USER MOD reduce.3.24.130724 H: found=0, std=0, add=133, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 133 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 G O2' : rot -18:sc= 0.0843 USER MOD Single : A 1 G O5' : rot 180:sc= -0.786 USER MOD Single : A 2 G O2' : rot -25:sc= 0.278 USER MOD Single : A 3 G O2' : rot -17:sc= 0.201 USER MOD Single : A 4 C O2' : rot -27:sc= 0.234 USER MOD Single : A 5 G O2' : rot -17:sc= 0.593 USER MOD Single : A 6 C O2' : rot -53:sc= 0.719 USER MOD Single : A 7 A O2' : rot -11:sc= -0.635 USER MOD Single : A 8 A O2' : rot -18:sc= 0.209 USER MOD Single : A 9 G O2' : rot -19:sc= 0.187 USER MOD Single : A 10 C O2' : rot -11:sc= -1.01 USER MOD Single : A 11 C O2' : rot -10:sc= -0.916 USER MOD Single : A 12 U O2' : rot -18:sc= 0.119 USER MOD Single : A 12 U O3' : rot 180:sc= 0.135 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -10.360 -6.237 -3.638 1.00 0.00 O ATOM 2 C5' G A 1 -10.607 -6.856 -4.905 1.00 0.00 C ATOM 3 C4' G A 1 -10.502 -5.856 -6.054 1.00 0.00 C ATOM 4 O4' G A 1 -11.436 -4.776 -5.899 1.00 0.00 O ATOM 5 C3' G A 1 -9.128 -5.198 -6.092 1.00 0.00 C ATOM 6 O3' G A 1 -8.265 -5.964 -6.941 1.00 0.00 O ATOM 7 C2' G A 1 -9.437 -3.881 -6.771 1.00 0.00 C ATOM 8 O2' G A 1 -9.572 -4.033 -8.190 1.00 0.00 O ATOM 9 C1' G A 1 -10.759 -3.525 -6.113 1.00 0.00 C ATOM 10 N9 G A 1 -10.528 -2.816 -4.842 1.00 0.00 N ATOM 11 C8 G A 1 -10.670 -3.258 -3.571 1.00 0.00 C ATOM 12 N7 G A 1 -10.374 -2.441 -2.615 1.00 0.00 N ATOM 13 C5 G A 1 -9.981 -1.304 -3.328 1.00 0.00 C ATOM 14 C6 G A 1 -9.528 -0.041 -2.858 1.00 0.00 C ATOM 15 O6 G A 1 -9.379 0.338 -1.697 1.00 0.00 O ATOM 16 N1 G A 1 -9.235 0.814 -3.907 1.00 0.00 N ATOM 17 C2 G A 1 -9.358 0.507 -5.243 1.00 0.00 C ATOM 18 N2 G A 1 -9.022 1.463 -6.101 1.00 0.00 N ATOM 19 N3 G A 1 -9.782 -0.672 -5.696 1.00 0.00 N ATOM 20 C4 G A 1 -10.075 -1.528 -4.693 1.00 0.00 C ATOM 0 H5' G A 1 -11.600 -7.305 -4.903 1.00 0.00 H new ATOM 0 H5'' G A 1 -9.893 -7.664 -5.060 1.00 0.00 H new ATOM 0 H4' G A 1 -10.700 -6.429 -6.960 1.00 0.00 H new ATOM 0 H3' G A 1 -8.646 -5.106 -5.119 1.00 0.00 H new ATOM 0 H2' G A 1 -8.661 -3.124 -6.661 1.00 0.00 H new ATOM 0 HO2' G A 1 -9.165 -4.880 -8.469 1.00 0.00 H new ATOM 0 HO5' G A 1 -10.437 -6.906 -2.926 1.00 0.00 H new ATOM 0 H1' G A 1 -11.356 -2.857 -6.733 1.00 0.00 H new ATOM 0 H8 G A 1 -11.019 -4.259 -3.363 1.00 0.00 H new ATOM 0 H1 G A 1 -8.901 1.748 -3.670 1.00 0.00 H new ATOM 0 H21 G A 1 -9.092 1.295 -7.105 1.00 0.00 H new ATOM 0 H22 G A 1 -8.694 2.365 -5.756 1.00 0.00 H new ATOM 33 P G A 2 -6.677 -6.008 -6.664 1.00 0.00 P ATOM 34 OP1 G A 2 -6.046 -6.828 -7.722 1.00 0.00 O ATOM 35 OP2 G A 2 -6.464 -6.354 -5.240 1.00 0.00 O ATOM 36 O5' G A 2 -6.236 -4.473 -6.882 1.00 0.00 O ATOM 37 C5' G A 2 -6.226 -3.894 -8.193 1.00 0.00 C ATOM 38 C4' G A 2 -5.993 -2.384 -8.148 1.00 0.00 C ATOM 39 O4' G A 2 -6.958 -1.724 -7.322 1.00 0.00 O ATOM 40 C3' G A 2 -4.653 -2.041 -7.521 1.00 0.00 C ATOM 41 O3' G A 2 -3.640 -2.066 -8.535 1.00 0.00 O ATOM 42 C2' G A 2 -4.872 -0.607 -7.088 1.00 0.00 C ATOM 43 O2' G A 2 -4.677 0.312 -8.171 1.00 0.00 O ATOM 44 C1' G A 2 -6.323 -0.632 -6.626 1.00 0.00 C ATOM 45 N9 G A 2 -6.392 -0.808 -5.165 1.00 0.00 N ATOM 46 C8 G A 2 -6.913 -1.823 -4.442 1.00 0.00 C ATOM 47 N7 G A 2 -6.843 -1.741 -3.154 1.00 0.00 N ATOM 48 C5 G A 2 -6.190 -0.515 -2.984 1.00 0.00 C ATOM 49 C6 G A 2 -5.806 0.158 -1.792 1.00 0.00 C ATOM 50 O6 G A 2 -5.974 -0.190 -0.627 1.00 0.00 O ATOM 51 N1 G A 2 -5.171 1.359 -2.070 1.00 0.00 N ATOM 52 C2 G A 2 -4.932 1.855 -3.333 1.00 0.00 C ATOM 53 N2 G A 2 -4.286 3.011 -3.395 1.00 0.00 N ATOM 54 N3 G A 2 -5.291 1.235 -4.456 1.00 0.00 N ATOM 55 C4 G A 2 -5.911 0.060 -4.213 1.00 0.00 C ATOM 0 H5' G A 2 -7.175 -4.100 -8.688 1.00 0.00 H new ATOM 0 H5'' G A 2 -5.446 -4.364 -8.791 1.00 0.00 H new ATOM 0 H4' G A 2 -6.053 -2.059 -9.187 1.00 0.00 H new ATOM 0 H3' G A 2 -4.346 -2.716 -6.722 1.00 0.00 H new ATOM 0 H2' G A 2 -4.174 -0.272 -6.321 1.00 0.00 H new ATOM 0 HO2' G A 2 -4.076 -0.087 -8.835 1.00 0.00 H new ATOM 0 H1' G A 2 -6.831 0.306 -6.850 1.00 0.00 H new ATOM 0 H8 G A 2 -7.372 -2.674 -4.923 1.00 0.00 H new ATOM 0 H1 G A 2 -4.856 1.919 -1.278 1.00 0.00 H new ATOM 0 H21 G A 2 -4.078 3.431 -4.301 1.00 0.00 H new ATOM 0 H22 G A 2 -3.997 3.480 -2.537 1.00 0.00 H new ATOM 67 P G A 3 -2.117 -2.445 -8.167 1.00 0.00 P ATOM 68 OP1 G A 3 -1.432 -2.877 -9.406 1.00 0.00 O ATOM 69 OP2 G A 3 -2.132 -3.335 -6.984 1.00 0.00 O ATOM 70 O5' G A 3 -1.502 -1.022 -7.717 1.00 0.00 O ATOM 71 C5' G A 3 -1.113 -0.050 -8.698 1.00 0.00 C ATOM 72 C4' G A 3 -0.622 1.248 -8.057 1.00 0.00 C ATOM 73 O4' G A 3 -1.636 1.858 -7.246 1.00 0.00 O ATOM 74 C3' G A 3 0.541 0.998 -7.111 1.00 0.00 C ATOM 75 O3' G A 3 1.767 1.039 -7.852 1.00 0.00 O ATOM 76 C2' G A 3 0.466 2.221 -6.219 1.00 0.00 C ATOM 77 O2' G A 3 1.016 3.378 -6.862 1.00 0.00 O ATOM 78 C1' G A 3 -1.040 2.351 -6.029 1.00 0.00 C ATOM 79 N9 G A 3 -1.497 1.570 -4.863 1.00 0.00 N ATOM 80 C8 G A 3 -2.073 0.344 -4.816 1.00 0.00 C ATOM 81 N7 G A 3 -2.396 -0.122 -3.658 1.00 0.00 N ATOM 82 C5 G A 3 -1.991 0.915 -2.811 1.00 0.00 C ATOM 83 C6 G A 3 -2.072 1.019 -1.399 1.00 0.00 C ATOM 84 O6 G A 3 -2.532 0.208 -0.602 1.00 0.00 O ATOM 85 N1 G A 3 -1.550 2.220 -0.943 1.00 0.00 N ATOM 86 C2 G A 3 -1.016 3.205 -1.745 1.00 0.00 C ATOM 87 N2 G A 3 -0.563 4.289 -1.123 1.00 0.00 N ATOM 88 N3 G A 3 -0.935 3.119 -3.075 1.00 0.00 N ATOM 89 C4 G A 3 -1.438 1.954 -3.542 1.00 0.00 C ATOM 0 H5' G A 3 -1.960 0.166 -9.350 1.00 0.00 H new ATOM 0 H5'' G A 3 -0.325 -0.465 -9.326 1.00 0.00 H new ATOM 0 H4' G A 3 -0.336 1.888 -8.892 1.00 0.00 H new ATOM 0 H3' G A 3 0.502 0.044 -6.585 1.00 0.00 H new ATOM 0 H2' G A 3 1.031 2.134 -5.291 1.00 0.00 H new ATOM 0 HO2' G A 3 1.567 3.099 -7.622 1.00 0.00 H new ATOM 0 H1' G A 3 -1.327 3.385 -5.836 1.00 0.00 H new ATOM 0 H8 G A 3 -2.255 -0.223 -5.717 1.00 0.00 H new ATOM 0 H1 G A 3 -1.562 2.387 0.063 1.00 0.00 H new ATOM 0 H21 G A 3 -0.156 5.053 -1.662 1.00 0.00 H new ATOM 0 H22 G A 3 -0.622 4.356 -0.107 1.00 0.00 H new ATOM 101 P C A 4 3.079 0.283 -7.303 1.00 0.00 P ATOM 102 OP1 C A 4 4.162 0.450 -8.297 1.00 0.00 O ATOM 103 OP2 C A 4 2.683 -1.075 -6.866 1.00 0.00 O ATOM 104 O5' C A 4 3.457 1.142 -5.993 1.00 0.00 O ATOM 105 C5' C A 4 4.187 2.369 -6.107 1.00 0.00 C ATOM 106 C4' C A 4 4.416 3.021 -4.744 1.00 0.00 C ATOM 107 O4' C A 4 3.176 3.331 -4.092 1.00 0.00 O ATOM 108 C3' C A 4 5.145 2.083 -3.796 1.00 0.00 C ATOM 109 O3' C A 4 6.557 2.266 -3.959 1.00 0.00 O ATOM 110 C2' C A 4 4.727 2.630 -2.446 1.00 0.00 C ATOM 111 O2' C A 4 5.480 3.799 -2.095 1.00 0.00 O ATOM 112 C1' C A 4 3.262 2.964 -2.702 1.00 0.00 C ATOM 113 N1 C A 4 2.387 1.808 -2.402 1.00 0.00 N ATOM 114 C2 C A 4 1.799 1.756 -1.145 1.00 0.00 C ATOM 115 O2 C A 4 2.016 2.643 -0.323 1.00 0.00 O ATOM 116 N3 C A 4 0.986 0.706 -0.855 1.00 0.00 N ATOM 117 C4 C A 4 0.757 -0.254 -1.760 1.00 0.00 C ATOM 118 N4 C A 4 -0.051 -1.261 -1.445 1.00 0.00 N ATOM 119 C5 C A 4 1.359 -0.207 -3.055 1.00 0.00 C ATOM 120 C6 C A 4 2.163 0.835 -3.333 1.00 0.00 C ATOM 0 H5' C A 4 3.642 3.058 -6.753 1.00 0.00 H new ATOM 0 H5'' C A 4 5.148 2.177 -6.584 1.00 0.00 H new ATOM 0 H4' C A 4 4.997 3.921 -4.946 1.00 0.00 H new ATOM 0 H3' C A 4 4.925 1.026 -3.943 1.00 0.00 H new ATOM 0 H2' C A 4 4.890 1.943 -1.616 1.00 0.00 H new ATOM 0 HO2' C A 4 6.357 3.767 -2.531 1.00 0.00 H new ATOM 0 H1' C A 4 2.924 3.774 -2.056 1.00 0.00 H new ATOM 0 H41 C A 4 -0.235 -1.999 -2.124 1.00 0.00 H new ATOM 0 H42 C A 4 -0.488 -1.296 -0.524 1.00 0.00 H new ATOM 0 H5 C A 4 1.175 -0.981 -3.785 1.00 0.00 H new ATOM 0 H6 C A 4 2.636 0.902 -4.302 1.00 0.00 H new ATOM 132 P G A 5 7.556 1.000 -3.943 1.00 0.00 P ATOM 133 OP1 G A 5 8.903 1.468 -4.342 1.00 0.00 O ATOM 134 OP2 G A 5 6.911 -0.109 -4.682 1.00 0.00 O ATOM 135 O5' G A 5 7.595 0.608 -2.383 1.00 0.00 O ATOM 136 C5' G A 5 8.440 1.319 -1.470 1.00 0.00 C ATOM 137 C4' G A 5 8.179 0.907 -0.024 1.00 0.00 C ATOM 138 O4' G A 5 6.831 1.213 0.371 1.00 0.00 O ATOM 139 C3' G A 5 8.326 -0.599 0.154 1.00 0.00 C ATOM 140 O3' G A 5 9.675 -0.894 0.543 1.00 0.00 O ATOM 141 C2' G A 5 7.413 -0.863 1.331 1.00 0.00 C ATOM 142 O2' G A 5 8.043 -0.519 2.571 1.00 0.00 O ATOM 143 C1' G A 5 6.250 0.067 1.015 1.00 0.00 C ATOM 144 N9 G A 5 5.261 -0.593 0.139 1.00 0.00 N ATOM 145 C8 G A 5 5.147 -0.572 -1.213 1.00 0.00 C ATOM 146 N7 G A 5 4.197 -1.268 -1.744 1.00 0.00 N ATOM 147 C5 G A 5 3.593 -1.830 -0.614 1.00 0.00 C ATOM 148 C6 G A 5 2.481 -2.709 -0.516 1.00 0.00 C ATOM 149 O6 G A 5 1.801 -3.188 -1.419 1.00 0.00 O ATOM 150 N1 G A 5 2.203 -3.031 0.804 1.00 0.00 N ATOM 151 C2 G A 5 2.903 -2.569 1.897 1.00 0.00 C ATOM 152 N2 G A 5 2.480 -2.978 3.082 1.00 0.00 N ATOM 153 N3 G A 5 3.948 -1.747 1.816 1.00 0.00 N ATOM 154 C4 G A 5 4.239 -1.417 0.541 1.00 0.00 C ATOM 0 H5' G A 5 8.274 2.391 -1.579 1.00 0.00 H new ATOM 0 H5'' G A 5 9.484 1.132 -1.719 1.00 0.00 H new ATOM 0 H4' G A 5 8.904 1.454 0.578 1.00 0.00 H new ATOM 0 H3' G A 5 8.096 -1.181 -0.738 1.00 0.00 H new ATOM 0 H2' G A 5 7.128 -1.908 1.453 1.00 0.00 H new ATOM 0 HO2' G A 5 9.012 -0.451 2.438 1.00 0.00 H new ATOM 0 H1' G A 5 5.710 0.349 1.919 1.00 0.00 H new ATOM 0 H8 G A 5 5.826 0.006 -1.823 1.00 0.00 H new ATOM 0 H1 G A 5 1.419 -3.659 0.979 1.00 0.00 H new ATOM 0 H21 G A 5 2.958 -2.670 3.929 1.00 0.00 H new ATOM 0 H22 G A 5 1.676 -3.602 3.149 1.00 0.00 H new ATOM 166 P C A 6 10.726 -1.528 -0.506 1.00 0.00 P ATOM 167 OP1 C A 6 12.052 -1.585 0.149 1.00 0.00 O ATOM 168 OP2 C A 6 10.575 -0.824 -1.800 1.00 0.00 O ATOM 169 O5' C A 6 10.188 -3.040 -0.682 1.00 0.00 O ATOM 170 C5' C A 6 9.320 -3.392 -1.768 1.00 0.00 C ATOM 171 C4' C A 6 8.725 -4.789 -1.592 1.00 0.00 C ATOM 172 O4' C A 6 9.747 -5.797 -1.588 1.00 0.00 O ATOM 173 C3' C A 6 7.992 -4.916 -0.261 1.00 0.00 C ATOM 174 O3' C A 6 6.900 -5.831 -0.434 1.00 0.00 O ATOM 175 C2' C A 6 9.026 -5.553 0.645 1.00 0.00 C ATOM 176 O2' C A 6 8.413 -6.287 1.714 1.00 0.00 O ATOM 177 C1' C A 6 9.762 -6.470 -0.322 1.00 0.00 C ATOM 178 N1 C A 6 11.149 -6.712 0.125 1.00 0.00 N ATOM 179 C2 C A 6 11.545 -8.028 0.323 1.00 0.00 C ATOM 180 O2 C A 6 10.752 -8.948 0.134 1.00 0.00 O ATOM 181 N3 C A 6 12.823 -8.262 0.727 1.00 0.00 N ATOM 182 C4 C A 6 13.676 -7.251 0.928 1.00 0.00 C ATOM 183 N4 C A 6 14.918 -7.520 1.324 1.00 0.00 N ATOM 184 C5 C A 6 13.273 -5.893 0.727 1.00 0.00 C ATOM 185 C6 C A 6 12.007 -5.670 0.327 1.00 0.00 C ATOM 0 H5' C A 6 9.875 -3.349 -2.705 1.00 0.00 H new ATOM 0 H5'' C A 6 8.515 -2.661 -1.841 1.00 0.00 H new ATOM 0 H4' C A 6 8.042 -4.930 -2.429 1.00 0.00 H new ATOM 0 H3' C A 6 7.603 -3.973 0.122 1.00 0.00 H new ATOM 0 H2' C A 6 9.674 -4.836 1.149 1.00 0.00 H new ATOM 0 HO2' C A 6 7.776 -5.709 2.184 1.00 0.00 H new ATOM 0 H1' C A 6 9.283 -7.447 -0.381 1.00 0.00 H new ATOM 0 H41 C A 6 15.579 -6.759 1.481 1.00 0.00 H new ATOM 0 H42 C A 6 15.208 -8.487 1.470 1.00 0.00 H new ATOM 0 H5 C A 6 13.960 -5.076 0.890 1.00 0.00 H new ATOM 0 H6 C A 6 11.667 -4.658 0.165 1.00 0.00 H new ATOM 197 P A A 7 5.380 -5.295 -0.462 1.00 0.00 P ATOM 198 OP1 A A 7 4.612 -6.115 -1.428 1.00 0.00 O ATOM 199 OP2 A A 7 5.415 -3.825 -0.606 1.00 0.00 O ATOM 200 O5' A A 7 4.864 -5.646 1.026 1.00 0.00 O ATOM 201 C5' A A 7 4.344 -6.946 1.331 1.00 0.00 C ATOM 202 C4' A A 7 4.386 -7.238 2.830 1.00 0.00 C ATOM 203 O4' A A 7 5.713 -7.067 3.350 1.00 0.00 O ATOM 204 C3' A A 7 3.510 -6.272 3.621 1.00 0.00 C ATOM 205 O3' A A 7 2.201 -6.843 3.769 1.00 0.00 O ATOM 206 C2' A A 7 4.195 -6.280 4.972 1.00 0.00 C ATOM 207 O2' A A 7 3.856 -7.450 5.727 1.00 0.00 O ATOM 208 C1' A A 7 5.658 -6.288 4.556 1.00 0.00 C ATOM 209 N9 A A 7 6.158 -4.915 4.333 1.00 0.00 N ATOM 210 C8 A A 7 6.317 -4.221 3.177 1.00 0.00 C ATOM 211 N7 A A 7 6.788 -3.024 3.261 1.00 0.00 N ATOM 212 C5 A A 7 6.969 -2.888 4.642 1.00 0.00 C ATOM 213 C6 A A 7 7.447 -1.842 5.438 1.00 0.00 C ATOM 214 N6 A A 7 7.858 -0.679 4.941 1.00 0.00 N ATOM 215 N1 A A 7 7.493 -2.044 6.765 1.00 0.00 N ATOM 216 C2 A A 7 7.091 -3.205 7.285 1.00 0.00 C ATOM 217 N3 A A 7 6.622 -4.260 6.627 1.00 0.00 N ATOM 218 C4 A A 7 6.587 -4.034 5.300 1.00 0.00 C ATOM 0 H5' A A 7 4.920 -7.702 0.797 1.00 0.00 H new ATOM 0 H5'' A A 7 3.316 -7.019 0.975 1.00 0.00 H new ATOM 0 H4' A A 7 4.035 -8.264 2.939 1.00 0.00 H new ATOM 0 H3' A A 7 3.401 -5.287 3.168 1.00 0.00 H new ATOM 0 H2' A A 7 3.917 -5.450 5.621 1.00 0.00 H new ATOM 0 HO2' A A 7 3.118 -7.921 5.287 1.00 0.00 H new ATOM 0 H1' A A 7 6.293 -6.713 5.333 1.00 0.00 H new ATOM 0 H8 A A 7 6.059 -4.656 2.223 1.00 0.00 H new ATOM 0 H61 A A 7 8.198 0.051 5.567 1.00 0.00 H new ATOM 0 H62 A A 7 7.833 -0.517 3.934 1.00 0.00 H new ATOM 0 H2 A A 7 7.154 -3.298 8.359 1.00 0.00 H new ATOM 230 P A A 8 0.944 -5.930 4.207 1.00 0.00 P ATOM 231 OP1 A A 8 -0.228 -6.815 4.390 1.00 0.00 O ATOM 232 OP2 A A 8 0.860 -4.780 3.278 1.00 0.00 O ATOM 233 O5' A A 8 1.394 -5.379 5.655 1.00 0.00 O ATOM 234 C5' A A 8 1.267 -6.201 6.823 1.00 0.00 C ATOM 235 C4' A A 8 1.773 -5.492 8.078 1.00 0.00 C ATOM 236 O4' A A 8 3.158 -5.128 7.962 1.00 0.00 O ATOM 237 C3' A A 8 1.035 -4.183 8.313 1.00 0.00 C ATOM 238 O3' A A 8 -0.127 -4.436 9.111 1.00 0.00 O ATOM 239 C2' A A 8 2.042 -3.413 9.141 1.00 0.00 C ATOM 240 O2' A A 8 2.051 -3.850 10.505 1.00 0.00 O ATOM 241 C1' A A 8 3.335 -3.776 8.424 1.00 0.00 C ATOM 242 N9 A A 8 3.587 -2.860 7.295 1.00 0.00 N ATOM 243 C8 A A 8 3.200 -2.961 6.002 1.00 0.00 C ATOM 244 N7 A A 8 3.544 -2.011 5.200 1.00 0.00 N ATOM 245 C5 A A 8 4.251 -1.162 6.057 1.00 0.00 C ATOM 246 C6 A A 8 4.903 0.059 5.856 1.00 0.00 C ATOM 247 N6 A A 8 4.957 0.670 4.674 1.00 0.00 N ATOM 248 N1 A A 8 5.499 0.625 6.918 1.00 0.00 N ATOM 249 C2 A A 8 5.458 0.029 8.112 1.00 0.00 C ATOM 250 N3 A A 8 4.871 -1.124 8.415 1.00 0.00 N ATOM 251 C4 A A 8 4.281 -1.672 7.334 1.00 0.00 C ATOM 0 H5' A A 8 1.826 -7.126 6.678 1.00 0.00 H new ATOM 0 H5'' A A 8 0.222 -6.478 6.960 1.00 0.00 H new ATOM 0 H4' A A 8 1.612 -6.199 8.892 1.00 0.00 H new ATOM 0 H3' A A 8 0.711 -3.677 7.404 1.00 0.00 H new ATOM 0 H2' A A 8 1.848 -2.342 9.208 1.00 0.00 H new ATOM 0 HO2' A A 8 1.225 -4.341 10.697 1.00 0.00 H new ATOM 0 H1' A A 8 4.197 -3.690 9.086 1.00 0.00 H new ATOM 0 H8 A A 8 2.624 -3.806 5.654 1.00 0.00 H new ATOM 0 H61 A A 8 5.446 1.560 4.582 1.00 0.00 H new ATOM 0 H62 A A 8 4.509 0.248 3.861 1.00 0.00 H new ATOM 0 H2 A A 8 5.957 0.541 8.921 1.00 0.00 H new ATOM 263 P G A 9 -1.604 -4.157 8.526 1.00 0.00 P ATOM 264 OP1 G A 9 -2.592 -4.582 9.543 1.00 0.00 O ATOM 265 OP2 G A 9 -1.673 -4.713 7.156 1.00 0.00 O ATOM 266 O5' G A 9 -1.653 -2.546 8.418 1.00 0.00 O ATOM 267 C5' G A 9 -1.126 -1.722 9.467 1.00 0.00 C ATOM 268 C4' G A 9 -0.184 -0.645 8.928 1.00 0.00 C ATOM 269 O4' G A 9 0.791 -1.192 8.030 1.00 0.00 O ATOM 270 C3' G A 9 -0.932 0.389 8.104 1.00 0.00 C ATOM 271 O3' G A 9 -1.432 1.413 8.975 1.00 0.00 O ATOM 272 C2' G A 9 0.190 0.969 7.266 1.00 0.00 C ATOM 273 O2' G A 9 0.982 1.901 8.012 1.00 0.00 O ATOM 274 C1' G A 9 0.979 -0.287 6.923 1.00 0.00 C ATOM 275 N9 G A 9 0.496 -0.874 5.659 1.00 0.00 N ATOM 276 C8 G A 9 -0.266 -1.973 5.449 1.00 0.00 C ATOM 277 N7 G A 9 -0.575 -2.263 4.230 1.00 0.00 N ATOM 278 C5 G A 9 0.053 -1.230 3.524 1.00 0.00 C ATOM 279 C6 G A 9 0.094 -0.971 2.128 1.00 0.00 C ATOM 280 O6 G A 9 -0.427 -1.609 1.218 1.00 0.00 O ATOM 281 N1 G A 9 0.833 0.168 1.843 1.00 0.00 N ATOM 282 C2 G A 9 1.457 0.963 2.779 1.00 0.00 C ATOM 283 N2 G A 9 2.114 2.020 2.314 1.00 0.00 N ATOM 284 N3 G A 9 1.425 0.728 4.091 1.00 0.00 N ATOM 285 C4 G A 9 0.711 -0.377 4.395 1.00 0.00 C ATOM 0 H5' G A 9 -0.592 -2.345 10.184 1.00 0.00 H new ATOM 0 H5'' G A 9 -1.948 -1.249 10.005 1.00 0.00 H new ATOM 0 H4' G A 9 0.280 -0.206 9.811 1.00 0.00 H new ATOM 0 H3' G A 9 -1.774 -0.007 7.536 1.00 0.00 H new ATOM 0 H2' G A 9 -0.148 1.538 6.400 1.00 0.00 H new ATOM 0 HO2' G A 9 0.479 2.204 8.797 1.00 0.00 H new ATOM 0 H1' G A 9 2.037 -0.070 6.776 1.00 0.00 H new ATOM 0 H8 G A 9 -0.603 -2.585 6.272 1.00 0.00 H new ATOM 0 H1 G A 9 0.921 0.438 0.863 1.00 0.00 H new ATOM 0 H21 G A 9 2.596 2.646 2.960 1.00 0.00 H new ATOM 0 H22 G A 9 2.137 2.206 1.311 1.00 0.00 H new ATOM 297 P C A 10 -2.567 2.438 8.466 1.00 0.00 P ATOM 298 OP1 C A 10 -2.925 3.331 9.592 1.00 0.00 O ATOM 299 OP2 C A 10 -3.622 1.659 7.778 1.00 0.00 O ATOM 300 O5' C A 10 -1.786 3.309 7.356 1.00 0.00 O ATOM 301 C5' C A 10 -1.034 4.470 7.729 1.00 0.00 C ATOM 302 C4' C A 10 -0.679 5.331 6.519 1.00 0.00 C ATOM 303 O4' C A 10 0.156 4.625 5.582 1.00 0.00 O ATOM 304 C3' C A 10 -1.920 5.712 5.723 1.00 0.00 C ATOM 305 O3' C A 10 -2.481 6.917 6.257 1.00 0.00 O ATOM 306 C2' C A 10 -1.310 6.012 4.374 1.00 0.00 C ATOM 307 O2' C A 10 -0.626 7.272 4.377 1.00 0.00 O ATOM 308 C1' C A 10 -0.339 4.852 4.247 1.00 0.00 C ATOM 309 N1 C A 10 -0.995 3.639 3.706 1.00 0.00 N ATOM 310 C2 C A 10 -0.999 3.466 2.327 1.00 0.00 C ATOM 311 O2 C A 10 -0.493 4.312 1.594 1.00 0.00 O ATOM 312 N3 C A 10 -1.579 2.345 1.818 1.00 0.00 N ATOM 313 C4 C A 10 -2.130 1.431 2.625 1.00 0.00 C ATOM 314 N4 C A 10 -2.689 0.350 2.093 1.00 0.00 N ATOM 315 C5 C A 10 -2.129 1.602 4.043 1.00 0.00 C ATOM 316 C6 C A 10 -1.556 2.713 4.539 1.00 0.00 C ATOM 0 H5' C A 10 -0.120 4.163 8.237 1.00 0.00 H new ATOM 0 H5'' C A 10 -1.610 5.063 8.440 1.00 0.00 H new ATOM 0 H4' C A 10 -0.172 6.203 6.932 1.00 0.00 H new ATOM 0 H3' C A 10 -2.708 4.959 5.721 1.00 0.00 H new ATOM 0 H2' C A 10 -2.027 6.096 3.558 1.00 0.00 H new ATOM 0 HO2' C A 10 -0.838 7.757 5.202 1.00 0.00 H new ATOM 0 H1' C A 10 0.464 5.083 3.547 1.00 0.00 H new ATOM 0 H41 C A 10 -3.113 -0.355 2.697 1.00 0.00 H new ATOM 0 H42 C A 10 -2.695 0.225 1.081 1.00 0.00 H new ATOM 0 H5 C A 10 -2.573 0.864 4.695 1.00 0.00 H new ATOM 0 H6 C A 10 -1.539 2.875 5.607 1.00 0.00 H new ATOM 328 P C A 11 -4.022 7.293 5.962 1.00 0.00 P ATOM 329 OP1 C A 11 -4.279 8.650 6.491 1.00 0.00 O ATOM 330 OP2 C A 11 -4.867 6.158 6.399 1.00 0.00 O ATOM 331 O5' C A 11 -4.065 7.360 4.351 1.00 0.00 O ATOM 332 C5' C A 11 -3.369 8.397 3.649 1.00 0.00 C ATOM 333 C4' C A 11 -3.174 8.066 2.169 1.00 0.00 C ATOM 334 O4' C A 11 -2.537 6.797 1.975 1.00 0.00 O ATOM 335 C3' C A 11 -4.495 7.931 1.439 1.00 0.00 C ATOM 336 O3' C A 11 -4.961 9.236 1.070 1.00 0.00 O ATOM 337 C2' C A 11 -4.053 7.197 0.191 1.00 0.00 C ATOM 338 O2' C A 11 -3.424 8.086 -0.740 1.00 0.00 O ATOM 339 C1' C A 11 -3.054 6.196 0.767 1.00 0.00 C ATOM 340 N1 C A 11 -3.688 4.883 1.039 1.00 0.00 N ATOM 341 C2 C A 11 -3.985 4.082 -0.054 1.00 0.00 C ATOM 342 O2 C A 11 -3.717 4.462 -1.189 1.00 0.00 O ATOM 343 N3 C A 11 -4.571 2.873 0.168 1.00 0.00 N ATOM 344 C4 C A 11 -4.855 2.467 1.411 1.00 0.00 C ATOM 345 N4 C A 11 -5.439 1.285 1.591 1.00 0.00 N ATOM 346 C5 C A 11 -4.550 3.288 2.543 1.00 0.00 C ATOM 347 C6 C A 11 -3.967 4.480 2.313 1.00 0.00 C ATOM 0 H5' C A 11 -2.396 8.558 4.114 1.00 0.00 H new ATOM 0 H5'' C A 11 -3.924 9.330 3.740 1.00 0.00 H new ATOM 0 H4' C A 11 -2.571 8.890 1.788 1.00 0.00 H new ATOM 0 H3' C A 11 -5.288 7.445 2.007 1.00 0.00 H new ATOM 0 H2' C A 11 -4.868 6.740 -0.370 1.00 0.00 H new ATOM 0 HO2' C A 11 -3.552 9.012 -0.446 1.00 0.00 H new ATOM 0 H1' C A 11 -2.253 5.990 0.057 1.00 0.00 H new ATOM 0 H41 C A 11 -5.661 0.964 2.533 1.00 0.00 H new ATOM 0 H42 C A 11 -5.665 0.700 0.787 1.00 0.00 H new ATOM 0 H5 C A 11 -4.779 2.963 3.547 1.00 0.00 H new ATOM 0 H6 C A 11 -3.718 5.123 3.144 1.00 0.00 H new ATOM 359 P U A 12 -6.533 9.510 0.839 1.00 0.00 P ATOM 360 OP1 U A 12 -6.701 10.916 0.407 1.00 0.00 O ATOM 361 OP2 U A 12 -7.268 9.009 2.022 1.00 0.00 O ATOM 362 O5' U A 12 -6.876 8.550 -0.409 1.00 0.00 O ATOM 363 C5' U A 12 -6.298 8.792 -1.696 1.00 0.00 C ATOM 364 C4' U A 12 -6.435 7.579 -2.612 1.00 0.00 C ATOM 365 O4' U A 12 -5.850 6.410 -2.038 1.00 0.00 O ATOM 366 C3' U A 12 -7.886 7.209 -2.831 1.00 0.00 C ATOM 367 O3' U A 12 -8.520 8.060 -3.794 1.00 0.00 O ATOM 368 C2' U A 12 -7.741 5.789 -3.344 1.00 0.00 C ATOM 369 O2' U A 12 -7.422 5.766 -4.741 1.00 0.00 O ATOM 370 C1' U A 12 -6.579 5.257 -2.496 1.00 0.00 C ATOM 371 N1 U A 12 -7.076 4.441 -1.364 1.00 0.00 N ATOM 372 C2 U A 12 -7.711 3.253 -1.673 1.00 0.00 C ATOM 373 O2 U A 12 -7.856 2.871 -2.830 1.00 0.00 O ATOM 374 N3 U A 12 -8.174 2.514 -0.605 1.00 0.00 N ATOM 375 C4 U A 12 -8.062 2.853 0.730 1.00 0.00 C ATOM 376 O4 U A 12 -8.511 2.114 1.601 1.00 0.00 O ATOM 377 C5 U A 12 -7.385 4.108 0.964 1.00 0.00 C ATOM 378 C6 U A 12 -6.919 4.851 -0.068 1.00 0.00 C ATOM 0 H5' U A 12 -5.244 9.044 -1.580 1.00 0.00 H new ATOM 0 H5'' U A 12 -6.782 9.653 -2.157 1.00 0.00 H new ATOM 0 H4' U A 12 -5.939 7.869 -3.538 1.00 0.00 H new ATOM 0 H3' U A 12 -8.513 7.309 -1.945 1.00 0.00 H new ATOM 0 H2' U A 12 -8.653 5.198 -3.258 1.00 0.00 H new ATOM 0 HO2' U A 12 -7.636 6.635 -5.140 1.00 0.00 H new ATOM 0 HO3' U A 12 -9.454 7.787 -3.907 1.00 0.00 H new ATOM 0 H1' U A 12 -5.934 4.600 -3.079 1.00 0.00 H new ATOM 0 H3 U A 12 -8.643 1.634 -0.821 1.00 0.00 H new ATOM 0 H5 U A 12 -7.249 4.459 1.976 1.00 0.00 H new ATOM 0 H6 U A 12 -6.414 5.784 0.136 1.00 0.00 H new TER 390 U A 12