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 -130:sc= 0.45 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 G O2' : rot -11:sc= -1.43! USER MOD Single : A 3 C O2' : rot -6:sc= -1 USER MOD Single : A 4 C O2' : rot -10:sc= -1.29! USER MOD Single : A 5 U O2' : rot -19:sc= 0.412 USER MOD Single : A 6 G O2' : rot -131:sc= -6.35! USER MOD Single : A 7 A O2' : rot 147:sc= -6.35! USER MOD Single : A 8 U O2' : rot 141:sc= 0.72 USER MOD Single : A 9 A O2' : rot -80:sc= 0.59 USER MOD Single : A 10 G O2' : rot -73:sc= 0.825 USER MOD Single : A 11 G O2' : rot -17:sc= 0.391 USER MOD Single : A 12 G O2' : rot -7:sc= -2.02! USER MOD Single : A 13 U O2' : rot 7:sc= -0.84 USER MOD Single : A 14 C O2' : rot -29:sc= 0.213 USER MOD Single : A 14 C O3' : rot 180:sc= 0.194 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -3.963 -5.872 13.437 1.00 0.00 O ATOM 2 C5' G A 1 -3.542 -6.967 12.620 1.00 0.00 C ATOM 3 C4' G A 1 -2.039 -6.924 12.359 1.00 0.00 C ATOM 4 O4' G A 1 -1.666 -8.058 11.567 1.00 0.00 O ATOM 5 C3' G A 1 -1.567 -5.730 11.551 1.00 0.00 C ATOM 6 O3' G A 1 -1.168 -4.720 12.486 1.00 0.00 O ATOM 7 C2' G A 1 -0.307 -6.245 10.874 1.00 0.00 C ATOM 8 O2' G A 1 0.812 -6.177 11.763 1.00 0.00 O ATOM 9 C1' G A 1 -0.674 -7.701 10.589 1.00 0.00 C ATOM 10 N9 G A 1 -1.251 -7.883 9.241 1.00 0.00 N ATOM 11 C8 G A 1 -2.512 -7.575 8.801 1.00 0.00 C ATOM 12 N7 G A 1 -2.714 -7.863 7.546 1.00 0.00 N ATOM 13 C5 G A 1 -1.503 -8.398 7.123 1.00 0.00 C ATOM 14 C6 G A 1 -1.120 -8.891 5.846 1.00 0.00 C ATOM 15 O6 G A 1 -1.792 -8.949 4.819 1.00 0.00 O ATOM 16 N1 G A 1 0.189 -9.340 5.843 1.00 0.00 N ATOM 17 C2 G A 1 1.034 -9.319 6.931 1.00 0.00 C ATOM 18 N2 G A 1 2.268 -9.791 6.749 1.00 0.00 N ATOM 19 N3 G A 1 0.685 -8.859 8.135 1.00 0.00 N ATOM 20 C4 G A 1 -0.596 -8.414 8.156 1.00 0.00 C ATOM 0 H5' G A 1 -4.078 -6.942 11.671 1.00 0.00 H new ATOM 0 H5'' G A 1 -3.801 -7.907 13.108 1.00 0.00 H new ATOM 0 H4' G A 1 -1.590 -6.889 13.352 1.00 0.00 H new ATOM 0 H3' G A 1 -2.312 -5.336 10.859 1.00 0.00 H new ATOM 0 H2' G A 1 -0.019 -5.676 9.990 1.00 0.00 H new ATOM 0 HO2' G A 1 1.559 -5.728 11.315 1.00 0.00 H new ATOM 0 HO5' G A 1 -4.930 -5.927 13.585 1.00 0.00 H new ATOM 0 H1' G A 1 0.222 -8.320 10.638 1.00 0.00 H new ATOM 0 H8 G A 1 -3.268 -7.135 9.435 1.00 0.00 H new ATOM 0 H1 G A 1 0.556 -9.715 4.968 1.00 0.00 H new ATOM 0 H21 G A 1 2.931 -9.797 7.524 1.00 0.00 H new ATOM 0 H22 G A 1 2.549 -10.146 5.835 1.00 0.00 H new ATOM 33 P G A 2 -1.013 -3.183 12.023 1.00 0.00 P ATOM 34 OP1 G A 2 -1.159 -2.326 13.220 1.00 0.00 O ATOM 35 OP2 G A 2 -1.884 -2.961 10.846 1.00 0.00 O ATOM 36 O5' G A 2 0.523 -3.116 11.541 1.00 0.00 O ATOM 37 C5' G A 2 0.855 -2.894 10.166 1.00 0.00 C ATOM 38 C4' G A 2 2.185 -3.544 9.802 1.00 0.00 C ATOM 39 O4' G A 2 1.965 -4.926 9.497 1.00 0.00 O ATOM 40 C3' G A 2 2.850 -2.990 8.554 1.00 0.00 C ATOM 41 O3' G A 2 3.746 -1.957 8.974 1.00 0.00 O ATOM 42 C2' G A 2 3.695 -4.160 8.074 1.00 0.00 C ATOM 43 O2' G A 2 4.915 -4.244 8.814 1.00 0.00 O ATOM 44 C1' G A 2 2.790 -5.345 8.395 1.00 0.00 C ATOM 45 N9 G A 2 1.918 -5.705 7.259 1.00 0.00 N ATOM 46 C8 G A 2 0.564 -5.529 7.125 1.00 0.00 C ATOM 47 N7 G A 2 0.089 -5.951 5.986 1.00 0.00 N ATOM 48 C5 G A 2 1.207 -6.441 5.318 1.00 0.00 C ATOM 49 C6 G A 2 1.311 -7.030 4.030 1.00 0.00 C ATOM 50 O6 G A 2 0.417 -7.236 3.212 1.00 0.00 O ATOM 51 N1 G A 2 2.616 -7.385 3.735 1.00 0.00 N ATOM 52 C2 G A 2 3.694 -7.201 4.572 1.00 0.00 C ATOM 53 N2 G A 2 4.884 -7.599 4.123 1.00 0.00 N ATOM 54 N3 G A 2 3.607 -6.650 5.785 1.00 0.00 N ATOM 55 C4 G A 2 2.334 -6.295 6.089 1.00 0.00 C ATOM 0 H5' G A 2 0.907 -1.823 9.971 1.00 0.00 H new ATOM 0 H5'' G A 2 0.066 -3.296 9.530 1.00 0.00 H new ATOM 0 H4' G A 2 2.823 -3.356 10.665 1.00 0.00 H new ATOM 0 H3' G A 2 2.155 -2.605 7.807 1.00 0.00 H new ATOM 0 H2' G A 2 3.991 -4.093 7.027 1.00 0.00 H new ATOM 0 HO2' G A 2 5.031 -3.430 9.347 1.00 0.00 H new ATOM 0 H1' G A 2 3.397 -6.222 8.622 1.00 0.00 H new ATOM 0 H8 G A 2 -0.052 -5.082 7.892 1.00 0.00 H new ATOM 0 H1 G A 2 2.793 -7.816 2.828 1.00 0.00 H new ATOM 0 H21 G A 2 5.713 -7.484 4.706 1.00 0.00 H new ATOM 0 H22 G A 2 4.965 -8.018 3.197 1.00 0.00 H new ATOM 67 P C A 3 4.160 -0.768 7.966 1.00 0.00 P ATOM 68 OP1 C A 3 5.139 0.101 8.655 1.00 0.00 O ATOM 69 OP2 C A 3 2.920 -0.184 7.407 1.00 0.00 O ATOM 70 O5' C A 3 4.923 -1.555 6.787 1.00 0.00 O ATOM 71 C5' C A 3 6.219 -2.123 7.005 1.00 0.00 C ATOM 72 C4' C A 3 6.775 -2.755 5.733 1.00 0.00 C ATOM 73 O4' C A 3 6.033 -3.942 5.432 1.00 0.00 O ATOM 74 C3' C A 3 6.634 -1.901 4.484 1.00 0.00 C ATOM 75 O3' C A 3 7.849 -1.155 4.347 1.00 0.00 O ATOM 76 C2' C A 3 6.602 -2.930 3.364 1.00 0.00 C ATOM 77 O2' C A 3 7.925 -3.349 3.021 1.00 0.00 O ATOM 78 C1' C A 3 5.829 -4.077 4.014 1.00 0.00 C ATOM 79 N1 C A 3 4.376 -4.011 3.730 1.00 0.00 N ATOM 80 C2 C A 3 3.896 -4.746 2.654 1.00 0.00 C ATOM 81 O2 C A 3 4.665 -5.417 1.967 1.00 0.00 O ATOM 82 N3 C A 3 2.564 -4.707 2.378 1.00 0.00 N ATOM 83 C4 C A 3 1.731 -3.974 3.130 1.00 0.00 C ATOM 84 N4 C A 3 0.437 -3.981 2.813 1.00 0.00 N ATOM 85 C5 C A 3 2.217 -3.213 4.236 1.00 0.00 C ATOM 86 C6 C A 3 3.536 -3.259 4.501 1.00 0.00 C ATOM 0 H5' C A 3 6.159 -2.876 7.791 1.00 0.00 H new ATOM 0 H5'' C A 3 6.902 -1.349 7.356 1.00 0.00 H new ATOM 0 H4' C A 3 7.832 -2.915 5.948 1.00 0.00 H new ATOM 0 H3' C A 3 5.775 -1.231 4.493 1.00 0.00 H new ATOM 0 H2' C A 3 6.159 -2.561 2.439 1.00 0.00 H new ATOM 0 HO2' C A 3 8.577 -2.815 3.521 1.00 0.00 H new ATOM 0 H1' C A 3 6.185 -5.029 3.620 1.00 0.00 H new ATOM 0 H41 C A 3 -0.226 -3.435 3.363 1.00 0.00 H new ATOM 0 H42 C A 3 0.109 -4.532 2.020 1.00 0.00 H new ATOM 0 H5 C A 3 1.548 -2.619 4.841 1.00 0.00 H new ATOM 0 H6 C A 3 3.934 -2.695 5.332 1.00 0.00 H new ATOM 98 P C A 4 7.843 0.307 3.673 1.00 0.00 P ATOM 99 OP1 C A 4 9.194 0.891 3.825 1.00 0.00 O ATOM 100 OP2 C A 4 6.660 1.043 4.171 1.00 0.00 O ATOM 101 O5' C A 4 7.609 -0.026 2.115 1.00 0.00 O ATOM 102 C5' C A 4 8.597 -0.742 1.366 1.00 0.00 C ATOM 103 C4' C A 4 8.190 -0.894 -0.097 1.00 0.00 C ATOM 104 O4' C A 4 7.254 -1.971 -0.221 1.00 0.00 O ATOM 105 C3' C A 4 7.446 0.295 -0.681 1.00 0.00 C ATOM 106 O3' C A 4 8.421 1.175 -1.248 1.00 0.00 O ATOM 107 C2' C A 4 6.672 -0.334 -1.825 1.00 0.00 C ATOM 108 O2' C A 4 7.526 -0.575 -2.948 1.00 0.00 O ATOM 109 C1' C A 4 6.237 -1.651 -1.189 1.00 0.00 C ATOM 110 N1 C A 4 4.946 -1.510 -0.482 1.00 0.00 N ATOM 111 C2 C A 4 3.793 -1.901 -1.147 1.00 0.00 C ATOM 112 O2 C A 4 3.857 -2.363 -2.286 1.00 0.00 O ATOM 113 N3 C A 4 2.597 -1.755 -0.514 1.00 0.00 N ATOM 114 C4 C A 4 2.535 -1.245 0.723 1.00 0.00 C ATOM 115 N4 C A 4 1.335 -1.127 1.288 1.00 0.00 N ATOM 116 C5 C A 4 3.722 -0.839 1.410 1.00 0.00 C ATOM 117 C6 C A 4 4.894 -0.989 0.778 1.00 0.00 C ATOM 0 H5' C A 4 8.746 -1.727 1.807 1.00 0.00 H new ATOM 0 H5'' C A 4 9.551 -0.218 1.427 1.00 0.00 H new ATOM 0 H4' C A 4 9.135 -1.034 -0.623 1.00 0.00 H new ATOM 0 H3' C A 4 6.828 0.838 0.034 1.00 0.00 H new ATOM 0 H2' C A 4 5.856 0.279 -2.208 1.00 0.00 H new ATOM 0 HO2' C A 4 8.392 -0.142 -2.799 1.00 0.00 H new ATOM 0 H1' C A 4 6.114 -2.418 -1.953 1.00 0.00 H new ATOM 0 H41 C A 4 1.250 -0.743 2.229 1.00 0.00 H new ATOM 0 H42 C A 4 0.501 -1.421 0.780 1.00 0.00 H new ATOM 0 H5 C A 4 3.675 -0.425 2.406 1.00 0.00 H new ATOM 0 H6 C A 4 5.808 -0.694 1.272 1.00 0.00 H new ATOM 129 P U A 5 8.117 2.749 -1.394 1.00 0.00 P ATOM 130 OP1 U A 5 9.289 3.391 -2.028 1.00 0.00 O ATOM 131 OP2 U A 5 7.614 3.248 -0.094 1.00 0.00 O ATOM 132 O5' U A 5 6.898 2.772 -2.446 1.00 0.00 O ATOM 133 C5' U A 5 7.104 2.395 -3.812 1.00 0.00 C ATOM 134 C4' U A 5 5.841 2.565 -4.634 1.00 0.00 C ATOM 135 O4' U A 5 4.871 1.620 -4.190 1.00 0.00 O ATOM 136 C3' U A 5 5.165 3.914 -4.475 1.00 0.00 C ATOM 137 O3' U A 5 5.637 4.743 -5.544 1.00 0.00 O ATOM 138 C2' U A 5 3.701 3.610 -4.747 1.00 0.00 C ATOM 139 O2' U A 5 3.434 3.619 -6.153 1.00 0.00 O ATOM 140 C1' U A 5 3.558 2.194 -4.187 1.00 0.00 C ATOM 141 N1 U A 5 3.036 2.179 -2.801 1.00 0.00 N ATOM 142 C2 U A 5 1.661 2.216 -2.632 1.00 0.00 C ATOM 143 O2 U A 5 0.877 2.280 -3.578 1.00 0.00 O ATOM 144 N3 U A 5 1.213 2.175 -1.326 1.00 0.00 N ATOM 145 C4 U A 5 2.004 2.102 -0.195 1.00 0.00 C ATOM 146 O4 U A 5 1.484 2.058 0.917 1.00 0.00 O ATOM 147 C5 U A 5 3.425 2.071 -0.453 1.00 0.00 C ATOM 148 C6 U A 5 3.885 2.112 -1.727 1.00 0.00 C ATOM 0 H5' U A 5 7.432 1.356 -3.858 1.00 0.00 H new ATOM 0 H5'' U A 5 7.902 3.001 -4.241 1.00 0.00 H new ATOM 0 H4' U A 5 6.158 2.442 -5.670 1.00 0.00 H new ATOM 0 H3' U A 5 5.341 4.392 -3.511 1.00 0.00 H new ATOM 0 H2' U A 5 3.014 4.333 -4.307 1.00 0.00 H new ATOM 0 HO2' U A 5 4.144 4.110 -6.618 1.00 0.00 H new ATOM 0 H1' U A 5 2.848 1.638 -4.800 1.00 0.00 H new ATOM 0 H3 U A 5 0.203 2.201 -1.183 1.00 0.00 H new ATOM 0 H5 U A 5 4.122 2.015 0.370 1.00 0.00 H new ATOM 0 H6 U A 5 4.951 2.091 -1.901 1.00 0.00 H new ATOM 159 P G A 6 6.209 6.219 -5.249 1.00 0.00 P ATOM 160 OP1 G A 6 6.785 6.752 -6.505 1.00 0.00 O ATOM 161 OP2 G A 6 7.036 6.162 -4.023 1.00 0.00 O ATOM 162 O5' G A 6 4.870 7.048 -4.917 1.00 0.00 O ATOM 163 C5' G A 6 3.819 7.153 -5.883 1.00 0.00 C ATOM 164 C4' G A 6 2.454 7.254 -5.212 1.00 0.00 C ATOM 165 O4' G A 6 2.327 6.205 -4.262 1.00 0.00 O ATOM 166 C3' G A 6 2.233 8.512 -4.387 1.00 0.00 C ATOM 167 O3' G A 6 1.520 9.439 -5.212 1.00 0.00 O ATOM 168 C2' G A 6 1.288 8.073 -3.258 1.00 0.00 C ATOM 169 O2' G A 6 -0.037 8.517 -3.498 1.00 0.00 O ATOM 170 C1' G A 6 1.322 6.546 -3.311 1.00 0.00 C ATOM 171 N9 G A 6 1.673 5.968 -2.000 1.00 0.00 N ATOM 172 C8 G A 6 2.897 5.550 -1.546 1.00 0.00 C ATOM 173 N7 G A 6 2.883 5.127 -0.314 1.00 0.00 N ATOM 174 C5 G A 6 1.556 5.276 0.077 1.00 0.00 C ATOM 175 C6 G A 6 0.932 4.979 1.320 1.00 0.00 C ATOM 176 O6 G A 6 1.444 4.522 2.339 1.00 0.00 O ATOM 177 N1 G A 6 -0.421 5.276 1.297 1.00 0.00 N ATOM 178 C2 G A 6 -1.097 5.794 0.216 1.00 0.00 C ATOM 179 N2 G A 6 -2.402 6.022 0.367 1.00 0.00 N ATOM 180 N3 G A 6 -0.521 6.075 -0.956 1.00 0.00 N ATOM 181 C4 G A 6 0.804 5.790 -0.950 1.00 0.00 C ATOM 0 H5' G A 6 3.839 6.284 -6.541 1.00 0.00 H new ATOM 0 H5'' G A 6 3.984 8.030 -6.509 1.00 0.00 H new ATOM 0 H4' G A 6 1.745 7.229 -6.039 1.00 0.00 H new ATOM 0 H3' G A 6 3.158 8.957 -4.020 1.00 0.00 H new ATOM 0 H2' G A 6 1.593 8.483 -2.295 1.00 0.00 H new ATOM 0 HO2' G A 6 -0.385 8.957 -2.694 1.00 0.00 H new ATOM 0 H1' G A 6 0.342 6.154 -3.583 1.00 0.00 H new ATOM 0 H8 G A 6 3.790 5.570 -2.153 1.00 0.00 H new ATOM 0 H1 G A 6 -0.957 5.097 2.146 1.00 0.00 H new ATOM 0 H21 G A 6 -2.946 6.405 -0.406 1.00 0.00 H new ATOM 0 H22 G A 6 -2.857 5.813 1.256 1.00 0.00 H new ATOM 193 P A A 7 1.381 10.991 -4.782 1.00 0.00 P ATOM 194 OP1 A A 7 1.674 11.827 -5.968 1.00 0.00 O ATOM 195 OP2 A A 7 2.136 11.200 -3.527 1.00 0.00 O ATOM 196 O5' A A 7 -0.191 11.121 -4.451 1.00 0.00 O ATOM 197 C5' A A 7 -1.108 10.144 -4.950 1.00 0.00 C ATOM 198 C4' A A 7 -2.415 10.131 -4.191 1.00 0.00 C ATOM 199 O4' A A 7 -2.219 9.430 -2.949 1.00 0.00 O ATOM 200 C3' A A 7 -2.927 11.488 -3.767 1.00 0.00 C ATOM 201 O3' A A 7 -4.287 11.219 -3.414 1.00 0.00 O ATOM 202 C2' A A 7 -2.108 11.716 -2.502 1.00 0.00 C ATOM 203 O2' A A 7 -2.659 12.740 -1.695 1.00 0.00 O ATOM 204 C1' A A 7 -2.230 10.349 -1.848 1.00 0.00 C ATOM 205 N9 A A 7 -1.101 10.029 -0.950 1.00 0.00 N ATOM 206 C8 A A 7 0.241 10.242 -1.144 1.00 0.00 C ATOM 207 N7 A A 7 0.987 9.817 -0.162 1.00 0.00 N ATOM 208 C5 A A 7 0.075 9.288 0.743 1.00 0.00 C ATOM 209 C6 A A 7 0.227 8.676 1.998 1.00 0.00 C ATOM 210 N6 A A 7 1.408 8.480 2.584 1.00 0.00 N ATOM 211 N1 A A 7 -0.883 8.266 2.631 1.00 0.00 N ATOM 212 C2 A A 7 -2.063 8.453 2.052 1.00 0.00 C ATOM 213 N3 A A 7 -2.337 9.010 0.883 1.00 0.00 N ATOM 214 C4 A A 7 -1.202 9.411 0.275 1.00 0.00 C ATOM 0 H5' A A 7 -0.649 9.157 -4.892 1.00 0.00 H new ATOM 0 H5'' A A 7 -1.306 10.342 -6.003 1.00 0.00 H new ATOM 0 H4' A A 7 -3.128 9.679 -4.881 1.00 0.00 H new ATOM 0 H3' A A 7 -2.861 12.317 -4.472 1.00 0.00 H new ATOM 0 H2' A A 7 -1.084 12.047 -2.675 1.00 0.00 H new ATOM 0 HO2' A A 7 -2.495 12.536 -0.751 1.00 0.00 H new ATOM 0 H1' A A 7 -3.125 10.305 -1.228 1.00 0.00 H new ATOM 0 H8 A A 7 0.642 10.717 -2.027 1.00 0.00 H new ATOM 0 H61 A A 7 1.455 8.029 3.498 1.00 0.00 H new ATOM 0 H62 A A 7 2.264 8.781 2.119 1.00 0.00 H new ATOM 0 H2 A A 7 -2.917 8.102 2.612 1.00 0.00 H new ATOM 226 P U A 8 -5.382 12.320 -2.992 1.00 0.00 P ATOM 227 OP1 U A 8 -6.310 12.511 -4.127 1.00 0.00 O ATOM 228 OP2 U A 8 -4.718 13.488 -2.377 1.00 0.00 O ATOM 229 O5' U A 8 -6.153 11.495 -1.843 1.00 0.00 O ATOM 230 C5' U A 8 -6.149 10.057 -1.901 1.00 0.00 C ATOM 231 C4' U A 8 -5.723 9.416 -0.580 1.00 0.00 C ATOM 232 O4' U A 8 -4.631 10.151 -0.010 1.00 0.00 O ATOM 233 C3' U A 8 -6.800 9.416 0.497 1.00 0.00 C ATOM 234 O3' U A 8 -6.518 8.324 1.383 1.00 0.00 O ATOM 235 C2' U A 8 -6.500 10.698 1.243 1.00 0.00 C ATOM 236 O2' U A 8 -7.056 10.680 2.561 1.00 0.00 O ATOM 237 C1' U A 8 -4.991 10.648 1.282 1.00 0.00 C ATOM 238 N1 U A 8 -4.391 11.977 1.464 1.00 0.00 N ATOM 239 C2 U A 8 -4.358 12.505 2.745 1.00 0.00 C ATOM 240 O2 U A 8 -4.786 11.897 3.726 1.00 0.00 O ATOM 241 N3 U A 8 -3.808 13.766 2.864 1.00 0.00 N ATOM 242 C4 U A 8 -3.299 14.532 1.834 1.00 0.00 C ATOM 243 O4 U A 8 -2.834 15.645 2.066 1.00 0.00 O ATOM 244 C5 U A 8 -3.368 13.911 0.532 1.00 0.00 C ATOM 245 C6 U A 8 -3.904 12.671 0.394 1.00 0.00 C ATOM 0 H5' U A 8 -5.475 9.731 -2.693 1.00 0.00 H new ATOM 0 H5'' U A 8 -7.146 9.705 -2.166 1.00 0.00 H new ATOM 0 H4' U A 8 -5.475 8.388 -0.845 1.00 0.00 H new ATOM 0 H3' U A 8 -7.821 9.337 0.123 1.00 0.00 H new ATOM 0 H2' U A 8 -6.915 11.596 0.786 1.00 0.00 H new ATOM 0 HO2' U A 8 -6.430 11.102 3.186 1.00 0.00 H new ATOM 0 H1' U A 8 -4.640 10.038 2.115 1.00 0.00 H new ATOM 0 H3 U A 8 -3.775 14.169 3.800 1.00 0.00 H new ATOM 0 H5 U A 8 -2.992 14.434 -0.335 1.00 0.00 H new ATOM 0 H6 U A 8 -3.946 12.222 -0.587 1.00 0.00 H new ATOM 256 P A A 9 -7.711 7.529 2.126 1.00 0.00 P ATOM 257 OP1 A A 9 -8.162 8.338 3.279 1.00 0.00 O ATOM 258 OP2 A A 9 -7.270 6.130 2.335 1.00 0.00 O ATOM 259 O5' A A 9 -8.880 7.535 1.017 1.00 0.00 O ATOM 260 C5' A A 9 -9.311 6.319 0.390 1.00 0.00 C ATOM 261 C4' A A 9 -9.763 6.570 -1.047 1.00 0.00 C ATOM 262 O4' A A 9 -9.072 7.727 -1.554 1.00 0.00 O ATOM 263 C3' A A 9 -9.427 5.453 -2.036 1.00 0.00 C ATOM 264 O3' A A 9 -10.617 4.679 -2.243 1.00 0.00 O ATOM 265 C2' A A 9 -9.148 6.216 -3.325 1.00 0.00 C ATOM 266 O2' A A 9 -10.367 6.627 -3.953 1.00 0.00 O ATOM 267 C1' A A 9 -8.396 7.413 -2.779 1.00 0.00 C ATOM 268 N9 A A 9 -6.984 7.095 -2.489 1.00 0.00 N ATOM 269 C8 A A 9 -6.428 6.640 -1.323 1.00 0.00 C ATOM 270 N7 A A 9 -5.142 6.434 -1.400 1.00 0.00 N ATOM 271 C5 A A 9 -4.828 6.783 -2.709 1.00 0.00 C ATOM 272 C6 A A 9 -3.624 6.794 -3.429 1.00 0.00 C ATOM 273 N6 A A 9 -2.451 6.433 -2.909 1.00 0.00 N ATOM 274 N1 A A 9 -3.665 7.196 -4.706 1.00 0.00 N ATOM 275 C2 A A 9 -4.827 7.562 -5.229 1.00 0.00 C ATOM 276 N3 A A 9 -6.022 7.597 -4.664 1.00 0.00 N ATOM 277 C4 A A 9 -5.944 7.188 -3.382 1.00 0.00 C ATOM 0 H5' A A 9 -10.131 5.883 0.961 1.00 0.00 H new ATOM 0 H5'' A A 9 -8.497 5.595 0.397 1.00 0.00 H new ATOM 0 H4' A A 9 -10.847 6.669 -0.984 1.00 0.00 H new ATOM 0 H3' A A 9 -8.613 4.803 -1.713 1.00 0.00 H new ATOM 0 H2' A A 9 -8.615 5.645 -4.085 1.00 0.00 H new ATOM 0 HO2' A A 9 -10.751 5.873 -4.448 1.00 0.00 H new ATOM 0 H1' A A 9 -8.384 8.232 -3.498 1.00 0.00 H new ATOM 0 H8 A A 9 -7.001 6.468 -0.424 1.00 0.00 H new ATOM 0 H61 A A 9 -1.608 6.462 -3.483 1.00 0.00 H new ATOM 0 H62 A A 9 -2.396 6.128 -1.937 1.00 0.00 H new ATOM 0 H2 A A 9 -4.793 7.876 -6.262 1.00 0.00 H new ATOM 289 P G A 10 -10.598 3.386 -3.210 1.00 0.00 P ATOM 290 OP1 G A 10 -11.989 2.904 -3.366 1.00 0.00 O ATOM 291 OP2 G A 10 -9.546 2.462 -2.733 1.00 0.00 O ATOM 292 O5' G A 10 -10.120 4.016 -4.616 1.00 0.00 O ATOM 293 C5' G A 10 -10.357 3.342 -5.856 1.00 0.00 C ATOM 294 C4' G A 10 -9.097 2.677 -6.409 1.00 0.00 C ATOM 295 O4' G A 10 -7.984 3.570 -6.267 1.00 0.00 O ATOM 296 C3' G A 10 -8.641 1.424 -5.686 1.00 0.00 C ATOM 297 O3' G A 10 -9.296 0.309 -6.304 1.00 0.00 O ATOM 298 C2' G A 10 -7.168 1.356 -6.061 1.00 0.00 C ATOM 299 O2' G A 10 -7.001 0.835 -7.383 1.00 0.00 O ATOM 300 C1' G A 10 -6.774 2.830 -6.015 1.00 0.00 C ATOM 301 N9 G A 10 -6.247 3.213 -4.691 1.00 0.00 N ATOM 302 C8 G A 10 -6.945 3.565 -3.568 1.00 0.00 C ATOM 303 N7 G A 10 -6.190 3.798 -2.533 1.00 0.00 N ATOM 304 C5 G A 10 -4.899 3.587 -3.003 1.00 0.00 C ATOM 305 C6 G A 10 -3.654 3.691 -2.325 1.00 0.00 C ATOM 306 O6 G A 10 -3.448 3.989 -1.152 1.00 0.00 O ATOM 307 N1 G A 10 -2.590 3.396 -3.163 1.00 0.00 N ATOM 308 C2 G A 10 -2.704 3.043 -4.489 1.00 0.00 C ATOM 309 N2 G A 10 -1.574 2.796 -5.148 1.00 0.00 N ATOM 310 N3 G A 10 -3.868 2.941 -5.134 1.00 0.00 N ATOM 311 C4 G A 10 -4.922 3.228 -4.328 1.00 0.00 C ATOM 0 H5' G A 10 -10.738 4.055 -6.587 1.00 0.00 H new ATOM 0 H5'' G A 10 -11.130 2.587 -5.714 1.00 0.00 H new ATOM 0 H4' G A 10 -9.373 2.424 -7.433 1.00 0.00 H new ATOM 0 H3' G A 10 -8.837 1.421 -4.614 1.00 0.00 H new ATOM 0 H2' G A 10 -6.575 0.710 -5.414 1.00 0.00 H new ATOM 0 HO2' G A 10 -7.182 -0.128 -7.380 1.00 0.00 H new ATOM 0 H1' G A 10 -5.991 3.033 -6.746 1.00 0.00 H new ATOM 0 H8 G A 10 -8.022 3.642 -3.542 1.00 0.00 H new ATOM 0 H1 G A 10 -1.651 3.444 -2.767 1.00 0.00 H new ATOM 0 H21 G A 10 -1.605 2.531 -6.132 1.00 0.00 H new ATOM 0 H22 G A 10 -0.677 2.872 -4.668 1.00 0.00 H new ATOM 323 P G A 11 -9.112 -1.182 -5.718 1.00 0.00 P ATOM 324 OP1 G A 11 -10.144 -2.048 -6.327 1.00 0.00 O ATOM 325 OP2 G A 11 -9.000 -1.092 -4.243 1.00 0.00 O ATOM 326 O5' G A 11 -7.676 -1.617 -6.313 1.00 0.00 O ATOM 327 C5' G A 11 -6.561 -1.858 -5.447 1.00 0.00 C ATOM 328 C4' G A 11 -5.241 -1.518 -6.133 1.00 0.00 C ATOM 329 O4' G A 11 -4.759 -0.264 -5.634 1.00 0.00 O ATOM 330 C3' G A 11 -4.108 -2.492 -5.857 1.00 0.00 C ATOM 331 O3' G A 11 -4.110 -3.445 -6.925 1.00 0.00 O ATOM 332 C2' G A 11 -2.862 -1.632 -6.017 1.00 0.00 C ATOM 333 O2' G A 11 -2.507 -1.507 -7.397 1.00 0.00 O ATOM 334 C1' G A 11 -3.331 -0.287 -5.462 1.00 0.00 C ATOM 335 N9 G A 11 -3.024 -0.126 -4.026 1.00 0.00 N ATOM 336 C8 G A 11 -3.860 0.264 -3.010 1.00 0.00 C ATOM 337 N7 G A 11 -3.278 0.330 -1.845 1.00 0.00 N ATOM 338 C5 G A 11 -1.964 -0.043 -2.104 1.00 0.00 C ATOM 339 C6 G A 11 -0.860 -0.157 -1.217 1.00 0.00 C ATOM 340 O6 G A 11 -0.830 0.057 -0.008 1.00 0.00 O ATOM 341 N1 G A 11 0.288 -0.561 -1.879 1.00 0.00 N ATOM 342 C2 G A 11 0.369 -0.827 -3.227 1.00 0.00 C ATOM 343 N2 G A 11 1.555 -1.220 -3.694 1.00 0.00 N ATOM 344 N3 G A 11 -0.662 -0.723 -4.070 1.00 0.00 N ATOM 345 C4 G A 11 -1.794 -0.327 -3.438 1.00 0.00 C ATOM 0 H5' G A 11 -6.555 -2.904 -5.141 1.00 0.00 H new ATOM 0 H5'' G A 11 -6.666 -1.262 -4.541 1.00 0.00 H new ATOM 0 H4' G A 11 -5.477 -1.530 -7.197 1.00 0.00 H new ATOM 0 H3' G A 11 -4.175 -2.996 -4.893 1.00 0.00 H new ATOM 0 H2' G A 11 -1.981 -2.036 -5.518 1.00 0.00 H new ATOM 0 HO2' G A 11 -2.956 -2.207 -7.915 1.00 0.00 H new ATOM 0 H1' G A 11 -2.819 0.521 -5.986 1.00 0.00 H new ATOM 0 H8 G A 11 -4.904 0.495 -3.161 1.00 0.00 H new ATOM 0 H1 G A 11 1.138 -0.670 -1.325 1.00 0.00 H new ATOM 0 H21 G A 11 1.669 -1.430 -4.686 1.00 0.00 H new ATOM 0 H22 G A 11 2.348 -1.311 -3.059 1.00 0.00 H new ATOM 357 P G A 12 -3.581 -4.949 -6.693 1.00 0.00 P ATOM 358 OP1 G A 12 -4.244 -5.830 -7.679 1.00 0.00 O ATOM 359 OP2 G A 12 -3.671 -5.257 -5.248 1.00 0.00 O ATOM 360 O5' G A 12 -2.023 -4.834 -7.085 1.00 0.00 O ATOM 361 C5' G A 12 -1.291 -5.984 -7.524 1.00 0.00 C ATOM 362 C4' G A 12 0.185 -5.897 -7.140 1.00 0.00 C ATOM 363 O4' G A 12 0.438 -4.628 -6.527 1.00 0.00 O ATOM 364 C3' G A 12 0.629 -6.913 -6.099 1.00 0.00 C ATOM 365 O3' G A 12 1.167 -8.034 -6.807 1.00 0.00 O ATOM 366 C2' G A 12 1.786 -6.216 -5.404 1.00 0.00 C ATOM 367 O2' G A 12 2.990 -6.348 -6.165 1.00 0.00 O ATOM 368 C1' G A 12 1.316 -4.764 -5.398 1.00 0.00 C ATOM 369 N9 G A 12 0.563 -4.424 -4.174 1.00 0.00 N ATOM 370 C8 G A 12 -0.739 -4.009 -4.056 1.00 0.00 C ATOM 371 N7 G A 12 -1.109 -3.781 -2.829 1.00 0.00 N ATOM 372 C5 G A 12 0.025 -4.064 -2.078 1.00 0.00 C ATOM 373 C6 G A 12 0.227 -3.997 -0.673 1.00 0.00 C ATOM 374 O6 G A 12 -0.576 -3.665 0.196 1.00 0.00 O ATOM 375 N1 G A 12 1.515 -4.365 -0.324 1.00 0.00 N ATOM 376 C2 G A 12 2.494 -4.752 -1.210 1.00 0.00 C ATOM 377 N2 G A 12 3.682 -5.072 -0.700 1.00 0.00 N ATOM 378 N3 G A 12 2.315 -4.818 -2.532 1.00 0.00 N ATOM 379 C4 G A 12 1.059 -4.461 -2.892 1.00 0.00 C ATOM 0 H5' G A 12 -1.380 -6.080 -8.606 1.00 0.00 H new ATOM 0 H5'' G A 12 -1.728 -6.882 -7.087 1.00 0.00 H new ATOM 0 H4' G A 12 0.723 -6.071 -8.072 1.00 0.00 H new ATOM 0 H3' G A 12 -0.163 -7.235 -5.423 1.00 0.00 H new ATOM 0 H2' G A 12 2.014 -6.617 -4.417 1.00 0.00 H new ATOM 0 HO2' G A 12 2.835 -6.954 -6.919 1.00 0.00 H new ATOM 0 H1' G A 12 2.179 -4.099 -5.439 1.00 0.00 H new ATOM 0 H8 G A 12 -1.397 -3.883 -4.903 1.00 0.00 H new ATOM 0 H1 G A 12 1.757 -4.348 0.667 1.00 0.00 H new ATOM 0 H21 G A 12 4.440 -5.365 -1.317 1.00 0.00 H new ATOM 0 H22 G A 12 3.834 -5.024 0.307 1.00 0.00 H new ATOM 391 P U A 13 1.164 -9.503 -6.146 1.00 0.00 P ATOM 392 OP1 U A 13 1.720 -10.457 -7.132 1.00 0.00 O ATOM 393 OP2 U A 13 -0.173 -9.745 -5.559 1.00 0.00 O ATOM 394 O5' U A 13 2.221 -9.349 -4.941 1.00 0.00 O ATOM 395 C5' U A 13 3.610 -9.132 -5.210 1.00 0.00 C ATOM 396 C4' U A 13 4.428 -9.068 -3.923 1.00 0.00 C ATOM 397 O4' U A 13 4.060 -7.896 -3.187 1.00 0.00 O ATOM 398 C3' U A 13 4.180 -10.210 -2.953 1.00 0.00 C ATOM 399 O3' U A 13 5.151 -11.221 -3.234 1.00 0.00 O ATOM 400 C2' U A 13 4.533 -9.598 -1.606 1.00 0.00 C ATOM 401 O2' U A 13 5.949 -9.609 -1.398 1.00 0.00 O ATOM 402 C1' U A 13 4.029 -8.166 -1.773 1.00 0.00 C ATOM 403 N1 U A 13 2.642 -7.998 -1.278 1.00 0.00 N ATOM 404 C2 U A 13 2.468 -7.781 0.079 1.00 0.00 C ATOM 405 O2 U A 13 3.409 -7.736 0.869 1.00 0.00 O ATOM 406 N3 U A 13 1.164 -7.622 0.501 1.00 0.00 N ATOM 407 C4 U A 13 0.037 -7.658 -0.296 1.00 0.00 C ATOM 408 O4 U A 13 -1.074 -7.499 0.202 1.00 0.00 O ATOM 409 C5 U A 13 0.298 -7.889 -1.698 1.00 0.00 C ATOM 410 C6 U A 13 1.572 -8.049 -2.135 1.00 0.00 C ATOM 0 H5' U A 13 3.733 -8.203 -5.766 1.00 0.00 H new ATOM 0 H5'' U A 13 3.988 -9.935 -5.843 1.00 0.00 H new ATOM 0 H4' U A 13 5.465 -9.095 -4.258 1.00 0.00 H new ATOM 0 H3' U A 13 3.175 -10.628 -3.000 1.00 0.00 H new ATOM 0 H2' U A 13 4.105 -10.127 -0.754 1.00 0.00 H new ATOM 0 HO2' U A 13 6.398 -9.907 -2.217 1.00 0.00 H new ATOM 0 H1' U A 13 4.654 -7.484 -1.196 1.00 0.00 H new ATOM 0 H3 U A 13 1.018 -7.462 1.498 1.00 0.00 H new ATOM 0 H5 U A 13 -0.522 -7.934 -2.399 1.00 0.00 H new ATOM 0 H6 U A 13 1.749 -8.221 -3.186 1.00 0.00 H new ATOM 421 P C A 14 4.881 -12.755 -2.820 1.00 0.00 P ATOM 422 OP1 C A 14 5.900 -13.599 -3.483 1.00 0.00 O ATOM 423 OP2 C A 14 3.443 -13.044 -3.017 1.00 0.00 O ATOM 424 O5' C A 14 5.181 -12.748 -1.238 1.00 0.00 O ATOM 425 C5' C A 14 6.509 -12.528 -0.750 1.00 0.00 C ATOM 426 C4' C A 14 6.538 -12.412 0.770 1.00 0.00 C ATOM 427 O4' C A 14 5.854 -11.226 1.168 1.00 0.00 O ATOM 428 C3' C A 14 5.809 -13.519 1.514 1.00 0.00 C ATOM 429 O3' C A 14 6.655 -14.660 1.672 1.00 0.00 O ATOM 430 C2' C A 14 5.539 -12.857 2.861 1.00 0.00 C ATOM 431 O2' C A 14 6.686 -12.959 3.710 1.00 0.00 O ATOM 432 C1' C A 14 5.289 -11.395 2.476 1.00 0.00 C ATOM 433 N1 C A 14 3.846 -11.064 2.425 1.00 0.00 N ATOM 434 C2 C A 14 3.282 -10.484 3.555 1.00 0.00 C ATOM 435 O2 C A 14 3.968 -10.266 4.552 1.00 0.00 O ATOM 436 N3 C A 14 1.959 -10.167 3.532 1.00 0.00 N ATOM 437 C4 C A 14 1.215 -10.410 2.447 1.00 0.00 C ATOM 438 N4 C A 14 -0.075 -10.075 2.490 1.00 0.00 N ATOM 439 C5 C A 14 1.788 -11.007 1.281 1.00 0.00 C ATOM 440 C6 C A 14 3.097 -11.317 1.313 1.00 0.00 C ATOM 0 H5' C A 14 6.913 -11.618 -1.192 1.00 0.00 H new ATOM 0 H5'' C A 14 7.153 -13.349 -1.065 1.00 0.00 H new ATOM 0 H4' C A 14 7.599 -12.442 1.018 1.00 0.00 H new ATOM 0 H3' C A 14 4.914 -13.883 1.009 1.00 0.00 H new ATOM 0 H2' C A 14 4.713 -13.311 3.409 1.00 0.00 H new ATOM 0 HO2' C A 14 7.187 -13.771 3.487 1.00 0.00 H new ATOM 0 HO3' C A 14 6.171 -15.362 2.154 1.00 0.00 H new ATOM 0 H1' C A 14 5.737 -10.738 3.221 1.00 0.00 H new ATOM 0 H41 C A 14 -0.673 -10.245 1.682 1.00 0.00 H new ATOM 0 H42 C A 14 -0.463 -9.649 3.331 1.00 0.00 H new ATOM 0 H5 C A 14 1.190 -11.203 0.403 1.00 0.00 H new ATOM 0 H6 C A 14 3.560 -11.771 0.449 1.00 0.00 H new TER 453 C A 14