USER MOD reduce.3.24.130724 H: found=0, std=0, add=153, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 153 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 -22:sc= 0.396 USER MOD Single : A 1 G O5' : rot 180:sc= -0.0744 USER MOD Single : A 2 G O2' : rot -10:sc= -0.665 USER MOD Single : A 3 C O2' : rot -15:sc= 0.345 USER MOD Single : A 4 C O2' : rot -20:sc= -0.926 USER MOD Single : A 5 U O2' : rot -12:sc= 0.429 USER MOD Single : A 6 G O2' : rot -144:sc= -6.73! USER MOD Single : A 7 A O2' : rot 150:sc= -6.07! USER MOD Single : A 8 U O2' : rot 141:sc= 0.659 USER MOD Single : A 9 A O2' : rot -80:sc= 0.788 USER MOD Single : A 10 G O2' : rot -75:sc= 1.16 USER MOD Single : A 11 G O2' : rot -16:sc= 0.396 USER MOD Single : A 12 G O2' : rot -17:sc= 0.405 USER MOD Single : A 13 U O2' : rot -16:sc= -0.388 USER MOD Single : A 14 C O2' : rot -24:sc= 0.202 USER MOD Single : A 14 C O3' : rot 180:sc= 0.21 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -6.146 -3.557 7.394 1.00 0.00 O ATOM 2 C5' G A 1 -5.992 -3.739 8.805 1.00 0.00 C ATOM 3 C4' G A 1 -4.834 -4.678 9.126 1.00 0.00 C ATOM 4 O4' G A 1 -5.065 -5.941 8.492 1.00 0.00 O ATOM 5 C3' G A 1 -3.484 -4.232 8.595 1.00 0.00 C ATOM 6 O3' G A 1 -2.836 -3.506 9.646 1.00 0.00 O ATOM 7 C2' G A 1 -2.731 -5.542 8.418 1.00 0.00 C ATOM 8 O2' G A 1 -2.183 -5.984 9.664 1.00 0.00 O ATOM 9 C1' G A 1 -3.843 -6.482 7.959 1.00 0.00 C ATOM 10 N9 G A 1 -3.951 -6.544 6.487 1.00 0.00 N ATOM 11 C8 G A 1 -4.895 -5.971 5.671 1.00 0.00 C ATOM 12 N7 G A 1 -4.707 -6.211 4.403 1.00 0.00 N ATOM 13 C5 G A 1 -3.561 -6.997 4.376 1.00 0.00 C ATOM 14 C6 G A 1 -2.874 -7.566 3.270 1.00 0.00 C ATOM 15 O6 G A 1 -3.150 -7.482 2.076 1.00 0.00 O ATOM 16 N1 G A 1 -1.764 -8.290 3.675 1.00 0.00 N ATOM 17 C2 G A 1 -1.361 -8.450 4.982 1.00 0.00 C ATOM 18 N2 G A 1 -0.267 -9.181 5.193 1.00 0.00 N ATOM 19 N3 G A 1 -1.998 -7.920 6.027 1.00 0.00 N ATOM 20 C4 G A 1 -3.088 -7.208 5.648 1.00 0.00 C ATOM 0 H5' G A 1 -6.914 -4.141 9.223 1.00 0.00 H new ATOM 0 H5'' G A 1 -5.821 -2.773 9.281 1.00 0.00 H new ATOM 0 H4' G A 1 -4.800 -4.708 10.215 1.00 0.00 H new ATOM 0 H3' G A 1 -3.538 -3.626 7.691 1.00 0.00 H new ATOM 0 H2' G A 1 -1.888 -5.478 7.730 1.00 0.00 H new ATOM 0 HO2' G A 1 -2.099 -5.221 10.273 1.00 0.00 H new ATOM 0 HO5' G A 1 -6.897 -2.952 7.222 1.00 0.00 H new ATOM 0 H1' G A 1 -3.636 -7.494 8.306 1.00 0.00 H new ATOM 0 H8 G A 1 -5.716 -5.377 6.044 1.00 0.00 H new ATOM 0 H1 G A 1 -1.203 -8.738 2.950 1.00 0.00 H new ATOM 0 H21 G A 1 0.072 -9.329 6.144 1.00 0.00 H new ATOM 0 H22 G A 1 0.231 -9.593 4.404 1.00 0.00 H new ATOM 33 P G A 2 -2.271 -2.018 9.393 1.00 0.00 P ATOM 34 OP1 G A 2 -2.939 -1.103 10.345 1.00 0.00 O ATOM 35 OP2 G A 2 -2.325 -1.738 7.940 1.00 0.00 O ATOM 36 O5' G A 2 -0.725 -2.151 9.824 1.00 0.00 O ATOM 37 C5' G A 2 0.282 -1.351 9.196 1.00 0.00 C ATOM 38 C4' G A 2 1.639 -2.052 9.194 1.00 0.00 C ATOM 39 O4' G A 2 1.441 -3.470 9.150 1.00 0.00 O ATOM 40 C3' G A 2 2.508 -1.759 7.981 1.00 0.00 C ATOM 41 O3' G A 2 3.361 -0.663 8.326 1.00 0.00 O ATOM 42 C2' G A 2 3.382 -3.000 7.876 1.00 0.00 C ATOM 43 O2' G A 2 4.477 -2.930 8.792 1.00 0.00 O ATOM 44 C1' G A 2 2.406 -4.100 8.289 1.00 0.00 C ATOM 45 N9 G A 2 1.699 -4.686 7.133 1.00 0.00 N ATOM 46 C8 G A 2 0.376 -4.566 6.787 1.00 0.00 C ATOM 47 N7 G A 2 0.060 -5.206 5.697 1.00 0.00 N ATOM 48 C5 G A 2 1.254 -5.791 5.292 1.00 0.00 C ATOM 49 C6 G A 2 1.528 -6.610 4.164 1.00 0.00 C ATOM 50 O6 G A 2 0.754 -6.981 3.287 1.00 0.00 O ATOM 51 N1 G A 2 2.860 -6.990 4.121 1.00 0.00 N ATOM 52 C2 G A 2 3.815 -6.630 5.045 1.00 0.00 C ATOM 53 N2 G A 2 5.051 -7.085 4.847 1.00 0.00 N ATOM 54 N3 G A 2 3.568 -5.859 6.107 1.00 0.00 N ATOM 55 C4 G A 2 2.267 -5.479 6.165 1.00 0.00 C ATOM 0 H5' G A 2 0.366 -0.397 9.716 1.00 0.00 H new ATOM 0 H5'' G A 2 -0.015 -1.130 8.171 1.00 0.00 H new ATOM 0 H4' G A 2 2.134 -1.684 10.093 1.00 0.00 H new ATOM 0 H3' G A 2 1.948 -1.532 7.074 1.00 0.00 H new ATOM 0 H2' G A 2 3.830 -3.145 6.893 1.00 0.00 H new ATOM 0 HO2' G A 2 4.524 -2.030 9.178 1.00 0.00 H new ATOM 0 H1' G A 2 2.950 -4.911 8.774 1.00 0.00 H new ATOM 0 H8 G A 2 -0.336 -3.995 7.364 1.00 0.00 H new ATOM 0 H1 G A 2 3.156 -7.582 3.345 1.00 0.00 H new ATOM 0 H21 G A 2 5.794 -6.846 5.504 1.00 0.00 H new ATOM 0 H22 G A 2 5.255 -7.673 4.039 1.00 0.00 H new ATOM 67 P C A 3 3.819 0.404 7.210 1.00 0.00 P ATOM 68 OP1 C A 3 4.705 1.400 7.855 1.00 0.00 O ATOM 69 OP2 C A 3 2.614 0.855 6.477 1.00 0.00 O ATOM 70 O5' C A 3 4.708 -0.491 6.210 1.00 0.00 O ATOM 71 C5' C A 3 5.955 -1.045 6.640 1.00 0.00 C ATOM 72 C4' C A 3 6.590 -1.907 5.552 1.00 0.00 C ATOM 73 O4' C A 3 5.870 -3.140 5.445 1.00 0.00 O ATOM 74 C3' C A 3 6.529 -1.314 4.155 1.00 0.00 C ATOM 75 O3' C A 3 7.750 -0.599 3.948 1.00 0.00 O ATOM 76 C2' C A 3 6.564 -2.543 3.259 1.00 0.00 C ATOM 77 O2' C A 3 7.904 -3.013 3.093 1.00 0.00 O ATOM 78 C1' C A 3 5.741 -3.543 4.069 1.00 0.00 C ATOM 79 N1 C A 3 4.306 -3.528 3.698 1.00 0.00 N ATOM 80 C2 C A 3 3.879 -4.433 2.734 1.00 0.00 C ATOM 81 O2 C A 3 4.680 -5.205 2.207 1.00 0.00 O ATOM 82 N3 C A 3 2.563 -4.444 2.387 1.00 0.00 N ATOM 83 C4 C A 3 1.697 -3.601 2.966 1.00 0.00 C ATOM 84 N4 C A 3 0.420 -3.667 2.590 1.00 0.00 N ATOM 85 C5 C A 3 2.129 -2.667 3.955 1.00 0.00 C ATOM 86 C6 C A 3 3.430 -2.663 4.289 1.00 0.00 C ATOM 0 H5' C A 3 5.798 -1.646 7.536 1.00 0.00 H new ATOM 0 H5'' C A 3 6.637 -0.240 6.912 1.00 0.00 H new ATOM 0 H4' C A 3 7.631 -2.009 5.858 1.00 0.00 H new ATOM 0 H3' C A 3 5.673 -0.662 3.981 1.00 0.00 H new ATOM 0 H2' C A 3 6.187 -2.367 2.252 1.00 0.00 H new ATOM 0 HO2' C A 3 8.532 -2.321 3.388 1.00 0.00 H new ATOM 0 H1' C A 3 6.104 -4.553 3.882 1.00 0.00 H new ATOM 0 H41 C A 3 -0.268 -3.041 3.009 1.00 0.00 H new ATOM 0 H42 C A 3 0.131 -4.343 1.883 1.00 0.00 H new ATOM 0 H5 C A 3 1.432 -1.985 4.420 1.00 0.00 H new ATOM 0 H6 C A 3 3.788 -1.967 5.034 1.00 0.00 H new ATOM 98 P C A 4 7.730 0.935 3.455 1.00 0.00 P ATOM 99 OP1 C A 4 8.988 1.579 3.892 1.00 0.00 O ATOM 100 OP2 C A 4 6.427 1.530 3.832 1.00 0.00 O ATOM 101 O5' C A 4 7.769 0.788 1.851 1.00 0.00 O ATOM 102 C5' C A 4 8.799 0.024 1.213 1.00 0.00 C ATOM 103 C4' C A 4 8.413 -0.358 -0.214 1.00 0.00 C ATOM 104 O4' C A 4 7.604 -1.541 -0.185 1.00 0.00 O ATOM 105 C3' C A 4 7.540 0.654 -0.934 1.00 0.00 C ATOM 106 O3' C A 4 8.409 1.558 -1.626 1.00 0.00 O ATOM 107 C2' C A 4 6.841 -0.200 -1.975 1.00 0.00 C ATOM 108 O2' C A 4 7.717 -0.494 -3.068 1.00 0.00 O ATOM 109 C1' C A 4 6.551 -1.459 -1.165 1.00 0.00 C ATOM 110 N1 C A 4 5.261 -1.354 -0.454 1.00 0.00 N ATOM 111 C2 C A 4 4.134 -1.880 -1.067 1.00 0.00 C ATOM 112 O2 C A 4 4.219 -2.428 -2.165 1.00 0.00 O ATOM 113 N3 C A 4 2.935 -1.764 -0.431 1.00 0.00 N ATOM 114 C4 C A 4 2.850 -1.155 0.760 1.00 0.00 C ATOM 115 N4 C A 4 1.652 -1.073 1.333 1.00 0.00 N ATOM 116 C5 C A 4 4.009 -0.610 1.392 1.00 0.00 C ATOM 117 C6 C A 4 5.183 -0.733 0.756 1.00 0.00 C ATOM 0 H5' C A 4 8.995 -0.879 1.792 1.00 0.00 H new ATOM 0 H5'' C A 4 9.724 0.600 1.198 1.00 0.00 H new ATOM 0 H4' C A 4 9.367 -0.457 -0.731 1.00 0.00 H new ATOM 0 H3' C A 4 6.866 1.213 -0.285 1.00 0.00 H new ATOM 0 H2' C A 4 5.964 0.265 -2.426 1.00 0.00 H new ATOM 0 HO2' C A 4 8.451 0.155 -3.082 1.00 0.00 H new ATOM 0 H1' C A 4 6.502 -2.330 -1.819 1.00 0.00 H new ATOM 0 H41 C A 4 1.550 -0.616 2.239 1.00 0.00 H new ATOM 0 H42 C A 4 0.835 -1.467 0.866 1.00 0.00 H new ATOM 0 H5 C A 4 3.942 -0.116 2.350 1.00 0.00 H new ATOM 0 H6 C A 4 6.079 -0.334 1.209 1.00 0.00 H new ATOM 129 P U A 5 7.884 3.009 -2.081 1.00 0.00 P ATOM 130 OP1 U A 5 8.922 3.635 -2.931 1.00 0.00 O ATOM 131 OP2 U A 5 7.386 3.720 -0.882 1.00 0.00 O ATOM 132 O5' U A 5 6.620 2.648 -3.011 1.00 0.00 O ATOM 133 C5' U A 5 6.804 2.211 -4.362 1.00 0.00 C ATOM 134 C4' U A 5 5.497 2.225 -5.133 1.00 0.00 C ATOM 135 O4' U A 5 4.604 1.295 -4.532 1.00 0.00 O ATOM 136 C3' U A 5 4.766 3.554 -5.095 1.00 0.00 C ATOM 137 O3' U A 5 5.112 4.249 -6.298 1.00 0.00 O ATOM 138 C2' U A 5 3.299 3.166 -5.200 1.00 0.00 C ATOM 139 O2' U A 5 2.905 3.038 -6.569 1.00 0.00 O ATOM 140 C1' U A 5 3.265 1.799 -4.510 1.00 0.00 C ATOM 141 N1 U A 5 2.811 1.879 -3.102 1.00 0.00 N ATOM 142 C2 U A 5 1.447 1.882 -2.866 1.00 0.00 C ATOM 143 O2 U A 5 0.618 1.862 -3.773 1.00 0.00 O ATOM 144 N3 U A 5 1.064 1.914 -1.540 1.00 0.00 N ATOM 145 C4 U A 5 1.908 1.941 -0.448 1.00 0.00 C ATOM 146 O4 U A 5 1.443 1.951 0.689 1.00 0.00 O ATOM 147 C5 U A 5 3.316 1.942 -0.775 1.00 0.00 C ATOM 148 C6 U A 5 3.714 1.911 -2.070 1.00 0.00 C ATOM 0 H5' U A 5 7.220 1.203 -4.366 1.00 0.00 H new ATOM 0 H5'' U A 5 7.528 2.857 -4.859 1.00 0.00 H new ATOM 0 H4' U A 5 5.765 1.995 -6.164 1.00 0.00 H new ATOM 0 H3' U A 5 4.992 4.160 -4.218 1.00 0.00 H new ATOM 0 H2' U A 5 2.625 3.900 -4.758 1.00 0.00 H new ATOM 0 HO2' U A 5 3.603 3.411 -7.147 1.00 0.00 H new ATOM 0 H1' U A 5 2.559 1.155 -5.035 1.00 0.00 H new ATOM 0 H3 U A 5 0.062 1.918 -1.349 1.00 0.00 H new ATOM 0 H5 U A 5 4.052 1.968 0.015 1.00 0.00 H new ATOM 0 H6 U A 5 4.770 1.912 -2.295 1.00 0.00 H new ATOM 159 P G A 6 5.751 5.728 -6.242 1.00 0.00 P ATOM 160 OP1 G A 6 5.994 6.181 -7.630 1.00 0.00 O ATOM 161 OP2 G A 6 6.862 5.715 -5.265 1.00 0.00 O ATOM 162 O5' G A 6 4.547 6.601 -5.626 1.00 0.00 O ATOM 163 C5' G A 6 3.338 6.805 -6.365 1.00 0.00 C ATOM 164 C4' G A 6 2.136 6.920 -5.436 1.00 0.00 C ATOM 165 O4' G A 6 2.214 5.890 -4.459 1.00 0.00 O ATOM 166 C3' G A 6 2.080 8.196 -4.610 1.00 0.00 C ATOM 167 O3' G A 6 1.201 9.103 -5.286 1.00 0.00 O ATOM 168 C2' G A 6 1.393 7.778 -3.302 1.00 0.00 C ATOM 169 O2' G A 6 0.042 8.207 -3.272 1.00 0.00 O ATOM 170 C1' G A 6 1.433 6.252 -3.324 1.00 0.00 C ATOM 171 N9 G A 6 2.062 5.711 -2.106 1.00 0.00 N ATOM 172 C8 G A 6 3.382 5.417 -1.879 1.00 0.00 C ATOM 173 N7 G A 6 3.627 5.006 -0.668 1.00 0.00 N ATOM 174 C5 G A 6 2.384 5.028 -0.046 1.00 0.00 C ATOM 175 C6 G A 6 2.024 4.684 1.285 1.00 0.00 C ATOM 176 O6 G A 6 2.751 4.287 2.193 1.00 0.00 O ATOM 177 N1 G A 6 0.665 4.847 1.505 1.00 0.00 N ATOM 178 C2 G A 6 -0.240 5.285 0.566 1.00 0.00 C ATOM 179 N2 G A 6 -1.513 5.380 0.947 1.00 0.00 N ATOM 180 N3 G A 6 0.088 5.611 -0.688 1.00 0.00 N ATOM 181 C4 G A 6 1.415 5.457 -0.920 1.00 0.00 C ATOM 0 H5' G A 6 3.188 5.976 -7.057 1.00 0.00 H new ATOM 0 H5'' G A 6 3.424 7.710 -6.966 1.00 0.00 H new ATOM 0 H4' G A 6 1.272 6.878 -6.100 1.00 0.00 H new ATOM 0 H3' G A 6 3.058 8.652 -4.454 1.00 0.00 H new ATOM 0 H2' G A 6 1.886 8.215 -2.433 1.00 0.00 H new ATOM 0 HO2' G A 6 -0.198 8.467 -2.358 1.00 0.00 H new ATOM 0 H1' G A 6 0.421 5.849 -3.371 1.00 0.00 H new ATOM 0 H8 G A 6 4.147 5.517 -2.634 1.00 0.00 H new ATOM 0 H1 G A 6 0.309 4.625 2.435 1.00 0.00 H new ATOM 0 H21 G A 6 -2.221 5.700 0.286 1.00 0.00 H new ATOM 0 H22 G A 6 -1.780 5.133 1.900 1.00 0.00 H new ATOM 193 P A A 7 1.077 10.643 -4.811 1.00 0.00 P ATOM 194 OP1 A A 7 1.101 11.502 -6.015 1.00 0.00 O ATOM 195 OP2 A A 7 2.048 10.875 -3.717 1.00 0.00 O ATOM 196 O5' A A 7 -0.408 10.695 -4.185 1.00 0.00 O ATOM 197 C5' A A 7 -1.367 9.702 -4.549 1.00 0.00 C ATOM 198 C4' A A 7 -2.521 9.614 -3.573 1.00 0.00 C ATOM 199 O4' A A 7 -2.065 8.937 -2.387 1.00 0.00 O ATOM 200 C3' A A 7 -3.039 10.937 -3.059 1.00 0.00 C ATOM 201 O3' A A 7 -4.298 10.577 -2.477 1.00 0.00 O ATOM 202 C2' A A 7 -2.031 11.231 -1.955 1.00 0.00 C ATOM 203 O2' A A 7 -2.502 12.216 -1.054 1.00 0.00 O ATOM 204 C1' A A 7 -1.935 9.863 -1.298 1.00 0.00 C ATOM 205 N9 A A 7 -0.640 9.627 -0.626 1.00 0.00 N ATOM 206 C8 A A 7 0.622 9.967 -1.046 1.00 0.00 C ATOM 207 N7 A A 7 1.564 9.599 -0.223 1.00 0.00 N ATOM 208 C5 A A 7 0.878 8.973 0.811 1.00 0.00 C ATOM 209 C6 A A 7 1.305 8.360 2.000 1.00 0.00 C ATOM 210 N6 A A 7 2.582 8.270 2.365 1.00 0.00 N ATOM 211 N1 A A 7 0.366 7.839 2.804 1.00 0.00 N ATOM 212 C2 A A 7 -0.909 7.922 2.447 1.00 0.00 C ATOM 213 N3 A A 7 -1.437 8.470 1.363 1.00 0.00 N ATOM 214 C4 A A 7 -0.466 8.984 0.577 1.00 0.00 C ATOM 0 H5' A A 7 -0.874 8.732 -4.609 1.00 0.00 H new ATOM 0 H5'' A A 7 -1.754 9.925 -5.543 1.00 0.00 H new ATOM 0 H4' A A 7 -3.313 9.115 -4.132 1.00 0.00 H new ATOM 0 H3' A A 7 -3.151 11.765 -3.760 1.00 0.00 H new ATOM 0 H2' A A 7 -1.082 11.636 -2.306 1.00 0.00 H new ATOM 0 HO2' A A 7 -2.118 12.058 -0.166 1.00 0.00 H new ATOM 0 H1' A A 7 -2.695 9.763 -0.523 1.00 0.00 H new ATOM 0 H8 A A 7 0.816 10.490 -1.971 1.00 0.00 H new ATOM 0 H61 A A 7 2.831 7.812 3.242 1.00 0.00 H new ATOM 0 H62 A A 7 3.312 8.659 1.768 1.00 0.00 H new ATOM 0 H2 A A 7 -1.614 7.482 3.136 1.00 0.00 H new ATOM 226 P U A 8 -5.369 11.595 -1.839 1.00 0.00 P ATOM 227 OP1 U A 8 -6.502 11.726 -2.781 1.00 0.00 O ATOM 228 OP2 U A 8 -4.688 12.804 -1.333 1.00 0.00 O ATOM 229 O5' U A 8 -5.855 10.707 -0.587 1.00 0.00 O ATOM 230 C5' U A 8 -5.807 9.272 -0.696 1.00 0.00 C ATOM 231 C4' U A 8 -5.089 8.612 0.483 1.00 0.00 C ATOM 232 O4' U A 8 -3.950 9.397 0.862 1.00 0.00 O ATOM 233 C3' U A 8 -5.926 8.496 1.751 1.00 0.00 C ATOM 234 O3' U A 8 -5.410 7.387 2.503 1.00 0.00 O ATOM 235 C2' U A 8 -5.553 9.761 2.494 1.00 0.00 C ATOM 236 O2' U A 8 -5.827 9.647 3.892 1.00 0.00 O ATOM 237 C1' U A 8 -4.068 9.809 2.225 1.00 0.00 C ATOM 238 N1 U A 8 -3.517 11.167 2.360 1.00 0.00 N ATOM 239 C2 U A 8 -3.241 11.633 3.632 1.00 0.00 C ATOM 240 O2 U A 8 -3.417 10.952 4.643 1.00 0.00 O ATOM 241 N3 U A 8 -2.748 12.921 3.710 1.00 0.00 N ATOM 242 C4 U A 8 -2.512 13.766 2.642 1.00 0.00 C ATOM 243 O4 U A 8 -2.071 14.896 2.839 1.00 0.00 O ATOM 244 C5 U A 8 -2.824 13.205 1.348 1.00 0.00 C ATOM 245 C6 U A 8 -3.309 11.939 1.252 1.00 0.00 C ATOM 0 H5' U A 8 -5.301 8.999 -1.622 1.00 0.00 H new ATOM 0 H5'' U A 8 -6.823 8.883 -0.761 1.00 0.00 H new ATOM 0 H4' U A 8 -4.841 7.614 0.123 1.00 0.00 H new ATOM 0 H3' U A 8 -6.995 8.367 1.582 1.00 0.00 H new ATOM 0 H2' U A 8 -6.102 10.650 2.183 1.00 0.00 H new ATOM 0 HO2' U A 8 -5.109 10.077 4.402 1.00 0.00 H new ATOM 0 H1' U A 8 -3.523 9.185 2.933 1.00 0.00 H new ATOM 0 H3 U A 8 -2.539 13.281 4.641 1.00 0.00 H new ATOM 0 H5 U A 8 -2.672 13.793 0.455 1.00 0.00 H new ATOM 0 H6 U A 8 -3.535 11.534 0.277 1.00 0.00 H new ATOM 256 P A A 9 -6.383 6.482 3.420 1.00 0.00 P ATOM 257 OP1 A A 9 -6.641 7.210 4.682 1.00 0.00 O ATOM 258 OP2 A A 9 -5.833 5.109 3.459 1.00 0.00 O ATOM 259 O5' A A 9 -7.749 6.460 2.564 1.00 0.00 O ATOM 260 C5' A A 9 -8.229 5.249 1.967 1.00 0.00 C ATOM 261 C4' A A 9 -8.960 5.533 0.658 1.00 0.00 C ATOM 262 O4' A A 9 -8.438 6.753 0.095 1.00 0.00 O ATOM 263 C3' A A 9 -8.761 4.485 -0.440 1.00 0.00 C ATOM 264 O3' A A 9 -9.931 3.655 -0.471 1.00 0.00 O ATOM 265 C2' A A 9 -8.757 5.321 -1.713 1.00 0.00 C ATOM 266 O2' A A 9 -10.087 5.692 -2.089 1.00 0.00 O ATOM 267 C1' A A 9 -7.978 6.533 -1.244 1.00 0.00 C ATOM 268 N9 A A 9 -6.523 6.284 -1.230 1.00 0.00 N ATOM 269 C8 A A 9 -5.743 5.812 -0.207 1.00 0.00 C ATOM 270 N7 A A 9 -4.482 5.689 -0.524 1.00 0.00 N ATOM 271 C5 A A 9 -4.430 6.117 -1.845 1.00 0.00 C ATOM 272 C6 A A 9 -3.378 6.234 -2.766 1.00 0.00 C ATOM 273 N6 A A 9 -2.112 5.926 -2.486 1.00 0.00 N ATOM 274 N1 A A 9 -3.671 6.691 -3.992 1.00 0.00 N ATOM 275 C2 A A 9 -4.928 7.009 -4.278 1.00 0.00 C ATOM 276 N3 A A 9 -5.999 6.944 -3.508 1.00 0.00 N ATOM 277 C4 A A 9 -5.668 6.482 -2.286 1.00 0.00 C ATOM 0 H5' A A 9 -8.900 4.740 2.659 1.00 0.00 H new ATOM 0 H5'' A A 9 -7.393 4.575 1.781 1.00 0.00 H new ATOM 0 H4' A A 9 -10.015 5.559 0.930 1.00 0.00 H new ATOM 0 H3' A A 9 -7.872 3.868 -0.308 1.00 0.00 H new ATOM 0 H2' A A 9 -8.344 4.816 -2.586 1.00 0.00 H new ATOM 0 HO2' A A 9 -10.517 4.943 -2.551 1.00 0.00 H new ATOM 0 H1' A A 9 -8.135 7.384 -1.907 1.00 0.00 H new ATOM 0 H8 A A 9 -6.134 5.565 0.769 1.00 0.00 H new ATOM 0 H61 A A 9 -1.391 6.033 -3.200 1.00 0.00 H new ATOM 0 H62 A A 9 -1.864 5.583 -1.558 1.00 0.00 H new ATOM 0 H2 A A 9 -5.099 7.372 -5.281 1.00 0.00 H new ATOM 289 P G A 10 -10.047 2.434 -1.524 1.00 0.00 P ATOM 290 OP1 G A 10 -11.414 1.877 -1.435 1.00 0.00 O ATOM 291 OP2 G A 10 -8.876 1.549 -1.341 1.00 0.00 O ATOM 292 O5' G A 10 -9.898 3.189 -2.941 1.00 0.00 O ATOM 293 C5' G A 10 -10.348 2.589 -4.159 1.00 0.00 C ATOM 294 C4' G A 10 -9.195 2.060 -5.013 1.00 0.00 C ATOM 295 O4' G A 10 -8.115 3.002 -5.000 1.00 0.00 O ATOM 296 C3' G A 10 -8.555 0.773 -4.529 1.00 0.00 C ATOM 297 O3' G A 10 -9.267 -0.312 -5.135 1.00 0.00 O ATOM 298 C2' G A 10 -7.176 0.835 -5.173 1.00 0.00 C ATOM 299 O2' G A 10 -7.237 0.443 -6.548 1.00 0.00 O ATOM 300 C1' G A 10 -6.847 2.322 -5.058 1.00 0.00 C ATOM 301 N9 G A 10 -6.089 2.625 -3.830 1.00 0.00 N ATOM 302 C8 G A 10 -6.568 2.821 -2.564 1.00 0.00 C ATOM 303 N7 G A 10 -5.638 3.030 -1.675 1.00 0.00 N ATOM 304 C5 G A 10 -4.456 2.969 -2.407 1.00 0.00 C ATOM 305 C6 G A 10 -3.109 3.123 -1.977 1.00 0.00 C ATOM 306 O6 G A 10 -2.691 3.341 -0.843 1.00 0.00 O ATOM 307 N1 G A 10 -2.220 2.991 -3.031 1.00 0.00 N ATOM 308 C2 G A 10 -2.576 2.743 -4.337 1.00 0.00 C ATOM 309 N2 G A 10 -1.586 2.653 -5.227 1.00 0.00 N ATOM 310 N3 G A 10 -3.836 2.596 -4.752 1.00 0.00 N ATOM 311 C4 G A 10 -4.722 2.723 -3.732 1.00 0.00 C ATOM 0 H5' G A 10 -10.915 3.322 -4.733 1.00 0.00 H new ATOM 0 H5'' G A 10 -11.029 1.770 -3.927 1.00 0.00 H new ATOM 0 H4' G A 10 -9.657 1.890 -5.985 1.00 0.00 H new ATOM 0 H3' G A 10 -8.542 0.651 -3.446 1.00 0.00 H new ATOM 0 H2' G A 10 -6.443 0.175 -4.710 1.00 0.00 H new ATOM 0 HO2' G A 10 -7.333 -0.531 -6.607 1.00 0.00 H new ATOM 0 H1' G A 10 -6.232 2.635 -5.902 1.00 0.00 H new ATOM 0 H8 G A 10 -7.621 2.804 -2.323 1.00 0.00 H new ATOM 0 H1 G A 10 -1.226 3.085 -2.823 1.00 0.00 H new ATOM 0 H21 G A 10 -1.797 2.470 -6.208 1.00 0.00 H new ATOM 0 H22 G A 10 -0.618 2.767 -4.926 1.00 0.00 H new ATOM 323 P G A 11 -8.880 -1.841 -4.801 1.00 0.00 P ATOM 324 OP1 G A 11 -9.956 -2.713 -5.320 1.00 0.00 O ATOM 325 OP2 G A 11 -8.489 -1.919 -3.374 1.00 0.00 O ATOM 326 O5' G A 11 -7.564 -2.073 -5.704 1.00 0.00 O ATOM 327 C5' G A 11 -6.331 -2.496 -5.113 1.00 0.00 C ATOM 328 C4' G A 11 -5.126 -1.963 -5.885 1.00 0.00 C ATOM 329 O4' G A 11 -4.738 -0.701 -5.332 1.00 0.00 O ATOM 330 C3' G A 11 -3.878 -2.825 -5.785 1.00 0.00 C ATOM 331 O3' G A 11 -3.857 -3.659 -6.949 1.00 0.00 O ATOM 332 C2' G A 11 -2.739 -1.825 -5.927 1.00 0.00 C ATOM 333 O2' G A 11 -2.479 -1.545 -7.304 1.00 0.00 O ATOM 334 C1' G A 11 -3.309 -0.591 -5.230 1.00 0.00 C ATOM 335 N9 G A 11 -2.948 -0.529 -3.797 1.00 0.00 N ATOM 336 C8 G A 11 -3.767 -0.274 -2.725 1.00 0.00 C ATOM 337 N7 G A 11 -3.147 -0.268 -1.581 1.00 0.00 N ATOM 338 C5 G A 11 -1.825 -0.540 -1.913 1.00 0.00 C ATOM 339 C6 G A 11 -0.685 -0.658 -1.074 1.00 0.00 C ATOM 340 O6 G A 11 -0.626 -0.542 0.145 1.00 0.00 O ATOM 341 N1 G A 11 0.460 -0.938 -1.803 1.00 0.00 N ATOM 342 C2 G A 11 0.508 -1.087 -3.170 1.00 0.00 C ATOM 343 N2 G A 11 1.695 -1.369 -3.703 1.00 0.00 N ATOM 344 N3 G A 11 -0.558 -0.978 -3.969 1.00 0.00 N ATOM 345 C4 G A 11 -1.689 -0.702 -3.271 1.00 0.00 C ATOM 0 H5' G A 11 -6.294 -3.585 -5.087 1.00 0.00 H new ATOM 0 H5'' G A 11 -6.284 -2.150 -4.080 1.00 0.00 H new ATOM 0 H4' G A 11 -5.455 -1.926 -6.924 1.00 0.00 H new ATOM 0 H3' G A 11 -3.824 -3.425 -4.876 1.00 0.00 H new ATOM 0 H2' G A 11 -1.794 -2.174 -5.511 1.00 0.00 H new ATOM 0 HO2' G A 11 -2.904 -2.229 -7.863 1.00 0.00 H new ATOM 0 H1' G A 11 -2.907 0.306 -5.700 1.00 0.00 H new ATOM 0 H8 G A 11 -4.828 -0.095 -2.822 1.00 0.00 H new ATOM 0 H1 G A 11 1.334 -1.041 -1.287 1.00 0.00 H new ATOM 0 H21 G A 11 1.785 -1.490 -4.712 1.00 0.00 H new ATOM 0 H22 G A 11 2.514 -1.465 -3.102 1.00 0.00 H new ATOM 357 P G A 12 -3.178 -5.120 -6.909 1.00 0.00 P ATOM 358 OP1 G A 12 -3.689 -5.897 -8.060 1.00 0.00 O ATOM 359 OP2 G A 12 -3.312 -5.658 -5.537 1.00 0.00 O ATOM 360 O5' G A 12 -1.622 -4.791 -7.172 1.00 0.00 O ATOM 361 C5' G A 12 -0.784 -5.719 -7.870 1.00 0.00 C ATOM 362 C4' G A 12 0.663 -5.646 -7.391 1.00 0.00 C ATOM 363 O4' G A 12 0.844 -4.448 -6.629 1.00 0.00 O ATOM 364 C3' G A 12 1.071 -6.767 -6.448 1.00 0.00 C ATOM 365 O3' G A 12 1.713 -7.769 -7.243 1.00 0.00 O ATOM 366 C2' G A 12 2.137 -6.127 -5.573 1.00 0.00 C ATOM 367 O2' G A 12 3.412 -6.160 -6.222 1.00 0.00 O ATOM 368 C1' G A 12 1.634 -4.691 -5.459 1.00 0.00 C ATOM 369 N9 G A 12 0.786 -4.484 -4.267 1.00 0.00 N ATOM 370 C8 G A 12 -0.559 -4.224 -4.209 1.00 0.00 C ATOM 371 N7 G A 12 -1.014 -4.077 -2.998 1.00 0.00 N ATOM 372 C5 G A 12 0.106 -4.254 -2.195 1.00 0.00 C ATOM 373 C6 G A 12 0.226 -4.210 -0.780 1.00 0.00 C ATOM 374 O6 G A 12 -0.652 -4.001 0.052 1.00 0.00 O ATOM 375 N1 G A 12 1.529 -4.441 -0.372 1.00 0.00 N ATOM 376 C2 G A 12 2.590 -4.687 -1.215 1.00 0.00 C ATOM 377 N2 G A 12 3.778 -4.892 -0.648 1.00 0.00 N ATOM 378 N3 G A 12 2.488 -4.731 -2.545 1.00 0.00 N ATOM 379 C4 G A 12 1.218 -4.505 -2.962 1.00 0.00 C ATOM 0 H5' G A 12 -0.824 -5.512 -8.939 1.00 0.00 H new ATOM 0 H5'' G A 12 -1.164 -6.731 -7.727 1.00 0.00 H new ATOM 0 H4' G A 12 1.263 -5.702 -8.300 1.00 0.00 H new ATOM 0 H3' G A 12 0.243 -7.197 -5.884 1.00 0.00 H new ATOM 0 H2' G A 12 2.277 -6.626 -4.614 1.00 0.00 H new ATOM 0 HO2' G A 12 3.390 -6.812 -6.953 1.00 0.00 H new ATOM 0 H1' G A 12 2.485 -4.016 -5.368 1.00 0.00 H new ATOM 0 H8 G A 12 -1.183 -4.148 -5.087 1.00 0.00 H new ATOM 0 H1 G A 12 1.718 -4.428 0.630 1.00 0.00 H new ATOM 0 H21 G A 12 4.595 -5.078 -1.229 1.00 0.00 H new ATOM 0 H22 G A 12 3.870 -4.863 0.367 1.00 0.00 H new ATOM 391 P U A 13 1.935 -9.259 -6.669 1.00 0.00 P ATOM 392 OP1 U A 13 2.296 -10.141 -7.802 1.00 0.00 O ATOM 393 OP2 U A 13 0.783 -9.600 -5.806 1.00 0.00 O ATOM 394 O5' U A 13 3.235 -9.083 -5.734 1.00 0.00 O ATOM 395 C5' U A 13 3.535 -10.043 -4.718 1.00 0.00 C ATOM 396 C4' U A 13 4.501 -9.482 -3.679 1.00 0.00 C ATOM 397 O4' U A 13 4.041 -8.194 -3.256 1.00 0.00 O ATOM 398 C3' U A 13 4.596 -10.293 -2.400 1.00 0.00 C ATOM 399 O3' U A 13 5.722 -11.167 -2.544 1.00 0.00 O ATOM 400 C2' U A 13 4.960 -9.258 -1.347 1.00 0.00 C ATOM 401 O2' U A 13 6.370 -9.017 -1.340 1.00 0.00 O ATOM 402 C1' U A 13 4.209 -8.020 -1.838 1.00 0.00 C ATOM 403 N1 U A 13 2.875 -7.878 -1.211 1.00 0.00 N ATOM 404 C2 U A 13 2.827 -7.660 0.158 1.00 0.00 C ATOM 405 O2 U A 13 3.836 -7.596 0.857 1.00 0.00 O ATOM 406 N3 U A 13 1.566 -7.514 0.702 1.00 0.00 N ATOM 407 C4 U A 13 0.370 -7.569 0.015 1.00 0.00 C ATOM 408 O4 U A 13 -0.691 -7.420 0.616 1.00 0.00 O ATOM 409 C5 U A 13 0.500 -7.801 -1.405 1.00 0.00 C ATOM 410 C6 U A 13 1.728 -7.946 -1.961 1.00 0.00 C ATOM 0 H5' U A 13 3.968 -10.933 -5.175 1.00 0.00 H new ATOM 0 H5'' U A 13 2.613 -10.354 -4.227 1.00 0.00 H new ATOM 0 H4' U A 13 5.471 -9.479 -4.176 1.00 0.00 H new ATOM 0 H3' U A 13 3.695 -10.859 -2.165 1.00 0.00 H new ATOM 0 H2' U A 13 4.703 -9.558 -0.331 1.00 0.00 H new ATOM 0 HO2' U A 13 6.827 -9.736 -1.824 1.00 0.00 H new ATOM 0 H1' U A 13 4.774 -7.124 -1.579 1.00 0.00 H new ATOM 0 H3 U A 13 1.513 -7.350 1.707 1.00 0.00 H new ATOM 0 H5 U A 13 -0.383 -7.859 -2.025 1.00 0.00 H new ATOM 0 H6 U A 13 1.806 -8.120 -3.024 1.00 0.00 H new ATOM 421 P C A 14 5.748 -12.604 -1.818 1.00 0.00 P ATOM 422 OP1 C A 14 7.081 -13.209 -2.036 1.00 0.00 O ATOM 423 OP2 C A 14 4.528 -13.343 -2.208 1.00 0.00 O ATOM 424 O5' C A 14 5.619 -12.210 -0.261 1.00 0.00 O ATOM 425 C5' C A 14 6.739 -11.676 0.454 1.00 0.00 C ATOM 426 C4' C A 14 6.420 -11.493 1.934 1.00 0.00 C ATOM 427 O4' C A 14 5.559 -10.360 2.088 1.00 0.00 O ATOM 428 C3' C A 14 5.654 -12.648 2.565 1.00 0.00 C ATOM 429 O3' C A 14 6.560 -13.634 3.066 1.00 0.00 O ATOM 430 C2' C A 14 4.924 -11.959 3.711 1.00 0.00 C ATOM 431 O2' C A 14 5.787 -11.810 4.842 1.00 0.00 O ATOM 432 C1' C A 14 4.584 -10.595 3.113 1.00 0.00 C ATOM 433 N1 C A 14 3.235 -10.570 2.509 1.00 0.00 N ATOM 434 C2 C A 14 2.194 -10.075 3.282 1.00 0.00 C ATOM 435 O2 C A 14 2.405 -9.677 4.426 1.00 0.00 O ATOM 436 N3 C A 14 0.941 -10.047 2.749 1.00 0.00 N ATOM 437 C4 C A 14 0.718 -10.488 1.505 1.00 0.00 C ATOM 438 N4 C A 14 -0.530 -10.433 1.040 1.00 0.00 N ATOM 439 C5 C A 14 1.785 -11.000 0.704 1.00 0.00 C ATOM 440 C6 C A 14 3.019 -11.022 1.240 1.00 0.00 C ATOM 0 H5' C A 14 7.025 -10.718 0.021 1.00 0.00 H new ATOM 0 H5'' C A 14 7.594 -12.343 0.345 1.00 0.00 H new ATOM 0 H4' C A 14 7.391 -11.399 2.420 1.00 0.00 H new ATOM 0 H3' C A 14 4.994 -13.171 1.874 1.00 0.00 H new ATOM 0 H2' C A 14 4.054 -12.510 4.068 1.00 0.00 H new ATOM 0 HO2' C A 14 6.497 -12.485 4.803 1.00 0.00 H new ATOM 0 HO3' C A 14 6.053 -14.369 3.470 1.00 0.00 H new ATOM 0 H1' C A 14 4.595 -9.835 3.894 1.00 0.00 H new ATOM 0 H41 C A 14 -0.738 -10.760 0.096 1.00 0.00 H new ATOM 0 H42 C A 14 -1.277 -10.064 1.628 1.00 0.00 H new ATOM 0 H5 C A 14 1.607 -11.358 -0.299 1.00 0.00 H new ATOM 0 H6 C A 14 3.847 -11.401 0.660 1.00 0.00 H new TER 453 C A 14