USER MOD reduce.3.24.130724 H: found=0, std=0, add=176, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 176 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= -0.424 USER MOD Single : A 1 G O5' : rot 17:sc= 0.324 USER MOD Single : A 2 A O2' : rot -9:sc= -0.138 USER MOD Single : A 3 G O2' : rot 180:sc= -0.269 USER MOD Single : A 4 G O2' : rot -15:sc= -0.324 USER MOD Single : A 5 U O2' : rot 180:sc= -0.442 USER MOD Single : A 6 C O2' : rot -22:sc= 0.157 USER MOD Single : A 7 U O2' : rot -18:sc= -0.198 USER MOD Single : A 8 C O2' : rot -31:sc= 0.133 USER MOD Single : A 8 C O3' : rot 180:sc= 0.166 USER MOD Single : B 9 G O2' : rot 180:sc= -0.395 USER MOD Single : B 9 G O5' : rot 180:sc= 0 USER MOD Single : B 10 A O2' : rot -9:sc= -0.164 USER MOD Single : B 11 G O2' : rot -125:sc= 0.197 USER MOD Single : B 12 G O2' : rot -27:sc= -0.0199 USER MOD Single : B 13 U O2' : rot 180:sc= -0.577 USER MOD Single : B 14 C O2' : rot -33:sc= 0.154 USER MOD Single : B 15 U O2' : rot -26:sc= 0.175 USER MOD Single : B 16 C O2' : rot -19:sc= 0.127 USER MOD Single : B 16 C O3' : rot 180:sc= 0.128 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 6.325 -9.720 6.110 1.00 0.00 O ATOM 2 C5' G A 1 5.943 -9.272 4.828 1.00 0.00 C ATOM 3 C4' G A 1 6.863 -8.134 4.382 1.00 0.00 C ATOM 4 O4' G A 1 6.492 -7.654 3.091 1.00 0.00 O ATOM 5 C3' G A 1 6.768 -6.927 5.295 1.00 0.00 C ATOM 6 O3' G A 1 7.513 -7.085 6.487 1.00 0.00 O ATOM 7 C2' G A 1 7.361 -5.873 4.396 1.00 0.00 C ATOM 8 O2' G A 1 8.764 -6.022 4.341 1.00 0.00 O ATOM 9 C1' G A 1 6.778 -6.249 3.043 1.00 0.00 C ATOM 10 N9 G A 1 5.532 -5.492 2.826 1.00 0.00 N ATOM 11 C8 G A 1 4.241 -5.869 3.079 1.00 0.00 C ATOM 12 N7 G A 1 3.354 -4.962 2.778 1.00 0.00 N ATOM 13 C5 G A 1 4.115 -3.899 2.301 1.00 0.00 C ATOM 14 C6 G A 1 3.706 -2.615 1.834 1.00 0.00 C ATOM 15 O6 G A 1 2.566 -2.170 1.725 1.00 0.00 O ATOM 16 N1 G A 1 4.797 -1.830 1.480 1.00 0.00 N ATOM 17 C2 G A 1 6.115 -2.224 1.555 1.00 0.00 C ATOM 18 N2 G A 1 7.034 -1.328 1.183 1.00 0.00 N ATOM 19 N3 G A 1 6.501 -3.431 1.981 1.00 0.00 N ATOM 20 C4 G A 1 5.452 -4.212 2.339 1.00 0.00 C ATOM 0 H5' G A 1 4.908 -8.930 4.846 1.00 0.00 H new ATOM 0 H5'' G A 1 5.995 -10.095 4.115 1.00 0.00 H new ATOM 0 H4' G A 1 7.868 -8.556 4.394 1.00 0.00 H new ATOM 0 H3' G A 1 5.763 -6.714 5.659 1.00 0.00 H new ATOM 0 H2' G A 1 7.151 -4.853 4.718 1.00 0.00 H new ATOM 0 HO2' G A 1 9.143 -5.335 3.754 1.00 0.00 H new ATOM 0 HO5' G A 1 6.901 -9.049 6.533 1.00 0.00 H new ATOM 0 H1' G A 1 7.469 -6.021 2.232 1.00 0.00 H new ATOM 0 H8 G A 1 3.980 -6.832 3.491 1.00 0.00 H new ATOM 0 H1 G A 1 4.607 -0.888 1.138 1.00 0.00 H new ATOM 0 H21 G A 1 8.025 -1.568 1.219 1.00 0.00 H new ATOM 0 H22 G A 1 6.745 -0.404 0.863 1.00 0.00 H new ATOM 33 P A A 2 7.279 -6.099 7.743 1.00 0.00 P ATOM 34 OP1 A A 2 8.240 -6.470 8.805 1.00 0.00 O ATOM 35 OP2 A A 2 5.830 -6.080 8.040 1.00 0.00 O ATOM 36 O5' A A 2 7.690 -4.646 7.181 1.00 0.00 O ATOM 37 C5' A A 2 9.045 -4.286 7.006 1.00 0.00 C ATOM 38 C4' A A 2 9.118 -2.847 6.491 1.00 0.00 C ATOM 39 O4' A A 2 8.407 -2.698 5.268 1.00 0.00 O ATOM 40 C3' A A 2 8.456 -1.875 7.442 1.00 0.00 C ATOM 41 O3' A A 2 9.276 -1.584 8.562 1.00 0.00 O ATOM 42 C2' A A 2 8.267 -0.685 6.538 1.00 0.00 C ATOM 43 O2' A A 2 9.490 0.010 6.397 1.00 0.00 O ATOM 44 C1' A A 2 7.922 -1.349 5.206 1.00 0.00 C ATOM 45 N9 A A 2 6.457 -1.340 4.992 1.00 0.00 N ATOM 46 C8 A A 2 5.554 -2.362 5.143 1.00 0.00 C ATOM 47 N7 A A 2 4.325 -2.031 4.848 1.00 0.00 N ATOM 48 C5 A A 2 4.420 -0.693 4.476 1.00 0.00 C ATOM 49 C6 A A 2 3.464 0.248 4.041 1.00 0.00 C ATOM 50 N6 A A 2 2.165 -0.035 3.896 1.00 0.00 N ATOM 51 N1 A A 2 3.896 1.492 3.756 1.00 0.00 N ATOM 52 C2 A A 2 5.189 1.772 3.896 1.00 0.00 C ATOM 53 N3 A A 2 6.179 0.980 4.288 1.00 0.00 N ATOM 54 C4 A A 2 5.715 -0.261 4.566 1.00 0.00 C ATOM 0 H5' A A 2 9.526 -4.963 6.300 1.00 0.00 H new ATOM 0 H5'' A A 2 9.583 -4.375 7.950 1.00 0.00 H new ATOM 0 H4' A A 2 10.182 -2.639 6.377 1.00 0.00 H new ATOM 0 H3' A A 2 7.535 -2.240 7.896 1.00 0.00 H new ATOM 0 H2' A A 2 7.524 0.027 6.899 1.00 0.00 H new ATOM 0 HO2' A A 2 10.147 -0.353 7.027 1.00 0.00 H new ATOM 0 H1' A A 2 8.380 -0.811 4.376 1.00 0.00 H new ATOM 0 H8 A A 2 5.834 -3.351 5.476 1.00 0.00 H new ATOM 0 H61 A A 2 1.518 0.687 3.577 1.00 0.00 H new ATOM 0 H62 A A 2 1.821 -0.972 4.104 1.00 0.00 H new ATOM 0 H2 A A 2 5.473 2.786 3.657 1.00 0.00 H new ATOM 66 P G A 3 8.667 -0.869 9.878 1.00 0.00 P ATOM 67 OP1 G A 3 9.766 -0.687 10.852 1.00 0.00 O ATOM 68 OP2 G A 3 7.450 -1.610 10.275 1.00 0.00 O ATOM 69 O5' G A 3 8.217 0.583 9.356 1.00 0.00 O ATOM 70 C5' G A 3 9.164 1.605 9.119 1.00 0.00 C ATOM 71 C4' G A 3 8.430 2.827 8.569 1.00 0.00 C ATOM 72 O4' G A 3 7.733 2.493 7.376 1.00 0.00 O ATOM 73 C3' G A 3 7.373 3.334 9.513 1.00 0.00 C ATOM 74 O3' G A 3 7.920 4.102 10.572 1.00 0.00 O ATOM 75 C2' G A 3 6.573 4.187 8.557 1.00 0.00 C ATOM 76 O2' G A 3 7.223 5.424 8.350 1.00 0.00 O ATOM 77 C1' G A 3 6.627 3.387 7.261 1.00 0.00 C ATOM 78 N9 G A 3 5.362 2.645 7.108 1.00 0.00 N ATOM 79 C8 G A 3 5.057 1.355 7.461 1.00 0.00 C ATOM 80 N7 G A 3 3.814 1.026 7.235 1.00 0.00 N ATOM 81 C5 G A 3 3.254 2.183 6.700 1.00 0.00 C ATOM 82 C6 G A 3 1.922 2.443 6.261 1.00 0.00 C ATOM 83 O6 G A 3 0.957 1.681 6.251 1.00 0.00 O ATOM 84 N1 G A 3 1.783 3.747 5.799 1.00 0.00 N ATOM 85 C2 G A 3 2.793 4.683 5.756 1.00 0.00 C ATOM 86 N2 G A 3 2.480 5.890 5.276 1.00 0.00 N ATOM 87 N3 G A 3 4.041 4.442 6.161 1.00 0.00 N ATOM 88 C4 G A 3 4.198 3.177 6.621 1.00 0.00 C ATOM 0 H5' G A 3 9.919 1.265 8.410 1.00 0.00 H new ATOM 0 H5'' G A 3 9.686 1.860 10.042 1.00 0.00 H new ATOM 0 H4' G A 3 9.200 3.582 8.409 1.00 0.00 H new ATOM 0 H3' G A 3 6.810 2.558 10.031 1.00 0.00 H new ATOM 0 H2' G A 3 5.565 4.397 8.915 1.00 0.00 H new ATOM 0 HO2' G A 3 6.697 5.970 7.728 1.00 0.00 H new ATOM 0 H1' G A 3 6.752 4.026 6.387 1.00 0.00 H new ATOM 0 H8 G A 3 5.779 0.674 7.887 1.00 0.00 H new ATOM 0 H1 G A 3 0.862 4.033 5.466 1.00 0.00 H new ATOM 0 H21 G A 3 3.192 6.618 5.223 1.00 0.00 H new ATOM 0 H22 G A 3 1.529 6.083 4.962 1.00 0.00 H new ATOM 100 P G A 4 6.975 4.702 11.742 1.00 0.00 P ATOM 101 OP1 G A 4 7.852 5.239 12.806 1.00 0.00 O ATOM 102 OP2 G A 4 5.963 3.677 12.076 1.00 0.00 O ATOM 103 O5' G A 4 6.211 5.952 11.050 1.00 0.00 O ATOM 104 C5' G A 4 6.882 7.178 10.808 1.00 0.00 C ATOM 105 C4' G A 4 5.885 8.222 10.283 1.00 0.00 C ATOM 106 O4' G A 4 5.280 7.805 9.057 1.00 0.00 O ATOM 107 C3' G A 4 4.740 8.449 11.252 1.00 0.00 C ATOM 108 O3' G A 4 5.089 9.344 12.290 1.00 0.00 O ATOM 109 C2' G A 4 3.716 9.058 10.327 1.00 0.00 C ATOM 110 O2' G A 4 4.057 10.403 10.060 1.00 0.00 O ATOM 111 C1' G A 4 3.913 8.251 9.055 1.00 0.00 C ATOM 112 N9 G A 4 3.017 7.081 9.035 1.00 0.00 N ATOM 113 C8 G A 4 3.337 5.768 9.222 1.00 0.00 C ATOM 114 N7 G A 4 2.333 4.948 9.079 1.00 0.00 N ATOM 115 C5 G A 4 1.262 5.783 8.778 1.00 0.00 C ATOM 116 C6 G A 4 -0.102 5.464 8.516 1.00 0.00 C ATOM 117 O6 G A 4 -0.633 4.357 8.483 1.00 0.00 O ATOM 118 N1 G A 4 -0.860 6.606 8.282 1.00 0.00 N ATOM 119 C2 G A 4 -0.369 7.894 8.281 1.00 0.00 C ATOM 120 N2 G A 4 -1.250 8.871 8.042 1.00 0.00 N ATOM 121 N3 G A 4 0.915 8.198 8.512 1.00 0.00 N ATOM 122 C4 G A 4 1.670 7.096 8.757 1.00 0.00 C ATOM 0 H5' G A 4 7.682 7.028 10.083 1.00 0.00 H new ATOM 0 H5'' G A 4 7.347 7.536 11.726 1.00 0.00 H new ATOM 0 H4' G A 4 6.470 9.131 10.147 1.00 0.00 H new ATOM 0 H3' G A 4 4.413 7.551 11.776 1.00 0.00 H new ATOM 0 H2' G A 4 2.702 9.042 10.726 1.00 0.00 H new ATOM 0 HO2' G A 4 4.728 10.705 10.707 1.00 0.00 H new ATOM 0 H1' G A 4 3.687 8.859 8.179 1.00 0.00 H new ATOM 0 H8 G A 4 4.335 5.436 9.467 1.00 0.00 H new ATOM 0 H1 G A 4 -1.855 6.481 8.097 1.00 0.00 H new ATOM 0 H21 G A 4 -0.942 9.843 8.029 1.00 0.00 H new ATOM 0 H22 G A 4 -2.230 8.644 7.872 1.00 0.00 H new ATOM 134 P U A 5 4.257 9.373 13.670 1.00 0.00 P ATOM 135 OP1 U A 5 4.656 10.581 14.425 1.00 0.00 O ATOM 136 OP2 U A 5 4.381 8.040 14.300 1.00 0.00 O ATOM 137 O5' U A 5 2.726 9.555 13.199 1.00 0.00 O ATOM 138 C5' U A 5 2.227 10.801 12.765 1.00 0.00 C ATOM 139 C4' U A 5 0.726 10.674 12.461 1.00 0.00 C ATOM 140 O4' U A 5 0.435 9.873 11.308 1.00 0.00 O ATOM 141 C3' U A 5 -0.037 10.060 13.601 1.00 0.00 C ATOM 142 O3' U A 5 -0.255 10.981 14.652 1.00 0.00 O ATOM 143 C2' U A 5 -1.308 9.708 12.875 1.00 0.00 C ATOM 144 O2' U A 5 -2.075 10.869 12.622 1.00 0.00 O ATOM 145 C1' U A 5 -0.793 9.164 11.567 1.00 0.00 C ATOM 146 N1 U A 5 -0.504 7.715 11.676 1.00 0.00 N ATOM 147 C2 U A 5 -1.528 6.809 11.420 1.00 0.00 C ATOM 148 O2 U A 5 -2.678 7.164 11.161 1.00 0.00 O ATOM 149 N3 U A 5 -1.180 5.469 11.472 1.00 0.00 N ATOM 150 C4 U A 5 0.080 4.964 11.758 1.00 0.00 C ATOM 151 O4 U A 5 0.278 3.752 11.779 1.00 0.00 O ATOM 152 C5 U A 5 1.076 5.979 12.013 1.00 0.00 C ATOM 153 C6 U A 5 0.756 7.293 11.961 1.00 0.00 C ATOM 0 H5' U A 5 2.763 11.129 11.874 1.00 0.00 H new ATOM 0 H5'' U A 5 2.391 11.558 13.532 1.00 0.00 H new ATOM 0 H4' U A 5 0.416 11.704 12.284 1.00 0.00 H new ATOM 0 H3' U A 5 0.457 9.228 14.102 1.00 0.00 H new ATOM 0 H2' U A 5 -1.945 9.022 13.433 1.00 0.00 H new ATOM 0 HO2' U A 5 -2.897 10.622 12.148 1.00 0.00 H new ATOM 0 H1' U A 5 -1.528 9.295 10.773 1.00 0.00 H new ATOM 0 H3 U A 5 -1.918 4.791 11.283 1.00 0.00 H new ATOM 0 H5 U A 5 2.088 5.686 12.248 1.00 0.00 H new ATOM 0 H6 U A 5 1.524 8.028 12.152 1.00 0.00 H new ATOM 164 P C A 6 -0.704 10.472 16.114 1.00 0.00 P ATOM 165 OP1 C A 6 -0.963 11.659 16.959 1.00 0.00 O ATOM 166 OP2 C A 6 0.268 9.450 16.560 1.00 0.00 O ATOM 167 O5' C A 6 -2.104 9.737 15.837 1.00 0.00 O ATOM 168 C5' C A 6 -3.274 10.477 15.569 1.00 0.00 C ATOM 169 C4' C A 6 -4.423 9.510 15.296 1.00 0.00 C ATOM 170 O4' C A 6 -4.166 8.685 14.165 1.00 0.00 O ATOM 171 C3' C A 6 -4.652 8.561 16.453 1.00 0.00 C ATOM 172 O3' C A 6 -5.367 9.189 17.500 1.00 0.00 O ATOM 173 C2' C A 6 -5.457 7.487 15.771 1.00 0.00 C ATOM 174 O2' C A 6 -6.793 7.919 15.616 1.00 0.00 O ATOM 175 C1' C A 6 -4.795 7.417 14.392 1.00 0.00 C ATOM 176 N1 C A 6 -3.781 6.336 14.361 1.00 0.00 N ATOM 177 C2 C A 6 -4.246 5.040 14.196 1.00 0.00 C ATOM 178 O2 C A 6 -5.450 4.829 14.072 1.00 0.00 O ATOM 179 N3 C A 6 -3.340 4.024 14.177 1.00 0.00 N ATOM 180 C4 C A 6 -2.030 4.267 14.325 1.00 0.00 C ATOM 181 N4 C A 6 -1.175 3.240 14.306 1.00 0.00 N ATOM 182 C5 C A 6 -1.534 5.601 14.489 1.00 0.00 C ATOM 183 C6 C A 6 -2.443 6.599 14.492 1.00 0.00 C ATOM 0 H5' C A 6 -3.118 11.129 14.709 1.00 0.00 H new ATOM 0 H5'' C A 6 -3.516 11.119 16.416 1.00 0.00 H new ATOM 0 H4' C A 6 -5.292 10.147 15.131 1.00 0.00 H new ATOM 0 H3' C A 6 -3.747 8.197 16.939 1.00 0.00 H new ATOM 0 H2' C A 6 -5.478 6.541 16.312 1.00 0.00 H new ATOM 0 HO2' C A 6 -6.984 8.630 16.263 1.00 0.00 H new ATOM 0 H1' C A 6 -5.534 7.202 13.620 1.00 0.00 H new ATOM 0 H41 C A 6 -0.175 3.407 14.417 1.00 0.00 H new ATOM 0 H42 C A 6 -1.523 2.289 14.180 1.00 0.00 H new ATOM 0 H5 C A 6 -0.479 5.800 14.605 1.00 0.00 H new ATOM 0 H6 C A 6 -2.110 7.621 14.599 1.00 0.00 H new ATOM 195 P U A 7 -5.587 8.451 18.909 1.00 0.00 P ATOM 196 OP1 U A 7 -6.312 9.374 19.809 1.00 0.00 O ATOM 197 OP2 U A 7 -4.289 7.879 19.331 1.00 0.00 O ATOM 198 O5' U A 7 -6.573 7.237 18.538 1.00 0.00 O ATOM 199 C5' U A 7 -6.546 6.051 19.295 1.00 0.00 C ATOM 200 C4' U A 7 -7.545 5.036 18.740 1.00 0.00 C ATOM 201 O4' U A 7 -7.244 4.686 17.379 1.00 0.00 O ATOM 202 C3' U A 7 -7.448 3.754 19.545 1.00 0.00 C ATOM 203 O3' U A 7 -8.302 3.764 20.672 1.00 0.00 O ATOM 204 C2' U A 7 -7.863 2.729 18.528 1.00 0.00 C ATOM 205 O2' U A 7 -9.262 2.769 18.343 1.00 0.00 O ATOM 206 C1' U A 7 -7.186 3.257 17.275 1.00 0.00 C ATOM 207 N1 U A 7 -5.766 2.817 17.178 1.00 0.00 N ATOM 208 C2 U A 7 -5.526 1.468 16.953 1.00 0.00 C ATOM 209 O2 U A 7 -6.435 0.645 16.873 1.00 0.00 O ATOM 210 N3 U A 7 -4.198 1.096 16.814 1.00 0.00 N ATOM 211 C4 U A 7 -3.105 1.946 16.855 1.00 0.00 C ATOM 212 O4 U A 7 -1.966 1.501 16.733 1.00 0.00 O ATOM 213 C5 U A 7 -3.447 3.342 17.036 1.00 0.00 C ATOM 214 C6 U A 7 -4.735 3.728 17.185 1.00 0.00 C ATOM 0 H5' U A 7 -6.784 6.272 20.336 1.00 0.00 H new ATOM 0 H5'' U A 7 -5.542 5.627 19.281 1.00 0.00 H new ATOM 0 H4' U A 7 -8.535 5.489 18.797 1.00 0.00 H new ATOM 0 H3' U A 7 -6.462 3.576 19.974 1.00 0.00 H new ATOM 0 H2' U A 7 -7.603 1.706 18.798 1.00 0.00 H new ATOM 0 HO2' U A 7 -9.679 3.228 19.101 1.00 0.00 H new ATOM 0 H1' U A 7 -7.686 2.878 16.384 1.00 0.00 H new ATOM 0 H3 U A 7 -4.008 0.105 16.668 1.00 0.00 H new ATOM 0 H5 U A 7 -2.663 4.085 17.052 1.00 0.00 H new ATOM 0 H6 U A 7 -4.959 4.777 17.313 1.00 0.00 H new ATOM 225 P C A 8 -8.035 2.775 21.917 1.00 0.00 P ATOM 226 OP1 C A 8 -9.147 2.934 22.881 1.00 0.00 O ATOM 227 OP2 C A 8 -6.641 2.978 22.367 1.00 0.00 O ATOM 228 O5' C A 8 -8.138 1.303 21.274 1.00 0.00 O ATOM 229 C5' C A 8 -9.385 0.740 20.930 1.00 0.00 C ATOM 230 C4' C A 8 -9.164 -0.683 20.413 1.00 0.00 C ATOM 231 O4' C A 8 -8.351 -0.698 19.241 1.00 0.00 O ATOM 232 C3' C A 8 -8.419 -1.536 21.416 1.00 0.00 C ATOM 233 O3' C A 8 -9.250 -2.013 22.451 1.00 0.00 O ATOM 234 C2' C A 8 -7.932 -2.647 20.539 1.00 0.00 C ATOM 235 O2' C A 8 -8.989 -3.544 20.264 1.00 0.00 O ATOM 236 C1' C A 8 -7.554 -1.896 19.269 1.00 0.00 C ATOM 237 N1 C A 8 -6.104 -1.565 19.314 1.00 0.00 N ATOM 238 C2 C A 8 -5.203 -2.606 19.124 1.00 0.00 C ATOM 239 O2 C A 8 -5.610 -3.745 18.909 1.00 0.00 O ATOM 240 N3 C A 8 -3.871 -2.327 19.184 1.00 0.00 N ATOM 241 C4 C A 8 -3.438 -1.081 19.423 1.00 0.00 C ATOM 242 N4 C A 8 -2.121 -0.850 19.458 1.00 0.00 N ATOM 243 C5 C A 8 -4.355 -0.001 19.630 1.00 0.00 C ATOM 244 C6 C A 8 -5.671 -0.294 19.564 1.00 0.00 C ATOM 0 H5' C A 8 -9.874 1.346 20.167 1.00 0.00 H new ATOM 0 H5'' C A 8 -10.044 0.727 21.798 1.00 0.00 H new ATOM 0 H4' C A 8 -10.164 -1.070 20.218 1.00 0.00 H new ATOM 0 H3' C A 8 -7.634 -1.000 21.950 1.00 0.00 H new ATOM 0 H2' C A 8 -7.124 -3.236 20.973 1.00 0.00 H new ATOM 0 HO2' C A 8 -9.609 -3.562 21.023 1.00 0.00 H new ATOM 0 HO3' C A 8 -8.721 -2.559 23.070 1.00 0.00 H new ATOM 0 H1' C A 8 -7.737 -2.491 18.374 1.00 0.00 H new ATOM 0 H41 C A 8 -1.773 0.092 19.638 1.00 0.00 H new ATOM 0 H42 C A 8 -1.465 -1.616 19.304 1.00 0.00 H new ATOM 0 H5 C A 8 -4.009 1.003 19.830 1.00 0.00 H new ATOM 0 H6 C A 8 -6.396 0.493 19.712 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 4.054 -10.960 16.985 1.00 0.00 O ATOM 259 C5' G B 9 3.354 -10.201 16.023 1.00 0.00 C ATOM 260 C4' G B 9 1.875 -10.133 16.402 1.00 0.00 C ATOM 261 O4' G B 9 1.685 -9.415 17.619 1.00 0.00 O ATOM 262 C3' G B 9 1.063 -9.372 15.374 1.00 0.00 C ATOM 263 O3' G B 9 0.786 -10.144 14.222 1.00 0.00 O ATOM 264 C2' G B 9 -0.177 -9.092 16.182 1.00 0.00 C ATOM 265 O2' G B 9 -0.958 -10.263 16.283 1.00 0.00 O ATOM 266 C1' G B 9 0.403 -8.773 17.553 1.00 0.00 C ATOM 267 N9 G B 9 0.565 -7.314 17.687 1.00 0.00 N ATOM 268 C8 G B 9 1.671 -6.544 17.446 1.00 0.00 C ATOM 269 N7 G B 9 1.487 -5.270 17.659 1.00 0.00 N ATOM 270 C5 G B 9 0.157 -5.189 18.061 1.00 0.00 C ATOM 271 C6 G B 9 -0.626 -4.051 18.419 1.00 0.00 C ATOM 272 O6 G B 9 -0.280 -2.873 18.473 1.00 0.00 O ATOM 273 N1 G B 9 -1.933 -4.408 18.730 1.00 0.00 N ATOM 274 C2 G B 9 -2.428 -5.694 18.711 1.00 0.00 C ATOM 275 N2 G B 9 -3.716 -5.849 19.035 1.00 0.00 N ATOM 276 N3 G B 9 -1.696 -6.763 18.385 1.00 0.00 N ATOM 277 C4 G B 9 -0.417 -6.437 18.071 1.00 0.00 C ATOM 0 H5' G B 9 3.467 -10.652 15.037 1.00 0.00 H new ATOM 0 H5'' G B 9 3.771 -9.196 15.964 1.00 0.00 H new ATOM 0 H4' G B 9 1.553 -11.171 16.481 1.00 0.00 H new ATOM 0 H3' G B 9 1.557 -8.491 14.965 1.00 0.00 H new ATOM 0 H2' G B 9 -0.808 -8.310 15.759 1.00 0.00 H new ATOM 0 HO2' G B 9 -1.762 -10.075 16.811 1.00 0.00 H new ATOM 0 HO5' G B 9 5.002 -11.004 16.740 1.00 0.00 H new ATOM 0 H1' G B 9 -0.249 -9.122 18.354 1.00 0.00 H new ATOM 0 H8 G B 9 2.612 -6.954 17.110 1.00 0.00 H new ATOM 0 H1 G B 9 -2.575 -3.660 18.993 1.00 0.00 H new ATOM 0 H21 G B 9 -4.133 -6.780 19.037 1.00 0.00 H new ATOM 0 H22 G B 9 -4.281 -5.036 19.280 1.00 0.00 H new ATOM 290 P A B 10 0.244 -9.445 12.871 1.00 0.00 P ATOM 291 OP1 A B 10 -0.015 -10.508 11.874 1.00 0.00 O ATOM 292 OP2 A B 10 1.164 -8.335 12.536 1.00 0.00 O ATOM 293 O5' A B 10 -1.171 -8.805 13.302 1.00 0.00 O ATOM 294 C5' A B 10 -2.316 -9.614 13.473 1.00 0.00 C ATOM 295 C4' A B 10 -3.500 -8.730 13.874 1.00 0.00 C ATOM 296 O4' A B 10 -3.223 -8.005 15.066 1.00 0.00 O ATOM 297 C3' A B 10 -3.791 -7.669 12.836 1.00 0.00 C ATOM 298 O3' A B 10 -4.482 -8.194 11.713 1.00 0.00 O ATOM 299 C2' A B 10 -4.638 -6.718 13.641 1.00 0.00 C ATOM 300 O2' A B 10 -5.952 -7.224 13.755 1.00 0.00 O ATOM 301 C1' A B 10 -3.967 -6.778 15.013 1.00 0.00 C ATOM 302 N9 A B 10 -3.062 -5.619 15.190 1.00 0.00 N ATOM 303 C8 A B 10 -1.695 -5.564 15.089 1.00 0.00 C ATOM 304 N7 A B 10 -1.195 -4.379 15.316 1.00 0.00 N ATOM 305 C5 A B 10 -2.310 -3.592 15.585 1.00 0.00 C ATOM 306 C6 A B 10 -2.463 -2.228 15.907 1.00 0.00 C ATOM 307 N6 A B 10 -1.434 -1.379 16.021 1.00 0.00 N ATOM 308 N1 A B 10 -3.713 -1.768 16.108 1.00 0.00 N ATOM 309 C2 A B 10 -4.735 -2.612 15.997 1.00 0.00 C ATOM 310 N3 A B 10 -4.722 -3.907 15.706 1.00 0.00 N ATOM 311 C4 A B 10 -3.453 -4.339 15.508 1.00 0.00 C ATOM 0 H5' A B 10 -2.133 -10.367 14.239 1.00 0.00 H new ATOM 0 H5'' A B 10 -2.541 -10.147 12.549 1.00 0.00 H new ATOM 0 H4' A B 10 -4.339 -9.416 13.993 1.00 0.00 H new ATOM 0 H3' A B 10 -2.905 -7.214 12.392 1.00 0.00 H new ATOM 0 H2' A B 10 -4.707 -5.719 13.210 1.00 0.00 H new ATOM 0 HO2' A B 10 -6.055 -8.002 13.168 1.00 0.00 H new ATOM 0 H1' A B 10 -4.709 -6.743 15.810 1.00 0.00 H new ATOM 0 H8 A B 10 -1.087 -6.423 14.844 1.00 0.00 H new ATOM 0 H61 A B 10 -1.603 -0.401 16.256 1.00 0.00 H new ATOM 0 H62 A B 10 -0.481 -1.710 15.872 1.00 0.00 H new ATOM 0 H2 A B 10 -5.712 -2.184 16.167 1.00 0.00 H new ATOM 323 P G B 11 -4.581 -7.362 10.330 1.00 0.00 P ATOM 324 OP1 G B 11 -5.385 -8.155 9.373 1.00 0.00 O ATOM 325 OP2 G B 11 -3.214 -6.934 9.959 1.00 0.00 O ATOM 326 O5' G B 11 -5.423 -6.050 10.722 1.00 0.00 O ATOM 327 C5' G B 11 -6.823 -6.105 10.913 1.00 0.00 C ATOM 328 C4' G B 11 -7.307 -4.723 11.353 1.00 0.00 C ATOM 329 O4' G B 11 -6.634 -4.319 12.538 1.00 0.00 O ATOM 330 C3' G B 11 -6.994 -3.652 10.340 1.00 0.00 C ATOM 331 O3' G B 11 -7.902 -3.671 9.246 1.00 0.00 O ATOM 332 C2' G B 11 -7.171 -2.429 11.213 1.00 0.00 C ATOM 333 O2' G B 11 -8.540 -2.140 11.368 1.00 0.00 O ATOM 334 C1' G B 11 -6.626 -2.894 12.560 1.00 0.00 C ATOM 335 N9 G B 11 -5.259 -2.371 12.726 1.00 0.00 N ATOM 336 C8 G B 11 -4.053 -2.994 12.527 1.00 0.00 C ATOM 337 N7 G B 11 -3.021 -2.218 12.718 1.00 0.00 N ATOM 338 C5 G B 11 -3.585 -0.992 13.063 1.00 0.00 C ATOM 339 C6 G B 11 -2.962 0.252 13.382 1.00 0.00 C ATOM 340 O6 G B 11 -1.763 0.515 13.435 1.00 0.00 O ATOM 341 N1 G B 11 -3.904 1.238 13.654 1.00 0.00 N ATOM 342 C2 G B 11 -5.269 1.055 13.634 1.00 0.00 C ATOM 343 N2 G B 11 -6.026 2.115 13.927 1.00 0.00 N ATOM 344 N3 G B 11 -5.853 -0.108 13.343 1.00 0.00 N ATOM 345 C4 G B 11 -4.954 -1.082 13.068 1.00 0.00 C ATOM 0 H5' G B 11 -7.073 -6.852 11.666 1.00 0.00 H new ATOM 0 H5'' G B 11 -7.320 -6.404 9.990 1.00 0.00 H new ATOM 0 H4' G B 11 -8.384 -4.821 11.489 1.00 0.00 H new ATOM 0 H3' G B 11 -6.021 -3.737 9.856 1.00 0.00 H new ATOM 0 H2' G B 11 -6.684 -1.542 10.807 1.00 0.00 H new ATOM 0 HO2' G B 11 -8.712 -1.215 11.093 1.00 0.00 H new ATOM 0 H1' G B 11 -7.227 -2.533 13.395 1.00 0.00 H new ATOM 0 H8 G B 11 -3.966 -4.031 12.239 1.00 0.00 H new ATOM 0 H1 G B 11 -3.557 2.169 13.886 1.00 0.00 H new ATOM 0 H21 G B 11 -7.043 2.032 13.926 1.00 0.00 H new ATOM 0 H22 G B 11 -5.588 3.008 14.152 1.00 0.00 H new ATOM 357 P G B 12 -7.723 -2.665 7.987 1.00 0.00 P ATOM 358 OP1 G B 12 -8.595 -3.145 6.892 1.00 0.00 O ATOM 359 OP2 G B 12 -6.274 -2.493 7.747 1.00 0.00 O ATOM 360 O5' G B 12 -8.315 -1.252 8.510 1.00 0.00 O ATOM 361 C5' G B 12 -9.713 -1.032 8.607 1.00 0.00 C ATOM 362 C4' G B 12 -9.975 0.413 9.054 1.00 0.00 C ATOM 363 O4' G B 12 -9.333 0.696 10.302 1.00 0.00 O ATOM 364 C3' G B 12 -9.421 1.424 8.070 1.00 0.00 C ATOM 365 O3' G B 12 -10.298 1.646 6.981 1.00 0.00 O ATOM 366 C2' G B 12 -9.341 2.643 8.952 1.00 0.00 C ATOM 367 O2' G B 12 -10.641 3.162 9.152 1.00 0.00 O ATOM 368 C1' G B 12 -8.856 2.054 10.265 1.00 0.00 C ATOM 369 N9 G B 12 -7.381 2.064 10.328 1.00 0.00 N ATOM 370 C8 G B 12 -6.520 1.011 10.213 1.00 0.00 C ATOM 371 N7 G B 12 -5.265 1.326 10.373 1.00 0.00 N ATOM 372 C5 G B 12 -5.294 2.697 10.610 1.00 0.00 C ATOM 373 C6 G B 12 -4.223 3.606 10.858 1.00 0.00 C ATOM 374 O6 G B 12 -3.021 3.365 10.933 1.00 0.00 O ATOM 375 N1 G B 12 -4.682 4.908 11.020 1.00 0.00 N ATOM 376 C2 G B 12 -6.006 5.290 10.974 1.00 0.00 C ATOM 377 N2 G B 12 -6.261 6.590 11.153 1.00 0.00 N ATOM 378 N3 G B 12 -7.016 4.438 10.757 1.00 0.00 N ATOM 379 C4 G B 12 -6.587 3.161 10.579 1.00 0.00 C ATOM 0 H5' G B 12 -10.153 -1.730 9.320 1.00 0.00 H new ATOM 0 H5'' G B 12 -10.189 -1.218 7.644 1.00 0.00 H new ATOM 0 H4' G B 12 -11.059 0.497 9.130 1.00 0.00 H new ATOM 0 H3' G B 12 -8.484 1.123 7.602 1.00 0.00 H new ATOM 0 H2' G B 12 -8.715 3.439 8.549 1.00 0.00 H new ATOM 0 HO2' G B 12 -11.206 2.932 8.385 1.00 0.00 H new ATOM 0 H1' G B 12 -9.225 2.636 11.109 1.00 0.00 H new ATOM 0 H8 G B 12 -6.850 0.003 10.007 1.00 0.00 H new ATOM 0 H1 G B 12 -3.987 5.636 11.185 1.00 0.00 H new ATOM 0 H21 G B 12 -7.223 6.929 11.129 1.00 0.00 H new ATOM 0 H22 G B 12 -5.494 7.243 11.314 1.00 0.00 H new ATOM 391 P U B 13 -9.755 2.254 5.590 1.00 0.00 P ATOM 392 OP1 U B 13 -10.923 2.655 4.776 1.00 0.00 O ATOM 393 OP2 U B 13 -8.767 1.303 5.037 1.00 0.00 O ATOM 394 O5' U B 13 -8.963 3.589 6.028 1.00 0.00 O ATOM 395 C5' U B 13 -9.643 4.779 6.368 1.00 0.00 C ATOM 396 C4' U B 13 -8.619 5.885 6.668 1.00 0.00 C ATOM 397 O4' U B 13 -7.861 5.660 7.863 1.00 0.00 O ATOM 398 C3' U B 13 -7.619 6.053 5.560 1.00 0.00 C ATOM 399 O3' U B 13 -8.159 6.763 4.462 1.00 0.00 O ATOM 400 C2' U B 13 -6.577 6.851 6.298 1.00 0.00 C ATOM 401 O2' U B 13 -7.009 8.184 6.485 1.00 0.00 O ATOM 402 C1' U B 13 -6.529 6.161 7.636 1.00 0.00 C ATOM 403 N1 U B 13 -5.581 5.026 7.606 1.00 0.00 N ATOM 404 C2 U B 13 -4.241 5.273 7.880 1.00 0.00 C ATOM 405 O2 U B 13 -3.809 6.404 8.099 1.00 0.00 O ATOM 406 N3 U B 13 -3.410 4.164 7.895 1.00 0.00 N ATOM 407 C4 U B 13 -3.795 2.853 7.658 1.00 0.00 C ATOM 408 O4 U B 13 -2.972 1.943 7.693 1.00 0.00 O ATOM 409 C5 U B 13 -5.205 2.696 7.380 1.00 0.00 C ATOM 410 C6 U B 13 -6.032 3.766 7.367 1.00 0.00 C ATOM 0 H5' U B 13 -10.279 4.612 7.237 1.00 0.00 H new ATOM 0 H5'' U B 13 -10.295 5.084 5.550 1.00 0.00 H new ATOM 0 H4' U B 13 -9.235 6.777 6.783 1.00 0.00 H new ATOM 0 H3' U B 13 -7.262 5.129 5.106 1.00 0.00 H new ATOM 0 H2' U B 13 -5.622 6.896 5.774 1.00 0.00 H new ATOM 0 HO2' U B 13 -6.320 8.687 6.967 1.00 0.00 H new ATOM 0 H1' U B 13 -6.201 6.845 8.418 1.00 0.00 H new ATOM 0 H3 U B 13 -2.424 4.327 8.099 1.00 0.00 H new ATOM 0 H5 U B 13 -5.603 1.712 7.180 1.00 0.00 H new ATOM 0 H6 U B 13 -7.081 3.615 7.161 1.00 0.00 H new ATOM 421 P C B 14 -7.423 6.749 3.030 1.00 0.00 P ATOM 422 OP1 C B 14 -8.150 7.668 2.127 1.00 0.00 O ATOM 423 OP2 C B 14 -7.222 5.337 2.635 1.00 0.00 O ATOM 424 O5' C B 14 -5.983 7.386 3.344 1.00 0.00 O ATOM 425 C5' C B 14 -5.833 8.768 3.579 1.00 0.00 C ATOM 426 C4' C B 14 -4.362 9.066 3.863 1.00 0.00 C ATOM 427 O4' C B 14 -3.892 8.381 5.018 1.00 0.00 O ATOM 428 C3' C B 14 -3.474 8.619 2.724 1.00 0.00 C ATOM 429 O3' C B 14 -3.502 9.555 1.664 1.00 0.00 O ATOM 430 C2' C B 14 -2.137 8.575 3.414 1.00 0.00 C ATOM 431 O2' C B 14 -1.625 9.886 3.534 1.00 0.00 O ATOM 432 C1' C B 14 -2.510 8.059 4.807 1.00 0.00 C ATOM 433 N1 C B 14 -2.318 6.591 4.893 1.00 0.00 N ATOM 434 C2 C B 14 -1.022 6.135 5.086 1.00 0.00 C ATOM 435 O2 C B 14 -0.093 6.933 5.173 1.00 0.00 O ATOM 436 N3 C B 14 -0.816 4.793 5.174 1.00 0.00 N ATOM 437 C4 C B 14 -1.835 3.930 5.071 1.00 0.00 C ATOM 438 N4 C B 14 -1.584 2.621 5.162 1.00 0.00 N ATOM 439 C5 C B 14 -3.180 4.386 4.882 1.00 0.00 C ATOM 440 C6 C B 14 -3.373 5.720 4.810 1.00 0.00 C ATOM 0 H5' C B 14 -6.450 9.076 4.424 1.00 0.00 H new ATOM 0 H5'' C B 14 -6.172 9.336 2.713 1.00 0.00 H new ATOM 0 H4' C B 14 -4.312 10.146 4.005 1.00 0.00 H new ATOM 0 H3' C B 14 -3.759 7.677 2.255 1.00 0.00 H new ATOM 0 H2' C B 14 -1.391 7.974 2.894 1.00 0.00 H new ATOM 0 HO2' C B 14 -1.904 10.418 2.760 1.00 0.00 H new ATOM 0 H1' C B 14 -1.875 8.520 5.564 1.00 0.00 H new ATOM 0 H41 C B 14 -2.347 1.949 5.086 1.00 0.00 H new ATOM 0 H42 C B 14 -0.629 2.294 5.308 1.00 0.00 H new ATOM 0 H5 C B 14 -4.004 3.692 4.801 1.00 0.00 H new ATOM 0 H6 C B 14 -4.374 6.107 4.685 1.00 0.00 H new ATOM 452 P U B 15 -2.797 9.236 0.261 1.00 0.00 P ATOM 453 OP1 U B 15 -3.036 10.377 -0.649 1.00 0.00 O ATOM 454 OP2 U B 15 -3.195 7.871 -0.149 1.00 0.00 O ATOM 455 O5' U B 15 -1.234 9.213 0.634 1.00 0.00 O ATOM 456 C5' U B 15 -0.350 8.420 -0.117 1.00 0.00 C ATOM 457 C4' U B 15 1.082 8.555 0.399 1.00 0.00 C ATOM 458 O4' U B 15 1.212 8.101 1.754 1.00 0.00 O ATOM 459 C3' U B 15 1.977 7.677 -0.454 1.00 0.00 C ATOM 460 O3' U B 15 2.499 8.398 -1.554 1.00 0.00 O ATOM 461 C2' U B 15 3.046 7.259 0.516 1.00 0.00 C ATOM 462 O2' U B 15 4.002 8.291 0.648 1.00 0.00 O ATOM 463 C1' U B 15 2.270 7.135 1.822 1.00 0.00 C ATOM 464 N1 U B 15 1.697 5.776 2.023 1.00 0.00 N ATOM 465 C2 U B 15 2.584 4.750 2.317 1.00 0.00 C ATOM 466 O2 U B 15 3.800 4.927 2.356 1.00 0.00 O ATOM 467 N3 U B 15 2.025 3.510 2.579 1.00 0.00 N ATOM 468 C4 U B 15 0.671 3.213 2.596 1.00 0.00 C ATOM 469 O4 U B 15 0.288 2.068 2.823 1.00 0.00 O ATOM 470 C5 U B 15 -0.187 4.354 2.346 1.00 0.00 C ATOM 471 C6 U B 15 0.336 5.574 2.079 1.00 0.00 C ATOM 0 H5' U B 15 -0.392 8.716 -1.165 1.00 0.00 H new ATOM 0 H5'' U B 15 -0.661 7.376 -0.068 1.00 0.00 H new ATOM 0 H4' U B 15 1.357 9.609 0.352 1.00 0.00 H new ATOM 0 H3' U B 15 1.464 6.828 -0.905 1.00 0.00 H new ATOM 0 H2' U B 15 3.577 6.354 0.219 1.00 0.00 H new ATOM 0 HO2' U B 15 4.011 8.835 -0.167 1.00 0.00 H new ATOM 0 H1' U B 15 2.941 7.308 2.663 1.00 0.00 H new ATOM 0 H3 U B 15 2.669 2.745 2.778 1.00 0.00 H new ATOM 0 H5 U B 15 -1.259 4.229 2.373 1.00 0.00 H new ATOM 0 H6 U B 15 -0.329 6.407 1.906 1.00 0.00 H new ATOM 482 P C B 16 3.296 7.647 -2.728 1.00 0.00 P ATOM 483 OP1 C B 16 3.736 8.659 -3.715 1.00 0.00 O ATOM 484 OP2 C B 16 2.477 6.496 -3.170 1.00 0.00 O ATOM 485 O5' C B 16 4.599 7.078 -1.981 1.00 0.00 O ATOM 486 C5' C B 16 5.208 5.897 -2.437 1.00 0.00 C ATOM 487 C4' C B 16 6.370 5.504 -1.525 1.00 0.00 C ATOM 488 O4' C B 16 5.947 5.340 -0.165 1.00 0.00 O ATOM 489 C3' C B 16 6.903 4.158 -1.963 1.00 0.00 C ATOM 490 O3' C B 16 7.912 4.267 -2.944 1.00 0.00 O ATOM 491 C2' C B 16 7.421 3.579 -0.688 1.00 0.00 C ATOM 492 O2' C B 16 8.682 4.126 -0.366 1.00 0.00 O ATOM 493 C1' C B 16 6.382 4.053 0.303 1.00 0.00 C ATOM 494 N1 C B 16 5.245 3.095 0.316 1.00 0.00 N ATOM 495 C2 C B 16 5.478 1.807 0.785 1.00 0.00 C ATOM 496 O2 C B 16 6.590 1.486 1.198 1.00 0.00 O ATOM 497 N3 C B 16 4.443 0.920 0.773 1.00 0.00 N ATOM 498 C4 C B 16 3.231 1.280 0.329 1.00 0.00 C ATOM 499 N4 C B 16 2.241 0.381 0.349 1.00 0.00 N ATOM 500 C5 C B 16 2.978 2.607 -0.144 1.00 0.00 C ATOM 501 C6 C B 16 4.016 3.469 -0.127 1.00 0.00 C ATOM 0 H5' C B 16 5.570 6.038 -3.456 1.00 0.00 H new ATOM 0 H5'' C B 16 4.474 5.092 -2.468 1.00 0.00 H new ATOM 0 H4' C B 16 7.115 6.296 -1.591 1.00 0.00 H new ATOM 0 H3' C B 16 6.145 3.539 -2.442 1.00 0.00 H new ATOM 0 H2' C B 16 7.561 2.498 -0.717 1.00 0.00 H new ATOM 0 HO2' C B 16 9.084 4.516 -1.170 1.00 0.00 H new ATOM 0 HO3' C B 16 8.225 3.372 -3.193 1.00 0.00 H new ATOM 0 H1' C B 16 6.778 4.118 1.316 1.00 0.00 H new ATOM 0 H41 C B 16 1.312 0.638 0.015 1.00 0.00 H new ATOM 0 H42 C B 16 2.415 -0.561 0.698 1.00 0.00 H new ATOM 0 H5 C B 16 2.002 2.904 -0.498 1.00 0.00 H new ATOM 0 H6 C B 16 3.866 4.481 -0.474 1.00 0.00 H new TER 514 C B 16