 0 H5 U A 6 33.345 17.873 24.504 1.00 0.41 H new ATOM 0 H6 U A 6 33.254 15.500 24.928 1.00 0.34 H new ATOM 191 P C A 7 37.424 12.892 26.444 1.00 0.27 P ATOM 192 OP1 C A 7 38.278 11.786 26.922 1.00 0.35 O ATOM 193 OP2 C A 7 36.961 13.903 27.416 1.00 0.37 O ATOM 194 O5' C A 7 38.191 13.647 25.242 1.00 0.28 O ATOM 195 C5' C A 7 38.725 12.921 24.129 1.00 0.28 C ATOM 196 C4' C A 7 39.265 13.851 23.072 1.00 0.26 C ATOM 197 O4' C A 7 38.217 14.649 22.545 1.00 0.27 O ATOM 198 C3' C A 7 40.311 14.761 23.696 1.00 0.28 C ATOM 199 O3' C A 7 41.639 14.222 23.545 1.00 0.35 O ATOM 200 C2' C A 7 40.126 16.067 22.920 1.00 0.29 C ATOM 201 O2' C A 7 41.068 16.159 21.841 1.00 0.37 O ATOM 202 C1' C A 7 38.688 15.980 22.400 1.00 0.25 C ATOM 203 N1 C A 7 37.801 16.946 23.097 1.00 0.29 N ATOM 204 C2 C A 7 37.682 18.208 22.542 1.00 0.45 C ATOM 205 O2 C A 7 38.298 18.488 21.515 1.00 0.57 O ATOM 206 N3 C A 7 36.881 19.117 23.166 1.00 0.54 N ATOM 207 C4 C A 7 36.228 18.798 24.292 1.00 0.47 C ATOM 208 N4 C A 7 35.457 19.711 24.881 1.00 0.58 N ATOM 209 C5 C A 7 36.345 17.495 24.867 1.00 0.37 C ATOM 210 C6 C A 7 37.140 16.603 24.242 1.00 0.31 C ATOM 0 H5' C A 7 37.948 12.290 23.698 1.00 0.28 H new ATOM 0 H5'' C A 7 39.519 12.258 24.473 1.00 0.28 H new ATOM 0 H4' C A 7 39.708 13.261 22.270 1.00 0.26 H new ATOM 0 H3' C A 7 40.192 14.886 24.772 1.00 0.28 H new ATOM 0 H2' C A 7 40.295 16.953 23.532 1.00 0.29 H new ATOM 0 HO2' C A 7 41.919 16.509 22.179 1.00 0.37 H new ATOM 0 H1' C A 7 38.677 16.247 21.343 1.00 0.25 H new ATOM 0 H41 C A 7 34.956 19.479 25.738 1.00 0.58 H new ATOM 0 H42 C A 7 35.368 20.642 24.475 1.00 0.58 H new ATOM 0 H5 C A 7 35.815 17.234 25.771 1.00 0.37 H new ATOM 0 H6 C A 7 37.255 15.610 24.650 1.00 0.31 H new ATOM 222 P A A 8 42.689 14.242 24.771 1.00 0.41 P ATOM 223 OP1 A A 8 43.941 13.587 24.335 1.00 0.70 O ATOM 224 OP2 A A 8 41.998 13.735 25.975 1.00 0.60 O ATOM 225 O5' A A 8 42.976 15.818 24.938 1.00 0.38 O ATOM 226 C5' A A 8 43.356 16.366 26.203 1.00 0.36 C ATOM 227 C4' A A 8 43.912 17.780 26.076 1.00 0.30 C ATOM 228 O4' A A 8 45.058 17.806 25.226 1.00 0.35 O ATOM 229 C3' A A 8 42.880 18.736 25.485 1.00 0.24 C ATOM 230 O3' A A 8 42.020 19.303 26.486 1.00 0.24 O ATOM 231 C2' A A 8 43.795 19.788 24.876 1.00 0.27 C ATOM 232 O2' A A 8 44.270 20.712 25.869 1.00 0.33 O ATOM 233 C1' A A 8 44.929 18.920 24.343 1.00 0.30 C ATOM 234 N9 A A 8 44.627 18.482 22.967 1.00 0.32 N ATOM 235 C8 A A 8 44.183 17.269 22.527 1.00 0.38 C ATOM 236 N7 A A 8 43.939 17.210 21.252 1.00 0.43 N ATOM 237 C5 A A 8 44.261 18.493 20.810 1.00 0.40 C ATOM 238 C6 A A 8 44.221 19.098 19.549 1.00 0.46 C ATOM 239 N6 A A 8 43.797 18.472 18.458 1.00 0.54 N ATOM 240 N1 A A 8 44.608 20.383 19.462 1.00 0.45 N ATOM 241 C2 A A 8 45.001 21.040 20.556 1.00 0.40 C ATOM 242 N3 A A 8 45.067 20.565 21.794 1.00 0.35 N ATOM 243 C4 A A 8 44.679 19.274 21.846 1.00 0.34 C ATOM 0 H5' A A 8 44.105 15.723 26.665 1.00 0.36 H new ATOM 0 H5'' A A 8 42.492 16.376 26.867 1.00 0.36 H new ATOM 0 H4' A A 8 44.179 18.097 27.084 1.00 0.30 H new ATOM 0 H3' A A 8 42.187 18.267 24.787 1.00 0.24 H new ATOM 0 H2' A A 8 43.315 20.415 24.124 1.00 0.27 H new ATOM 0 HO2' A A 8 43.705 20.653 26.668 1.00 0.33 H new ATOM 0 H1' A A 8 45.866 19.475 24.304 1.00 0.30 H new ATOM 0 H8 A A 8 44.045 16.425 23.186 1.00 0.38 H new ATOM 0 H61 A A 8 43.788 18.959 17.562 1.00 0.54 H new ATOM 0 H62 A A 8 43.480 17.504 18.516 1.00 0.54 H new ATOM 0 H2 A A 8 45.297 22.069 20.419 1.00 0.40 H new ATOM 255 P G A 9 40.521 19.777 26.105 1.00 0.26 P ATOM 256 OP1 G A 9 39.941 20.466 27.268 1.00 0.38 O ATOM 257 OP2 G A 9 39.809 18.609 25.535 1.00 0.32 O ATOM 258 O5' G A 9 40.770 20.863 24.927 1.00 0.27 O ATOM 259 C5' G A 9 41.453 22.102 25.199 1.00 0.27 C ATOM 260 C4' G A 9 41.729 22.927 23.951 1.00 0.26 C ATOM 261 O4' G A 9 42.533 22.218 23.032 1.00 0.27 O ATOM 262 C3' G A 9 40.444 23.291 23.226 1.00 0.25 C ATOM 263 O3' G A 9 39.786 24.404 23.828 1.00 0.28 O ATOM 264 C2' G A 9 40.991 23.634 21.841 1.00 0.28 C ATOM 265 O2' G A 9 41.495 24.975 21.785 1.00 0.35 O ATOM 266 C1' G A 9 42.129 22.619 21.721 1.00 0.26 C ATOM 267 N9 G A 9 41.703 21.456 20.923 1.00 0.24 N ATOM 268 C8 G A 9 41.382 20.194 21.331 1.00 0.28 C ATOM 269 N7 G A 9 41.038 19.376 20.376 1.00 0.32 N ATOM 270 C5 G A 9 41.133 20.167 19.227 1.00 0.28 C ATOM 271 C6 G A 9 40.894 19.836 17.872 1.00 0.33 C ATOM 272 O6 G A 9 40.513 18.778 17.394 1.00 0.39 O ATOM 273 N1 G A 9 41.113 20.905 17.041 1.00 0.36 N ATOM 274 C2 G A 9 41.514 22.154 17.443 1.00 0.37 C ATOM 275 N2 G A 9 41.657 23.068 16.491 1.00 0.47 N ATOM 276 N3 G A 9 41.752 22.478 18.711 1.00 0.33 N ATOM 277 C4 G A 9 41.549 21.444 19.555 1.00 0.26 C ATOM 0 H5' G A 9 42.397 21.886 25.698 1.00 0.27 H new ATOM 0 H5'' G A 9 40.854 22.694 25.892 1.00 0.27 H new ATOM 0 H4' G A 9 42.240 23.826 24.295 1.00 0.26 H new ATOM 0 H3' G A 9 39.685 22.509 23.233 1.00 0.25 H new ATOM 0 H2' G A 9 40.247 23.586 21.046 1.00 0.28 H new ATOM 0 HO2' G A 9 41.174 25.478 22.563 1.00 0.35 H new ATOM 0 H1' G A 9 42.975 23.077 21.209 1.00 0.26 H new ATOM 0 H8 G A 9 41.411 19.895 22.368 1.00 0.28 H new ATOM 0 H1 G A 9 40.966 20.759 16.042 1.00 0.36 H new ATOM 0 H21 G A 9 41.953 24.014 16.732 1.00 0.47 H new ATOM 0 H22 G A 9 41.471 22.824 15.518 1.00 0.47 H new ATOM 289 P U A 10 38.421 24.167 24.653 1.00 0.32 P ATOM 290 OP1 U A 10 38.207 25.317 25.556 1.00 0.39 O ATOM 291 OP2 U A 10 38.457 22.805 25.226 1.00 0.39 O ATOM 292 O5' U A 10 37.305 24.212 23.498 1.00 0.32 O ATOM 293 C5' U A 10 35.925 24.049 23.823 1.00 0.32 C ATOM 294 C4' U A 10 35.124 25.328 23.613 1.00 0.31 C ATOM 295 O4' U A 10 35.713 26.424 24.307 1.00 0.35 O ATOM 296 C3' U A 10 35.046 25.695 22.138 1.00 0.25 C ATOM 297 O3' U A 10 33.952 25.025 21.491 1.00 0.25 O ATOM 298 C2' U A 10 34.842 27.209 22.216 1.00 0.28 C ATOM 299 O2' U A 10 33.452 27.550 22.316 1.00 0.39 O ATOM 300 C1' U A 10 35.603 27.586 23.491 1.00 0.29 C ATOM 301 N1 U A 10 36.940 28.137 23.172 1.00 0.30 N ATOM 302 C2 U A 10 37.079 29.510 23.182 1.00 0.31 C ATOM 303 O2 U A 10 36.132 30.261 23.427 1.00 0.35 O ATOM 304 N3 U A 10 38.343 29.998 22.883 1.00 0.38 N ATOM 305 C4 U A 10 39.461 29.247 22.583 1.00 0.43 C ATOM 306 O4 U A 10 40.539 29.779 22.330 1.00 0.54 O ATOM 307 C5 U A 10 39.226 27.828 22.593 1.00 0.42 C ATOM 308 C6 U A 10 37.999 27.322 22.885 1.00 0.36 C ATOM 0 H5' U A 10 35.834 23.733 24.862 1.00 0.32 H new ATOM 0 H5'' U A 10 35.502 23.253 23.210 1.00 0.32 H new ATOM 0 H4' U A 10 34.124 25.135 24.001 1.00 0.31 H new ATOM 0 H3' U A 10 35.916 25.404 21.550 1.00 0.25 H new ATOM 0 H2' U A 10 35.195 27.736 21.330 1.00 0.28 H new ATOM 0 HO2' U A 10 33.081 27.676 21.418 1.00 0.39 H new ATOM 0 H1' U A 10 35.058 28.364 24.026 1.00 0.29 H new ATOM 0 H3 U A 10 38.457 31.012 22.885 1.00 0.38 H new ATOM 0 H5 U A 10 40.038 27.154 22.365 1.00 0.42 H new ATOM 0 H6 U A 10 37.857 26.251 22.890 1.00 0.36 H new ATOM 319 P U A 11 33.499 25.412 19.998 1.00 0.22 P ATOM 320 OP1 U A 11 32.980 26.798 20.005 1.00 0.26 O ATOM 321 OP2 U A 11 32.636 24.329 19.478 1.00 0.33 O ATOM 322 O5' U A 11 34.898 25.386 19.188 1.00 0.21 O ATOM 323 C5' U A 11 35.468 26.603 18.698 1.00 0.22 C ATOM 324 C4' U A 11 36.334 26.371 17.460 1.00 0.22 C ATOM 325 O4' U A 11 37.555 25.733 17.820 1.00 0.24 O ATOM 326 C3' U A 11 35.641 25.497 16.423 1.00 0.21 C ATOM 327 O3' U A 11 36.069 25.872 15.109 1.00 0.23 O ATOM 328 C2' U A 11 36.135 24.078 16.796 1.00 0.24 C ATOM 329 O2' U A 11 36.271 23.240 15.635 1.00 0.31 O ATOM 330 C1' U A 11 37.507 24.358 17.428 1.00 0.24 C ATOM 331 N1 U A 11 37.718 23.492 18.607 1.00 0.24 N ATOM 332 C2 U A 11 38.183 22.207 18.403 1.00 0.27 C ATOM 333 O2 U A 11 38.407 21.767 17.274 1.00 0.32 O ATOM 334 N3 U A 11 38.379 21.444 19.548 1.00 0.31 N ATOM 335 C4 U A 11 38.158 21.864 20.850 1.00 0.32 C ATOM 336 O4 U A 11 38.366 21.119 21.797 1.00 0.41 O ATOM 337 C5 U A 11 37.676 23.212 20.958 1.00 0.31 C ATOM 338 C6 U A 11 37.475 23.970 19.861 1.00 0.27 C ATOM 0 H5' U A 11 36.071 27.062 19.481 1.00 0.22 H new ATOM 0 H5'' U A 11 34.670 27.306 18.456 1.00 0.22 H new ATOM 0 H4' U A 11 36.519 27.355 17.028 1.00 0.22 H new ATOM 0 H3' U A 11 34.554 25.579 16.419 1.00 0.21 H new ATOM 0 H2' U A 11 35.446 23.546 17.452 1.00 0.24 H new ATOM 0 HO2' U A 11 35.636 22.496 15.693 1.00 0.31 H new ATOM 0 H1' U A 11 38.293 24.146 16.704 1.00 0.24 H new ATOM 0 H3 U A 11 38.715 20.490 19.418 1.00 0.31 H new ATOM 0 H5 U A 11 37.471 23.626 21.934 1.00 0.31 H new ATOM 0 H6 U A 11 37.113 24.981 19.978 1.00 0.27 H new ATOM 349 P U A 12 35.086 25.692 13.849 1.00 0.19 P ATOM 350 OP1 U A 12 35.644 26.452 12.714 1.00 0.29 O ATOM 351 OP2 U A 12 33.703 25.967 14.289 1.00 0.25 O ATOM 352 O5' U A 12 35.235 24.128 13.530 1.00 0.25 O ATOM 353 C5' U A 12 34.087 23.339 13.212 1.00 0.23 C ATOM 354 C4' U A 12 34.329 21.864 13.469 1.00 0.23 C ATOM 355 O4' U A 12 34.682 21.626 14.828 1.00 0.26 O ATOM 356 C3' U A 12 33.093 21.052 13.124 1.00 0.24 C ATOM 357 O3' U A 12 33.407 20.057 12.160 1.00 0.26 O ATOM 358 C2' U A 12 32.661 20.422 14.456 1.00 0.28 C ATOM 359 O2' U A 12 32.246 19.055 14.282 1.00 0.37 O ATOM 360 C1' U A 12 33.951 20.498 15.266 1.00 0.24 C ATOM 361 N1 U A 12 33.642 20.561 16.720 1.00 0.23 N ATOM 362 C2 U A 12 33.628 19.356 17.411 1.00 0.27 C ATOM 363 O2 U A 12 33.942 18.290 16.870 1.00 0.33 O ATOM 364 N3 U A 12 33.279 19.417 18.753 1.00 0.30 N ATOM 365 C4 U A 12 32.935 20.563 19.449 1.00 0.32 C ATOM 366 O4 U A 12 32.624 20.504 20.626 1.00 0.43 O ATOM 367 C5 U A 12 32.981 21.762 18.660 1.00 0.29 C ATOM 368 C6 U A 12 33.315 21.734 17.354 1.00 0.25 C ATOM 0 H5' U A 12 33.823 23.487 12.165 1.00 0.23 H new ATOM 0 H5'' U A 12 33.238 23.677 13.806 1.00 0.23 H new ATOM 0 H4' U A 12 35.158 21.555 12.832 1.00 0.23 H new ATOM 0 H3' U A 12 32.300 21.658 12.686 1.00 0.24 H new ATOM 0 H2' U A 12 31.809 20.919 14.920 1.00 0.28 H new ATOM 0 HO2' U A 12 31.456 18.880 14.834 1.00 0.37 H new ATOM 0 H1' U A 12 34.557 19.605 15.112 1.00 0.24 H new ATOM 0 H3 U A 12 33.276 18.539 19.273 1.00 0.30 H new ATOM 0 H5 U A 12 32.743 22.708 19.123 1.00 0.29 H new ATOM 0 H6 U A 12 33.326 22.657 16.793 1.00 0.25 H new ATOM 379 P G A 13 32.281 19.563 11.114 1.00 0.27 P ATOM 380 OP1 G A 13 32.952 18.985 9.929 1.00 0.35 O ATOM 381 OP2 G A 13 31.319 20.675 10.916 1.00 0.34 O ATOM 382 O5' G A 13 31.560 18.354 11.900 1.00 0.23 O ATOM 383 C5' G A 13 31.975 17.011 11.674 1.00 0.24 C ATOM 384 C4' G A 13 31.436 16.070 12.764 1.00 0.23 C ATOM 385 O4' G A 13 31.890 16.456 14.065 1.00 0.26 O ATOM 386 C3' G A 13 29.913 16.119 12.817 1.00 0.21 C ATOM 387 O3' G A 13 29.305 15.284 11.817 1.00 0.22 O ATOM 388 C2' G A 13 29.663 15.577 14.226 1.00 0.23 C ATOM 389 O2' G A 13 29.713 14.142 14.247 1.00 0.26 O ATOM 390 C1' G A 13 30.838 16.195 14.997 1.00 0.24 C ATOM 391 N9 G A 13 30.432 17.428 15.685 1.00 0.24 N ATOM 392 C8 G A 13 29.954 18.605 15.170 1.00 0.26 C ATOM 393 N7 G A 13 29.693 19.531 16.038 1.00 0.28 N ATOM 394 C5 G A 13 30.038 18.921 17.241 1.00 0.25 C ATOM 395 C6 G A 13 29.972 19.437 18.563 1.00 0.28 C ATOM 396 O6 G A 13 29.610 20.554 18.929 1.00 0.33 O ATOM 397 N1 G A 13 30.404 18.517 19.508 1.00 0.29 N ATOM 398 C2 G A 13 30.836 17.239 19.214 1.00 0.27 C ATOM 399 N2 G A 13 31.208 16.480 20.242 1.00 0.31 N ATOM 400 N3 G A 13 30.906 16.754 17.964 1.00 0.24 N ATOM 401 C4 G A 13 30.495 17.640 17.048 1.00 0.23 C ATOM 0 H5' G A 13 33.064 16.963 11.654 1.00 0.24 H new ATOM 0 H5'' G A 13 31.624 16.679 10.697 1.00 0.24 H new ATOM 0 H4' G A 13 31.797 15.074 12.508 1.00 0.23 H new ATOM 0 H3' G A 13 29.492 17.106 12.623 1.00 0.21 H new ATOM 0 H2' G A 13 28.684 15.823 14.637 1.00 0.23 H new ATOM 0 HO2' G A 13 29.551 13.822 15.159 1.00 0.26 H new ATOM 0 H1' G A 13 31.180 15.502 15.765 1.00 0.24 H new ATOM 0 H8 G A 13 29.805 18.751 14.110 1.00 0.26 H new ATOM 0 H1 G A 13 30.402 18.805 20.487 1.00 0.29 H new ATOM 0 H21 G A 13 31.535 15.528 20.081 1.00 0.31 H new ATOM 0 H22 G A 13 31.166 16.851 21.191 1.00 0.31 H new ATOM 413 P C A 14 27.732 15.432 11.514 1.00 0.21 P ATOM 414 OP1 C A 14 27.304 14.320 10.640 1.00 0.30 O ATOM 415 OP2 C A 14 27.492 16.819 11.079 1.00 0.29 O ATOM 416 O5' C A 14 27.050 15.243 12.970 1.00 0.23 O ATOM 417 C5' C A 14 26.992 13.941 13.557 1.00 0.22 C ATOM 418 C4' C A 14 26.535 13.977 15.009 1.00 0.21 C ATOM 419 O4' C A 14 27.325 14.858 15.795 1.00 0.24 O ATOM 420 C3' C A 14 25.100 14.438 15.154 1.00 0.19 C ATOM 421 O3' C A 14 24.151 13.407 14.832 1.00 0.23 O ATOM 422 C2' C A 14 25.088 14.766 16.644 1.00 0.20 C ATOM 423 O2' C A 14 24.754 13.613 17.431 1.00 0.26 O ATOM 424 C1' C A 14 26.527 15.227 16.911 1.00 0.20 C ATOM 425 N1 C A 14 26.585 16.689 17.175 1.00 0.21 N ATOM 426 C2 C A 14 26.417 17.081 18.475 1.00 0.26 C ATOM 427 O2 C A 14 26.241 16.241 19.338 1.00 0.33 O ATOM 428 N3 C A 14 26.474 18.409 18.766 1.00 0.31 N ATOM 429 C4 C A 14 26.670 19.315 17.813 1.00 0.30 C ATOM 430 N4 C A 14 26.698 20.609 18.137 1.00 0.38 N ATOM 431 C5 C A 14 26.853 18.918 16.461 1.00 0.28 C ATOM 432 C6 C A 14 26.790 17.606 16.182 1.00 0.23 C ATOM 0 H5' C A 14 27.976 13.476 13.500 1.00 0.22 H new ATOM 0 H5'' C A 14 26.311 13.316 12.980 1.00 0.22 H new ATOM 0 H4' C A 14 26.639 12.949 15.356 1.00 0.21 H new ATOM 0 H3' C A 14 24.817 15.254 14.489 1.00 0.19 H new ATOM 0 H2' C A 14 24.343 15.516 16.910 1.00 0.20 H new ATOM 0 HO2' C A 14 24.004 13.828 18.024 1.00 0.26 H new ATOM 0 H1' C A 14 26.913 14.742 17.807 1.00 0.20 H new ATOM 0 H41 C A 14 26.848 21.313 17.414 1.00 0.38 H new ATOM 0 H42 C A 14 26.570 20.895 19.108 1.00 0.38 H new ATOM 0 H5 C A 14 27.036 19.646 15.685 1.00 0.28 H new ATOM 0 H6 C A 14 26.903 17.271 15.161 1.00 0.23 H new ATOM 444 P U A 15 22.564 13.656 15.029 1.00 0.20 P ATOM 445 OP1 U A 15 21.826 12.562 14.364 1.00 0.23 O ATOM 446 OP2 U A 15 22.276 15.054 14.651 1.00 0.24 O ATOM 447 O5' U A 15 22.370 13.490 16.617 1.00 0.22 O ATOM 448 C5' U A 15 22.260 12.182 17.190 1.00 0.21 C ATOM 449 C4' U A 15 21.814 12.237 18.637 1.00 0.22 C ATOM 450 O4' U A 15 22.798 12.894 19.417 1.00 0.25 O ATOM 451 C3' U A 15 20.505 13.002 18.778 1.00 0.24 C ATOM 452 O3' U A 15 19.360 12.151 18.610 1.00 0.27 O ATOM 453 C2' U A 15 20.635 13.514 20.208 1.00 0.27 C ATOM 454 O2' U A 15 20.210 12.529 21.159 1.00 0.32 O ATOM 455 C1' U A 15 22.134 13.783 20.309 1.00 0.25 C ATOM 456 N1 U A 15 22.445 15.196 19.984 1.00 0.24 N ATOM 457 C2 U A 15 22.629 16.068 21.039 1.00 0.26 C ATOM 458 O2 U A 15 22.537 15.719 22.212 1.00 0.29 O ATOM 459 N3 U A 15 22.937 17.372 20.706 1.00 0.28 N ATOM 460 C4 U A 15 23.082 17.874 19.435 1.00 0.29 C ATOM 461 O4 U A 15 23.382 19.047 19.256 1.00 0.32 O ATOM 462 C5 U A 15 22.867 16.901 18.388 1.00 0.26 C ATOM 463 C6 U A 15 22.562 15.619 18.682 1.00 0.23 C ATOM 0 H5' U A 15 23.223 11.675 17.125 1.00 0.21 H new ATOM 0 H5'' U A 15 21.549 11.591 16.613 1.00 0.21 H new ATOM 0 H4' U A 15 21.672 11.212 18.981 1.00 0.22 H new ATOM 0 H3' U A 15 20.353 13.781 18.031 1.00 0.24 H new ATOM 0 H2' U A 15 20.017 14.386 20.423 1.00 0.27 H new ATOM 0 HO2' U A 15 20.307 12.887 22.066 1.00 0.32 H new ATOM 0 H1' U A 15 22.477 13.613 21.330 1.00 0.25 H new ATOM 0 H3 U A 15 23.070 18.026 21.478 1.00 0.28 H new ATOM 0 H5 U A 15 22.952 17.204 17.355 1.00 0.26 H new ATOM 0 H6 U A 15 22.407 14.913 17.879 1.00 0.23 H new ATOM 474 P C A 16 17.894 12.777 18.324 1.00 0.28 P ATOM 475 OP1 C A 16 16.954 11.675 18.038 1.00 0.37 O ATOM 476 OP2 C A 16 18.038 13.873 17.340 1.00 0.33 O ATOM 477 O5' C A 16 17.517 13.418 19.750 1.00 0.29 O ATOM 478 C5' C A 16 17.512 12.622 20.933 1.00 0.28 C ATOM 479 C4' C A 16 17.424 13.498 22.175 1.00 0.26 C ATOM 480 O4' C A 16 18.524 14.394 22.235 1.00 0.30 O ATOM 481 C3' C A 16 16.152 14.308 22.145 1.00 0.22 C ATOM 482 O3' C A 16 15.084 13.606 22.778 1.00 0.26 O ATOM 483 C2' C A 16 16.552 15.536 22.934 1.00 0.31 C ATOM 484 O2' C A 16 16.310 15.366 24.330 1.00 0.52 O ATOM 485 C1' C A 16 18.033 15.672 22.614 1.00 0.26 C ATOM 486 N1 C A 16 18.234 16.661 21.536 1.00 0.24 N ATOM 487 C2 C A 16 18.274 17.990 21.900 1.00 0.26 C ATOM 488 O2 C A 16 18.159 18.305 23.087 1.00 0.28 O ATOM 489 N3 C A 16 18.446 18.922 20.935 1.00 0.33 N ATOM 490 C4 C A 16 18.577 18.566 19.653 1.00 0.37 C ATOM 491 N4 C A 16 18.748 19.504 18.727 1.00 0.49 N ATOM 492 C5 C A 16 18.523 17.186 19.265 1.00 0.34 C ATOM 493 C6 C A 16 18.353 16.274 20.236 1.00 0.26 C ATOM 0 H5' C A 16 18.418 12.017 20.973 1.00 0.28 H new ATOM 0 H5'' C A 16 16.668 11.932 20.909 1.00 0.28 H new ATOM 0 H4' C A 16 17.436 12.846 23.048 1.00 0.26 H new ATOM 0 H3' C A 16 15.787 14.530 21.142 1.00 0.22 H new ATOM 0 H2' C A 16 15.981 16.427 22.673 1.00 0.31 H new ATOM 0 HO2' C A 16 15.687 14.622 24.466 1.00 0.52 H new ATOM 0 H1' C A 16 18.579 16.027 23.488 1.00 0.26 H new ATOM 0 H41 C A 16 18.849 19.241 17.747 1.00 0.49 H new ATOM 0 H42 C A 16 18.778 20.487 18.997 1.00 0.49 H new ATOM 0 H5 C A 16 18.616 16.891 18.230 1.00 0.34 H new ATOM 0 H6 C A 16 18.310 15.225 19.984 1.00 0.26 H new ATOM 505 P A A 17 13.559 13.876 22.355 1.00 0.20 P ATOM 506 OP1 A A 17 12.708 12.862 23.007 1.00 0.31 O ATOM 507 OP2 A A 17 13.503 14.028 20.888 1.00 0.28 O ATOM 508 O5' A A 17 13.264 15.320 23.022 1.00 0.26 O ATOM 509 C5' A A 17 12.831 15.422 24.374 1.00 0.33 C ATOM 510 C4' A A 17 12.756 16.881 24.827 1.00 0.27 C ATOM 511 O4' A A 17 13.995 17.546 24.590 1.00 0.28 O ATOM 512 C3' A A 17 11.676 17.642 24.092 1.00 0.27 C ATOM 513 O3' A A 17 10.384 17.464 24.679 1.00 0.36 O ATOM 514 C2' A A 17 12.186 19.056 24.262 1.00 0.28 C ATOM 515 O2' A A 17 11.843 19.567 25.562 1.00 0.35 O ATOM 516 C1' A A 17 13.702 18.860 24.103 1.00 0.26 C ATOM 517 N9 A A 17 14.122 18.993 22.687 1.00 0.24 N ATOM 518 C8 A A 17 14.318 18.022 21.759 1.00 0.24 C ATOM 519 N7 A A 17 14.693 18.468 20.589 1.00 0.24 N ATOM 520 C5 A A 17 14.768 19.838 20.777 1.00 0.22 C ATOM 521 C6 A A 17 15.115 20.899 19.933 1.00 0.23 C ATOM 522 N6 A A 17 15.500 20.736 18.662 1.00 0.29 N ATOM 523 N1 A A 17 15.062 22.145 20.446 1.00 0.26 N ATOM 524 C2 A A 17 14.696 22.336 21.705 1.00 0.27 C ATOM 525 N3 A A 17 14.350 21.399 22.574 1.00 0.26 N ATOM 526 C4 A A 17 14.405 20.171 22.045 1.00 0.22 C ATOM 0 H5' A A 17 13.517 14.874 25.020 1.00 0.33 H new ATOM 0 H5'' A A 17 11.852 14.956 24.480 1.00 0.33 H new ATOM 0 H4' A A 17 12.527 16.863 25.893 1.00 0.27 H new ATOM 0 H3' A A 17 11.524 17.328 23.059 1.00 0.27 H new ATOM 0 H2' A A 17 11.767 19.777 23.560 1.00 0.28 H new ATOM 0 HO2' A A 17 11.122 19.026 25.946 1.00 0.35 H new ATOM 0 HO3' A A 17 9.720 17.976 24.171 1.00 0.36 H new ATOM 0 H1' A A 17 14.245 19.623 24.660 1.00 0.26 H new ATOM 0 H8 A A 17 14.176 16.972 21.969 1.00 0.24 H new ATOM 0 H61 A A 17 15.741 21.548 18.094 1.00 0.29 H new ATOM 0 H62 A A 17 15.552 19.800 18.261 1.00 0.29 H new ATOM 0 H2 A A 17 14.678 23.357 22.057 1.00 0.27 H new TER 539 A A 17