USER MOD reduce.3.24.130724 H: found=0, std=0, add=163, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 163 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 -25:sc= 0.092 USER MOD Single : A 1 G O5' : rot 180:sc= -0.0644 USER MOD Single : A 2 A O2' : rot -147:sc= -1.55! USER MOD Single : A 3 G O2' : rot -16:sc= 0.0938 USER MOD Single : A 4 A O2' : rot 180:sc= -1.93! USER MOD Single : A 5 G O2' : rot -20:sc= 0.0788 USER MOD Single : A 6 U O2' : rot -169:sc= -4.66! USER MOD Single : A 7 U O2' : rot 134:sc= -0.898 USER MOD Single : A 8 G O2' : rot 26:sc= 0.223 USER MOD Single : A 9 G O2' : rot 180:sc= -0.0535 USER MOD Single : A 10 G O2' : rot 141:sc= -3.05! USER MOD Single : A 11 C O2' : rot -137:sc= 0.982 USER MOD Single : A 12 U O2' : rot 180:sc= -2.79! USER MOD Single : A 13 C O2' : rot 180:sc= -1.29 USER MOD Single : A 14 U O2' : rot 180:sc= 0 USER MOD Single : A 15 C O2' : rot -18:sc= 0.108 USER MOD Single : A 15 C O3' : rot 180:sc= 0.121 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -3.502 -10.380 -6.986 1.00 0.00 O ATOM 2 C5' G A 1 -4.344 -11.532 -6.911 1.00 0.00 C ATOM 3 C4' G A 1 -4.953 -11.663 -5.534 1.00 0.00 C ATOM 4 O4' G A 1 -3.951 -12.177 -4.618 1.00 0.00 O ATOM 5 C3' G A 1 -5.406 -10.362 -4.892 1.00 0.00 C ATOM 6 O3' G A 1 -6.709 -9.991 -5.329 1.00 0.00 O ATOM 7 C2' G A 1 -5.363 -10.694 -3.404 1.00 0.00 C ATOM 8 O2' G A 1 -6.506 -11.429 -3.010 1.00 0.00 O ATOM 9 C1' G A 1 -4.144 -11.613 -3.331 1.00 0.00 C ATOM 10 N9 G A 1 -2.911 -10.940 -2.939 1.00 0.00 N ATOM 11 C8 G A 1 -2.414 -9.752 -3.419 1.00 0.00 C ATOM 12 N7 G A 1 -1.255 -9.436 -2.908 1.00 0.00 N ATOM 13 C5 G A 1 -0.987 -10.462 -2.010 1.00 0.00 C ATOM 14 C6 G A 1 0.123 -10.665 -1.144 1.00 0.00 C ATOM 15 O6 G A 1 1.131 -9.965 -1.001 1.00 0.00 O ATOM 16 N1 G A 1 -0.020 -11.828 -0.399 1.00 0.00 N ATOM 17 C2 G A 1 -1.085 -12.687 -0.476 1.00 0.00 C ATOM 18 N2 G A 1 -1.039 -13.749 0.329 1.00 0.00 N ATOM 19 N3 G A 1 -2.119 -12.517 -1.278 1.00 0.00 N ATOM 20 C4 G A 1 -2.006 -11.390 -2.010 1.00 0.00 C ATOM 0 H5' G A 1 -3.766 -12.426 -7.145 1.00 0.00 H new ATOM 0 H5'' G A 1 -5.135 -11.459 -7.658 1.00 0.00 H new ATOM 0 H4' G A 1 -5.820 -12.305 -5.689 1.00 0.00 H new ATOM 0 H3' G A 1 -4.785 -9.505 -5.152 1.00 0.00 H new ATOM 0 H2' G A 1 -5.325 -9.810 -2.768 1.00 0.00 H new ATOM 0 HO2' G A 1 -7.247 -11.233 -3.621 1.00 0.00 H new ATOM 0 HO5' G A 1 -3.116 -10.315 -7.885 1.00 0.00 H new ATOM 0 H1' G A 1 -4.350 -12.358 -2.562 1.00 0.00 H new ATOM 0 H8 G A 1 -2.930 -9.142 -4.145 1.00 0.00 H new ATOM 0 H1 G A 1 0.726 -12.061 0.257 1.00 0.00 H new ATOM 0 H21 G A 1 -1.800 -14.428 0.321 1.00 0.00 H new ATOM 0 H22 G A 1 -0.243 -13.882 0.952 1.00 0.00 H new ATOM 33 P A A 2 -7.164 -8.451 -5.266 1.00 0.00 P ATOM 34 OP1 A A 2 -8.544 -8.380 -5.808 1.00 0.00 O ATOM 35 OP2 A A 2 -6.094 -7.616 -5.872 1.00 0.00 O ATOM 36 O5' A A 2 -7.234 -8.135 -3.706 1.00 0.00 O ATOM 37 C5' A A 2 -6.102 -7.619 -3.010 1.00 0.00 C ATOM 38 C4' A A 2 -6.129 -8.074 -1.570 1.00 0.00 C ATOM 39 O4' A A 2 -5.058 -9.034 -1.342 1.00 0.00 O ATOM 40 C3' A A 2 -5.874 -6.974 -0.552 1.00 0.00 C ATOM 41 O3' A A 2 -7.076 -6.284 -0.223 1.00 0.00 O ATOM 42 C2' A A 2 -5.296 -7.748 0.623 1.00 0.00 C ATOM 43 O2' A A 2 -6.302 -8.454 1.323 1.00 0.00 O ATOM 44 C1' A A 2 -4.413 -8.749 -0.112 1.00 0.00 C ATOM 45 N9 A A 2 -3.082 -8.224 -0.401 1.00 0.00 N ATOM 46 C8 A A 2 -2.717 -7.461 -1.477 1.00 0.00 C ATOM 47 N7 A A 2 -1.455 -7.109 -1.473 1.00 0.00 N ATOM 48 C5 A A 2 -0.953 -7.688 -0.315 1.00 0.00 C ATOM 49 C6 A A 2 0.326 -7.693 0.261 1.00 0.00 C ATOM 50 N6 A A 2 1.376 -7.066 -0.270 1.00 0.00 N ATOM 51 N1 A A 2 0.491 -8.371 1.417 1.00 0.00 N ATOM 52 C2 A A 2 -0.568 -8.995 1.952 1.00 0.00 C ATOM 53 N3 A A 2 -1.818 -9.061 1.506 1.00 0.00 N ATOM 54 C4 A A 2 -1.946 -8.379 0.353 1.00 0.00 C ATOM 0 H5' A A 2 -6.102 -6.530 -3.056 1.00 0.00 H new ATOM 0 H5'' A A 2 -5.184 -7.958 -3.490 1.00 0.00 H new ATOM 0 H4' A A 2 -7.134 -8.473 -1.431 1.00 0.00 H new ATOM 0 H3' A A 2 -5.208 -6.186 -0.904 1.00 0.00 H new ATOM 0 H2' A A 2 -4.799 -7.119 1.361 1.00 0.00 H new ATOM 0 HO2' A A 2 -6.073 -8.491 2.275 1.00 0.00 H new ATOM 0 H1' A A 2 -4.281 -9.629 0.517 1.00 0.00 H new ATOM 0 H8 A A 2 -3.406 -7.175 -2.258 1.00 0.00 H new ATOM 0 H61 A A 2 2.283 -7.106 0.196 1.00 0.00 H new ATOM 0 H62 A A 2 1.273 -6.547 -1.142 1.00 0.00 H new ATOM 0 H2 A A 2 -0.378 -9.519 2.877 1.00 0.00 H new ATOM 66 P G A 3 -7.046 -4.698 0.042 1.00 0.00 P ATOM 67 OP1 G A 3 -8.384 -4.172 -0.329 1.00 0.00 O ATOM 68 OP2 G A 3 -5.831 -4.121 -0.590 1.00 0.00 O ATOM 69 O5' G A 3 -6.890 -4.570 1.623 1.00 0.00 O ATOM 70 C5' G A 3 -6.987 -5.714 2.472 1.00 0.00 C ATOM 71 C4' G A 3 -6.269 -5.456 3.778 1.00 0.00 C ATOM 72 O4' G A 3 -4.999 -6.170 3.770 1.00 0.00 O ATOM 73 C3' G A 3 -5.910 -3.999 4.032 1.00 0.00 C ATOM 74 O3' G A 3 -6.958 -3.325 4.722 1.00 0.00 O ATOM 75 C2' G A 3 -4.633 -4.102 4.857 1.00 0.00 C ATOM 76 O2' G A 3 -4.923 -4.406 6.208 1.00 0.00 O ATOM 77 C1' G A 3 -3.963 -5.313 4.213 1.00 0.00 C ATOM 78 N9 G A 3 -3.115 -4.997 3.068 1.00 0.00 N ATOM 79 C8 G A 3 -3.534 -4.645 1.812 1.00 0.00 C ATOM 80 N7 G A 3 -2.552 -4.446 0.976 1.00 0.00 N ATOM 81 C5 G A 3 -1.409 -4.671 1.733 1.00 0.00 C ATOM 82 C6 G A 3 -0.036 -4.600 1.373 1.00 0.00 C ATOM 83 O6 G A 3 0.461 -4.320 0.276 1.00 0.00 O ATOM 84 N1 G A 3 0.792 -4.897 2.450 1.00 0.00 N ATOM 85 C2 G A 3 0.359 -5.225 3.711 1.00 0.00 C ATOM 86 N2 G A 3 1.313 -5.487 4.613 1.00 0.00 N ATOM 87 N3 G A 3 -0.917 -5.292 4.061 1.00 0.00 N ATOM 88 C4 G A 3 -1.739 -5.006 3.029 1.00 0.00 C ATOM 0 H5' G A 3 -6.554 -6.582 1.976 1.00 0.00 H new ATOM 0 H5'' G A 3 -8.035 -5.946 2.664 1.00 0.00 H new ATOM 0 H4' G A 3 -6.965 -5.782 4.550 1.00 0.00 H new ATOM 0 H3' G A 3 -5.769 -3.415 3.123 1.00 0.00 H new ATOM 0 H2' G A 3 -4.044 -3.185 4.865 1.00 0.00 H new ATOM 0 HO2' G A 3 -5.873 -4.242 6.383 1.00 0.00 H new ATOM 0 H1' G A 3 -3.310 -5.761 4.962 1.00 0.00 H new ATOM 0 H8 G A 3 -4.574 -4.542 1.541 1.00 0.00 H new ATOM 0 H1 G A 3 1.799 -4.869 2.291 1.00 0.00 H new ATOM 0 H21 G A 3 1.057 -5.737 5.568 1.00 0.00 H new ATOM 0 H22 G A 3 2.296 -5.437 4.345 1.00 0.00 H new ATOM 100 P A A 4 -7.365 -1.829 4.294 1.00 0.00 P ATOM 101 OP1 A A 4 -8.519 -1.408 5.129 1.00 0.00 O ATOM 102 OP2 A A 4 -7.480 -1.795 2.813 1.00 0.00 O ATOM 103 O5' A A 4 -6.099 -0.960 4.719 1.00 0.00 O ATOM 104 C5' A A 4 -4.936 -0.894 3.893 1.00 0.00 C ATOM 105 C4' A A 4 -3.695 -0.971 4.748 1.00 0.00 C ATOM 106 O4' A A 4 -2.823 -2.005 4.221 1.00 0.00 O ATOM 107 C3' A A 4 -2.840 0.288 4.781 1.00 0.00 C ATOM 108 O3' A A 4 -3.299 1.188 5.789 1.00 0.00 O ATOM 109 C2' A A 4 -1.444 -0.260 5.068 1.00 0.00 C ATOM 110 O2' A A 4 -1.266 -0.537 6.444 1.00 0.00 O ATOM 111 C1' A A 4 -1.473 -1.588 4.310 1.00 0.00 C ATOM 112 N9 A A 4 -0.939 -1.519 2.952 1.00 0.00 N ATOM 113 C8 A A 4 -1.666 -1.560 1.792 1.00 0.00 C ATOM 114 N7 A A 4 -0.937 -1.489 0.706 1.00 0.00 N ATOM 115 C5 A A 4 0.362 -1.396 1.183 1.00 0.00 C ATOM 116 C6 A A 4 1.604 -1.297 0.532 1.00 0.00 C ATOM 117 N6 A A 4 1.740 -1.273 -0.794 1.00 0.00 N ATOM 118 N1 A A 4 2.713 -1.224 1.300 1.00 0.00 N ATOM 119 C2 A A 4 2.570 -1.245 2.633 1.00 0.00 C ATOM 120 N3 A A 4 1.459 -1.336 3.361 1.00 0.00 N ATOM 121 C4 A A 4 0.376 -1.410 2.566 1.00 0.00 C ATOM 0 H5' A A 4 -4.937 0.034 3.321 1.00 0.00 H new ATOM 0 H5'' A A 4 -4.944 -1.712 3.173 1.00 0.00 H new ATOM 0 H4' A A 4 -4.072 -1.155 5.754 1.00 0.00 H new ATOM 0 H3' A A 4 -2.873 0.873 3.862 1.00 0.00 H new ATOM 0 H2' A A 4 -0.651 0.432 4.784 1.00 0.00 H new ATOM 0 HO2' A A 4 -0.363 -0.887 6.593 1.00 0.00 H new ATOM 0 H1' A A 4 -0.839 -2.280 4.864 1.00 0.00 H new ATOM 0 H8 A A 4 -2.743 -1.643 1.774 1.00 0.00 H new ATOM 0 H61 A A 4 2.668 -1.200 -1.210 1.00 0.00 H new ATOM 0 H62 A A 4 0.916 -1.328 -1.392 1.00 0.00 H new ATOM 0 H2 A A 4 3.488 -1.179 3.197 1.00 0.00 H new ATOM 133 P G A 5 -3.138 2.776 5.585 1.00 0.00 P ATOM 134 OP1 G A 5 -4.052 3.460 6.535 1.00 0.00 O ATOM 135 OP2 G A 5 -3.241 3.067 4.131 1.00 0.00 O ATOM 136 O5' G A 5 -1.640 3.070 6.038 1.00 0.00 O ATOM 137 C5' G A 5 -1.086 2.445 7.193 1.00 0.00 C ATOM 138 C4' G A 5 0.419 2.558 7.170 1.00 0.00 C ATOM 139 O4' G A 5 0.955 1.545 6.274 1.00 0.00 O ATOM 140 C3' G A 5 0.960 3.874 6.631 1.00 0.00 C ATOM 141 O3' G A 5 1.050 4.865 7.653 1.00 0.00 O ATOM 142 C2' G A 5 2.325 3.471 6.089 1.00 0.00 C ATOM 143 O2' G A 5 3.263 3.319 7.138 1.00 0.00 O ATOM 144 C1' G A 5 2.010 2.097 5.505 1.00 0.00 C ATOM 145 N9 G A 5 1.591 2.136 4.106 1.00 0.00 N ATOM 146 C8 G A 5 0.310 2.274 3.626 1.00 0.00 C ATOM 147 N7 G A 5 0.243 2.235 2.325 1.00 0.00 N ATOM 148 C5 G A 5 1.561 2.083 1.918 1.00 0.00 C ATOM 149 C6 G A 5 2.112 1.991 0.618 1.00 0.00 C ATOM 150 O6 G A 5 1.527 2.003 -0.466 1.00 0.00 O ATOM 151 N1 G A 5 3.494 1.868 0.654 1.00 0.00 N ATOM 152 C2 G A 5 4.251 1.815 1.800 1.00 0.00 C ATOM 153 N2 G A 5 5.570 1.674 1.633 1.00 0.00 N ATOM 154 N3 G A 5 3.748 1.893 3.021 1.00 0.00 N ATOM 155 C4 G A 5 2.406 2.028 3.005 1.00 0.00 C ATOM 0 H5' G A 5 -1.380 1.396 7.225 1.00 0.00 H new ATOM 0 H5'' G A 5 -1.480 2.914 8.095 1.00 0.00 H new ATOM 0 H4' G A 5 0.717 2.456 8.213 1.00 0.00 H new ATOM 0 H3' G A 5 0.322 4.333 5.876 1.00 0.00 H new ATOM 0 H2' G A 5 2.753 4.194 5.394 1.00 0.00 H new ATOM 0 HO2' G A 5 2.950 3.805 7.929 1.00 0.00 H new ATOM 0 H1' G A 5 2.923 1.502 5.541 1.00 0.00 H new ATOM 0 H8 G A 5 -0.553 2.402 4.262 1.00 0.00 H new ATOM 0 H1 G A 5 3.985 1.813 -0.238 1.00 0.00 H new ATOM 0 H21 G A 5 6.185 1.628 2.446 1.00 0.00 H new ATOM 0 H22 G A 5 5.961 1.612 0.693 1.00 0.00 H new ATOM 167 P U A 6 0.040 6.121 7.645 1.00 0.00 P ATOM 168 OP1 U A 6 0.044 6.717 9.005 1.00 0.00 O ATOM 169 OP2 U A 6 -1.243 5.667 7.048 1.00 0.00 O ATOM 170 O5' U A 6 0.709 7.163 6.641 1.00 0.00 O ATOM 171 C5' U A 6 1.778 6.775 5.777 1.00 0.00 C ATOM 172 C4' U A 6 1.672 7.496 4.454 1.00 0.00 C ATOM 173 O4' U A 6 1.928 6.560 3.383 1.00 0.00 O ATOM 174 C3' U A 6 0.303 8.070 4.122 1.00 0.00 C ATOM 175 O3' U A 6 0.162 9.376 4.673 1.00 0.00 O ATOM 176 C2' U A 6 0.266 8.083 2.589 1.00 0.00 C ATOM 177 O2' U A 6 0.676 9.332 2.069 1.00 0.00 O ATOM 178 C1' U A 6 1.311 7.032 2.205 1.00 0.00 C ATOM 179 N1 U A 6 0.715 5.902 1.476 1.00 0.00 N ATOM 180 C2 U A 6 1.361 5.452 0.337 1.00 0.00 C ATOM 181 O2 U A 6 2.423 5.910 -0.050 1.00 0.00 O ATOM 182 N3 U A 6 0.718 4.444 -0.332 1.00 0.00 N ATOM 183 C4 U A 6 -0.481 3.854 0.009 1.00 0.00 C ATOM 184 O4 U A 6 -0.958 2.986 -0.723 1.00 0.00 O ATOM 185 C5 U A 6 -1.071 4.359 1.208 1.00 0.00 C ATOM 186 C6 U A 6 -0.469 5.335 1.892 1.00 0.00 C ATOM 0 H5' U A 6 1.750 5.698 5.615 1.00 0.00 H new ATOM 0 H5'' U A 6 2.735 7.002 6.247 1.00 0.00 H new ATOM 0 H4' U A 6 2.386 8.314 4.545 1.00 0.00 H new ATOM 0 H3' U A 6 -0.520 7.490 4.540 1.00 0.00 H new ATOM 0 H2' U A 6 -0.737 7.893 2.206 1.00 0.00 H new ATOM 0 HO2' U A 6 0.478 9.368 1.110 1.00 0.00 H new ATOM 0 H1' U A 6 2.041 7.499 1.543 1.00 0.00 H new ATOM 0 H3 U A 6 1.175 4.092 -1.173 1.00 0.00 H new ATOM 0 H5 U A 6 -2.006 3.950 1.562 1.00 0.00 H new ATOM 0 H6 U A 6 -0.926 5.692 2.803 1.00 0.00 H new ATOM 197 P U A 7 -1.257 9.853 5.267 1.00 0.00 P ATOM 198 OP1 U A 7 -1.042 10.245 6.684 1.00 0.00 O ATOM 199 OP2 U A 7 -2.289 8.838 4.934 1.00 0.00 O ATOM 200 O5' U A 7 -1.567 11.170 4.426 1.00 0.00 O ATOM 201 C5' U A 7 -1.344 11.192 3.017 1.00 0.00 C ATOM 202 C4' U A 7 -0.833 12.542 2.578 1.00 0.00 C ATOM 203 O4' U A 7 0.017 13.103 3.622 1.00 0.00 O ATOM 204 C3' U A 7 0.057 12.479 1.345 1.00 0.00 C ATOM 205 O3' U A 7 0.007 13.677 0.578 1.00 0.00 O ATOM 206 C2' U A 7 1.435 12.243 1.943 1.00 0.00 C ATOM 207 O2' U A 7 2.457 12.730 1.093 1.00 0.00 O ATOM 208 C1' U A 7 1.363 13.136 3.176 1.00 0.00 C ATOM 209 N1 U A 7 2.232 12.709 4.282 1.00 0.00 N ATOM 210 C2 U A 7 3.485 13.289 4.378 1.00 0.00 C ATOM 211 O2 U A 7 3.889 14.125 3.591 1.00 0.00 O ATOM 212 N3 U A 7 4.246 12.850 5.430 1.00 0.00 N ATOM 213 C4 U A 7 3.895 11.913 6.375 1.00 0.00 C ATOM 214 O4 U A 7 4.692 11.623 7.267 1.00 0.00 O ATOM 215 C5 U A 7 2.587 11.361 6.206 1.00 0.00 C ATOM 216 C6 U A 7 1.817 11.765 5.192 1.00 0.00 C ATOM 0 H5' U A 7 -2.272 10.961 2.494 1.00 0.00 H new ATOM 0 H5'' U A 7 -0.624 10.420 2.746 1.00 0.00 H new ATOM 0 H4' U A 7 -1.723 13.134 2.367 1.00 0.00 H new ATOM 0 H3' U A 7 -0.247 11.706 0.639 1.00 0.00 H new ATOM 0 H2' U A 7 1.659 11.191 2.122 1.00 0.00 H new ATOM 0 HO2' U A 7 3.103 13.245 1.620 1.00 0.00 H new ATOM 0 H1' U A 7 1.706 14.130 2.891 1.00 0.00 H new ATOM 0 H3 U A 7 5.174 13.263 5.523 1.00 0.00 H new ATOM 0 H5 U A 7 2.221 10.617 6.898 1.00 0.00 H new ATOM 0 H6 U A 7 0.833 11.335 5.083 1.00 0.00 H new ATOM 227 P G A 8 0.030 13.597 -1.029 1.00 0.00 P ATOM 228 OP1 G A 8 1.331 14.133 -1.503 1.00 0.00 O ATOM 229 OP2 G A 8 -1.235 14.203 -1.517 1.00 0.00 O ATOM 230 O5' G A 8 -0.016 12.035 -1.348 1.00 0.00 O ATOM 231 C5' G A 8 1.125 11.199 -1.134 1.00 0.00 C ATOM 232 C4' G A 8 0.794 9.767 -1.490 1.00 0.00 C ATOM 233 O4' G A 8 -0.186 9.279 -0.535 1.00 0.00 O ATOM 234 C3' G A 8 0.158 9.557 -2.860 1.00 0.00 C ATOM 235 O3' G A 8 0.468 8.272 -3.397 1.00 0.00 O ATOM 236 C2' G A 8 -1.332 9.720 -2.574 1.00 0.00 C ATOM 237 O2' G A 8 -2.109 8.925 -3.449 1.00 0.00 O ATOM 238 C1' G A 8 -1.444 9.136 -1.165 1.00 0.00 C ATOM 239 N9 G A 8 -2.450 9.789 -0.333 1.00 0.00 N ATOM 240 C8 G A 8 -2.880 11.093 -0.415 1.00 0.00 C ATOM 241 N7 G A 8 -3.799 11.388 0.462 1.00 0.00 N ATOM 242 C5 G A 8 -3.988 10.210 1.169 1.00 0.00 C ATOM 243 C6 G A 8 -4.861 9.916 2.250 1.00 0.00 C ATOM 244 O6 G A 8 -5.669 10.664 2.814 1.00 0.00 O ATOM 245 N1 G A 8 -4.728 8.598 2.671 1.00 0.00 N ATOM 246 C2 G A 8 -3.870 7.679 2.124 1.00 0.00 C ATOM 247 N2 G A 8 -3.889 6.456 2.669 1.00 0.00 N ATOM 248 N3 G A 8 -3.051 7.936 1.118 1.00 0.00 N ATOM 249 C4 G A 8 -3.163 9.214 0.693 1.00 0.00 C ATOM 0 H5' G A 8 1.440 11.259 -0.092 1.00 0.00 H new ATOM 0 H5'' G A 8 1.961 11.549 -1.740 1.00 0.00 H new ATOM 0 H4' G A 8 1.752 9.247 -1.484 1.00 0.00 H new ATOM 0 H3' G A 8 0.522 10.255 -3.614 1.00 0.00 H new ATOM 0 H2' G A 8 -1.678 10.747 -2.687 1.00 0.00 H new ATOM 0 HO2' G A 8 -1.579 8.158 -3.752 1.00 0.00 H new ATOM 0 H1' G A 8 -1.750 8.095 -1.270 1.00 0.00 H new ATOM 0 H8 G A 8 -2.495 11.801 -1.134 1.00 0.00 H new ATOM 0 H1 G A 8 -5.314 8.291 3.447 1.00 0.00 H new ATOM 0 H21 G A 8 -3.274 5.727 2.307 1.00 0.00 H new ATOM 0 H22 G A 8 -4.518 6.254 3.446 1.00 0.00 H new ATOM 261 P G A 9 1.851 8.045 -4.187 1.00 0.00 P ATOM 262 OP1 G A 9 2.796 7.395 -3.244 1.00 0.00 O ATOM 263 OP2 G A 9 2.235 9.320 -4.847 1.00 0.00 O ATOM 264 O5' G A 9 1.484 6.989 -5.323 1.00 0.00 O ATOM 265 C5' G A 9 2.297 6.847 -6.488 1.00 0.00 C ATOM 266 C4' G A 9 1.437 6.517 -7.686 1.00 0.00 C ATOM 267 O4' G A 9 0.977 7.764 -8.278 1.00 0.00 O ATOM 268 C3' G A 9 2.138 5.777 -8.819 1.00 0.00 C ATOM 269 O3' G A 9 1.214 4.969 -9.546 1.00 0.00 O ATOM 270 C2' G A 9 2.709 6.916 -9.656 1.00 0.00 C ATOM 271 O2' G A 9 2.835 6.548 -11.017 1.00 0.00 O ATOM 272 C1' G A 9 1.594 7.954 -9.537 1.00 0.00 C ATOM 273 N9 G A 9 2.061 9.334 -9.616 1.00 0.00 N ATOM 274 C8 G A 9 2.922 9.970 -8.755 1.00 0.00 C ATOM 275 N7 G A 9 3.158 11.210 -9.084 1.00 0.00 N ATOM 276 C5 G A 9 2.403 11.408 -10.233 1.00 0.00 C ATOM 277 C6 G A 9 2.253 12.560 -11.048 1.00 0.00 C ATOM 278 O6 G A 9 2.774 13.673 -10.915 1.00 0.00 O ATOM 279 N1 G A 9 1.392 12.324 -12.115 1.00 0.00 N ATOM 280 C2 G A 9 0.757 11.132 -12.366 1.00 0.00 C ATOM 281 N2 G A 9 -0.034 11.102 -13.443 1.00 0.00 N ATOM 282 N3 G A 9 0.888 10.052 -11.616 1.00 0.00 N ATOM 283 C4 G A 9 1.719 10.259 -10.574 1.00 0.00 C ATOM 0 H5' G A 9 3.034 6.060 -6.332 1.00 0.00 H new ATOM 0 H5'' G A 9 2.849 7.769 -6.670 1.00 0.00 H new ATOM 0 H4' G A 9 0.654 5.869 -7.293 1.00 0.00 H new ATOM 0 H3' G A 9 2.907 5.078 -8.488 1.00 0.00 H new ATOM 0 H2' G A 9 3.699 7.236 -9.330 1.00 0.00 H new ATOM 0 HO2' G A 9 3.202 7.300 -11.527 1.00 0.00 H new ATOM 0 H1' G A 9 0.914 7.808 -10.376 1.00 0.00 H new ATOM 0 H8 G A 9 3.360 9.491 -7.892 1.00 0.00 H new ATOM 0 H1 G A 9 1.219 13.095 -12.760 1.00 0.00 H new ATOM 0 H21 G A 9 -0.534 10.247 -13.685 1.00 0.00 H new ATOM 0 H22 G A 9 -0.137 11.935 -14.023 1.00 0.00 H new ATOM 295 P G A 10 1.730 3.668 -10.341 1.00 0.00 P ATOM 296 OP1 G A 10 1.929 4.071 -11.758 1.00 0.00 O ATOM 297 OP2 G A 10 0.813 2.545 -10.022 1.00 0.00 O ATOM 298 O5' G A 10 3.151 3.342 -9.697 1.00 0.00 O ATOM 299 C5' G A 10 4.349 3.405 -10.470 1.00 0.00 C ATOM 300 C4' G A 10 5.513 3.816 -9.596 1.00 0.00 C ATOM 301 O4' G A 10 4.993 4.498 -8.420 1.00 0.00 O ATOM 302 C3' G A 10 6.357 2.670 -9.048 1.00 0.00 C ATOM 303 O3' G A 10 7.706 3.077 -8.840 1.00 0.00 O ATOM 304 C2' G A 10 5.638 2.316 -7.752 1.00 0.00 C ATOM 305 O2' G A 10 6.518 1.771 -6.786 1.00 0.00 O ATOM 306 C1' G A 10 5.195 3.695 -7.273 1.00 0.00 C ATOM 307 N9 G A 10 3.952 3.653 -6.510 1.00 0.00 N ATOM 308 C8 G A 10 2.733 3.185 -6.935 1.00 0.00 C ATOM 309 N7 G A 10 1.811 3.242 -6.016 1.00 0.00 N ATOM 310 C5 G A 10 2.461 3.788 -4.917 1.00 0.00 C ATOM 311 C6 G A 10 1.976 4.091 -3.625 1.00 0.00 C ATOM 312 O6 G A 10 0.835 3.942 -3.177 1.00 0.00 O ATOM 313 N1 G A 10 2.975 4.626 -2.817 1.00 0.00 N ATOM 314 C2 G A 10 4.267 4.853 -3.209 1.00 0.00 C ATOM 315 N2 G A 10 5.076 5.378 -2.284 1.00 0.00 N ATOM 316 N3 G A 10 4.731 4.583 -4.414 1.00 0.00 N ATOM 317 C4 G A 10 3.781 4.053 -5.210 1.00 0.00 C ATOM 0 H5' G A 10 4.227 4.118 -11.285 1.00 0.00 H new ATOM 0 H5'' G A 10 4.550 2.434 -10.923 1.00 0.00 H new ATOM 0 H4' G A 10 6.143 4.425 -10.244 1.00 0.00 H new ATOM 0 H3' G A 10 6.440 1.818 -9.723 1.00 0.00 H new ATOM 0 H2' G A 10 4.849 1.578 -7.895 1.00 0.00 H new ATOM 0 HO2' G A 10 6.279 2.109 -5.898 1.00 0.00 H new ATOM 0 H1' G A 10 5.966 4.095 -6.614 1.00 0.00 H new ATOM 0 H8 G A 10 2.556 2.807 -7.931 1.00 0.00 H new ATOM 0 H1 G A 10 2.725 4.868 -1.858 1.00 0.00 H new ATOM 0 H21 G A 10 6.051 5.572 -2.510 1.00 0.00 H new ATOM 0 H22 G A 10 4.718 5.585 -1.351 1.00 0.00 H new ATOM 329 P C A 11 8.857 1.970 -8.652 1.00 0.00 P ATOM 330 OP1 C A 11 10.116 2.547 -9.189 1.00 0.00 O ATOM 331 OP2 C A 11 8.365 0.670 -9.176 1.00 0.00 O ATOM 332 O5' C A 11 9.003 1.844 -7.070 1.00 0.00 O ATOM 333 C5' C A 11 9.562 2.904 -6.299 1.00 0.00 C ATOM 334 C4' C A 11 9.578 2.538 -4.833 1.00 0.00 C ATOM 335 O4' C A 11 8.420 3.104 -4.172 1.00 0.00 O ATOM 336 C3' C A 11 9.458 1.061 -4.494 1.00 0.00 C ATOM 337 O3' C A 11 10.682 0.358 -4.668 1.00 0.00 O ATOM 338 C2' C A 11 9.025 1.101 -3.031 1.00 0.00 C ATOM 339 O2' C A 11 10.129 1.306 -2.169 1.00 0.00 O ATOM 340 C1' C A 11 8.151 2.358 -3.000 1.00 0.00 C ATOM 341 N1 C A 11 6.711 2.060 -2.933 1.00 0.00 N ATOM 342 C2 C A 11 6.125 1.898 -1.675 1.00 0.00 C ATOM 343 O2 C A 11 6.831 2.017 -0.664 1.00 0.00 O ATOM 344 N3 C A 11 4.808 1.615 -1.590 1.00 0.00 N ATOM 345 C4 C A 11 4.081 1.490 -2.700 1.00 0.00 C ATOM 346 N4 C A 11 2.791 1.191 -2.569 1.00 0.00 N ATOM 347 C5 C A 11 4.646 1.660 -3.995 1.00 0.00 C ATOM 348 C6 C A 11 5.955 1.938 -4.067 1.00 0.00 C ATOM 0 H5' C A 11 8.982 3.815 -6.447 1.00 0.00 H new ATOM 0 H5'' C A 11 10.576 3.114 -6.639 1.00 0.00 H new ATOM 0 H4' C A 11 10.552 2.909 -4.514 1.00 0.00 H new ATOM 0 H3' C A 11 8.764 0.528 -5.143 1.00 0.00 H new ATOM 0 H2' C A 11 8.541 0.179 -2.708 1.00 0.00 H new ATOM 0 HO2' C A 11 10.050 0.717 -1.390 1.00 0.00 H new ATOM 0 H1' C A 11 8.396 2.916 -2.096 1.00 0.00 H new ATOM 0 H41 C A 11 2.205 1.088 -3.397 1.00 0.00 H new ATOM 0 H42 C A 11 2.388 1.065 -1.640 1.00 0.00 H new ATOM 0 H5 C A 11 4.043 1.568 -4.886 1.00 0.00 H new ATOM 0 H6 C A 11 6.420 2.068 -5.033 1.00 0.00 H new ATOM 360 P U A 12 10.723 -1.235 -4.447 1.00 0.00 P ATOM 361 OP1 U A 12 12.109 -1.691 -4.731 1.00 0.00 O ATOM 362 OP2 U A 12 9.587 -1.836 -5.191 1.00 0.00 O ATOM 363 O5' U A 12 10.444 -1.419 -2.888 1.00 0.00 O ATOM 364 C5' U A 12 11.514 -1.421 -1.943 1.00 0.00 C ATOM 365 C4' U A 12 10.980 -1.637 -0.543 1.00 0.00 C ATOM 366 O4' U A 12 9.838 -0.769 -0.324 1.00 0.00 O ATOM 367 C3' U A 12 10.441 -3.028 -0.247 1.00 0.00 C ATOM 368 O3' U A 12 11.487 -3.936 0.089 1.00 0.00 O ATOM 369 C2' U A 12 9.494 -2.771 0.920 1.00 0.00 C ATOM 370 O2' U A 12 10.198 -2.642 2.142 1.00 0.00 O ATOM 371 C1' U A 12 8.922 -1.400 0.555 1.00 0.00 C ATOM 372 N1 U A 12 7.609 -1.463 -0.104 1.00 0.00 N ATOM 373 C2 U A 12 6.482 -1.423 0.697 1.00 0.00 C ATOM 374 O2 U A 12 6.534 -1.352 1.912 1.00 0.00 O ATOM 375 N3 U A 12 5.288 -1.471 0.020 1.00 0.00 N ATOM 376 C4 U A 12 5.113 -1.547 -1.344 1.00 0.00 C ATOM 377 O4 U A 12 3.974 -1.543 -1.809 1.00 0.00 O ATOM 378 C5 U A 12 6.325 -1.594 -2.099 1.00 0.00 C ATOM 379 C6 U A 12 7.505 -1.555 -1.472 1.00 0.00 C ATOM 0 H5' U A 12 12.053 -0.475 -1.992 1.00 0.00 H new ATOM 0 H5'' U A 12 12.227 -2.207 -2.193 1.00 0.00 H new ATOM 0 H4' U A 12 11.845 -1.446 0.092 1.00 0.00 H new ATOM 0 H3' U A 12 9.948 -3.499 -1.098 1.00 0.00 H new ATOM 0 H2' U A 12 8.767 -3.571 1.058 1.00 0.00 H new ATOM 0 HO2' U A 12 9.563 -2.477 2.870 1.00 0.00 H new ATOM 0 H1' U A 12 8.780 -0.847 1.484 1.00 0.00 H new ATOM 0 H3 U A 12 4.441 -1.448 0.588 1.00 0.00 H new ATOM 0 H5 U A 12 6.288 -1.661 -3.176 1.00 0.00 H new ATOM 0 H6 U A 12 8.409 -1.597 -2.061 1.00 0.00 H new ATOM 390 P C A 13 11.172 -5.509 0.216 1.00 0.00 P ATOM 391 OP1 C A 13 12.459 -6.196 0.494 1.00 0.00 O ATOM 392 OP2 C A 13 10.360 -5.920 -0.957 1.00 0.00 O ATOM 393 O5' C A 13 10.255 -5.620 1.516 1.00 0.00 O ATOM 394 C5' C A 13 10.768 -5.286 2.805 1.00 0.00 C ATOM 395 C4' C A 13 9.674 -5.369 3.846 1.00 0.00 C ATOM 396 O4' C A 13 8.585 -4.476 3.497 1.00 0.00 O ATOM 397 C3' C A 13 8.977 -6.713 3.974 1.00 0.00 C ATOM 398 O3' C A 13 9.760 -7.641 4.717 1.00 0.00 O ATOM 399 C2' C A 13 7.678 -6.336 4.678 1.00 0.00 C ATOM 400 O2' C A 13 7.876 -6.154 6.069 1.00 0.00 O ATOM 401 C1' C A 13 7.379 -4.969 4.056 1.00 0.00 C ATOM 402 N1 C A 13 6.354 -5.013 2.999 1.00 0.00 N ATOM 403 C2 C A 13 5.003 -4.920 3.360 1.00 0.00 C ATOM 404 O2 C A 13 4.707 -4.819 4.560 1.00 0.00 O ATOM 405 N3 C A 13 4.057 -4.943 2.394 1.00 0.00 N ATOM 406 C4 C A 13 4.415 -5.055 1.114 1.00 0.00 C ATOM 407 N4 C A 13 3.447 -5.060 0.195 1.00 0.00 N ATOM 408 C5 C A 13 5.780 -5.163 0.719 1.00 0.00 C ATOM 409 C6 C A 13 6.707 -5.138 1.684 1.00 0.00 C ATOM 0 H5' C A 13 11.186 -4.280 2.787 1.00 0.00 H new ATOM 0 H5'' C A 13 11.580 -5.964 3.067 1.00 0.00 H new ATOM 0 H4' C A 13 10.205 -5.135 4.769 1.00 0.00 H new ATOM 0 H3' C A 13 8.811 -7.220 3.024 1.00 0.00 H new ATOM 0 H2' C A 13 6.900 -7.092 4.567 1.00 0.00 H new ATOM 0 HO2' C A 13 7.026 -5.912 6.492 1.00 0.00 H new ATOM 0 H1' C A 13 6.988 -4.326 4.845 1.00 0.00 H new ATOM 0 H41 C A 13 3.683 -5.144 -0.794 1.00 0.00 H new ATOM 0 H42 C A 13 2.471 -4.980 0.482 1.00 0.00 H new ATOM 0 H5 C A 13 6.056 -5.261 -0.320 1.00 0.00 H new ATOM 0 H6 C A 13 7.751 -5.218 1.420 1.00 0.00 H new ATOM 421 P U A 14 9.483 -9.218 4.567 1.00 0.00 P ATOM 422 OP1 U A 14 10.392 -9.944 5.489 1.00 0.00 O ATOM 423 OP2 U A 14 9.499 -9.538 3.117 1.00 0.00 O ATOM 424 O5' U A 14 7.986 -9.395 5.087 1.00 0.00 O ATOM 425 C5' U A 14 7.670 -9.264 6.472 1.00 0.00 C ATOM 426 C4' U A 14 6.312 -9.864 6.752 1.00 0.00 C ATOM 427 O4' U A 14 5.285 -8.942 6.301 1.00 0.00 O ATOM 428 C3' U A 14 6.012 -11.161 6.014 1.00 0.00 C ATOM 429 O3' U A 14 6.514 -12.289 6.724 1.00 0.00 O ATOM 430 C2' U A 14 4.490 -11.154 5.931 1.00 0.00 C ATOM 431 O2' U A 14 3.909 -11.568 7.153 1.00 0.00 O ATOM 432 C1' U A 14 4.205 -9.664 5.738 1.00 0.00 C ATOM 433 N1 U A 14 4.063 -9.262 4.330 1.00 0.00 N ATOM 434 C2 U A 14 2.816 -9.400 3.745 1.00 0.00 C ATOM 435 O2 U A 14 1.851 -9.851 4.337 1.00 0.00 O ATOM 436 N3 U A 14 2.743 -8.990 2.439 1.00 0.00 N ATOM 437 C4 U A 14 3.763 -8.468 1.673 1.00 0.00 C ATOM 438 O4 U A 14 3.539 -8.136 0.511 1.00 0.00 O ATOM 439 C5 U A 14 5.017 -8.365 2.347 1.00 0.00 C ATOM 440 C6 U A 14 5.128 -8.757 3.618 1.00 0.00 C ATOM 0 H5' U A 14 7.677 -8.212 6.757 1.00 0.00 H new ATOM 0 H5'' U A 14 8.428 -9.763 7.075 1.00 0.00 H new ATOM 0 H4' U A 14 6.318 -10.061 7.824 1.00 0.00 H new ATOM 0 H3' U A 14 6.485 -11.229 5.035 1.00 0.00 H new ATOM 0 H2' U A 14 4.098 -11.815 5.158 1.00 0.00 H new ATOM 0 HO2' U A 14 2.932 -11.553 7.073 1.00 0.00 H new ATOM 0 H1' U A 14 3.252 -9.450 6.222 1.00 0.00 H new ATOM 0 H3 U A 14 1.834 -9.081 1.984 1.00 0.00 H new ATOM 0 H5 U A 14 5.877 -7.969 1.828 1.00 0.00 H new ATOM 0 H6 U A 14 6.088 -8.675 4.106 1.00 0.00 H new ATOM 451 P C A 15 7.011 -13.587 5.916 1.00 0.00 P ATOM 452 OP1 C A 15 7.811 -14.413 6.855 1.00 0.00 O ATOM 453 OP2 C A 15 7.612 -13.150 4.631 1.00 0.00 O ATOM 454 O5' C A 15 5.665 -14.377 5.591 1.00 0.00 O ATOM 455 C5' C A 15 4.846 -14.893 6.637 1.00 0.00 C ATOM 456 C4' C A 15 3.623 -15.564 6.057 1.00 0.00 C ATOM 457 O4' C A 15 2.686 -14.536 5.638 1.00 0.00 O ATOM 458 C3' C A 15 3.873 -16.402 4.810 1.00 0.00 C ATOM 459 O3' C A 15 4.235 -17.750 5.129 1.00 0.00 O ATOM 460 C2' C A 15 2.538 -16.325 4.078 1.00 0.00 C ATOM 461 O2' C A 15 1.600 -17.231 4.628 1.00 0.00 O ATOM 462 C1' C A 15 2.092 -14.900 4.406 1.00 0.00 C ATOM 463 N1 C A 15 2.478 -13.904 3.392 1.00 0.00 N ATOM 464 C2 C A 15 1.532 -13.512 2.444 1.00 0.00 C ATOM 465 O2 C A 15 0.403 -14.019 2.482 1.00 0.00 O ATOM 466 N3 C A 15 1.870 -12.594 1.511 1.00 0.00 N ATOM 467 C4 C A 15 3.098 -12.071 1.506 1.00 0.00 C ATOM 468 N4 C A 15 3.386 -11.168 0.567 1.00 0.00 N ATOM 469 C5 C A 15 4.084 -12.451 2.463 1.00 0.00 C ATOM 470 C6 C A 15 3.735 -13.365 3.377 1.00 0.00 C ATOM 0 H5' C A 15 4.545 -14.086 7.305 1.00 0.00 H new ATOM 0 H5'' C A 15 5.413 -15.607 7.235 1.00 0.00 H new ATOM 0 H4' C A 15 3.264 -16.222 6.848 1.00 0.00 H new ATOM 0 H3' C A 15 4.710 -16.040 4.213 1.00 0.00 H new ATOM 0 H2' C A 15 2.615 -16.562 3.017 1.00 0.00 H new ATOM 0 HO2' C A 15 2.070 -17.905 5.162 1.00 0.00 H new ATOM 0 HO3' C A 15 4.385 -18.253 4.301 1.00 0.00 H new ATOM 0 H1' C A 15 1.003 -14.901 4.442 1.00 0.00 H new ATOM 0 H41 C A 15 4.314 -10.747 0.532 1.00 0.00 H new ATOM 0 H42 C A 15 2.678 -10.899 -0.116 1.00 0.00 H new ATOM 0 H5 C A 15 5.074 -12.019 2.451 1.00 0.00 H new ATOM 0 H6 C A 15 4.458 -13.682 4.114 1.00 0.00 H new TER 483 C A 15