USER MOD reduce.3.24.130724 H: found=0, std=0, add=153, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 152 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 -14:sc= 0.0494 USER MOD Single : A 1 G O5' : rot 180:sc= -0.745 USER MOD Single : A 2 G O2' : rot 180:sc= -0.499 USER MOD Single : A 3 U O2' : rot 180:sc= -0.406 USER MOD Single : A 4 A O2' : rot -23:sc= 0.124 USER MOD Single : A 5 U O2' : rot -22:sc= 0.124 USER MOD Single : A 6 C O2' : rot 168:sc= -1.56! USER MOD Single : A 7 A O2' : rot -141:sc= 0.15 USER MOD Single : A 8 C O2' : rot 24:sc= 0.206 USER MOD Single : A 9 G O2' : rot -18:sc= 0.105 USER MOD Single : A 10 G O2' : rot -24:sc= 0.102 USER MOD Single : A 11 U O2' : rot 180:sc= -0.149 USER MOD Single : A 12 A O2' : rot 180:sc= -0.0194 USER MOD Single : A 13 C O2' : rot 180:sc= -0.471 USER MOD Single : A 14 C O2' : rot -21:sc= 0.0945 USER MOD Single : A 14 C O3' : rot 180:sc= 0.114 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -11.636 -5.161 -2.422 1.00 0.00 O ATOM 2 C5' G A 1 -12.069 -6.155 -3.353 1.00 0.00 C ATOM 3 C4' G A 1 -11.669 -5.780 -4.760 1.00 0.00 C ATOM 4 O4' G A 1 -12.298 -4.517 -5.108 1.00 0.00 O ATOM 5 C3' G A 1 -10.181 -5.534 -4.972 1.00 0.00 C ATOM 6 O3' G A 1 -9.485 -6.754 -5.213 1.00 0.00 O ATOM 7 C2' G A 1 -10.180 -4.595 -6.171 1.00 0.00 C ATOM 8 O2' G A 1 -10.428 -5.299 -7.373 1.00 0.00 O ATOM 9 C1' G A 1 -11.394 -3.723 -5.856 1.00 0.00 C ATOM 10 N9 G A 1 -11.070 -2.538 -5.067 1.00 0.00 N ATOM 11 C8 G A 1 -11.210 -2.391 -3.709 1.00 0.00 C ATOM 12 N7 G A 1 -10.835 -1.218 -3.276 1.00 0.00 N ATOM 13 C5 G A 1 -10.421 -0.548 -4.420 1.00 0.00 C ATOM 14 C6 G A 1 -9.907 0.765 -4.579 1.00 0.00 C ATOM 15 O6 G A 1 -9.709 1.625 -3.713 1.00 0.00 O ATOM 16 N1 G A 1 -9.613 1.041 -5.910 1.00 0.00 N ATOM 17 C2 G A 1 -9.791 0.167 -6.955 1.00 0.00 C ATOM 18 N2 G A 1 -9.449 0.618 -8.171 1.00 0.00 N ATOM 19 N3 G A 1 -10.269 -1.060 -6.820 1.00 0.00 N ATOM 20 C4 G A 1 -10.561 -1.349 -5.534 1.00 0.00 C ATOM 0 H5' G A 1 -13.152 -6.267 -3.295 1.00 0.00 H new ATOM 0 H5'' G A 1 -11.634 -7.120 -3.091 1.00 0.00 H new ATOM 0 H4' G A 1 -11.974 -6.634 -5.364 1.00 0.00 H new ATOM 0 H3' G A 1 -9.666 -5.111 -4.110 1.00 0.00 H new ATOM 0 H2' G A 1 -9.237 -4.067 -6.311 1.00 0.00 H new ATOM 0 HO2' G A 1 -10.321 -6.261 -7.217 1.00 0.00 H new ATOM 0 HO5' G A 1 -11.906 -5.421 -1.517 1.00 0.00 H new ATOM 0 H1' G A 1 -11.809 -3.373 -6.801 1.00 0.00 H new ATOM 0 H8 G A 1 -11.592 -3.168 -3.064 1.00 0.00 H new ATOM 0 H1 G A 1 -9.236 1.964 -6.127 1.00 0.00 H new ATOM 0 H21 G A 1 -9.558 0.016 -8.987 1.00 0.00 H new ATOM 0 H22 G A 1 -9.080 1.563 -8.279 1.00 0.00 H new ATOM 32 P G A 2 -7.936 -6.889 -4.797 1.00 0.00 P ATOM 33 OP1 G A 2 -7.553 -8.312 -4.975 1.00 0.00 O ATOM 34 OP2 G A 2 -7.747 -6.239 -3.475 1.00 0.00 O ATOM 35 O5' G A 2 -7.161 -6.030 -5.892 1.00 0.00 O ATOM 36 C5' G A 2 -7.091 -6.472 -7.244 1.00 0.00 C ATOM 37 C4' G A 2 -6.405 -5.434 -8.101 1.00 0.00 C ATOM 38 O4' G A 2 -7.165 -4.196 -8.031 1.00 0.00 O ATOM 39 C3' G A 2 -5.000 -5.033 -7.671 1.00 0.00 C ATOM 40 O3' G A 2 -4.023 -5.939 -8.173 1.00 0.00 O ATOM 41 C2' G A 2 -4.874 -3.638 -8.266 1.00 0.00 C ATOM 42 O2' G A 2 -4.659 -3.692 -9.663 1.00 0.00 O ATOM 43 C1' G A 2 -6.277 -3.092 -8.009 1.00 0.00 C ATOM 44 N9 G A 2 -6.406 -2.429 -6.716 1.00 0.00 N ATOM 45 C8 G A 2 -6.914 -2.966 -5.558 1.00 0.00 C ATOM 46 N7 G A 2 -6.907 -2.132 -4.556 1.00 0.00 N ATOM 47 C5 G A 2 -6.355 -0.972 -5.081 1.00 0.00 C ATOM 48 C6 G A 2 -6.088 0.276 -4.466 1.00 0.00 C ATOM 49 O6 G A 2 -6.296 0.617 -3.296 1.00 0.00 O ATOM 50 N1 G A 2 -5.521 1.176 -5.362 1.00 0.00 N ATOM 51 C2 G A 2 -5.247 0.911 -6.681 1.00 0.00 C ATOM 52 N2 G A 2 -4.700 1.912 -7.385 1.00 0.00 N ATOM 53 N3 G A 2 -5.491 -0.250 -7.268 1.00 0.00 N ATOM 54 C4 G A 2 -6.041 -1.139 -6.414 1.00 0.00 C ATOM 0 H5' G A 2 -8.095 -6.661 -7.624 1.00 0.00 H new ATOM 0 H5'' G A 2 -6.547 -7.415 -7.298 1.00 0.00 H new ATOM 0 H4' G A 2 -6.346 -5.902 -9.084 1.00 0.00 H new ATOM 0 H3' G A 2 -4.839 -5.051 -6.593 1.00 0.00 H new ATOM 0 H2' G A 2 -4.050 -3.058 -7.850 1.00 0.00 H new ATOM 0 HO2' G A 2 -4.583 -2.782 -10.018 1.00 0.00 H new ATOM 0 H1' G A 2 -6.499 -2.349 -8.775 1.00 0.00 H new ATOM 0 H8 G A 2 -7.283 -3.979 -5.485 1.00 0.00 H new ATOM 0 H1 G A 2 -5.291 2.106 -5.012 1.00 0.00 H new ATOM 0 H21 G A 2 -4.473 1.778 -8.370 1.00 0.00 H new ATOM 0 H22 G A 2 -4.511 2.808 -6.935 1.00 0.00 H new ATOM 66 P U A 3 -2.608 -6.087 -7.421 1.00 0.00 P ATOM 67 OP1 U A 3 -1.831 -7.133 -8.133 1.00 0.00 O ATOM 68 OP2 U A 3 -2.863 -6.227 -5.964 1.00 0.00 O ATOM 69 O5' U A 3 -1.903 -4.683 -7.675 1.00 0.00 O ATOM 70 C5' U A 3 -1.547 -4.282 -8.991 1.00 0.00 C ATOM 71 C4' U A 3 -1.014 -2.870 -8.982 1.00 0.00 C ATOM 72 O4' U A 3 -2.050 -2.002 -8.452 1.00 0.00 O ATOM 73 C3' U A 3 0.187 -2.596 -8.088 1.00 0.00 C ATOM 74 O3' U A 3 1.401 -2.924 -8.756 1.00 0.00 O ATOM 75 C2' U A 3 0.059 -1.103 -7.812 1.00 0.00 C ATOM 76 O2' U A 3 0.524 -0.338 -8.907 1.00 0.00 O ATOM 77 C1' U A 3 -1.459 -0.945 -7.718 1.00 0.00 C ATOM 78 N1 U A 3 -1.972 -0.985 -6.341 1.00 0.00 N ATOM 79 C2 U A 3 -1.870 0.170 -5.586 1.00 0.00 C ATOM 80 O2 U A 3 -1.362 1.193 -6.011 1.00 0.00 O ATOM 81 N3 U A 3 -2.387 0.082 -4.317 1.00 0.00 N ATOM 82 C4 U A 3 -2.982 -1.019 -3.740 1.00 0.00 C ATOM 83 O4 U A 3 -3.406 -0.945 -2.586 1.00 0.00 O ATOM 84 C5 U A 3 -3.041 -2.172 -4.582 1.00 0.00 C ATOM 85 C6 U A 3 -2.540 -2.124 -5.820 1.00 0.00 C ATOM 0 H5' U A 3 -2.416 -4.346 -9.646 1.00 0.00 H new ATOM 0 H5'' U A 3 -0.794 -4.960 -9.394 1.00 0.00 H new ATOM 0 H4' U A 3 -0.711 -2.698 -10.015 1.00 0.00 H new ATOM 0 H3' U A 3 0.208 -3.190 -7.175 1.00 0.00 H new ATOM 0 H2' U A 3 0.625 -0.775 -6.940 1.00 0.00 H new ATOM 0 HO2' U A 3 0.429 0.616 -8.703 1.00 0.00 H new ATOM 0 H1' U A 3 -1.713 0.037 -8.118 1.00 0.00 H new ATOM 0 H3 U A 3 -2.324 0.921 -3.740 1.00 0.00 H new ATOM 0 H5 U A 3 -3.491 -3.084 -4.217 1.00 0.00 H new ATOM 0 H6 U A 3 -2.583 -3.012 -6.434 1.00 0.00 H new ATOM 96 P A A 4 2.720 -3.271 -7.904 1.00 0.00 P ATOM 97 OP1 A A 4 3.746 -3.768 -8.856 1.00 0.00 O ATOM 98 OP2 A A 4 2.325 -4.112 -6.745 1.00 0.00 O ATOM 99 O5' A A 4 3.197 -1.852 -7.357 1.00 0.00 O ATOM 100 C5' A A 4 3.631 -0.839 -8.260 1.00 0.00 C ATOM 101 C4' A A 4 3.936 0.439 -7.514 1.00 0.00 C ATOM 102 O4' A A 4 2.724 0.873 -6.836 1.00 0.00 O ATOM 103 C3' A A 4 4.979 0.342 -6.408 1.00 0.00 C ATOM 104 O3' A A 4 6.291 0.552 -6.916 1.00 0.00 O ATOM 105 C2' A A 4 4.562 1.443 -5.443 1.00 0.00 C ATOM 106 O2' A A 4 4.985 2.712 -5.901 1.00 0.00 O ATOM 107 C1' A A 4 3.041 1.371 -5.549 1.00 0.00 C ATOM 108 N9 A A 4 2.424 0.501 -4.549 1.00 0.00 N ATOM 109 C8 A A 4 2.066 -0.818 -4.677 1.00 0.00 C ATOM 110 N7 A A 4 1.513 -1.322 -3.601 1.00 0.00 N ATOM 111 C5 A A 4 1.514 -0.267 -2.700 1.00 0.00 C ATOM 112 C6 A A 4 1.065 -0.155 -1.372 1.00 0.00 C ATOM 113 N6 A A 4 0.502 -1.157 -0.692 1.00 0.00 N ATOM 114 N1 A A 4 1.217 1.039 -0.757 1.00 0.00 N ATOM 115 C2 A A 4 1.781 2.044 -1.439 1.00 0.00 C ATOM 116 N3 A A 4 2.241 2.061 -2.687 1.00 0.00 N ATOM 117 C4 A A 4 2.075 0.861 -3.270 1.00 0.00 C ATOM 0 H5' A A 4 2.860 -0.655 -9.008 1.00 0.00 H new ATOM 0 H5'' A A 4 4.519 -1.176 -8.794 1.00 0.00 H new ATOM 0 H4' A A 4 4.321 1.111 -8.281 1.00 0.00 H new ATOM 0 H3' A A 4 5.017 -0.640 -5.936 1.00 0.00 H new ATOM 0 H2' A A 4 4.975 1.319 -4.442 1.00 0.00 H new ATOM 0 HO2' A A 4 5.739 2.603 -6.517 1.00 0.00 H new ATOM 0 H1' A A 4 2.650 2.374 -5.376 1.00 0.00 H new ATOM 0 H8 A A 4 2.225 -1.388 -5.581 1.00 0.00 H new ATOM 0 H61 A A 4 0.197 -1.012 0.270 1.00 0.00 H new ATOM 0 H62 A A 4 0.377 -2.067 -1.135 1.00 0.00 H new ATOM 0 H2 A A 4 1.876 2.974 -0.898 1.00 0.00 H new ATOM 129 P U A 5 7.557 -0.037 -6.122 1.00 0.00 P ATOM 130 OP1 U A 5 8.753 0.157 -6.980 1.00 0.00 O ATOM 131 OP2 U A 5 7.216 -1.396 -5.633 1.00 0.00 O ATOM 132 O5' U A 5 7.680 0.936 -4.867 1.00 0.00 O ATOM 133 C5' U A 5 8.694 0.750 -3.886 1.00 0.00 C ATOM 134 C4' U A 5 8.296 1.437 -2.597 1.00 0.00 C ATOM 135 O4' U A 5 6.849 1.568 -2.573 1.00 0.00 O ATOM 136 C3' U A 5 8.643 0.682 -1.321 1.00 0.00 C ATOM 137 O3' U A 5 9.956 1.005 -0.879 1.00 0.00 O ATOM 138 C2' U A 5 7.568 1.153 -0.348 1.00 0.00 C ATOM 139 O2' U A 5 7.879 2.429 0.177 1.00 0.00 O ATOM 140 C1' U A 5 6.360 1.290 -1.274 1.00 0.00 C ATOM 141 N1 U A 5 5.527 0.082 -1.355 1.00 0.00 N ATOM 142 C2 U A 5 4.726 -0.237 -0.272 1.00 0.00 C ATOM 143 O2 U A 5 4.685 0.435 0.748 1.00 0.00 O ATOM 144 N3 U A 5 3.974 -1.375 -0.427 1.00 0.00 N ATOM 145 C4 U A 5 3.944 -2.209 -1.525 1.00 0.00 C ATOM 146 O4 U A 5 3.213 -3.201 -1.513 1.00 0.00 O ATOM 147 C5 U A 5 4.800 -1.811 -2.596 1.00 0.00 C ATOM 148 C6 U A 5 5.545 -0.708 -2.482 1.00 0.00 C ATOM 0 H5' U A 5 9.640 1.154 -4.247 1.00 0.00 H new ATOM 0 H5'' U A 5 8.849 -0.314 -3.708 1.00 0.00 H new ATOM 0 H4' U A 5 8.848 2.377 -2.600 1.00 0.00 H new ATOM 0 H3' U A 5 8.654 -0.402 -1.438 1.00 0.00 H new ATOM 0 H2' U A 5 7.437 0.486 0.504 1.00 0.00 H new ATOM 0 HO2' U A 5 8.843 2.588 0.101 1.00 0.00 H new ATOM 0 H1' U A 5 5.730 2.082 -0.868 1.00 0.00 H new ATOM 0 H3 U A 5 3.372 -1.632 0.355 1.00 0.00 H new ATOM 0 H5 U A 5 4.845 -2.402 -3.499 1.00 0.00 H new ATOM 0 H6 U A 5 6.185 -0.426 -3.305 1.00 0.00 H new ATOM 159 P C A 6 10.575 0.253 0.398 1.00 0.00 P ATOM 160 OP1 C A 6 11.534 1.187 1.040 1.00 0.00 O ATOM 161 OP2 C A 6 11.036 -1.092 -0.031 1.00 0.00 O ATOM 162 O5' C A 6 9.330 0.069 1.374 1.00 0.00 O ATOM 163 C5' C A 6 9.260 0.767 2.613 1.00 0.00 C ATOM 164 C4' C A 6 8.428 -0.016 3.599 1.00 0.00 C ATOM 165 O4' C A 6 7.120 -0.256 3.019 1.00 0.00 O ATOM 166 C3' C A 6 8.961 -1.400 3.933 1.00 0.00 C ATOM 167 O3' C A 6 9.907 -1.348 4.995 1.00 0.00 O ATOM 168 C2' C A 6 7.701 -2.166 4.319 1.00 0.00 C ATOM 169 O2' C A 6 7.323 -1.893 5.653 1.00 0.00 O ATOM 170 C1' C A 6 6.663 -1.545 3.384 1.00 0.00 C ATOM 171 N1 C A 6 6.441 -2.324 2.155 1.00 0.00 N ATOM 172 C2 C A 6 5.327 -3.166 2.080 1.00 0.00 C ATOM 173 O2 C A 6 4.559 -3.231 3.051 1.00 0.00 O ATOM 174 N3 C A 6 5.118 -3.885 0.954 1.00 0.00 N ATOM 175 C4 C A 6 5.969 -3.785 -0.069 1.00 0.00 C ATOM 176 N4 C A 6 5.723 -4.512 -1.161 1.00 0.00 N ATOM 177 C5 C A 6 7.112 -2.935 -0.019 1.00 0.00 C ATOM 178 C6 C A 6 7.307 -2.229 1.103 1.00 0.00 C ATOM 0 H5' C A 6 8.824 1.754 2.460 1.00 0.00 H new ATOM 0 H5'' C A 6 10.263 0.920 3.011 1.00 0.00 H new ATOM 0 H4' C A 6 8.428 0.590 4.505 1.00 0.00 H new ATOM 0 H3' C A 6 9.502 -1.869 3.111 1.00 0.00 H new ATOM 0 H2' C A 6 7.819 -3.247 4.241 1.00 0.00 H new ATOM 0 HO2' C A 6 6.417 -2.231 5.812 1.00 0.00 H new ATOM 0 H1' C A 6 5.715 -1.517 3.920 1.00 0.00 H new ATOM 0 H41 C A 6 6.353 -4.459 -1.961 1.00 0.00 H new ATOM 0 H42 C A 6 4.905 -5.120 -1.195 1.00 0.00 H new ATOM 0 H5 C A 6 7.794 -2.863 -0.853 1.00 0.00 H new ATOM 0 H6 C A 6 8.163 -1.574 1.177 1.00 0.00 H new ATOM 190 P A A 7 10.774 -2.652 5.354 1.00 0.00 P ATOM 191 OP1 A A 7 12.206 -2.270 5.269 1.00 0.00 O ATOM 192 OP2 A A 7 10.269 -3.788 4.543 1.00 0.00 O ATOM 193 O5' A A 7 10.426 -2.934 6.883 1.00 0.00 O ATOM 194 C5' A A 7 10.834 -4.142 7.519 1.00 0.00 C ATOM 195 C4' A A 7 10.154 -4.272 8.861 1.00 0.00 C ATOM 196 O4' A A 7 10.006 -2.939 9.425 1.00 0.00 O ATOM 197 C3' A A 7 8.747 -4.859 8.819 1.00 0.00 C ATOM 198 O3' A A 7 8.463 -5.613 9.993 1.00 0.00 O ATOM 199 C2' A A 7 7.861 -3.625 8.706 1.00 0.00 C ATOM 200 O2' A A 7 6.598 -3.846 9.303 1.00 0.00 O ATOM 201 C1' A A 7 8.635 -2.624 9.559 1.00 0.00 C ATOM 202 N9 A A 7 8.445 -1.228 9.166 1.00 0.00 N ATOM 203 C8 A A 7 8.378 -0.708 7.895 1.00 0.00 C ATOM 204 N7 A A 7 8.202 0.590 7.864 1.00 0.00 N ATOM 205 C5 A A 7 8.150 0.952 9.203 1.00 0.00 C ATOM 206 C6 A A 7 7.981 2.193 9.842 1.00 0.00 C ATOM 207 N6 A A 7 7.825 3.347 9.189 1.00 0.00 N ATOM 208 N1 A A 7 7.977 2.208 11.193 1.00 0.00 N ATOM 209 C2 A A 7 8.132 1.050 11.848 1.00 0.00 C ATOM 210 N3 A A 7 8.298 -0.178 11.360 1.00 0.00 N ATOM 211 C4 A A 7 8.298 -0.158 10.016 1.00 0.00 C ATOM 0 H5' A A 7 11.916 -4.148 7.648 1.00 0.00 H new ATOM 0 H5'' A A 7 10.584 -4.997 6.890 1.00 0.00 H new ATOM 0 H4' A A 7 10.783 -4.948 9.440 1.00 0.00 H new ATOM 0 H3' A A 7 8.598 -5.561 7.999 1.00 0.00 H new ATOM 0 H2' A A 7 7.670 -3.322 7.676 1.00 0.00 H new ATOM 0 HO2' A A 7 5.901 -3.418 8.762 1.00 0.00 H new ATOM 0 H1' A A 7 8.266 -2.708 10.581 1.00 0.00 H new ATOM 0 H8 A A 7 8.463 -1.313 7.005 1.00 0.00 H new ATOM 0 H61 A A 7 7.707 4.216 9.710 1.00 0.00 H new ATOM 0 H62 A A 7 7.824 3.360 8.169 1.00 0.00 H new ATOM 0 H2 A A 7 8.121 1.122 12.926 1.00 0.00 H new ATOM 223 P C A 8 7.464 -6.870 9.915 1.00 0.00 P ATOM 224 OP1 C A 8 6.953 -7.109 11.289 1.00 0.00 O ATOM 225 OP2 C A 8 8.153 -7.967 9.189 1.00 0.00 O ATOM 226 O5' C A 8 6.256 -6.355 9.010 1.00 0.00 O ATOM 227 C5' C A 8 4.917 -6.352 9.501 1.00 0.00 C ATOM 228 C4' C A 8 3.975 -6.893 8.451 1.00 0.00 C ATOM 229 O4' C A 8 4.294 -6.267 7.176 1.00 0.00 O ATOM 230 C3' C A 8 4.070 -8.400 8.207 1.00 0.00 C ATOM 231 O3' C A 8 2.794 -8.976 7.957 1.00 0.00 O ATOM 232 C2' C A 8 4.967 -8.498 6.980 1.00 0.00 C ATOM 233 O2' C A 8 4.666 -9.647 6.211 1.00 0.00 O ATOM 234 C1' C A 8 4.524 -7.264 6.206 1.00 0.00 C ATOM 235 N1 C A 8 5.519 -6.763 5.245 1.00 0.00 N ATOM 236 C2 C A 8 5.279 -6.917 3.876 1.00 0.00 C ATOM 237 O2 C A 8 4.231 -7.468 3.510 1.00 0.00 O ATOM 238 N3 C A 8 6.194 -6.462 2.990 1.00 0.00 N ATOM 239 C4 C A 8 7.310 -5.875 3.427 1.00 0.00 C ATOM 240 N4 C A 8 8.186 -5.440 2.517 1.00 0.00 N ATOM 241 C5 C A 8 7.579 -5.705 4.816 1.00 0.00 C ATOM 242 C6 C A 8 6.663 -6.158 5.681 1.00 0.00 C ATOM 0 H5' C A 8 4.625 -5.338 9.775 1.00 0.00 H new ATOM 0 H5'' C A 8 4.852 -6.958 10.405 1.00 0.00 H new ATOM 0 H4' C A 8 2.975 -6.675 8.827 1.00 0.00 H new ATOM 0 H3' C A 8 4.459 -8.941 9.070 1.00 0.00 H new ATOM 0 H2' C A 8 6.029 -8.559 7.219 1.00 0.00 H new ATOM 0 HO2' C A 8 3.741 -9.922 6.383 1.00 0.00 H new ATOM 0 H1' C A 8 3.647 -7.523 5.613 1.00 0.00 H new ATOM 0 H41 C A 8 9.049 -4.987 2.816 1.00 0.00 H new ATOM 0 H42 C A 8 7.991 -5.561 1.523 1.00 0.00 H new ATOM 0 H5 C A 8 8.486 -5.229 5.158 1.00 0.00 H new ATOM 0 H6 C A 8 6.832 -6.043 6.742 1.00 0.00 H new ATOM 254 P G A 9 1.764 -9.196 9.169 1.00 0.00 P ATOM 255 OP1 G A 9 2.167 -8.288 10.273 1.00 0.00 O ATOM 256 OP2 G A 9 1.651 -10.654 9.424 1.00 0.00 O ATOM 257 O5' G A 9 0.375 -8.682 8.583 1.00 0.00 O ATOM 258 C5' G A 9 0.233 -7.350 8.098 1.00 0.00 C ATOM 259 C4' G A 9 0.003 -6.403 9.251 1.00 0.00 C ATOM 260 O4' G A 9 1.280 -6.014 9.819 1.00 0.00 O ATOM 261 C3' G A 9 -0.654 -5.078 8.898 1.00 0.00 C ATOM 262 O3' G A 9 -2.068 -5.202 8.806 1.00 0.00 O ATOM 263 C2' G A 9 -0.227 -4.181 10.055 1.00 0.00 C ATOM 264 O2' G A 9 -1.032 -4.407 11.197 1.00 0.00 O ATOM 265 C1' G A 9 1.182 -4.702 10.345 1.00 0.00 C ATOM 266 N9 G A 9 2.240 -3.888 9.756 1.00 0.00 N ATOM 267 C8 G A 9 3.057 -2.997 10.409 1.00 0.00 C ATOM 268 N7 G A 9 3.912 -2.408 9.619 1.00 0.00 N ATOM 269 C5 G A 9 3.645 -2.942 8.366 1.00 0.00 C ATOM 270 C6 G A 9 4.252 -2.685 7.109 1.00 0.00 C ATOM 271 O6 G A 9 5.176 -1.907 6.844 1.00 0.00 O ATOM 272 N1 G A 9 3.674 -3.445 6.097 1.00 0.00 N ATOM 273 C2 G A 9 2.644 -4.337 6.271 1.00 0.00 C ATOM 274 N2 G A 9 2.221 -4.975 5.171 1.00 0.00 N ATOM 275 N3 G A 9 2.069 -4.585 7.437 1.00 0.00 N ATOM 276 C4 G A 9 2.616 -3.858 8.433 1.00 0.00 C ATOM 0 H5' G A 9 -0.602 -7.295 7.400 1.00 0.00 H new ATOM 0 H5'' G A 9 1.128 -7.057 7.549 1.00 0.00 H new ATOM 0 H4' G A 9 -0.655 -6.965 9.914 1.00 0.00 H new ATOM 0 H3' G A 9 -0.357 -4.689 7.924 1.00 0.00 H new ATOM 0 H2' G A 9 -0.297 -3.118 9.823 1.00 0.00 H new ATOM 0 HO2' G A 9 -1.858 -4.861 10.930 1.00 0.00 H new ATOM 0 H1' G A 9 1.324 -4.671 11.425 1.00 0.00 H new ATOM 0 H8 G A 9 2.997 -2.804 11.470 1.00 0.00 H new ATOM 0 H1 G A 9 4.044 -3.331 5.153 1.00 0.00 H new ATOM 0 H21 G A 9 1.459 -5.650 5.234 1.00 0.00 H new ATOM 0 H22 G A 9 2.661 -4.785 4.271 1.00 0.00 H new ATOM 288 P G A 10 -2.921 -4.056 8.067 1.00 0.00 P ATOM 289 OP1 G A 10 -4.358 -4.356 8.293 1.00 0.00 O ATOM 290 OP2 G A 10 -2.410 -3.915 6.680 1.00 0.00 O ATOM 291 O5' G A 10 -2.562 -2.728 8.871 1.00 0.00 O ATOM 292 C5' G A 10 -2.679 -1.447 8.258 1.00 0.00 C ATOM 293 C4' G A 10 -1.511 -0.576 8.649 1.00 0.00 C ATOM 294 O4' G A 10 -0.283 -1.328 8.452 1.00 0.00 O ATOM 295 C3' G A 10 -1.345 0.678 7.804 1.00 0.00 C ATOM 296 O3' G A 10 -2.107 1.757 8.340 1.00 0.00 O ATOM 297 C2' G A 10 0.156 0.933 7.868 1.00 0.00 C ATOM 298 O2' G A 10 0.516 1.561 9.084 1.00 0.00 O ATOM 299 C1' G A 10 0.705 -0.493 7.877 1.00 0.00 C ATOM 300 N9 G A 10 1.016 -1.016 6.550 1.00 0.00 N ATOM 301 C8 G A 10 0.566 -2.195 6.009 1.00 0.00 C ATOM 302 N7 G A 10 1.007 -2.409 4.801 1.00 0.00 N ATOM 303 C5 G A 10 1.799 -1.303 4.524 1.00 0.00 C ATOM 304 C6 G A 10 2.542 -0.977 3.362 1.00 0.00 C ATOM 305 O6 G A 10 2.652 -1.621 2.316 1.00 0.00 O ATOM 306 N1 G A 10 3.203 0.240 3.500 1.00 0.00 N ATOM 307 C2 G A 10 3.154 1.040 4.616 1.00 0.00 C ATOM 308 N2 G A 10 3.861 2.180 4.558 1.00 0.00 N ATOM 309 N3 G A 10 2.465 0.746 5.709 1.00 0.00 N ATOM 310 C4 G A 10 1.815 -0.432 5.594 1.00 0.00 C ATOM 0 H5' G A 10 -3.613 -0.974 8.562 1.00 0.00 H new ATOM 0 H5'' G A 10 -2.715 -1.556 7.174 1.00 0.00 H new ATOM 0 H4' G A 10 -1.706 -0.282 9.680 1.00 0.00 H new ATOM 0 H3' G A 10 -1.704 0.573 6.780 1.00 0.00 H new ATOM 0 H2' G A 10 0.518 1.574 7.064 1.00 0.00 H new ATOM 0 HO2' G A 10 -0.258 2.039 9.447 1.00 0.00 H new ATOM 0 H1' G A 10 1.638 -0.477 8.440 1.00 0.00 H new ATOM 0 H8 G A 10 -0.088 -2.877 6.532 1.00 0.00 H new ATOM 0 H1 G A 10 3.766 0.562 2.713 1.00 0.00 H new ATOM 0 H21 G A 10 3.866 2.818 5.354 1.00 0.00 H new ATOM 0 H22 G A 10 4.393 2.408 3.718 1.00 0.00 H new ATOM 322 P U A 11 -3.181 2.516 7.415 1.00 0.00 P ATOM 323 OP1 U A 11 -4.072 3.290 8.317 1.00 0.00 O ATOM 324 OP2 U A 11 -3.771 1.537 6.467 1.00 0.00 O ATOM 325 O5' U A 11 -2.300 3.549 6.585 1.00 0.00 O ATOM 326 C5' U A 11 -1.721 4.686 7.218 1.00 0.00 C ATOM 327 C4' U A 11 -0.839 5.427 6.245 1.00 0.00 C ATOM 328 O4' U A 11 0.263 4.559 5.864 1.00 0.00 O ATOM 329 C3' U A 11 -1.496 5.813 4.926 1.00 0.00 C ATOM 330 O3' U A 11 -2.182 7.057 5.026 1.00 0.00 O ATOM 331 C2' U A 11 -0.306 5.881 3.979 1.00 0.00 C ATOM 332 O2' U A 11 0.425 7.078 4.165 1.00 0.00 O ATOM 333 C1' U A 11 0.538 4.713 4.483 1.00 0.00 C ATOM 334 N1 U A 11 0.248 3.440 3.807 1.00 0.00 N ATOM 335 C2 U A 11 0.695 3.290 2.507 1.00 0.00 C ATOM 336 O2 U A 11 1.295 4.167 1.910 1.00 0.00 O ATOM 337 N3 U A 11 0.412 2.076 1.932 1.00 0.00 N ATOM 338 C4 U A 11 -0.260 1.020 2.511 1.00 0.00 C ATOM 339 O4 U A 11 -0.432 -0.016 1.867 1.00 0.00 O ATOM 340 C5 U A 11 -0.696 1.257 3.852 1.00 0.00 C ATOM 341 C6 U A 11 -0.439 2.428 4.442 1.00 0.00 C ATOM 0 H5' U A 11 -1.138 4.372 8.084 1.00 0.00 H new ATOM 0 H5'' U A 11 -2.506 5.347 7.585 1.00 0.00 H new ATOM 0 H4' U A 11 -0.557 6.339 6.772 1.00 0.00 H new ATOM 0 H3' U A 11 -2.265 5.114 4.596 1.00 0.00 H new ATOM 0 H2' U A 11 -0.586 5.846 2.926 1.00 0.00 H new ATOM 0 HO2' U A 11 1.185 7.097 3.546 1.00 0.00 H new ATOM 0 H1' U A 11 1.583 4.945 4.278 1.00 0.00 H new ATOM 0 H3 U A 11 0.733 1.940 0.973 1.00 0.00 H new ATOM 0 H5 U A 11 -1.233 0.489 4.388 1.00 0.00 H new ATOM 0 H6 U A 11 -0.782 2.587 5.454 1.00 0.00 H new ATOM 352 P A A 12 -3.438 7.356 4.067 1.00 0.00 P ATOM 353 OP1 A A 12 -4.028 8.649 4.500 1.00 0.00 O ATOM 354 OP2 A A 12 -4.290 6.141 4.018 1.00 0.00 O ATOM 355 O5' A A 12 -2.786 7.568 2.628 1.00 0.00 O ATOM 356 C5' A A 12 -1.916 8.666 2.376 1.00 0.00 C ATOM 357 C4' A A 12 -1.368 8.586 0.970 1.00 0.00 C ATOM 358 O4' A A 12 -0.631 7.342 0.829 1.00 0.00 O ATOM 359 C3' A A 12 -2.405 8.545 -0.145 1.00 0.00 C ATOM 360 O3' A A 12 -2.804 9.857 -0.527 1.00 0.00 O ATOM 361 C2' A A 12 -1.667 7.811 -1.256 1.00 0.00 C ATOM 362 O2' A A 12 -0.761 8.666 -1.925 1.00 0.00 O ATOM 363 C1' A A 12 -0.869 6.786 -0.452 1.00 0.00 C ATOM 364 N9 A A 12 -1.559 5.508 -0.281 1.00 0.00 N ATOM 365 C8 A A 12 -2.217 5.043 0.832 1.00 0.00 C ATOM 366 N7 A A 12 -2.725 3.845 0.683 1.00 0.00 N ATOM 367 C5 A A 12 -2.387 3.499 -0.618 1.00 0.00 C ATOM 368 C6 A A 12 -2.638 2.350 -1.385 1.00 0.00 C ATOM 369 N6 A A 12 -3.314 1.292 -0.934 1.00 0.00 N ATOM 370 N1 A A 12 -2.162 2.323 -2.650 1.00 0.00 N ATOM 371 C2 A A 12 -1.484 3.386 -3.102 1.00 0.00 C ATOM 372 N3 A A 12 -1.186 4.523 -2.477 1.00 0.00 N ATOM 373 C4 A A 12 -1.671 4.516 -1.224 1.00 0.00 C ATOM 0 H5' A A 12 -1.096 8.662 3.094 1.00 0.00 H new ATOM 0 H5'' A A 12 -2.454 9.604 2.512 1.00 0.00 H new ATOM 0 H4' A A 12 -0.780 9.497 0.859 1.00 0.00 H new ATOM 0 H3' A A 12 -3.337 8.054 0.135 1.00 0.00 H new ATOM 0 H2' A A 12 -2.329 7.405 -2.021 1.00 0.00 H new ATOM 0 HO2' A A 12 -0.301 8.167 -2.632 1.00 0.00 H new ATOM 0 H1' A A 12 0.048 6.576 -1.002 1.00 0.00 H new ATOM 0 H8 A A 12 -2.307 5.613 1.745 1.00 0.00 H new ATOM 0 H61 A A 12 -3.464 0.486 -1.541 1.00 0.00 H new ATOM 0 H62 A A 12 -3.681 1.289 0.018 1.00 0.00 H new ATOM 0 H2 A A 12 -1.128 3.310 -4.119 1.00 0.00 H new ATOM 385 P C A 13 -4.233 10.086 -1.228 1.00 0.00 P ATOM 386 OP1 C A 13 -4.454 11.552 -1.315 1.00 0.00 O ATOM 387 OP2 C A 13 -5.236 9.233 -0.541 1.00 0.00 O ATOM 388 O5' C A 13 -4.030 9.528 -2.706 1.00 0.00 O ATOM 389 C5' C A 13 -3.197 10.217 -3.635 1.00 0.00 C ATOM 390 C4' C A 13 -3.190 9.502 -4.966 1.00 0.00 C ATOM 391 O4' C A 13 -2.685 8.153 -4.780 1.00 0.00 O ATOM 392 C3' C A 13 -4.551 9.301 -5.615 1.00 0.00 C ATOM 393 O3' C A 13 -4.964 10.448 -6.349 1.00 0.00 O ATOM 394 C2' C A 13 -4.304 8.102 -6.521 1.00 0.00 C ATOM 395 O2' C A 13 -3.620 8.483 -7.699 1.00 0.00 O ATOM 396 C1' C A 13 -3.358 7.267 -5.659 1.00 0.00 C ATOM 397 N1 C A 13 -4.045 6.246 -4.853 1.00 0.00 N ATOM 398 C2 C A 13 -4.281 4.990 -5.415 1.00 0.00 C ATOM 399 O2 C A 13 -3.909 4.774 -6.578 1.00 0.00 O ATOM 400 N3 C A 13 -4.907 4.043 -4.679 1.00 0.00 N ATOM 401 C4 C A 13 -5.293 4.317 -3.431 1.00 0.00 C ATOM 402 N4 C A 13 -5.906 3.353 -2.742 1.00 0.00 N ATOM 403 C5 C A 13 -5.068 5.591 -2.834 1.00 0.00 C ATOM 404 C6 C A 13 -4.448 6.518 -3.575 1.00 0.00 C ATOM 0 H5' C A 13 -2.181 10.282 -3.244 1.00 0.00 H new ATOM 0 H5'' C A 13 -3.554 11.239 -3.765 1.00 0.00 H new ATOM 0 H4' C A 13 -2.585 10.146 -5.604 1.00 0.00 H new ATOM 0 H3' C A 13 -5.356 9.143 -4.897 1.00 0.00 H new ATOM 0 H2' C A 13 -5.220 7.605 -6.839 1.00 0.00 H new ATOM 0 HO2' C A 13 -3.473 7.694 -8.262 1.00 0.00 H new ATOM 0 H1' C A 13 -2.680 6.738 -6.329 1.00 0.00 H new ATOM 0 H41 C A 13 -6.215 3.527 -1.786 1.00 0.00 H new ATOM 0 H42 C A 13 -6.066 2.442 -3.172 1.00 0.00 H new ATOM 0 H5 C A 13 -5.385 5.801 -1.823 1.00 0.00 H new ATOM 0 H6 C A 13 -4.263 7.496 -3.157 1.00 0.00 H new ATOM 416 P C A 14 -6.531 10.738 -6.559 1.00 0.00 P ATOM 417 OP1 C A 14 -6.649 12.017 -7.304 1.00 0.00 O ATOM 418 OP2 C A 14 -7.216 10.586 -5.250 1.00 0.00 O ATOM 419 O5' C A 14 -7.015 9.561 -7.517 1.00 0.00 O ATOM 420 C5' C A 14 -6.523 9.452 -8.849 1.00 0.00 C ATOM 421 C4' C A 14 -7.057 8.197 -9.499 1.00 0.00 C ATOM 422 O4' C A 14 -6.581 7.040 -8.765 1.00 0.00 O ATOM 423 C3' C A 14 -8.570 8.044 -9.481 1.00 0.00 C ATOM 424 O3' C A 14 -9.200 8.765 -10.543 1.00 0.00 O ATOM 425 C2' C A 14 -8.749 6.535 -9.617 1.00 0.00 C ATOM 426 O2' C A 14 -8.613 6.126 -10.964 1.00 0.00 O ATOM 427 C1' C A 14 -7.549 6.008 -8.827 1.00 0.00 C ATOM 428 N1 C A 14 -7.878 5.598 -7.452 1.00 0.00 N ATOM 429 C2 C A 14 -8.269 4.276 -7.217 1.00 0.00 C ATOM 430 O2 C A 14 -8.329 3.489 -8.173 1.00 0.00 O ATOM 431 N3 C A 14 -8.570 3.890 -5.955 1.00 0.00 N ATOM 432 C4 C A 14 -8.491 4.769 -4.953 1.00 0.00 C ATOM 433 N4 C A 14 -8.796 4.347 -3.724 1.00 0.00 N ATOM 434 C5 C A 14 -8.096 6.122 -5.165 1.00 0.00 C ATOM 435 C6 C A 14 -7.803 6.490 -6.419 1.00 0.00 C ATOM 0 H5' C A 14 -5.433 9.432 -8.842 1.00 0.00 H new ATOM 0 H5'' C A 14 -6.822 10.326 -9.428 1.00 0.00 H new ATOM 0 H4' C A 14 -6.716 8.271 -10.532 1.00 0.00 H new ATOM 0 H3' C A 14 -9.035 8.453 -8.584 1.00 0.00 H new ATOM 0 H2' C A 14 -9.725 6.187 -9.278 1.00 0.00 H new ATOM 0 HO2' C A 14 -8.760 6.893 -11.555 1.00 0.00 H new ATOM 0 HO3' C A 14 -10.170 8.637 -10.494 1.00 0.00 H new ATOM 0 H1' C A 14 -7.186 5.119 -9.343 1.00 0.00 H new ATOM 0 H41 C A 14 -8.746 4.993 -2.936 1.00 0.00 H new ATOM 0 H42 C A 14 -9.079 3.379 -3.573 1.00 0.00 H new ATOM 0 H5 C A 14 -8.035 6.823 -4.346 1.00 0.00 H new ATOM 0 H6 C A 14 -7.503 7.508 -6.617 1.00 0.00 H new TER 448 C A 14