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 -20:sc= 0.385 USER MOD Single : A 1 G O5' : rot 180:sc=-0.00162 USER MOD Single : A 2 G O2' : rot -8:sc= -0.633 USER MOD Single : A 3 C O2' : rot -8:sc= -0.213 USER MOD Single : A 4 C O2' : rot -9:sc= -1.63! USER MOD Single : A 5 U O2' : rot -20:sc= 0.4 USER MOD Single : A 6 G O2' : rot -135:sc= -6.94! USER MOD Single : A 7 A O2' : rot 114:sc= -7.16! USER MOD Single : A 8 U O2' : rot 139:sc= 0.686 USER MOD Single : A 9 A O2' : rot -82:sc= 0.788 USER MOD Single : A 10 G O2' : rot -69:sc= 1.12 USER MOD Single : A 11 G O2' : rot -19:sc= 0.39 USER MOD Single : A 12 G O2' : rot -11:sc= -0.357 USER MOD Single : A 13 U O2' : rot -4:sc= -1.34! USER MOD Single : A 14 C O2' : rot -26:sc= 0.212 USER MOD Single : A 14 C O3' : rot 180:sc= 0.199 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -5.301 -3.725 7.592 1.00 0.00 O ATOM 2 C5' G A 1 -5.248 -3.902 9.010 1.00 0.00 C ATOM 3 C4' G A 1 -4.148 -4.878 9.414 1.00 0.00 C ATOM 4 O4' G A 1 -4.445 -6.170 8.871 1.00 0.00 O ATOM 5 C3' G A 1 -2.771 -4.549 8.869 1.00 0.00 C ATOM 6 O3' G A 1 -2.091 -3.789 9.875 1.00 0.00 O ATOM 7 C2' G A 1 -2.091 -5.906 8.789 1.00 0.00 C ATOM 8 O2' G A 1 -1.570 -6.290 10.066 1.00 0.00 O ATOM 9 C1' G A 1 -3.253 -6.815 8.391 1.00 0.00 C ATOM 10 N9 G A 1 -3.357 -6.979 6.926 1.00 0.00 N ATOM 11 C8 G A 1 -4.332 -6.518 6.079 1.00 0.00 C ATOM 12 N7 G A 1 -4.132 -6.832 4.830 1.00 0.00 N ATOM 13 C5 G A 1 -2.944 -7.552 4.850 1.00 0.00 C ATOM 14 C6 G A 1 -2.225 -8.154 3.782 1.00 0.00 C ATOM 15 O6 G A 1 -2.505 -8.167 2.585 1.00 0.00 O ATOM 16 N1 G A 1 -1.075 -8.783 4.231 1.00 0.00 N ATOM 17 C2 G A 1 -0.662 -8.832 5.544 1.00 0.00 C ATOM 18 N2 G A 1 0.476 -9.479 5.797 1.00 0.00 N ATOM 19 N3 G A 1 -1.329 -8.269 6.554 1.00 0.00 N ATOM 20 C4 G A 1 -2.457 -7.648 6.132 1.00 0.00 C ATOM 0 H5' G A 1 -6.210 -4.269 9.367 1.00 0.00 H new ATOM 0 H5'' G A 1 -5.076 -2.939 9.491 1.00 0.00 H new ATOM 0 H4' G A 1 -4.125 -4.829 10.503 1.00 0.00 H new ATOM 0 H3' G A 1 -2.784 -4.006 7.924 1.00 0.00 H new ATOM 0 H2' G A 1 -1.245 -5.936 8.103 1.00 0.00 H new ATOM 0 HO2' G A 1 -1.477 -5.496 10.634 1.00 0.00 H new ATOM 0 HO5' G A 1 -6.017 -3.095 7.368 1.00 0.00 H new ATOM 0 H1' G A 1 -3.105 -7.809 8.814 1.00 0.00 H new ATOM 0 H8 G A 1 -5.186 -5.948 6.415 1.00 0.00 H new ATOM 0 H1 G A 1 -0.489 -9.245 3.536 1.00 0.00 H new ATOM 0 H21 G A 1 0.824 -9.543 6.754 1.00 0.00 H new ATOM 0 H22 G A 1 0.998 -9.910 5.034 1.00 0.00 H new ATOM 33 P G A 2 -1.001 -2.672 9.470 1.00 0.00 P ATOM 34 OP1 G A 2 -1.211 -1.488 10.330 1.00 0.00 O ATOM 35 OP2 G A 2 -1.007 -2.525 7.996 1.00 0.00 O ATOM 36 O5' G A 2 0.388 -3.367 9.897 1.00 0.00 O ATOM 37 C5' G A 2 1.566 -2.579 10.100 1.00 0.00 C ATOM 38 C4' G A 2 2.838 -3.359 9.770 1.00 0.00 C ATOM 39 O4' G A 2 2.499 -4.720 9.476 1.00 0.00 O ATOM 40 C3' G A 2 3.570 -2.880 8.528 1.00 0.00 C ATOM 41 O3' G A 2 4.560 -1.941 8.959 1.00 0.00 O ATOM 42 C2' G A 2 4.300 -4.127 8.057 1.00 0.00 C ATOM 43 O2' G A 2 5.506 -4.324 8.801 1.00 0.00 O ATOM 44 C1' G A 2 3.284 -5.221 8.382 1.00 0.00 C ATOM 45 N9 G A 2 2.387 -5.507 7.245 1.00 0.00 N ATOM 46 C8 G A 2 1.060 -5.196 7.100 1.00 0.00 C ATOM 47 N7 G A 2 0.550 -5.584 5.965 1.00 0.00 N ATOM 48 C5 G A 2 1.613 -6.194 5.311 1.00 0.00 C ATOM 49 C6 G A 2 1.663 -6.809 4.031 1.00 0.00 C ATOM 50 O6 G A 2 0.759 -6.931 3.209 1.00 0.00 O ATOM 51 N1 G A 2 2.926 -7.302 3.750 1.00 0.00 N ATOM 52 C2 G A 2 4.012 -7.218 4.591 1.00 0.00 C ATOM 53 N2 G A 2 5.157 -7.746 4.156 1.00 0.00 N ATOM 54 N3 G A 2 3.977 -6.643 5.795 1.00 0.00 N ATOM 55 C4 G A 2 2.747 -6.155 6.086 1.00 0.00 C ATOM 0 H5' G A 2 1.604 -2.244 11.137 1.00 0.00 H new ATOM 0 H5'' G A 2 1.517 -1.685 9.478 1.00 0.00 H new ATOM 0 H4' G A 2 3.474 -3.225 10.645 1.00 0.00 H new ATOM 0 H3' G A 2 2.925 -2.432 7.772 1.00 0.00 H new ATOM 0 H2' G A 2 4.603 -4.094 7.011 1.00 0.00 H new ATOM 0 HO2' G A 2 5.670 -3.543 9.370 1.00 0.00 H new ATOM 0 H1' G A 2 3.805 -6.149 8.618 1.00 0.00 H new ATOM 0 H8 G A 2 0.490 -4.677 7.856 1.00 0.00 H new ATOM 0 H1 G A 2 3.062 -7.763 2.850 1.00 0.00 H new ATOM 0 H21 G A 2 5.991 -7.709 4.742 1.00 0.00 H new ATOM 0 H22 G A 2 5.199 -8.187 3.237 1.00 0.00 H new ATOM 67 P C A 3 4.962 -0.687 8.029 1.00 0.00 P ATOM 68 OP1 C A 3 5.962 0.126 8.756 1.00 0.00 O ATOM 69 OP2 C A 3 3.717 -0.058 7.535 1.00 0.00 O ATOM 70 O5' C A 3 5.697 -1.396 6.785 1.00 0.00 O ATOM 71 C5' C A 3 6.929 -2.098 6.967 1.00 0.00 C ATOM 72 C4' C A 3 7.382 -2.783 5.682 1.00 0.00 C ATOM 73 O4' C A 3 6.554 -3.926 5.440 1.00 0.00 O ATOM 74 C3' C A 3 7.234 -1.942 4.425 1.00 0.00 C ATOM 75 O3' C A 3 8.482 -1.275 4.216 1.00 0.00 O ATOM 76 C2' C A 3 7.084 -2.986 3.329 1.00 0.00 C ATOM 77 O2' C A 3 8.361 -3.496 2.937 1.00 0.00 O ATOM 78 C1' C A 3 6.267 -4.065 4.036 1.00 0.00 C ATOM 79 N1 C A 3 4.812 -3.900 3.825 1.00 0.00 N ATOM 80 C2 C A 3 4.220 -4.638 2.809 1.00 0.00 C ATOM 81 O2 C A 3 4.899 -5.390 2.112 1.00 0.00 O ATOM 82 N3 C A 3 2.882 -4.508 2.602 1.00 0.00 N ATOM 83 C4 C A 3 2.149 -3.683 3.364 1.00 0.00 C ATOM 84 N4 C A 3 0.842 -3.605 3.120 1.00 0.00 N ATOM 85 C5 C A 3 2.750 -2.920 4.408 1.00 0.00 C ATOM 86 C6 C A 3 4.074 -3.056 4.606 1.00 0.00 C ATOM 0 H5' C A 3 6.811 -2.843 7.754 1.00 0.00 H new ATOM 0 H5'' C A 3 7.699 -1.402 7.299 1.00 0.00 H new ATOM 0 H4' C A 3 8.436 -3.005 5.848 1.00 0.00 H new ATOM 0 H3' C A 3 6.419 -1.219 4.462 1.00 0.00 H new ATOM 0 H2' C A 3 6.625 -2.607 2.416 1.00 0.00 H new ATOM 0 HO2' C A 3 9.069 -2.975 3.371 1.00 0.00 H new ATOM 0 H1' C A 3 6.534 -5.045 3.640 1.00 0.00 H new ATOM 0 H41 C A 3 0.255 -2.988 3.680 1.00 0.00 H new ATOM 0 H42 C A 3 0.429 -4.163 2.373 1.00 0.00 H new ATOM 0 H5 C A 3 2.161 -2.254 5.021 1.00 0.00 H new ATOM 0 H6 C A 3 4.558 -2.493 5.390 1.00 0.00 H new ATOM 98 P C A 4 8.526 0.200 3.572 1.00 0.00 P ATOM 99 OP1 C A 4 9.919 0.697 3.645 1.00 0.00 O ATOM 100 OP2 C A 4 7.427 0.998 4.163 1.00 0.00 O ATOM 101 O5' C A 4 8.170 -0.080 2.026 1.00 0.00 O ATOM 102 C5' C A 4 9.074 -0.810 1.191 1.00 0.00 C ATOM 103 C4' C A 4 8.565 -0.898 -0.245 1.00 0.00 C ATOM 104 O4' C A 4 7.618 -1.969 -0.350 1.00 0.00 O ATOM 105 C3' C A 4 7.788 0.314 -0.726 1.00 0.00 C ATOM 106 O3' C A 4 8.727 1.216 -1.320 1.00 0.00 O ATOM 107 C2' C A 4 6.936 -0.266 -1.841 1.00 0.00 C ATOM 108 O2' C A 4 7.711 -0.457 -3.029 1.00 0.00 O ATOM 109 C1' C A 4 6.540 -1.607 -1.234 1.00 0.00 C ATOM 110 N1 C A 4 5.300 -1.496 -0.438 1.00 0.00 N ATOM 111 C2 C A 4 4.109 -1.885 -1.034 1.00 0.00 C ATOM 112 O2 C A 4 4.101 -2.323 -2.183 1.00 0.00 O ATOM 113 N3 C A 4 2.956 -1.765 -0.319 1.00 0.00 N ATOM 114 C4 C A 4 2.973 -1.284 0.930 1.00 0.00 C ATOM 115 N4 C A 4 1.812 -1.195 1.579 1.00 0.00 N ATOM 116 C5 C A 4 4.198 -0.882 1.547 1.00 0.00 C ATOM 117 C6 C A 4 5.326 -1.006 0.834 1.00 0.00 C ATOM 0 H5' C A 4 9.210 -1.815 1.592 1.00 0.00 H new ATOM 0 H5'' C A 4 10.051 -0.327 1.202 1.00 0.00 H new ATOM 0 H4' C A 4 9.471 -1.016 -0.840 1.00 0.00 H new ATOM 0 H3' C A 4 7.222 0.827 0.051 1.00 0.00 H new ATOM 0 H2' C A 4 6.097 0.362 -2.142 1.00 0.00 H new ATOM 0 HO2' C A 4 8.593 -0.045 -2.914 1.00 0.00 H new ATOM 0 H1' C A 4 6.364 -2.341 -2.021 1.00 0.00 H new ATOM 0 H41 C A 4 1.787 -0.833 2.532 1.00 0.00 H new ATOM 0 H42 C A 4 0.949 -1.489 1.122 1.00 0.00 H new ATOM 0 H5 C A 4 4.214 -0.491 2.554 1.00 0.00 H new ATOM 0 H6 C A 4 6.268 -0.714 1.273 1.00 0.00 H new ATOM 129 P U A 5 8.391 2.787 -1.436 1.00 0.00 P ATOM 130 OP1 U A 5 9.520 3.453 -2.120 1.00 0.00 O ATOM 131 OP2 U A 5 7.947 3.265 -0.108 1.00 0.00 O ATOM 132 O5' U A 5 7.118 2.800 -2.424 1.00 0.00 O ATOM 133 C5' U A 5 7.268 2.464 -3.808 1.00 0.00 C ATOM 134 C4' U A 5 5.950 2.561 -4.554 1.00 0.00 C ATOM 135 O4' U A 5 5.039 1.614 -4.004 1.00 0.00 O ATOM 136 C3' U A 5 5.243 3.897 -4.415 1.00 0.00 C ATOM 137 O3' U A 5 5.636 4.696 -5.537 1.00 0.00 O ATOM 138 C2' U A 5 3.778 3.538 -4.602 1.00 0.00 C ATOM 139 O2' U A 5 3.443 3.483 -5.992 1.00 0.00 O ATOM 140 C1' U A 5 3.706 2.142 -3.979 1.00 0.00 C ATOM 141 N1 U A 5 3.233 2.170 -2.577 1.00 0.00 N ATOM 142 C2 U A 5 1.864 2.154 -2.359 1.00 0.00 C ATOM 143 O2 U A 5 1.045 2.131 -3.276 1.00 0.00 O ATOM 144 N3 U A 5 1.464 2.167 -1.037 1.00 0.00 N ATOM 145 C4 U A 5 2.297 2.194 0.066 1.00 0.00 C ATOM 146 O4 U A 5 1.819 2.195 1.198 1.00 0.00 O ATOM 147 C5 U A 5 3.708 2.212 -0.244 1.00 0.00 C ATOM 148 C6 U A 5 4.120 2.200 -1.534 1.00 0.00 C ATOM 0 H5' U A 5 7.663 1.452 -3.896 1.00 0.00 H new ATOM 0 H5'' U A 5 7.997 3.132 -4.268 1.00 0.00 H new ATOM 0 H4' U A 5 6.206 2.397 -5.601 1.00 0.00 H new ATOM 0 H3' U A 5 5.452 4.419 -3.482 1.00 0.00 H new ATOM 0 H2' U A 5 3.090 4.258 -4.158 1.00 0.00 H new ATOM 0 HO2' U A 5 4.104 3.989 -6.508 1.00 0.00 H new ATOM 0 H1' U A 5 2.998 1.535 -4.543 1.00 0.00 H new ATOM 0 H3 U A 5 0.460 2.156 -0.858 1.00 0.00 H new ATOM 0 H5 U A 5 4.435 2.235 0.554 1.00 0.00 H new ATOM 0 H6 U A 5 5.179 2.215 -1.746 1.00 0.00 H new ATOM 159 P G A 6 6.165 6.203 -5.328 1.00 0.00 P ATOM 160 OP1 G A 6 6.670 6.700 -6.626 1.00 0.00 O ATOM 161 OP2 G A 6 7.043 6.225 -4.136 1.00 0.00 O ATOM 162 O5' G A 6 4.813 7.001 -4.971 1.00 0.00 O ATOM 163 C5' G A 6 3.722 7.040 -5.897 1.00 0.00 C ATOM 164 C4' G A 6 2.382 7.137 -5.177 1.00 0.00 C ATOM 165 O4' G A 6 2.326 6.141 -4.165 1.00 0.00 O ATOM 166 C3' G A 6 2.154 8.432 -4.413 1.00 0.00 C ATOM 167 O3' G A 6 1.389 9.296 -5.260 1.00 0.00 O ATOM 168 C2' G A 6 1.258 8.027 -3.232 1.00 0.00 C ATOM 169 O2' G A 6 -0.085 8.416 -3.447 1.00 0.00 O ATOM 170 C1' G A 6 1.334 6.504 -3.206 1.00 0.00 C ATOM 171 N9 G A 6 1.730 6.007 -1.877 1.00 0.00 N ATOM 172 C8 G A 6 2.974 5.639 -1.436 1.00 0.00 C ATOM 173 N7 G A 6 3.000 5.278 -0.184 1.00 0.00 N ATOM 174 C5 G A 6 1.682 5.417 0.235 1.00 0.00 C ATOM 175 C6 G A 6 1.097 5.170 1.507 1.00 0.00 C ATOM 176 O6 G A 6 1.643 4.773 2.534 1.00 0.00 O ATOM 177 N1 G A 6 -0.264 5.436 1.505 1.00 0.00 N ATOM 178 C2 G A 6 -0.980 5.886 0.416 1.00 0.00 C ATOM 179 N2 G A 6 -2.285 6.098 0.591 1.00 0.00 N ATOM 180 N3 G A 6 -0.439 6.118 -0.782 1.00 0.00 N ATOM 181 C4 G A 6 0.893 5.862 -0.798 1.00 0.00 C ATOM 0 H5' G A 6 3.738 6.145 -6.518 1.00 0.00 H new ATOM 0 H5'' G A 6 3.840 7.893 -6.565 1.00 0.00 H new ATOM 0 H4' G A 6 1.643 7.044 -5.972 1.00 0.00 H new ATOM 0 H3' G A 6 3.078 8.920 -4.102 1.00 0.00 H new ATOM 0 H2' G A 6 1.583 8.499 -2.305 1.00 0.00 H new ATOM 0 HO2' G A 6 -0.441 8.828 -2.632 1.00 0.00 H new ATOM 0 H1' G A 6 0.360 6.071 -3.433 1.00 0.00 H new ATOM 0 H8 G A 6 3.851 5.647 -2.067 1.00 0.00 H new ATOM 0 H1 G A 6 -0.774 5.287 2.376 1.00 0.00 H new ATOM 0 H21 G A 6 -2.856 6.431 -0.186 1.00 0.00 H new ATOM 0 H22 G A 6 -2.712 5.927 1.501 1.00 0.00 H new ATOM 193 P A A 7 1.137 10.842 -4.856 1.00 0.00 P ATOM 194 OP1 A A 7 1.263 11.666 -6.077 1.00 0.00 O ATOM 195 OP2 A A 7 1.959 11.156 -3.665 1.00 0.00 O ATOM 196 O5' A A 7 -0.410 10.831 -4.411 1.00 0.00 O ATOM 197 C5' A A 7 -1.291 9.845 -4.954 1.00 0.00 C ATOM 198 C4' A A 7 -2.590 9.724 -4.186 1.00 0.00 C ATOM 199 O4' A A 7 -2.316 9.106 -2.919 1.00 0.00 O ATOM 200 C3' A A 7 -3.256 11.037 -3.839 1.00 0.00 C ATOM 201 O3' A A 7 -4.626 10.673 -3.590 1.00 0.00 O ATOM 202 C2' A A 7 -2.549 11.409 -2.536 1.00 0.00 C ATOM 203 O2' A A 7 -3.329 12.298 -1.757 1.00 0.00 O ATOM 204 C1' A A 7 -2.415 10.053 -1.852 1.00 0.00 C ATOM 205 N9 A A 7 -1.189 9.948 -1.022 1.00 0.00 N ATOM 206 C8 A A 7 0.104 10.269 -1.359 1.00 0.00 C ATOM 207 N7 A A 7 0.963 10.057 -0.404 1.00 0.00 N ATOM 208 C5 A A 7 0.190 9.560 0.636 1.00 0.00 C ATOM 209 C6 A A 7 0.508 9.140 1.938 1.00 0.00 C ATOM 210 N6 A A 7 1.745 9.151 2.435 1.00 0.00 N ATOM 211 N1 A A 7 -0.493 8.704 2.715 1.00 0.00 N ATOM 212 C2 A A 7 -1.727 8.689 2.229 1.00 0.00 C ATOM 213 N3 A A 7 -2.153 9.057 1.031 1.00 0.00 N ATOM 214 C4 A A 7 -1.124 9.489 0.275 1.00 0.00 C ATOM 0 H5' A A 7 -0.787 8.879 -4.959 1.00 0.00 H new ATOM 0 H5'' A A 7 -1.511 10.095 -5.992 1.00 0.00 H new ATOM 0 H4' A A 7 -3.252 9.161 -4.844 1.00 0.00 H new ATOM 0 H3' A A 7 -3.211 11.844 -4.571 1.00 0.00 H new ATOM 0 H2' A A 7 -1.601 11.926 -2.686 1.00 0.00 H new ATOM 0 HO2' A A 7 -3.603 11.852 -0.928 1.00 0.00 H new ATOM 0 H1' A A 7 -3.262 9.889 -1.185 1.00 0.00 H new ATOM 0 H8 A A 7 0.382 10.661 -2.326 1.00 0.00 H new ATOM 0 H61 A A 7 1.914 8.833 3.389 1.00 0.00 H new ATOM 0 H62 A A 7 2.522 9.477 1.861 1.00 0.00 H new ATOM 0 H2 A A 7 -2.489 8.327 2.903 1.00 0.00 H new ATOM 226 P U A 8 -5.750 11.663 -2.992 1.00 0.00 P ATOM 227 OP1 U A 8 -6.990 11.473 -3.777 1.00 0.00 O ATOM 228 OP2 U A 8 -5.191 13.024 -2.831 1.00 0.00 O ATOM 229 O5' U A 8 -5.974 11.000 -1.543 1.00 0.00 O ATOM 230 C5' U A 8 -5.915 9.571 -1.428 1.00 0.00 C ATOM 231 C4' U A 8 -5.602 9.105 -0.009 1.00 0.00 C ATOM 232 O4' U A 8 -4.468 9.820 0.495 1.00 0.00 O ATOM 233 C3' U A 8 -6.713 9.355 1.002 1.00 0.00 C ATOM 234 O3' U A 8 -6.597 8.347 2.014 1.00 0.00 O ATOM 235 C2' U A 8 -6.301 10.675 1.621 1.00 0.00 C ATOM 236 O2' U A 8 -6.883 10.851 2.915 1.00 0.00 O ATOM 237 C1' U A 8 -4.803 10.485 1.713 1.00 0.00 C ATOM 238 N1 U A 8 -4.063 11.757 1.781 1.00 0.00 N ATOM 239 C2 U A 8 -3.958 12.378 3.015 1.00 0.00 C ATOM 240 O2 U A 8 -4.457 11.913 4.036 1.00 0.00 O ATOM 241 N3 U A 8 -3.252 13.564 3.034 1.00 0.00 N ATOM 242 C4 U A 8 -2.651 14.173 1.949 1.00 0.00 C ATOM 243 O4 U A 8 -2.048 15.234 2.094 1.00 0.00 O ATOM 244 C5 U A 8 -2.807 13.465 0.699 1.00 0.00 C ATOM 245 C6 U A 8 -3.497 12.297 0.657 1.00 0.00 C ATOM 0 H5' U A 8 -5.154 9.187 -2.108 1.00 0.00 H new ATOM 0 H5'' U A 8 -6.868 9.146 -1.743 1.00 0.00 H new ATOM 0 H4' U A 8 -5.444 8.031 -0.104 1.00 0.00 H new ATOM 0 H3' U A 8 -7.719 9.352 0.583 1.00 0.00 H new ATOM 0 H2' U A 8 -6.614 11.555 1.060 1.00 0.00 H new ATOM 0 HO2' U A 8 -6.219 11.240 3.522 1.00 0.00 H new ATOM 0 H1' U A 8 -4.539 9.939 2.619 1.00 0.00 H new ATOM 0 H3 U A 8 -3.166 14.036 3.934 1.00 0.00 H new ATOM 0 H5 U A 8 -2.373 13.867 -0.205 1.00 0.00 H new ATOM 0 H6 U A 8 -3.602 11.781 -0.286 1.00 0.00 H new ATOM 256 P A A 9 -7.905 7.663 2.666 1.00 0.00 P ATOM 257 OP1 A A 9 -8.497 8.623 3.626 1.00 0.00 O ATOM 258 OP2 A A 9 -7.537 6.303 3.119 1.00 0.00 O ATOM 259 O5' A A 9 -8.907 7.529 1.409 1.00 0.00 O ATOM 260 C5' A A 9 -9.311 6.243 0.920 1.00 0.00 C ATOM 261 C4' A A 9 -9.783 6.320 -0.531 1.00 0.00 C ATOM 262 O4' A A 9 -9.133 7.434 -1.174 1.00 0.00 O ATOM 263 C3' A A 9 -9.422 5.113 -1.400 1.00 0.00 C ATOM 264 O3' A A 9 -10.579 4.270 -1.483 1.00 0.00 O ATOM 265 C2' A A 9 -9.209 5.739 -2.771 1.00 0.00 C ATOM 266 O2' A A 9 -10.460 6.040 -3.397 1.00 0.00 O ATOM 267 C1' A A 9 -8.487 7.011 -2.382 1.00 0.00 C ATOM 268 N9 A A 9 -7.055 6.776 -2.107 1.00 0.00 N ATOM 269 C8 A A 9 -6.450 6.463 -0.918 1.00 0.00 C ATOM 270 N7 A A 9 -5.162 6.288 -1.014 1.00 0.00 N ATOM 271 C5 A A 9 -4.896 6.508 -2.358 1.00 0.00 C ATOM 272 C6 A A 9 -3.712 6.479 -3.110 1.00 0.00 C ATOM 273 N6 A A 9 -2.515 6.206 -2.591 1.00 0.00 N ATOM 274 N1 A A 9 -3.799 6.745 -4.419 1.00 0.00 N ATOM 275 C2 A A 9 -4.985 7.020 -4.944 1.00 0.00 C ATOM 276 N3 A A 9 -6.168 7.077 -4.351 1.00 0.00 N ATOM 277 C4 A A 9 -6.043 6.806 -3.036 1.00 0.00 C ATOM 0 H5' A A 9 -10.113 5.850 1.545 1.00 0.00 H new ATOM 0 H5'' A A 9 -8.477 5.545 0.996 1.00 0.00 H new ATOM 0 H4' A A 9 -10.868 6.392 -0.461 1.00 0.00 H new ATOM 0 H3' A A 9 -8.573 4.537 -1.032 1.00 0.00 H new ATOM 0 H2' A A 9 -8.678 5.107 -3.483 1.00 0.00 H new ATOM 0 HO2' A A 9 -10.820 5.230 -3.814 1.00 0.00 H new ATOM 0 H1' A A 9 -8.531 7.745 -3.186 1.00 0.00 H new ATOM 0 H8 A A 9 -6.990 6.370 0.012 1.00 0.00 H new ATOM 0 H61 A A 9 -1.689 6.200 -3.189 1.00 0.00 H new ATOM 0 H62 A A 9 -2.425 6.003 -1.595 1.00 0.00 H new ATOM 0 H2 A A 9 -4.987 7.227 -6.004 1.00 0.00 H new ATOM 289 P G A 10 -10.542 2.900 -2.342 1.00 0.00 P ATOM 290 OP1 G A 10 -11.911 2.339 -2.374 1.00 0.00 O ATOM 291 OP2 G A 10 -9.416 2.073 -1.855 1.00 0.00 O ATOM 292 O5' G A 10 -10.179 3.434 -3.819 1.00 0.00 O ATOM 293 C5' G A 10 -10.442 2.646 -4.985 1.00 0.00 C ATOM 294 C4' G A 10 -9.176 2.019 -5.568 1.00 0.00 C ATOM 295 O4' G A 10 -8.106 2.972 -5.526 1.00 0.00 O ATOM 296 C3' G A 10 -8.621 0.826 -4.812 1.00 0.00 C ATOM 297 O3' G A 10 -9.243 -0.349 -5.346 1.00 0.00 O ATOM 298 C2' G A 10 -7.164 0.816 -5.258 1.00 0.00 C ATOM 299 O2' G A 10 -7.034 0.238 -6.560 1.00 0.00 O ATOM 300 C1' G A 10 -6.847 2.309 -5.302 1.00 0.00 C ATOM 301 N9 G A 10 -6.278 2.788 -4.029 1.00 0.00 N ATOM 302 C8 G A 10 -6.940 3.167 -2.894 1.00 0.00 C ATOM 303 N7 G A 10 -6.152 3.500 -1.911 1.00 0.00 N ATOM 304 C5 G A 10 -4.874 3.331 -2.433 1.00 0.00 C ATOM 305 C6 G A 10 -3.606 3.541 -1.827 1.00 0.00 C ATOM 306 O6 G A 10 -3.362 3.917 -0.684 1.00 0.00 O ATOM 307 N1 G A 10 -2.568 3.256 -2.699 1.00 0.00 N ATOM 308 C2 G A 10 -2.725 2.821 -3.997 1.00 0.00 C ATOM 309 N2 G A 10 -1.614 2.598 -4.698 1.00 0.00 N ATOM 310 N3 G A 10 -3.911 2.619 -4.576 1.00 0.00 N ATOM 311 C4 G A 10 -4.939 2.895 -3.735 1.00 0.00 C ATOM 0 H5' G A 10 -10.915 3.271 -5.742 1.00 0.00 H new ATOM 0 H5'' G A 10 -11.151 1.857 -4.734 1.00 0.00 H new ATOM 0 H4' G A 10 -9.487 1.703 -6.564 1.00 0.00 H new ATOM 0 H3' G A 10 -8.766 0.864 -3.732 1.00 0.00 H new ATOM 0 H2' G A 10 -6.506 0.235 -4.611 1.00 0.00 H new ATOM 0 HO2' G A 10 -7.224 -0.722 -6.512 1.00 0.00 H new ATOM 0 H1' G A 10 -6.112 2.513 -6.081 1.00 0.00 H new ATOM 0 H8 G A 10 -8.017 3.188 -2.819 1.00 0.00 H new ATOM 0 H1 G A 10 -1.616 3.377 -2.354 1.00 0.00 H new ATOM 0 H21 G A 10 -1.676 2.275 -5.663 1.00 0.00 H new ATOM 0 H22 G A 10 -0.701 2.750 -4.269 1.00 0.00 H new ATOM 323 P G A 11 -8.902 -1.808 -4.748 1.00 0.00 P ATOM 324 OP1 G A 11 -9.920 -2.760 -5.242 1.00 0.00 O ATOM 325 OP2 G A 11 -8.670 -1.669 -3.290 1.00 0.00 O ATOM 326 O5' G A 11 -7.498 -2.158 -5.458 1.00 0.00 O ATOM 327 C5' G A 11 -6.308 -2.350 -4.687 1.00 0.00 C ATOM 328 C4' G A 11 -5.064 -1.921 -5.461 1.00 0.00 C ATOM 329 O4' G A 11 -4.644 -0.634 -4.998 1.00 0.00 O ATOM 330 C3' G A 11 -3.848 -2.809 -5.262 1.00 0.00 C ATOM 331 O3' G A 11 -3.850 -3.765 -6.330 1.00 0.00 O ATOM 332 C2' G A 11 -2.682 -1.862 -5.504 1.00 0.00 C ATOM 333 O2' G A 11 -2.431 -1.713 -6.904 1.00 0.00 O ATOM 334 C1' G A 11 -3.210 -0.555 -4.913 1.00 0.00 C ATOM 335 N9 G A 11 -2.830 -0.375 -3.494 1.00 0.00 N ATOM 336 C8 G A 11 -3.625 -0.005 -2.438 1.00 0.00 C ATOM 337 N7 G A 11 -2.986 0.082 -1.306 1.00 0.00 N ATOM 338 C5 G A 11 -1.677 -0.254 -1.632 1.00 0.00 C ATOM 339 C6 G A 11 -0.525 -0.332 -0.802 1.00 0.00 C ATOM 340 O6 G A 11 -0.437 -0.113 0.403 1.00 0.00 O ATOM 341 N1 G A 11 0.600 -0.704 -1.523 1.00 0.00 N ATOM 342 C2 G A 11 0.618 -0.973 -2.873 1.00 0.00 C ATOM 343 N2 G A 11 1.789 -1.329 -3.401 1.00 0.00 N ATOM 344 N3 G A 11 -0.458 -0.902 -3.660 1.00 0.00 N ATOM 345 C4 G A 11 -1.568 -0.536 -2.971 1.00 0.00 C ATOM 0 H5' G A 11 -6.220 -3.400 -4.408 1.00 0.00 H new ATOM 0 H5'' G A 11 -6.377 -1.779 -3.761 1.00 0.00 H new ATOM 0 H4' G A 11 -5.368 -1.958 -6.507 1.00 0.00 H new ATOM 0 H3' G A 11 -3.815 -3.313 -4.296 1.00 0.00 H new ATOM 0 H2' G A 11 -1.742 -2.200 -5.069 1.00 0.00 H new ATOM 0 HO2' G A 11 -2.833 -2.463 -7.390 1.00 0.00 H new ATOM 0 H1' G A 11 -2.788 0.287 -5.461 1.00 0.00 H new ATOM 0 H8 G A 11 -4.682 0.195 -2.536 1.00 0.00 H new ATOM 0 H1 G A 11 1.481 -0.784 -1.015 1.00 0.00 H new ATOM 0 H21 G A 11 1.857 -1.539 -4.397 1.00 0.00 H new ATOM 0 H22 G A 11 2.617 -1.391 -2.809 1.00 0.00 H new ATOM 357 P G A 12 -3.817 -5.346 -6.023 1.00 0.00 P ATOM 358 OP1 G A 12 -4.284 -6.062 -7.232 1.00 0.00 O ATOM 359 OP2 G A 12 -4.487 -5.581 -4.724 1.00 0.00 O ATOM 360 O5' G A 12 -2.244 -5.636 -5.835 1.00 0.00 O ATOM 361 C5' G A 12 -1.462 -6.173 -6.907 1.00 0.00 C ATOM 362 C4' G A 12 0.022 -5.930 -6.691 1.00 0.00 C ATOM 363 O4' G A 12 0.192 -4.655 -6.070 1.00 0.00 O ATOM 364 C3' G A 12 0.688 -6.915 -5.743 1.00 0.00 C ATOM 365 O3' G A 12 1.297 -7.926 -6.550 1.00 0.00 O ATOM 366 C2' G A 12 1.805 -6.101 -5.114 1.00 0.00 C ATOM 367 O2' G A 12 2.956 -6.076 -5.964 1.00 0.00 O ATOM 368 C1' G A 12 1.174 -4.714 -5.029 1.00 0.00 C ATOM 369 N9 G A 12 0.498 -4.478 -3.736 1.00 0.00 N ATOM 370 C8 G A 12 -0.824 -4.200 -3.501 1.00 0.00 C ATOM 371 N7 G A 12 -1.111 -4.033 -2.243 1.00 0.00 N ATOM 372 C5 G A 12 0.105 -4.213 -1.595 1.00 0.00 C ATOM 373 C6 G A 12 0.414 -4.152 -0.210 1.00 0.00 C ATOM 374 O6 G A 12 -0.343 -3.921 0.728 1.00 0.00 O ATOM 375 N1 G A 12 1.758 -4.393 0.025 1.00 0.00 N ATOM 376 C2 G A 12 2.693 -4.664 -0.949 1.00 0.00 C ATOM 377 N2 G A 12 3.946 -4.875 -0.545 1.00 0.00 N ATOM 378 N3 G A 12 2.413 -4.724 -2.253 1.00 0.00 N ATOM 379 C4 G A 12 1.102 -4.489 -2.500 1.00 0.00 C ATOM 0 H5' G A 12 -1.773 -5.719 -7.848 1.00 0.00 H new ATOM 0 H5'' G A 12 -1.648 -7.244 -6.993 1.00 0.00 H new ATOM 0 H4' G A 12 0.475 -6.022 -7.678 1.00 0.00 H new ATOM 0 H3' G A 12 0.009 -7.362 -5.017 1.00 0.00 H new ATOM 0 H2' G A 12 2.151 -6.493 -4.158 1.00 0.00 H new ATOM 0 HO2' G A 12 2.844 -6.730 -6.685 1.00 0.00 H new ATOM 0 H1' G A 12 1.953 -3.958 -5.128 1.00 0.00 H new ATOM 0 H8 G A 12 -1.560 -4.126 -4.288 1.00 0.00 H new ATOM 0 H1 G A 12 2.079 -4.368 0.993 1.00 0.00 H new ATOM 0 H21 G A 12 4.675 -5.080 -1.229 1.00 0.00 H new ATOM 0 H22 G A 12 4.176 -4.832 0.448 1.00 0.00 H new ATOM 391 P U A 13 1.363 -9.454 -6.043 1.00 0.00 P ATOM 392 OP1 U A 13 1.922 -10.281 -7.136 1.00 0.00 O ATOM 393 OP2 U A 13 0.054 -9.804 -5.451 1.00 0.00 O ATOM 394 O5' U A 13 2.451 -9.382 -4.857 1.00 0.00 O ATOM 395 C5' U A 13 3.820 -9.084 -5.140 1.00 0.00 C ATOM 396 C4' U A 13 4.639 -8.946 -3.860 1.00 0.00 C ATOM 397 O4' U A 13 4.203 -7.786 -3.143 1.00 0.00 O ATOM 398 C3' U A 13 4.468 -10.085 -2.869 1.00 0.00 C ATOM 399 O3' U A 13 5.509 -11.031 -3.130 1.00 0.00 O ATOM 400 C2' U A 13 4.775 -9.428 -1.532 1.00 0.00 C ATOM 401 O2' U A 13 6.187 -9.348 -1.319 1.00 0.00 O ATOM 402 C1' U A 13 4.184 -8.033 -1.725 1.00 0.00 C ATOM 403 N1 U A 13 2.789 -7.939 -1.238 1.00 0.00 N ATOM 404 C2 U A 13 2.597 -7.673 0.109 1.00 0.00 C ATOM 405 O2 U A 13 3.530 -7.539 0.898 1.00 0.00 O ATOM 406 N3 U A 13 1.284 -7.577 0.524 1.00 0.00 N ATOM 407 C4 U A 13 0.165 -7.718 -0.273 1.00 0.00 C ATOM 408 O4 U A 13 -0.957 -7.603 0.217 1.00 0.00 O ATOM 409 C5 U A 13 0.444 -7.994 -1.662 1.00 0.00 C ATOM 410 C6 U A 13 1.726 -8.093 -2.092 1.00 0.00 C ATOM 0 H5' U A 13 3.881 -8.159 -5.714 1.00 0.00 H new ATOM 0 H5'' U A 13 4.244 -9.873 -5.761 1.00 0.00 H new ATOM 0 H4' U A 13 5.674 -8.914 -4.201 1.00 0.00 H new ATOM 0 H3' U A 13 3.494 -10.572 -2.910 1.00 0.00 H new ATOM 0 H2' U A 13 4.375 -9.967 -0.673 1.00 0.00 H new ATOM 0 HO2' U A 13 6.655 -9.791 -2.058 1.00 0.00 H new ATOM 0 H1' U A 13 4.765 -7.306 -1.157 1.00 0.00 H new ATOM 0 H3 U A 13 1.125 -7.384 1.513 1.00 0.00 H new ATOM 0 H5 U A 13 -0.370 -8.122 -2.360 1.00 0.00 H new ATOM 0 H6 U A 13 1.916 -8.299 -3.135 1.00 0.00 H new ATOM 421 P C A 14 5.330 -12.580 -2.723 1.00 0.00 P ATOM 422 OP1 C A 14 6.539 -13.315 -3.161 1.00 0.00 O ATOM 423 OP2 C A 14 3.993 -13.026 -3.172 1.00 0.00 O ATOM 424 O5' C A 14 5.329 -12.522 -1.113 1.00 0.00 O ATOM 425 C5' C A 14 6.521 -12.190 -0.393 1.00 0.00 C ATOM 426 C4' C A 14 6.243 -11.999 1.095 1.00 0.00 C ATOM 427 O4' C A 14 5.379 -10.878 1.273 1.00 0.00 O ATOM 428 C3' C A 14 5.496 -13.145 1.758 1.00 0.00 C ATOM 429 O3' C A 14 6.406 -14.170 2.162 1.00 0.00 O ATOM 430 C2' C A 14 4.888 -12.454 2.975 1.00 0.00 C ATOM 431 O2' C A 14 5.841 -12.383 4.041 1.00 0.00 O ATOM 432 C1' C A 14 4.573 -11.052 2.447 1.00 0.00 C ATOM 433 N1 C A 14 3.148 -10.898 2.081 1.00 0.00 N ATOM 434 C2 C A 14 2.293 -10.356 3.032 1.00 0.00 C ATOM 435 O2 C A 14 2.723 -10.028 4.137 1.00 0.00 O ATOM 436 N3 C A 14 0.978 -10.204 2.719 1.00 0.00 N ATOM 437 C4 C A 14 0.515 -10.571 1.516 1.00 0.00 C ATOM 438 N4 C A 14 -0.783 -10.396 1.272 1.00 0.00 N ATOM 439 C5 C A 14 1.387 -11.132 0.533 1.00 0.00 C ATOM 440 C6 C A 14 2.686 -11.277 0.852 1.00 0.00 C ATOM 0 H5' C A 14 6.952 -11.277 -0.803 1.00 0.00 H new ATOM 0 H5'' C A 14 7.260 -12.980 -0.527 1.00 0.00 H new ATOM 0 H4' C A 14 7.232 -11.898 1.543 1.00 0.00 H new ATOM 0 H3' C A 14 4.766 -13.635 1.114 1.00 0.00 H new ATOM 0 H2' C A 14 4.018 -12.973 3.378 1.00 0.00 H new ATOM 0 HO2' C A 14 6.487 -13.114 3.951 1.00 0.00 H new ATOM 0 HO3' C A 14 5.909 -14.899 2.588 1.00 0.00 H new ATOM 0 H1' C A 14 4.783 -10.312 3.219 1.00 0.00 H new ATOM 0 H41 C A 14 -1.173 -10.663 0.368 1.00 0.00 H new ATOM 0 H42 C A 14 -1.387 -9.995 1.989 1.00 0.00 H new ATOM 0 H5 C A 14 1.015 -11.430 -0.436 1.00 0.00 H new ATOM 0 H6 C A 14 3.370 -11.697 0.130 1.00 0.00 H new TER 453 C A 14