USER MOD reduce.3.24.130724 H: found=0, std=0, add=152, rem=0, adj=15 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 180:sc= -0.225 USER MOD Single : A 2 G O2' : rot -16:sc= 0.132 USER MOD Single : A 3 C O2' : rot -17:sc= 0.224 USER MOD Single : A 4 A O2' : rot -119:sc= 0.261 USER MOD Single : A 5 C O2' : rot -18:sc= 0.142 USER MOD Single : A 6 U O2' : rot -162:sc= 1.22 USER MOD Single : A 7 U O2' : rot -114:sc= 1.24 USER MOD Single : A 8 C O2' : rot 18:sc= 0.192 USER MOD Single : A 9 G O2' : rot -17:sc= 0.121 USER MOD Single : A 10 G O2' : rot -20:sc= 0.0436 USER MOD Single : A 11 U O2' : rot -14:sc= 0.163 USER MOD Single : A 12 G O2' : rot -25:sc= 0.0709 USER MOD Single : A 13 C O2' : rot -23:sc= 0.233 USER MOD Single : A 14 C O2' : rot -24:sc= 0.294 USER MOD Single : A 14 C O3' : rot 180:sc= 0.231 USER MOD ----------------------------------------------------------------- ATOM 1 OP3 G A 1 -10.439 -4.998 9.616 1.00 10.00 O ATOM 2 P G A 1 -11.992 -4.669 9.507 1.00 10.00 P ATOM 3 OP1 G A 1 -12.190 -3.251 9.891 1.00 10.00 O ATOM 4 OP2 G A 1 -12.746 -5.727 10.222 1.00 10.00 O ATOM 5 O5' G A 1 -12.284 -4.807 7.949 1.00 10.00 O ATOM 6 C5' G A 1 -12.494 -6.086 7.355 1.00 10.00 C ATOM 7 C4' G A 1 -12.920 -5.934 5.912 1.00 10.00 C ATOM 8 O4' G A 1 -13.688 -4.705 5.748 1.00 10.00 O ATOM 9 C3' G A 1 -11.789 -5.802 4.901 1.00 10.00 C ATOM 10 O3' G A 1 -11.247 -7.075 4.548 1.00 10.00 O ATOM 11 C2' G A 1 -12.515 -5.145 3.734 1.00 10.00 C ATOM 12 O2' G A 1 -13.321 -6.061 3.016 1.00 10.00 O ATOM 13 C1' G A 1 -13.410 -4.154 4.471 1.00 10.00 C ATOM 14 N9 G A 1 -12.792 -2.840 4.614 1.00 10.00 N ATOM 15 C8 G A 1 -12.305 -2.242 5.752 1.00 10.00 C ATOM 16 N7 G A 1 -11.816 -1.050 5.537 1.00 10.00 N ATOM 17 C5 G A 1 -11.984 -0.850 4.174 1.00 10.00 C ATOM 18 C6 G A 1 -11.640 0.262 3.355 1.00 10.00 C ATOM 19 O6 G A 1 -11.108 1.331 3.688 1.00 10.00 O ATOM 20 N1 G A 1 -11.981 0.049 2.022 1.00 10.00 N ATOM 21 C2 G A 1 -12.583 -1.093 1.547 1.00 10.00 C ATOM 22 N2 G A 1 -12.846 -1.131 0.235 1.00 10.00 N ATOM 23 N3 G A 1 -12.910 -2.131 2.297 1.00 10.00 N ATOM 24 C4 G A 1 -12.583 -1.943 3.593 1.00 10.00 C ATOM 0 H5' G A 1 -13.257 -6.631 7.911 1.00 10.00 H new ATOM 0 H5'' G A 1 -11.578 -6.674 7.410 1.00 10.00 H new ATOM 0 H4' G A 1 -13.472 -6.853 5.715 1.00 10.00 H new ATOM 0 H3' G A 1 -10.927 -5.240 5.260 1.00 10.00 H new ATOM 0 H2' G A 1 -11.838 -4.718 2.994 1.00 10.00 H new ATOM 0 HO2' G A 1 -13.768 -5.595 2.279 1.00 10.00 H new ATOM 0 H1' G A 1 -14.322 -4.000 3.894 1.00 10.00 H new ATOM 0 H8 G A 1 -12.325 -2.710 6.725 1.00 10.00 H new ATOM 0 H1 G A 1 -11.770 0.789 1.353 1.00 10.00 H new ATOM 0 H21 G A 1 -13.292 -1.953 -0.172 1.00 10.00 H new ATOM 0 H22 G A 1 -12.601 -0.338 -0.357 1.00 10.00 H new ATOM 37 P G A 2 -9.681 -7.273 4.228 1.00 10.00 P ATOM 38 OP1 G A 2 -9.255 -8.562 4.825 1.00 10.00 O ATOM 39 OP2 G A 2 -8.971 -6.035 4.621 1.00 10.00 O ATOM 40 O5' G A 2 -9.580 -7.407 2.640 1.00 10.00 O ATOM 41 C5' G A 2 -10.683 -7.886 1.876 1.00 10.00 C ATOM 42 C4' G A 2 -10.730 -7.298 0.482 1.00 10.00 C ATOM 43 O4' G A 2 -11.357 -5.992 0.559 1.00 10.00 O ATOM 44 C3' G A 2 -9.406 -7.053 -0.230 1.00 10.00 C ATOM 45 O3' G A 2 -9.006 -8.213 -0.955 1.00 10.00 O ATOM 46 C2' G A 2 -9.755 -5.908 -1.175 1.00 10.00 C ATOM 47 O2' G A 2 -10.457 -6.384 -2.305 1.00 10.00 O ATOM 48 C1' G A 2 -10.690 -5.081 -0.293 1.00 10.00 C ATOM 49 N9 G A 2 -10.014 -4.113 0.564 1.00 10.00 N ATOM 50 C8 G A 2 -9.735 -4.274 1.899 1.00 10.00 C ATOM 51 N7 G A 2 -9.169 -3.231 2.442 1.00 10.00 N ATOM 52 C5 G A 2 -9.064 -2.321 1.401 1.00 10.00 C ATOM 53 C6 G A 2 -8.529 -1.004 1.389 1.00 10.00 C ATOM 54 O6 G A 2 -8.035 -0.361 2.330 1.00 10.00 O ATOM 55 N1 G A 2 -8.609 -0.425 0.127 1.00 10.00 N ATOM 56 C2 G A 2 -9.147 -1.042 -0.978 1.00 10.00 C ATOM 57 N2 G A 2 -9.158 -0.325 -2.108 1.00 10.00 N ATOM 58 N3 G A 2 -9.650 -2.268 -0.984 1.00 10.00 N ATOM 59 C4 G A 2 -9.576 -2.847 0.232 1.00 10.00 C ATOM 0 H5' G A 2 -11.610 -7.649 2.397 1.00 10.00 H new ATOM 0 H5'' G A 2 -10.626 -8.972 1.806 1.00 10.00 H new ATOM 0 H4' G A 2 -11.260 -8.059 -0.091 1.00 10.00 H new ATOM 0 H3' G A 2 -8.577 -6.826 0.440 1.00 10.00 H new ATOM 0 H2' G A 2 -8.890 -5.371 -1.565 1.00 10.00 H new ATOM 0 HO2' G A 2 -10.355 -7.357 -2.368 1.00 10.00 H new ATOM 0 H1' G A 2 -11.344 -4.516 -0.957 1.00 10.00 H new ATOM 0 H8 G A 2 -9.962 -5.177 2.447 1.00 10.00 H new ATOM 0 H1 G A 2 -8.244 0.521 0.013 1.00 10.00 H new ATOM 0 H21 G A 2 -9.544 -0.726 -2.963 1.00 10.00 H new ATOM 0 H22 G A 2 -8.781 0.623 -2.114 1.00 10.00 H new ATOM 71 P C A 3 -7.448 -8.524 -1.191 1.00 10.00 P ATOM 72 OP1 C A 3 -7.362 -9.862 -1.828 1.00 10.00 O ATOM 73 OP2 C A 3 -6.717 -8.282 0.074 1.00 10.00 O ATOM 74 O5' C A 3 -6.992 -7.435 -2.257 1.00 10.00 O ATOM 75 C5' C A 3 -7.384 -7.554 -3.619 1.00 10.00 C ATOM 76 C4' C A 3 -6.862 -6.394 -4.432 1.00 10.00 C ATOM 77 O4' C A 3 -7.339 -5.150 -3.859 1.00 10.00 O ATOM 78 C3' C A 3 -5.348 -6.236 -4.470 1.00 10.00 C ATOM 79 O3' C A 3 -4.796 -7.037 -5.510 1.00 10.00 O ATOM 80 C2' C A 3 -5.167 -4.748 -4.760 1.00 10.00 C ATOM 81 O2' C A 3 -5.224 -4.494 -6.150 1.00 10.00 O ATOM 82 C1' C A 3 -6.392 -4.123 -4.086 1.00 10.00 C ATOM 83 N1 C A 3 -6.097 -3.452 -2.806 1.00 10.00 N ATOM 84 C2 C A 3 -5.619 -2.135 -2.827 1.00 10.00 C ATOM 85 O2 C A 3 -5.376 -1.593 -3.918 1.00 10.00 O ATOM 86 N3 C A 3 -5.411 -1.486 -1.655 1.00 10.00 N ATOM 87 C4 C A 3 -5.666 -2.098 -0.496 1.00 10.00 C ATOM 88 N4 C A 3 -5.495 -1.402 0.632 1.00 10.00 N ATOM 89 C5 C A 3 -6.141 -3.441 -0.444 1.00 10.00 C ATOM 90 C6 C A 3 -6.336 -4.075 -1.609 1.00 10.00 C ATOM 0 H5' C A 3 -8.471 -7.591 -3.687 1.00 10.00 H new ATOM 0 H5'' C A 3 -7.007 -8.490 -4.030 1.00 10.00 H new ATOM 0 H4' C A 3 -7.217 -6.608 -5.440 1.00 10.00 H new ATOM 0 H3' C A 3 -4.849 -6.552 -3.554 1.00 10.00 H new ATOM 0 H2' C A 3 -4.210 -4.362 -4.408 1.00 10.00 H new ATOM 0 HO2' C A 3 -5.090 -5.331 -6.641 1.00 10.00 H new ATOM 0 H1' C A 3 -6.769 -3.350 -4.756 1.00 10.00 H new ATOM 0 H41 C A 3 -5.681 -1.840 1.534 1.00 10.00 H new ATOM 0 H42 C A 3 -5.179 -0.433 0.590 1.00 10.00 H new ATOM 0 H5 C A 3 -6.337 -3.930 0.499 1.00 10.00 H new ATOM 0 H6 C A 3 -6.688 -5.096 -1.604 1.00 10.00 H new ATOM 102 P A A 4 -3.210 -7.267 -5.606 1.00 10.00 P ATOM 103 OP1 A A 4 -2.954 -8.203 -6.724 1.00 10.00 O ATOM 104 OP2 A A 4 -2.719 -7.608 -4.253 1.00 10.00 O ATOM 105 O5' A A 4 -2.626 -5.841 -6.003 1.00 10.00 O ATOM 106 C5' A A 4 -2.145 -5.596 -7.316 1.00 10.00 C ATOM 107 C4' A A 4 -1.511 -4.227 -7.415 1.00 10.00 C ATOM 108 O4' A A 4 -2.132 -3.299 -6.482 1.00 10.00 O ATOM 109 C3' A A 4 -0.028 -4.167 -7.078 1.00 10.00 C ATOM 110 O3' A A 4 0.752 -4.540 -8.208 1.00 10.00 O ATOM 111 C2' A A 4 0.147 -2.702 -6.719 1.00 10.00 C ATOM 112 O2' A A 4 0.210 -1.899 -7.877 1.00 10.00 O ATOM 113 C1' A A 4 -1.145 -2.422 -5.960 1.00 10.00 C ATOM 114 N9 A A 4 -1.059 -2.635 -4.516 1.00 10.00 N ATOM 115 C8 A A 4 -1.388 -3.765 -3.804 1.00 10.00 C ATOM 116 N7 A A 4 -1.247 -3.635 -2.508 1.00 10.00 N ATOM 117 C5 A A 4 -0.796 -2.332 -2.358 1.00 10.00 C ATOM 118 C6 A A 4 -0.460 -1.582 -1.223 1.00 10.00 C ATOM 119 N6 A A 4 -0.551 -2.055 0.019 1.00 10.00 N ATOM 120 N1 A A 4 -0.040 -0.312 -1.408 1.00 10.00 N ATOM 121 C2 A A 4 0.028 0.164 -2.658 1.00 10.00 C ATOM 122 N3 A A 4 -0.262 -0.446 -3.806 1.00 10.00 N ATOM 123 C4 A A 4 -0.673 -1.706 -3.582 1.00 10.00 C ATOM 0 H5' A A 4 -2.967 -5.672 -8.028 1.00 10.00 H new ATOM 0 H5'' A A 4 -1.416 -6.359 -7.588 1.00 10.00 H new ATOM 0 H4' A A 4 -1.656 -3.969 -8.464 1.00 10.00 H new ATOM 0 H3' A A 4 0.289 -4.843 -6.284 1.00 10.00 H new ATOM 0 H2' A A 4 1.060 -2.491 -6.163 1.00 10.00 H new ATOM 0 HO2' A A 4 1.074 -1.438 -7.909 1.00 10.00 H new ATOM 0 H1' A A 4 -1.380 -1.366 -6.096 1.00 10.00 H new ATOM 0 H8 A A 4 -1.731 -4.676 -4.271 1.00 10.00 H new ATOM 0 H61 A A 4 -0.293 -1.465 0.810 1.00 10.00 H new ATOM 0 H62 A A 4 -0.879 -3.008 0.179 1.00 10.00 H new ATOM 0 H2 A A 4 0.365 1.186 -2.748 1.00 10.00 H new ATOM 135 P C A 5 2.258 -5.057 -8.017 1.00 10.00 P ATOM 136 OP1 C A 5 2.787 -5.360 -9.368 1.00 10.00 O ATOM 137 OP2 C A 5 2.269 -6.111 -6.974 1.00 10.00 O ATOM 138 O5' C A 5 3.010 -3.772 -7.458 1.00 10.00 O ATOM 139 C5' C A 5 3.637 -2.836 -8.324 1.00 10.00 C ATOM 140 C4' C A 5 3.783 -1.511 -7.618 1.00 10.00 C ATOM 141 O4' C A 5 2.749 -1.391 -6.608 1.00 10.00 O ATOM 142 C3' C A 5 5.076 -1.339 -6.840 1.00 10.00 C ATOM 143 O3' C A 5 6.103 -0.840 -7.687 1.00 10.00 O ATOM 144 C2' C A 5 4.696 -0.324 -5.770 1.00 10.00 C ATOM 145 O2' C A 5 4.730 1.002 -6.265 1.00 10.00 O ATOM 146 C1' C A 5 3.246 -0.717 -5.469 1.00 10.00 C ATOM 147 N1 C A 5 3.129 -1.566 -4.269 1.00 10.00 N ATOM 148 C2 C A 5 3.343 -0.978 -3.016 1.00 10.00 C ATOM 149 O2 C A 5 3.611 0.231 -2.958 1.00 10.00 O ATOM 150 N3 C A 5 3.245 -1.736 -1.898 1.00 10.00 N ATOM 151 C4 C A 5 2.933 -3.030 -1.994 1.00 10.00 C ATOM 152 N4 C A 5 2.842 -3.737 -0.862 1.00 10.00 N ATOM 153 C5 C A 5 2.705 -3.656 -3.254 1.00 10.00 C ATOM 154 C6 C A 5 2.819 -2.897 -4.354 1.00 10.00 C ATOM 0 H5' C A 5 3.046 -2.713 -9.231 1.00 10.00 H new ATOM 0 H5'' C A 5 4.616 -3.207 -8.629 1.00 10.00 H new ATOM 0 H4' C A 5 3.738 -0.773 -8.419 1.00 10.00 H new ATOM 0 H3' C A 5 5.465 -2.268 -6.423 1.00 10.00 H new ATOM 0 H2' C A 5 5.370 -0.338 -4.913 1.00 10.00 H new ATOM 0 HO2' C A 5 5.260 1.030 -7.089 1.00 10.00 H new ATOM 0 H1' C A 5 2.665 0.180 -5.257 1.00 10.00 H new ATOM 0 H41 C A 5 2.605 -4.729 -0.898 1.00 10.00 H new ATOM 0 H42 C A 5 3.009 -3.284 0.037 1.00 10.00 H new ATOM 0 H5 C A 5 2.450 -4.703 -3.321 1.00 10.00 H new ATOM 0 H6 C A 5 2.663 -3.344 -5.325 1.00 10.00 H new ATOM 166 P U A 6 7.634 -1.252 -7.449 1.00 10.00 P ATOM 167 OP1 U A 6 8.478 -0.398 -8.317 1.00 10.00 O ATOM 168 OP2 U A 6 7.727 -2.725 -7.562 1.00 10.00 O ATOM 169 O5' U A 6 7.924 -0.854 -5.937 1.00 10.00 O ATOM 170 C5' U A 6 8.447 0.428 -5.602 1.00 10.00 C ATOM 171 C4' U A 6 8.812 0.469 -4.136 1.00 10.00 C ATOM 172 O4' U A 6 7.648 0.144 -3.329 1.00 10.00 O ATOM 173 C3' U A 6 9.850 -0.548 -3.689 1.00 10.00 C ATOM 174 O3' U A 6 11.175 -0.119 -4.001 1.00 10.00 O ATOM 175 C2' U A 6 9.601 -0.582 -2.187 1.00 10.00 C ATOM 176 O2' U A 6 10.171 0.549 -1.558 1.00 10.00 O ATOM 177 C1' U A 6 8.074 -0.495 -2.135 1.00 10.00 C ATOM 178 N1 U A 6 7.409 -1.805 -2.033 1.00 10.00 N ATOM 179 C2 U A 6 7.216 -2.340 -0.772 1.00 10.00 C ATOM 180 O2 U A 6 7.563 -1.774 0.248 1.00 10.00 O ATOM 181 N3 U A 6 6.592 -3.563 -0.747 1.00 10.00 N ATOM 182 C4 U A 6 6.150 -4.294 -1.828 1.00 10.00 C ATOM 183 O4 U A 6 5.597 -5.380 -1.647 1.00 10.00 O ATOM 184 C5 U A 6 6.387 -3.677 -3.095 1.00 10.00 C ATOM 185 C6 U A 6 6.991 -2.487 -3.157 1.00 10.00 C ATOM 0 H5' U A 6 7.710 1.200 -5.824 1.00 10.00 H new ATOM 0 H5'' U A 6 9.326 0.642 -6.210 1.00 10.00 H new ATOM 0 H4' U A 6 9.206 1.477 -4.004 1.00 10.00 H new ATOM 0 H3' U A 6 9.766 -1.520 -4.175 1.00 10.00 H new ATOM 0 H2' U A 6 10.027 -1.451 -1.685 1.00 10.00 H new ATOM 0 HO2' U A 6 10.264 0.377 -0.598 1.00 10.00 H new ATOM 0 H1' U A 6 7.800 0.058 -1.237 1.00 10.00 H new ATOM 0 H3 U A 6 6.439 -3.976 0.173 1.00 10.00 H new ATOM 0 H5 U A 6 6.078 -4.173 -4.003 1.00 10.00 H new ATOM 0 H6 U A 6 7.159 -2.041 -4.126 1.00 10.00 H new ATOM 196 P U A 7 12.405 -1.146 -3.881 1.00 10.00 P ATOM 197 OP1 U A 7 13.415 -0.771 -4.899 1.00 10.00 O ATOM 198 OP2 U A 7 11.843 -2.518 -3.905 1.00 10.00 O ATOM 199 O5' U A 7 13.014 -0.871 -2.435 1.00 10.00 O ATOM 200 C5' U A 7 14.306 -1.358 -2.067 1.00 10.00 C ATOM 201 C4' U A 7 14.918 -0.479 -1.003 1.00 10.00 C ATOM 202 O4' U A 7 14.905 0.898 -1.469 1.00 10.00 O ATOM 203 C3' U A 7 14.199 -0.479 0.344 1.00 10.00 C ATOM 204 O3' U A 7 15.126 -0.557 1.418 1.00 10.00 O ATOM 205 C2' U A 7 13.451 0.847 0.375 1.00 10.00 C ATOM 206 O2' U A 7 13.386 1.371 1.687 1.00 10.00 O ATOM 207 C1' U A 7 14.380 1.727 -0.457 1.00 10.00 C ATOM 208 N1 U A 7 13.714 2.876 -1.085 1.00 10.00 N ATOM 209 C2 U A 7 14.134 4.153 -0.743 1.00 10.00 C ATOM 210 O2 U A 7 15.048 4.366 0.037 1.00 10.00 O ATOM 211 N3 U A 7 13.456 5.175 -1.359 1.00 10.00 N ATOM 212 C4 U A 7 12.423 5.061 -2.265 1.00 10.00 C ATOM 213 O4 U A 7 11.906 6.080 -2.727 1.00 10.00 O ATOM 214 C5 U A 7 12.051 3.716 -2.568 1.00 10.00 C ATOM 215 C6 U A 7 12.683 2.695 -1.984 1.00 10.00 C ATOM 0 H5' U A 7 14.954 -1.384 -2.943 1.00 10.00 H new ATOM 0 H5'' U A 7 14.225 -2.381 -1.700 1.00 10.00 H new ATOM 0 H4' U A 7 15.915 -0.890 -0.842 1.00 10.00 H new ATOM 0 H3' U A 7 13.535 -1.336 0.455 1.00 10.00 H new ATOM 0 H2' U A 7 12.423 0.773 0.022 1.00 10.00 H new ATOM 0 HO2' U A 7 12.455 1.373 1.993 1.00 10.00 H new ATOM 0 H1' U A 7 15.138 2.148 0.203 1.00 10.00 H new ATOM 0 H3 U A 7 13.748 6.123 -1.120 1.00 10.00 H new ATOM 0 H5 U A 7 11.255 3.524 -3.272 1.00 10.00 H new ATOM 0 H6 U A 7 12.375 1.688 -2.225 1.00 10.00 H new ATOM 226 P C A 8 15.307 -1.925 2.234 1.00 10.00 P ATOM 227 OP1 C A 8 16.065 -1.609 3.466 1.00 10.00 O ATOM 228 OP2 C A 8 15.845 -2.929 1.286 1.00 10.00 O ATOM 229 O5' C A 8 13.825 -2.353 2.635 1.00 10.00 O ATOM 230 C5' C A 8 13.206 -1.882 3.832 1.00 10.00 C ATOM 231 C4' C A 8 12.051 -2.781 4.219 1.00 10.00 C ATOM 232 O4' C A 8 11.116 -2.859 3.104 1.00 10.00 O ATOM 233 C3' C A 8 12.411 -4.231 4.537 1.00 10.00 C ATOM 234 O3' C A 8 11.571 -4.764 5.558 1.00 10.00 O ATOM 235 C2' C A 8 12.164 -4.952 3.217 1.00 10.00 C ATOM 236 O2' C A 8 11.858 -6.319 3.413 1.00 10.00 O ATOM 237 C1' C A 8 10.917 -4.210 2.744 1.00 10.00 C ATOM 238 N1 C A 8 10.704 -4.272 1.290 1.00 10.00 N ATOM 239 C2 C A 8 9.638 -5.007 0.767 1.00 10.00 C ATOM 240 O2 C A 8 8.889 -5.628 1.534 1.00 10.00 O ATOM 241 N3 C A 8 9.453 -5.032 -0.575 1.00 10.00 N ATOM 242 C4 C A 8 10.284 -4.359 -1.376 1.00 10.00 C ATOM 243 N4 C A 8 10.056 -4.369 -2.685 1.00 10.00 N ATOM 244 C5 C A 8 11.375 -3.614 -0.869 1.00 10.00 C ATOM 245 C6 C A 8 11.545 -3.593 0.456 1.00 10.00 C ATOM 0 H5' C A 8 12.849 -0.862 3.687 1.00 10.00 H new ATOM 0 H5'' C A 8 13.938 -1.852 4.639 1.00 10.00 H new ATOM 0 H4' C A 8 11.653 -2.325 5.125 1.00 10.00 H new ATOM 0 H3' C A 8 13.431 -4.337 4.907 1.00 10.00 H new ATOM 0 H2' C A 8 13.016 -4.945 2.538 1.00 10.00 H new ATOM 0 HO2' C A 8 11.584 -6.463 4.343 1.00 10.00 H new ATOM 0 H1' C A 8 10.041 -4.671 3.200 1.00 10.00 H new ATOM 0 H41 C A 8 10.678 -3.862 -3.315 1.00 10.00 H new ATOM 0 H42 C A 8 9.259 -4.884 -3.060 1.00 10.00 H new ATOM 0 H5 C A 8 12.045 -3.082 -1.528 1.00 10.00 H new ATOM 0 H6 C A 8 12.364 -3.028 0.876 1.00 10.00 H new ATOM 257 P G A 9 12.016 -4.701 7.099 1.00 10.00 P ATOM 258 OP1 G A 9 13.464 -5.003 7.189 1.00 10.00 O ATOM 259 OP2 G A 9 11.053 -5.528 7.868 1.00 10.00 O ATOM 260 O5' G A 9 11.798 -3.180 7.509 1.00 10.00 O ATOM 261 C5' G A 9 10.523 -2.713 7.943 1.00 10.00 C ATOM 262 C4' G A 9 10.530 -1.208 8.043 1.00 10.00 C ATOM 263 O4' G A 9 11.365 -0.652 7.000 1.00 10.00 O ATOM 264 C3' G A 9 9.195 -0.514 7.819 1.00 10.00 C ATOM 265 O3' G A 9 8.359 -0.586 8.966 1.00 10.00 O ATOM 266 C2' G A 9 9.643 0.913 7.534 1.00 10.00 C ATOM 267 O2' G A 9 9.912 1.623 8.726 1.00 10.00 O ATOM 268 C1' G A 9 10.956 0.684 6.781 1.00 10.00 C ATOM 269 N9 G A 9 10.840 0.923 5.349 1.00 10.00 N ATOM 270 C8 G A 9 11.472 1.924 4.660 1.00 10.00 C ATOM 271 N7 G A 9 11.196 1.931 3.385 1.00 10.00 N ATOM 272 C5 G A 9 10.322 0.865 3.225 1.00 10.00 C ATOM 273 C6 G A 9 9.684 0.377 2.061 1.00 10.00 C ATOM 274 O6 G A 9 9.746 0.825 0.914 1.00 10.00 O ATOM 275 N1 G A 9 8.885 -0.732 2.318 1.00 10.00 N ATOM 276 C2 G A 9 8.711 -1.293 3.562 1.00 10.00 C ATOM 277 N2 G A 9 7.885 -2.347 3.630 1.00 10.00 N ATOM 278 N3 G A 9 9.296 -0.845 4.664 1.00 10.00 N ATOM 279 C4 G A 9 10.089 0.227 4.426 1.00 10.00 C ATOM 0 H5' G A 9 10.278 -3.149 8.912 1.00 10.00 H new ATOM 0 H5'' G A 9 9.751 -3.035 7.244 1.00 10.00 H new ATOM 0 H4' G A 9 10.864 -1.036 9.066 1.00 10.00 H new ATOM 0 H3' G A 9 8.592 -0.958 7.027 1.00 10.00 H new ATOM 0 H2' G A 9 8.893 1.495 6.998 1.00 10.00 H new ATOM 0 HO2' G A 9 9.510 1.152 9.485 1.00 10.00 H new ATOM 0 H1' G A 9 11.688 1.397 7.161 1.00 10.00 H new ATOM 0 H8 G A 9 12.134 2.638 5.127 1.00 10.00 H new ATOM 0 H1 G A 9 8.395 -1.158 1.531 1.00 10.00 H new ATOM 0 H21 G A 9 7.716 -2.806 4.525 1.00 10.00 H new ATOM 0 H22 G A 9 7.426 -2.690 2.786 1.00 10.00 H new ATOM 291 P G A 10 6.766 -0.522 8.783 1.00 10.00 P ATOM 292 OP1 G A 10 6.193 0.083 10.006 1.00 10.00 O ATOM 293 OP2 G A 10 6.312 -1.867 8.356 1.00 10.00 O ATOM 294 O5' G A 10 6.528 0.489 7.576 1.00 10.00 O ATOM 295 C5' G A 10 6.394 1.886 7.816 1.00 10.00 C ATOM 296 C4' G A 10 6.494 2.699 6.546 1.00 10.00 C ATOM 297 O4' G A 10 7.066 1.870 5.497 1.00 10.00 O ATOM 298 C3' G A 10 5.182 3.184 5.941 1.00 10.00 C ATOM 299 O3' G A 10 4.785 4.413 6.545 1.00 10.00 O ATOM 300 C2' G A 10 5.572 3.379 4.481 1.00 10.00 C ATOM 301 O2' G A 10 6.387 4.521 4.302 1.00 10.00 O ATOM 302 C1' G A 10 6.406 2.120 4.269 1.00 10.00 C ATOM 303 N9 G A 10 5.596 0.954 3.938 1.00 10.00 N ATOM 304 C8 G A 10 5.149 0.004 4.816 1.00 10.00 C ATOM 305 N7 G A 10 4.480 -0.958 4.241 1.00 10.00 N ATOM 306 C5 G A 10 4.474 -0.610 2.895 1.00 10.00 C ATOM 307 C6 G A 10 3.895 -1.264 1.773 1.00 10.00 C ATOM 308 O6 G A 10 3.267 -2.331 1.740 1.00 10.00 O ATOM 309 N1 G A 10 4.121 -0.564 0.588 1.00 10.00 N ATOM 310 C2 G A 10 4.815 0.621 0.504 1.00 10.00 C ATOM 311 N2 G A 10 4.916 1.173 -0.714 1.00 10.00 N ATOM 312 N3 G A 10 5.358 1.239 1.538 1.00 10.00 N ATOM 313 C4 G A 10 5.150 0.574 2.694 1.00 10.00 C ATOM 0 H5' G A 10 7.168 2.208 8.513 1.00 10.00 H new ATOM 0 H5'' G A 10 5.434 2.080 8.294 1.00 10.00 H new ATOM 0 H4' G A 10 7.080 3.566 6.851 1.00 10.00 H new ATOM 0 H3' G A 10 4.338 2.508 6.079 1.00 10.00 H new ATOM 0 H2' G A 10 4.728 3.521 3.807 1.00 10.00 H new ATOM 0 HO2' G A 10 6.274 5.127 5.064 1.00 10.00 H new ATOM 0 H1' G A 10 7.088 2.282 3.434 1.00 10.00 H new ATOM 0 H8 G A 10 5.332 0.046 5.880 1.00 10.00 H new ATOM 0 H1 G A 10 3.746 -0.957 -0.275 1.00 10.00 H new ATOM 0 H21 G A 10 5.419 2.052 -0.836 1.00 10.00 H new ATOM 0 H22 G A 10 4.489 0.714 -1.519 1.00 10.00 H new ATOM 325 P U A 11 3.293 4.979 6.375 1.00 10.00 P ATOM 326 OP1 U A 11 3.274 6.372 6.889 1.00 10.00 O ATOM 327 OP2 U A 11 2.368 3.978 6.963 1.00 10.00 O ATOM 328 O5' U A 11 3.060 5.030 4.802 1.00 10.00 O ATOM 329 C5' U A 11 3.497 6.156 4.046 1.00 10.00 C ATOM 330 C4' U A 11 3.169 6.002 2.578 1.00 10.00 C ATOM 331 O4' U A 11 3.436 4.643 2.148 1.00 10.00 O ATOM 332 C3' U A 11 1.711 6.244 2.216 1.00 10.00 C ATOM 333 O3' U A 11 1.485 7.633 2.011 1.00 10.00 O ATOM 334 C2' U A 11 1.542 5.446 0.927 1.00 10.00 C ATOM 335 O2' U A 11 1.940 6.196 -0.204 1.00 10.00 O ATOM 336 C1' U A 11 2.512 4.279 1.137 1.00 10.00 C ATOM 337 N1 U A 11 1.852 3.022 1.522 1.00 10.00 N ATOM 338 C2 U A 11 1.339 2.243 0.504 1.00 10.00 C ATOM 339 O2 U A 11 1.344 2.595 -0.664 1.00 10.00 O ATOM 340 N3 U A 11 0.792 1.052 0.904 1.00 10.00 N ATOM 341 C4 U A 11 0.711 0.564 2.191 1.00 10.00 C ATOM 342 O4 U A 11 0.197 -0.539 2.394 1.00 10.00 O ATOM 343 C5 U A 11 1.257 1.431 3.187 1.00 10.00 C ATOM 344 C6 U A 11 1.793 2.603 2.833 1.00 10.00 C ATOM 0 H5' U A 11 4.573 6.281 4.168 1.00 10.00 H new ATOM 0 H5'' U A 11 3.025 7.060 4.432 1.00 10.00 H new ATOM 0 H4' U A 11 3.789 6.755 2.092 1.00 10.00 H new ATOM 0 H3' U A 11 1.004 5.941 2.988 1.00 10.00 H new ATOM 0 H2' U A 11 0.509 5.152 0.743 1.00 10.00 H new ATOM 0 HO2' U A 11 2.026 7.140 0.044 1.00 10.00 H new ATOM 0 H1' U A 11 3.002 4.092 0.182 1.00 10.00 H new ATOM 0 H3 U A 11 0.402 0.462 0.169 1.00 10.00 H new ATOM 0 H5 U A 11 1.237 1.139 4.227 1.00 10.00 H new ATOM 0 H6 U A 11 2.195 3.245 3.603 1.00 10.00 H new ATOM 355 P G A 12 -0.005 8.218 1.987 1.00 10.00 P ATOM 356 OP1 G A 12 0.091 9.696 1.913 1.00 10.00 O ATOM 357 OP2 G A 12 -0.767 7.595 3.091 1.00 10.00 O ATOM 358 O5' G A 12 -0.607 7.683 0.616 1.00 10.00 O ATOM 359 C5' G A 12 -0.801 8.567 -0.479 1.00 10.00 C ATOM 360 C4' G A 12 -1.445 7.833 -1.628 1.00 10.00 C ATOM 361 O4' G A 12 -0.979 6.458 -1.658 1.00 10.00 O ATOM 362 C3' G A 12 -2.956 7.695 -1.546 1.00 10.00 C ATOM 363 O3' G A 12 -3.613 8.881 -1.970 1.00 10.00 O ATOM 364 C2' G A 12 -3.200 6.532 -2.496 1.00 10.00 C ATOM 365 O2' G A 12 -3.092 6.935 -3.847 1.00 10.00 O ATOM 366 C1' G A 12 -2.030 5.623 -2.121 1.00 10.00 C ATOM 367 N9 G A 12 -2.386 4.667 -1.078 1.00 10.00 N ATOM 368 C8 G A 12 -2.263 4.823 0.282 1.00 10.00 C ATOM 369 N7 G A 12 -2.710 3.801 0.960 1.00 10.00 N ATOM 370 C5 G A 12 -3.160 2.916 -0.009 1.00 10.00 C ATOM 371 C6 G A 12 -3.754 1.629 0.117 1.00 10.00 C ATOM 372 O6 G A 12 -4.004 0.994 1.153 1.00 10.00 O ATOM 373 N1 G A 12 -4.060 1.075 -1.122 1.00 10.00 N ATOM 374 C2 G A 12 -3.824 1.690 -2.330 1.00 10.00 C ATOM 375 N2 G A 12 -4.197 1.014 -3.427 1.00 10.00 N ATOM 376 N3 G A 12 -3.270 2.884 -2.463 1.00 10.00 N ATOM 377 C4 G A 12 -2.968 3.437 -1.270 1.00 10.00 C ATOM 0 H5' G A 12 0.156 8.984 -0.794 1.00 10.00 H new ATOM 0 H5'' G A 12 -1.429 9.404 -0.174 1.00 10.00 H new ATOM 0 H4' G A 12 -1.176 8.434 -2.496 1.00 10.00 H new ATOM 0 H3' G A 12 -3.339 7.529 -0.539 1.00 10.00 H new ATOM 0 H2' G A 12 -4.190 6.083 -2.411 1.00 10.00 H new ATOM 0 HO2' G A 12 -3.276 7.895 -3.918 1.00 10.00 H new ATOM 0 H1' G A 12 -1.734 5.043 -2.995 1.00 10.00 H new ATOM 0 H8 G A 12 -1.839 5.703 0.743 1.00 10.00 H new ATOM 0 H1 G A 12 -4.489 0.150 -1.136 1.00 10.00 H new ATOM 0 H21 G A 12 -4.048 1.419 -4.351 1.00 10.00 H new ATOM 0 H22 G A 12 -4.630 0.095 -3.337 1.00 10.00 H new ATOM 389 P C A 13 -5.011 9.298 -1.295 1.00 10.00 P ATOM 390 OP1 C A 13 -5.389 10.641 -1.798 1.00 10.00 O ATOM 391 OP2 C A 13 -4.890 9.085 0.168 1.00 10.00 O ATOM 392 O5' C A 13 -6.050 8.240 -1.870 1.00 10.00 O ATOM 393 C5' C A 13 -6.563 8.390 -3.188 1.00 10.00 C ATOM 394 C4' C A 13 -7.129 7.082 -3.688 1.00 10.00 C ATOM 395 O4' C A 13 -6.469 5.981 -3.017 1.00 10.00 O ATOM 396 C3' C A 13 -8.607 6.858 -3.401 1.00 10.00 C ATOM 397 O3' C A 13 -9.414 7.453 -4.415 1.00 10.00 O ATOM 398 C2' C A 13 -8.730 5.337 -3.418 1.00 10.00 C ATOM 399 O2' C A 13 -8.984 4.870 -4.728 1.00 10.00 O ATOM 400 C1' C A 13 -7.342 4.868 -2.973 1.00 10.00 C ATOM 401 N1 C A 13 -7.313 4.287 -1.618 1.00 10.00 N ATOM 402 C2 C A 13 -7.696 2.950 -1.452 1.00 10.00 C ATOM 403 O2 C A 13 -8.058 2.300 -2.442 1.00 10.00 O ATOM 404 N3 C A 13 -7.654 2.393 -0.217 1.00 10.00 N ATOM 405 C4 C A 13 -7.244 3.113 0.830 1.00 10.00 C ATOM 406 N4 C A 13 -7.214 2.518 2.023 1.00 10.00 N ATOM 407 C5 C A 13 -6.845 4.475 0.692 1.00 10.00 C ATOM 408 C6 C A 13 -6.900 5.016 -0.536 1.00 10.00 C ATOM 0 H5' C A 13 -5.771 8.729 -3.856 1.00 10.00 H new ATOM 0 H5'' C A 13 -7.339 9.156 -3.198 1.00 10.00 H new ATOM 0 H4' C A 13 -6.975 7.127 -4.766 1.00 10.00 H new ATOM 0 H3' C A 13 -8.941 7.303 -2.464 1.00 10.00 H new ATOM 0 H2' C A 13 -9.543 4.974 -2.789 1.00 10.00 H new ATOM 0 HO2' C A 13 -9.387 5.588 -5.259 1.00 10.00 H new ATOM 0 H1' C A 13 -7.035 4.073 -3.652 1.00 10.00 H new ATOM 0 H41 C A 13 -6.906 3.038 2.845 1.00 10.00 H new ATOM 0 H42 C A 13 -7.499 1.543 2.114 1.00 10.00 H new ATOM 0 H5 C A 13 -6.511 5.050 1.543 1.00 10.00 H new ATOM 0 H6 C A 13 -6.612 6.048 -0.672 1.00 10.00 H new ATOM 420 P C A 14 -10.954 7.807 -4.135 1.00 10.00 P ATOM 421 OP1 C A 14 -11.465 8.586 -5.286 1.00 10.00 O ATOM 422 OP2 C A 14 -11.066 8.379 -2.773 1.00 10.00 O ATOM 423 O5' C A 14 -11.683 6.395 -4.141 1.00 10.00 O ATOM 424 C5' C A 14 -12.275 5.887 -5.332 1.00 10.00 C ATOM 425 C4' C A 14 -12.753 4.480 -5.097 1.00 10.00 C ATOM 426 O4' C A 14 -11.841 3.824 -4.181 1.00 10.00 O ATOM 427 C3' C A 14 -14.112 4.370 -4.425 1.00 10.00 C ATOM 428 O3' C A 14 -15.167 4.357 -5.383 1.00 10.00 O ATOM 429 C2' C A 14 -14.037 3.036 -3.690 1.00 10.00 C ATOM 430 O2' C A 14 -14.465 1.987 -4.533 1.00 10.00 O ATOM 431 C1' C A 14 -12.543 2.879 -3.398 1.00 10.00 C ATOM 432 N1 C A 14 -12.191 3.088 -1.979 1.00 10.00 N ATOM 433 C2 C A 14 -12.091 1.980 -1.135 1.00 10.00 C ATOM 434 O2 C A 14 -12.366 0.856 -1.575 1.00 10.00 O ATOM 435 N3 C A 14 -11.729 2.163 0.157 1.00 10.00 N ATOM 436 C4 C A 14 -11.472 3.389 0.616 1.00 10.00 C ATOM 437 N4 C A 14 -11.128 3.522 1.900 1.00 10.00 N ATOM 438 C5 C A 14 -11.570 4.537 -0.221 1.00 10.00 C ATOM 439 C6 C A 14 -11.931 4.341 -1.495 1.00 10.00 C ATOM 0 H5' C A 14 -11.551 5.905 -6.146 1.00 10.00 H new ATOM 0 H5'' C A 14 -13.110 6.520 -5.634 1.00 10.00 H new ATOM 0 H4' C A 14 -12.810 4.036 -6.091 1.00 10.00 H new ATOM 0 H3' C A 14 -14.323 5.214 -3.768 1.00 10.00 H new ATOM 0 H2' C A 14 -14.663 3.007 -2.798 1.00 10.00 H new ATOM 0 HO2' C A 14 -15.063 2.344 -5.222 1.00 10.00 H new ATOM 0 HO3' C A 14 -16.028 4.284 -4.921 1.00 10.00 H new ATOM 0 H1' C A 14 -12.271 1.852 -3.641 1.00 10.00 H new ATOM 0 H41 C A 14 -10.925 4.446 2.281 1.00 10.00 H new ATOM 0 H42 C A 14 -11.068 2.699 2.500 1.00 10.00 H new ATOM 0 H5 C A 14 -11.361 5.527 0.157 1.00 10.00 H new ATOM 0 H6 C A 14 -12.019 5.191 -2.156 1.00 10.00 H new TER 452 C A 14