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= -0.246 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 G O2' : rot 180:sc= -0.383 USER MOD Single : A 3 A O2' : rot -33:sc= 0.154 USER MOD Single : A 4 U O2' : rot -124:sc= 0.17 USER MOD Single : A 5 G O2' : rot -11:sc= 0.152 USER MOD Single : A 6 U O2' : rot -16:sc= -0.408 USER MOD Single : A 7 C O2' : rot -11:sc= -0.2 USER MOD Single : A 8 C O2' : rot -27:sc= 0.203 USER MOD Single : A 8 C O3' : rot 180:sc= 0.216 USER MOD Single : B 9 G O2' : rot 180:sc= -0.25 USER MOD Single : B 9 G O5' : rot 180:sc= 0 USER MOD Single : B 10 G O2' : rot 180:sc= -0.356 USER MOD Single : B 11 A O2' : rot -26:sc= 0.153 USER MOD Single : B 12 U O2' : rot 180:sc= -0.214 USER MOD Single : B 13 G O2' : rot -9:sc= 0.125 USER MOD Single : B 14 U O2' : rot -15:sc= -0.417 USER MOD Single : B 15 C O2' : rot -10:sc= -0.218 USER MOD Single : B 16 C O2' : rot -28:sc= 0.19 USER MOD Single : B 16 C O3' : rot 180:sc= 0.181 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 5.165 -8.213 6.045 1.00 0.00 O ATOM 2 C5' G A 1 6.525 -8.583 6.104 1.00 0.00 C ATOM 3 C4' G A 1 7.401 -7.444 5.578 1.00 0.00 C ATOM 4 O4' G A 1 7.103 -7.140 4.217 1.00 0.00 O ATOM 5 C3' G A 1 7.185 -6.143 6.323 1.00 0.00 C ATOM 6 O3' G A 1 7.797 -6.137 7.600 1.00 0.00 O ATOM 7 C2' G A 1 7.851 -5.192 5.358 1.00 0.00 C ATOM 8 O2' G A 1 9.254 -5.325 5.445 1.00 0.00 O ATOM 9 C1' G A 1 7.389 -5.747 4.009 1.00 0.00 C ATOM 10 N9 G A 1 6.163 -5.038 3.582 1.00 0.00 N ATOM 11 C8 G A 1 4.862 -5.473 3.599 1.00 0.00 C ATOM 12 N7 G A 1 4.003 -4.593 3.169 1.00 0.00 N ATOM 13 C5 G A 1 4.787 -3.491 2.843 1.00 0.00 C ATOM 14 C6 G A 1 4.406 -2.218 2.325 1.00 0.00 C ATOM 15 O6 G A 1 3.279 -1.813 2.051 1.00 0.00 O ATOM 16 N1 G A 1 5.508 -1.392 2.133 1.00 0.00 N ATOM 17 C2 G A 1 6.814 -1.740 2.407 1.00 0.00 C ATOM 18 N2 G A 1 7.747 -0.813 2.164 1.00 0.00 N ATOM 19 N3 G A 1 7.175 -2.932 2.896 1.00 0.00 N ATOM 20 C4 G A 1 6.112 -3.755 3.089 1.00 0.00 C ATOM 0 H5' G A 1 6.691 -9.483 5.513 1.00 0.00 H new ATOM 0 H5'' G A 1 6.801 -8.821 7.131 1.00 0.00 H new ATOM 0 H4' G A 1 8.421 -7.806 5.709 1.00 0.00 H new ATOM 0 H3' G A 1 6.146 -5.913 6.558 1.00 0.00 H new ATOM 0 H2' G A 1 7.609 -4.144 5.532 1.00 0.00 H new ATOM 0 HO2' G A 1 9.681 -4.707 4.816 1.00 0.00 H new ATOM 0 HO5' G A 1 4.611 -8.948 6.382 1.00 0.00 H new ATOM 0 H1' G A 1 8.148 -5.614 3.238 1.00 0.00 H new ATOM 0 H8 G A 1 4.575 -6.457 3.939 1.00 0.00 H new ATOM 0 H1 G A 1 5.337 -0.458 1.761 1.00 0.00 H new ATOM 0 H21 G A 1 8.729 -1.017 2.349 1.00 0.00 H new ATOM 0 H22 G A 1 7.476 0.098 1.794 1.00 0.00 H new ATOM 33 P G A 2 7.452 -4.981 8.679 1.00 0.00 P ATOM 34 OP1 G A 2 8.206 -5.271 9.919 1.00 0.00 O ATOM 35 OP2 G A 2 5.981 -4.836 8.734 1.00 0.00 O ATOM 36 O5' G A 2 8.062 -3.639 8.026 1.00 0.00 O ATOM 37 C5' G A 2 9.455 -3.417 7.996 1.00 0.00 C ATOM 38 C4' G A 2 9.750 -2.083 7.305 1.00 0.00 C ATOM 39 O4' G A 2 9.229 -2.063 5.973 1.00 0.00 O ATOM 40 C3' G A 2 9.104 -0.899 8.000 1.00 0.00 C ATOM 41 O3' G A 2 9.806 -0.490 9.160 1.00 0.00 O ATOM 42 C2' G A 2 9.192 0.123 6.890 1.00 0.00 C ATOM 43 O2' G A 2 10.525 0.568 6.736 1.00 0.00 O ATOM 44 C1' G A 2 8.809 -0.719 5.680 1.00 0.00 C ATOM 45 N9 G A 2 7.338 -0.670 5.507 1.00 0.00 N ATOM 46 C8 G A 2 6.395 -1.608 5.846 1.00 0.00 C ATOM 47 N7 G A 2 5.171 -1.253 5.574 1.00 0.00 N ATOM 48 C5 G A 2 5.305 0.016 5.023 1.00 0.00 C ATOM 49 C6 G A 2 4.307 0.913 4.543 1.00 0.00 C ATOM 50 O6 G A 2 3.091 0.746 4.499 1.00 0.00 O ATOM 51 N1 G A 2 4.863 2.103 4.089 1.00 0.00 N ATOM 52 C2 G A 2 6.210 2.395 4.086 1.00 0.00 C ATOM 53 N2 G A 2 6.564 3.595 3.613 1.00 0.00 N ATOM 54 N3 G A 2 7.151 1.553 4.528 1.00 0.00 N ATOM 55 C4 G A 2 6.628 0.386 4.983 1.00 0.00 C ATOM 0 H5' G A 2 9.951 -4.230 7.466 1.00 0.00 H new ATOM 0 H5'' G A 2 9.854 -3.408 9.010 1.00 0.00 H new ATOM 0 H4' G A 2 10.836 -1.998 7.329 1.00 0.00 H new ATOM 0 H3' G A 2 8.101 -1.088 8.382 1.00 0.00 H new ATOM 0 H2' G A 2 8.578 1.009 7.054 1.00 0.00 H new ATOM 0 HO2' G A 2 10.568 1.228 6.013 1.00 0.00 H new ATOM 0 H1' G A 2 9.276 -0.357 4.764 1.00 0.00 H new ATOM 0 H8 G A 2 6.645 -2.556 6.298 1.00 0.00 H new ATOM 0 H1 G A 2 4.226 2.814 3.731 1.00 0.00 H new ATOM 0 H21 G A 2 7.548 3.863 3.588 1.00 0.00 H new ATOM 0 H22 G A 2 5.850 4.242 3.278 1.00 0.00 H new ATOM 67 P A A 3 9.107 0.481 10.257 1.00 0.00 P ATOM 68 OP1 A A 3 10.098 0.754 11.322 1.00 0.00 O ATOM 69 OP2 A A 3 7.796 -0.105 10.611 1.00 0.00 O ATOM 70 O5' A A 3 8.838 1.857 9.459 1.00 0.00 O ATOM 71 C5' A A 3 9.906 2.704 9.094 1.00 0.00 C ATOM 72 C4' A A 3 9.374 3.907 8.312 1.00 0.00 C ATOM 73 O4' A A 3 8.631 3.492 7.164 1.00 0.00 O ATOM 74 C3' A A 3 8.418 4.779 9.103 1.00 0.00 C ATOM 75 O3' A A 3 9.091 5.654 9.986 1.00 0.00 O ATOM 76 C2' A A 3 7.740 5.535 7.997 1.00 0.00 C ATOM 77 O2' A A 3 8.603 6.544 7.516 1.00 0.00 O ATOM 78 C1' A A 3 7.587 4.455 6.932 1.00 0.00 C ATOM 79 N9 A A 3 6.260 3.805 7.062 1.00 0.00 N ATOM 80 C8 A A 3 5.952 2.537 7.490 1.00 0.00 C ATOM 81 N7 A A 3 4.681 2.252 7.432 1.00 0.00 N ATOM 82 C5 A A 3 4.100 3.418 6.948 1.00 0.00 C ATOM 83 C6 A A 3 2.768 3.771 6.665 1.00 0.00 C ATOM 84 N6 A A 3 1.737 2.933 6.824 1.00 0.00 N ATOM 85 N1 A A 3 2.535 5.022 6.226 1.00 0.00 N ATOM 86 C2 A A 3 3.561 5.853 6.069 1.00 0.00 C ATOM 87 N3 A A 3 4.852 5.637 6.284 1.00 0.00 N ATOM 88 C4 A A 3 5.053 4.376 6.733 1.00 0.00 C ATOM 0 H5' A A 3 10.626 2.155 8.487 1.00 0.00 H new ATOM 0 H5'' A A 3 10.433 3.043 9.986 1.00 0.00 H new ATOM 0 H4' A A 3 10.272 4.468 8.055 1.00 0.00 H new ATOM 0 H3' A A 3 7.746 4.218 9.753 1.00 0.00 H new ATOM 0 H2' A A 3 6.807 6.017 8.290 1.00 0.00 H new ATOM 0 HO2' A A 3 9.152 6.884 8.253 1.00 0.00 H new ATOM 0 H1' A A 3 7.660 4.877 5.930 1.00 0.00 H new ATOM 0 H8 A A 3 6.696 1.838 7.843 1.00 0.00 H new ATOM 0 H61 A A 3 0.790 3.242 6.603 1.00 0.00 H new ATOM 0 H62 A A 3 1.898 1.986 7.166 1.00 0.00 H new ATOM 0 H2 A A 3 3.308 6.842 5.717 1.00 0.00 H new ATOM 100 P U A 4 8.713 5.694 11.546 1.00 0.00 P ATOM 101 OP1 U A 4 9.692 6.555 12.246 1.00 0.00 O ATOM 102 OP2 U A 4 8.473 4.310 12.010 1.00 0.00 O ATOM 103 O5' U A 4 7.306 6.469 11.482 1.00 0.00 O ATOM 104 C5' U A 4 7.262 7.839 11.138 1.00 0.00 C ATOM 105 C4' U A 4 5.821 8.261 10.852 1.00 0.00 C ATOM 106 O4' U A 4 5.298 7.550 9.732 1.00 0.00 O ATOM 107 C3' U A 4 4.875 7.958 11.996 1.00 0.00 C ATOM 108 O3' U A 4 4.984 8.905 13.046 1.00 0.00 O ATOM 109 C2' U A 4 3.555 8.052 11.268 1.00 0.00 C ATOM 110 O2' U A 4 3.235 9.406 11.044 1.00 0.00 O ATOM 111 C1' U A 4 3.883 7.411 9.919 1.00 0.00 C ATOM 112 N1 U A 4 3.499 5.978 9.924 1.00 0.00 N ATOM 113 C2 U A 4 2.164 5.688 9.697 1.00 0.00 C ATOM 114 O2 U A 4 1.334 6.572 9.502 1.00 0.00 O ATOM 115 N3 U A 4 1.815 4.346 9.699 1.00 0.00 N ATOM 116 C4 U A 4 2.679 3.284 9.918 1.00 0.00 C ATOM 117 O4 U A 4 2.262 2.129 9.910 1.00 0.00 O ATOM 118 C5 U A 4 4.056 3.678 10.135 1.00 0.00 C ATOM 119 C6 U A 4 4.420 4.982 10.129 1.00 0.00 C ATOM 0 H5' U A 4 7.884 8.022 10.262 1.00 0.00 H new ATOM 0 H5'' U A 4 7.671 8.440 11.950 1.00 0.00 H new ATOM 0 H4' U A 4 5.874 9.336 10.679 1.00 0.00 H new ATOM 0 H3' U A 4 5.051 7.009 12.503 1.00 0.00 H new ATOM 0 H2' U A 4 2.727 7.591 11.806 1.00 0.00 H new ATOM 0 HO2' U A 4 2.352 9.601 11.423 1.00 0.00 H new ATOM 0 H1' U A 4 3.333 7.893 9.110 1.00 0.00 H new ATOM 0 H3 U A 4 0.836 4.120 9.524 1.00 0.00 H new ATOM 0 H5 U A 4 4.805 2.919 10.304 1.00 0.00 H new ATOM 0 H6 U A 4 5.456 5.243 10.289 1.00 0.00 H new ATOM 130 P G A 5 4.234 8.668 14.457 1.00 0.00 P ATOM 131 OP1 G A 5 4.669 9.729 15.393 1.00 0.00 O ATOM 132 OP2 G A 5 4.404 7.246 14.829 1.00 0.00 O ATOM 133 O5' G A 5 2.680 8.914 14.113 1.00 0.00 O ATOM 134 C5' G A 5 2.146 10.222 14.034 1.00 0.00 C ATOM 135 C4' G A 5 0.661 10.133 13.681 1.00 0.00 C ATOM 136 O4' G A 5 0.461 9.404 12.474 1.00 0.00 O ATOM 137 C3' G A 5 -0.120 9.368 14.727 1.00 0.00 C ATOM 138 O3' G A 5 -0.406 10.158 15.870 1.00 0.00 O ATOM 139 C2' G A 5 -1.367 9.030 13.949 1.00 0.00 C ATOM 140 O2' G A 5 -2.262 10.123 13.975 1.00 0.00 O ATOM 141 C1' G A 5 -0.856 8.839 12.526 1.00 0.00 C ATOM 142 N9 G A 5 -0.830 7.398 12.213 1.00 0.00 N ATOM 143 C8 G A 5 0.213 6.519 12.293 1.00 0.00 C ATOM 144 N7 G A 5 -0.102 5.290 11.986 1.00 0.00 N ATOM 145 C5 G A 5 -1.459 5.359 11.685 1.00 0.00 C ATOM 146 C6 G A 5 -2.370 4.331 11.292 1.00 0.00 C ATOM 147 O6 G A 5 -2.150 3.135 11.111 1.00 0.00 O ATOM 148 N1 G A 5 -3.650 4.831 11.110 1.00 0.00 N ATOM 149 C2 G A 5 -4.022 6.144 11.274 1.00 0.00 C ATOM 150 N2 G A 5 -5.308 6.433 11.048 1.00 0.00 N ATOM 151 N3 G A 5 -3.176 7.111 11.639 1.00 0.00 N ATOM 152 C4 G A 5 -1.914 6.648 11.827 1.00 0.00 C ATOM 0 H5' G A 5 2.678 10.801 13.279 1.00 0.00 H new ATOM 0 H5'' G A 5 2.277 10.740 14.984 1.00 0.00 H new ATOM 0 H4' G A 5 0.322 11.166 13.601 1.00 0.00 H new ATOM 0 H3' G A 5 0.406 8.507 15.139 1.00 0.00 H new ATOM 0 H2' G A 5 -1.893 8.162 14.346 1.00 0.00 H new ATOM 0 HO2' G A 5 -1.954 10.782 14.632 1.00 0.00 H new ATOM 0 H1' G A 5 -1.498 9.328 11.794 1.00 0.00 H new ATOM 0 H8 G A 5 1.210 6.815 12.584 1.00 0.00 H new ATOM 0 H1 G A 5 -4.375 4.170 10.831 1.00 0.00 H new ATOM 0 H21 G A 5 -5.642 7.391 11.154 1.00 0.00 H new ATOM 0 H22 G A 5 -5.955 5.695 10.769 1.00 0.00 H new ATOM 164 P U A 6 -0.910 9.476 17.249 1.00 0.00 P ATOM 165 OP1 U A 6 -1.059 10.547 18.260 1.00 0.00 O ATOM 166 OP2 U A 6 -0.027 8.324 17.531 1.00 0.00 O ATOM 167 O5' U A 6 -2.383 8.901 16.911 1.00 0.00 O ATOM 168 C5' U A 6 -3.523 9.739 16.928 1.00 0.00 C ATOM 169 C4' U A 6 -4.791 8.901 16.685 1.00 0.00 C ATOM 170 O4' U A 6 -4.804 8.316 15.376 1.00 0.00 O ATOM 171 C3' U A 6 -4.911 7.727 17.645 1.00 0.00 C ATOM 172 O3' U A 6 -5.381 8.090 18.927 1.00 0.00 O ATOM 173 C2' U A 6 -5.928 6.903 16.904 1.00 0.00 C ATOM 174 O2' U A 6 -7.200 7.506 17.014 1.00 0.00 O ATOM 175 C1' U A 6 -5.459 7.034 15.470 1.00 0.00 C ATOM 176 N1 U A 6 -4.505 5.948 15.129 1.00 0.00 N ATOM 177 C2 U A 6 -5.024 4.785 14.576 1.00 0.00 C ATOM 178 O2 U A 6 -6.231 4.613 14.420 1.00 0.00 O ATOM 179 N3 U A 6 -4.102 3.821 14.207 1.00 0.00 N ATOM 180 C4 U A 6 -2.727 3.915 14.340 1.00 0.00 C ATOM 181 O4 U A 6 -2.002 2.985 13.997 1.00 0.00 O ATOM 182 C5 U A 6 -2.274 5.166 14.904 1.00 0.00 C ATOM 183 C6 U A 6 -3.158 6.118 15.280 1.00 0.00 C ATOM 0 H5' U A 6 -3.432 10.508 16.161 1.00 0.00 H new ATOM 0 H5'' U A 6 -3.594 10.252 17.887 1.00 0.00 H new ATOM 0 H4' U A 6 -5.609 9.608 16.823 1.00 0.00 H new ATOM 0 H3' U A 6 -3.963 7.237 17.866 1.00 0.00 H new ATOM 0 H2' U A 6 -6.010 5.879 17.267 1.00 0.00 H new ATOM 0 HO2' U A 6 -7.191 8.157 17.746 1.00 0.00 H new ATOM 0 H1' U A 6 -6.296 6.959 14.776 1.00 0.00 H new ATOM 0 H3 U A 6 -4.470 2.961 13.799 1.00 0.00 H new ATOM 0 H5 U A 6 -1.216 5.343 15.027 1.00 0.00 H new ATOM 0 H6 U A 6 -2.789 7.037 15.711 1.00 0.00 H new ATOM 194 P C A 7 -5.292 7.044 20.160 1.00 0.00 P ATOM 195 OP1 C A 7 -5.972 7.649 21.326 1.00 0.00 O ATOM 196 OP2 C A 7 -3.884 6.607 20.280 1.00 0.00 O ATOM 197 O5' C A 7 -6.167 5.772 19.671 1.00 0.00 O ATOM 198 C5' C A 7 -7.580 5.806 19.687 1.00 0.00 C ATOM 199 C4' C A 7 -8.143 4.455 19.222 1.00 0.00 C ATOM 200 O4' C A 7 -7.733 4.126 17.891 1.00 0.00 O ATOM 201 C3' C A 7 -7.652 3.304 20.074 1.00 0.00 C ATOM 202 O3' C A 7 -8.319 3.233 21.320 1.00 0.00 O ATOM 203 C2' C A 7 -8.001 2.139 19.176 1.00 0.00 C ATOM 204 O2' C A 7 -9.388 1.879 19.247 1.00 0.00 O ATOM 205 C1' C A 7 -7.679 2.687 17.785 1.00 0.00 C ATOM 206 N1 C A 7 -6.327 2.230 17.358 1.00 0.00 N ATOM 207 C2 C A 7 -6.200 0.903 16.957 1.00 0.00 C ATOM 208 O2 C A 7 -7.179 0.161 16.946 1.00 0.00 O ATOM 209 N3 C A 7 -4.969 0.456 16.580 1.00 0.00 N ATOM 210 C4 C A 7 -3.906 1.271 16.600 1.00 0.00 C ATOM 211 N4 C A 7 -2.717 0.793 16.219 1.00 0.00 N ATOM 212 C5 C A 7 -4.021 2.638 17.007 1.00 0.00 C ATOM 213 C6 C A 7 -5.247 3.071 17.369 1.00 0.00 C ATOM 0 H5' C A 7 -7.940 6.603 19.036 1.00 0.00 H new ATOM 0 H5'' C A 7 -7.935 6.031 20.693 1.00 0.00 H new ATOM 0 H4' C A 7 -9.224 4.577 19.293 1.00 0.00 H new ATOM 0 H3' C A 7 -6.601 3.366 20.357 1.00 0.00 H new ATOM 0 H2' C A 7 -7.475 1.220 19.434 1.00 0.00 H new ATOM 0 HO2' C A 7 -9.778 2.383 19.991 1.00 0.00 H new ATOM 0 H1' C A 7 -8.388 2.331 17.037 1.00 0.00 H new ATOM 0 H41 C A 7 -1.897 1.399 16.228 1.00 0.00 H new ATOM 0 H42 C A 7 -2.630 -0.178 15.919 1.00 0.00 H new ATOM 0 H5 C A 7 -3.164 3.295 17.024 1.00 0.00 H new ATOM 0 H6 C A 7 -5.378 4.099 17.673 1.00 0.00 H new ATOM 225 P C A 8 -7.745 2.305 22.512 1.00 0.00 P ATOM 226 OP1 C A 8 -8.660 2.423 23.669 1.00 0.00 O ATOM 227 OP2 C A 8 -6.309 2.618 22.679 1.00 0.00 O ATOM 228 O5' C A 8 -7.861 0.806 21.934 1.00 0.00 O ATOM 229 C5' C A 8 -9.101 0.129 21.899 1.00 0.00 C ATOM 230 C4' C A 8 -8.884 -1.288 21.362 1.00 0.00 C ATOM 231 O4' C A 8 -8.365 -1.272 20.037 1.00 0.00 O ATOM 232 C3' C A 8 -7.856 -2.049 22.174 1.00 0.00 C ATOM 233 O3' C A 8 -8.390 -2.559 23.376 1.00 0.00 O ATOM 234 C2' C A 8 -7.506 -3.159 21.216 1.00 0.00 C ATOM 235 O2' C A 8 -8.483 -4.176 21.295 1.00 0.00 O ATOM 236 C1' C A 8 -7.598 -2.472 19.852 1.00 0.00 C ATOM 237 N1 C A 8 -6.226 -2.144 19.403 1.00 0.00 N ATOM 238 C2 C A 8 -5.503 -3.147 18.764 1.00 0.00 C ATOM 239 O2 C A 8 -6.027 -4.231 18.518 1.00 0.00 O ATOM 240 N3 C A 8 -4.207 -2.893 18.429 1.00 0.00 N ATOM 241 C4 C A 8 -3.640 -1.715 18.721 1.00 0.00 C ATOM 242 N4 C A 8 -2.367 -1.505 18.373 1.00 0.00 N ATOM 243 C5 C A 8 -4.368 -0.687 19.403 1.00 0.00 C ATOM 244 C6 C A 8 -5.651 -0.947 19.717 1.00 0.00 C ATOM 0 H5' C A 8 -9.805 0.667 21.265 1.00 0.00 H new ATOM 0 H5'' C A 8 -9.536 0.090 22.898 1.00 0.00 H new ATOM 0 H4' C A 8 -9.865 -1.761 21.410 1.00 0.00 H new ATOM 0 H3' C A 8 -7.013 -1.440 22.500 1.00 0.00 H new ATOM 0 H2' C A 8 -6.537 -3.617 21.413 1.00 0.00 H new ATOM 0 HO2' C A 8 -8.893 -4.167 22.185 1.00 0.00 H new ATOM 0 HO3' C A 8 -7.692 -3.043 23.865 1.00 0.00 H new ATOM 0 H1' C A 8 -8.071 -3.107 19.103 1.00 0.00 H new ATOM 0 H41 C A 8 -1.920 -0.614 18.588 1.00 0.00 H new ATOM 0 H42 C A 8 -1.842 -2.236 17.893 1.00 0.00 H new ATOM 0 H5 C A 8 -3.907 0.257 19.655 1.00 0.00 H new ATOM 0 H6 C A 8 -6.235 -0.195 20.226 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 2.687 -9.358 13.363 1.00 0.00 O ATOM 259 C5' G B 9 2.056 -10.617 13.292 1.00 0.00 C ATOM 260 C4' G B 9 0.628 -10.519 13.834 1.00 0.00 C ATOM 261 O4' G B 9 0.615 -10.112 15.200 1.00 0.00 O ATOM 262 C3' G B 9 -0.205 -9.482 13.111 1.00 0.00 C ATOM 263 O3' G B 9 -0.631 -9.916 11.832 1.00 0.00 O ATOM 264 C2' G B 9 -1.348 -9.357 14.089 1.00 0.00 C ATOM 265 O2' G B 9 -2.187 -10.489 13.992 1.00 0.00 O ATOM 266 C1' G B 9 -0.615 -9.404 15.431 1.00 0.00 C ATOM 267 N9 G B 9 -0.327 -8.025 15.881 1.00 0.00 N ATOM 268 C8 G B 9 0.862 -7.340 15.864 1.00 0.00 C ATOM 269 N7 G B 9 0.778 -6.121 16.317 1.00 0.00 N ATOM 270 C5 G B 9 -0.564 -5.983 16.660 1.00 0.00 C ATOM 271 C6 G B 9 -1.258 -4.863 17.207 1.00 0.00 C ATOM 272 O6 G B 9 -0.811 -3.756 17.496 1.00 0.00 O ATOM 273 N1 G B 9 -2.605 -5.144 17.407 1.00 0.00 N ATOM 274 C2 G B 9 -3.214 -6.347 17.117 1.00 0.00 C ATOM 275 N2 G B 9 -4.523 -6.435 17.371 1.00 0.00 N ATOM 276 N3 G B 9 -2.566 -7.398 16.602 1.00 0.00 N ATOM 277 C4 G B 9 -1.247 -7.145 16.400 1.00 0.00 C ATOM 0 H5' G B 9 2.622 -11.350 13.867 1.00 0.00 H new ATOM 0 H5'' G B 9 2.039 -10.966 12.260 1.00 0.00 H new ATOM 0 H4' G B 9 0.216 -11.518 13.694 1.00 0.00 H new ATOM 0 H3' G B 9 0.315 -8.552 12.883 1.00 0.00 H new ATOM 0 H2' G B 9 -1.968 -8.474 13.934 1.00 0.00 H new ATOM 0 HO2' G B 9 -2.926 -10.404 14.629 1.00 0.00 H new ATOM 0 HO5' G B 9 3.601 -9.430 13.016 1.00 0.00 H new ATOM 0 H1' G B 9 -1.212 -9.896 16.198 1.00 0.00 H new ATOM 0 H8 G B 9 1.785 -7.773 15.507 1.00 0.00 H new ATOM 0 H1 G B 9 -3.187 -4.404 17.798 1.00 0.00 H new ATOM 0 H21 G B 9 -5.023 -7.302 17.175 1.00 0.00 H new ATOM 0 H22 G B 9 -5.022 -5.635 17.761 1.00 0.00 H new ATOM 290 P G B 10 -1.273 -8.874 10.774 1.00 0.00 P ATOM 291 OP1 G B 10 -1.577 -9.613 9.529 1.00 0.00 O ATOM 292 OP2 G B 10 -0.398 -7.682 10.723 1.00 0.00 O ATOM 293 O5' G B 10 -2.670 -8.438 11.450 1.00 0.00 O ATOM 294 C5' G B 10 -3.770 -9.322 11.477 1.00 0.00 C ATOM 295 C4' G B 10 -4.948 -8.656 12.191 1.00 0.00 C ATOM 296 O4' G B 10 -4.600 -8.280 13.526 1.00 0.00 O ATOM 297 C3' G B 10 -5.394 -7.368 11.525 1.00 0.00 C ATOM 298 O3' G B 10 -6.162 -7.587 10.355 1.00 0.00 O ATOM 299 C2' G B 10 -6.218 -6.788 12.649 1.00 0.00 C ATOM 300 O2' G B 10 -7.426 -7.507 12.788 1.00 0.00 O ATOM 301 C1' G B 10 -5.328 -7.083 13.850 1.00 0.00 C ATOM 302 N9 G B 10 -4.390 -5.952 14.043 1.00 0.00 N ATOM 303 C8 G B 10 -3.064 -5.861 13.704 1.00 0.00 C ATOM 304 N7 G B 10 -2.520 -4.713 13.993 1.00 0.00 N ATOM 305 C5 G B 10 -3.559 -3.982 14.556 1.00 0.00 C ATOM 306 C6 G B 10 -3.571 -2.648 15.056 1.00 0.00 C ATOM 307 O6 G B 10 -2.641 -1.847 15.110 1.00 0.00 O ATOM 308 N1 G B 10 -4.831 -2.284 15.517 1.00 0.00 N ATOM 309 C2 G B 10 -5.941 -3.102 15.510 1.00 0.00 C ATOM 310 N2 G B 10 -7.074 -2.581 15.993 1.00 0.00 N ATOM 311 N3 G B 10 -5.933 -4.358 15.048 1.00 0.00 N ATOM 312 C4 G B 10 -4.711 -4.730 14.586 1.00 0.00 C ATOM 0 H5' G B 10 -3.496 -10.244 11.989 1.00 0.00 H new ATOM 0 H5'' G B 10 -4.055 -9.595 10.461 1.00 0.00 H new ATOM 0 H4' G B 10 -5.742 -9.403 12.160 1.00 0.00 H new ATOM 0 H3' G B 10 -4.584 -6.736 11.160 1.00 0.00 H new ATOM 0 H2' G B 10 -6.483 -5.740 12.512 1.00 0.00 H new ATOM 0 HO2' G B 10 -7.952 -7.124 13.521 1.00 0.00 H new ATOM 0 H1' G B 10 -5.904 -7.212 14.766 1.00 0.00 H new ATOM 0 H8 G B 10 -2.519 -6.669 13.239 1.00 0.00 H new ATOM 0 H1 G B 10 -4.943 -1.341 15.888 1.00 0.00 H new ATOM 0 H21 G B 10 -7.926 -3.142 16.012 1.00 0.00 H new ATOM 0 H22 G B 10 -7.086 -1.623 16.343 1.00 0.00 H new ATOM 324 P A B 11 -6.423 -6.387 9.295 1.00 0.00 P ATOM 325 OP1 A B 11 -7.275 -6.916 8.207 1.00 0.00 O ATOM 326 OP2 A B 11 -5.115 -5.777 8.969 1.00 0.00 O ATOM 327 O5' A B 11 -7.284 -5.302 10.123 1.00 0.00 O ATOM 328 C5' A B 11 -8.625 -5.561 10.477 1.00 0.00 C ATOM 329 C4' A B 11 -9.188 -4.387 11.284 1.00 0.00 C ATOM 330 O4' A B 11 -8.393 -4.124 12.444 1.00 0.00 O ATOM 331 C3' A B 11 -9.217 -3.077 10.521 1.00 0.00 C ATOM 332 O3' A B 11 -10.320 -2.990 9.643 1.00 0.00 O ATOM 333 C2' A B 11 -9.331 -2.085 11.645 1.00 0.00 C ATOM 334 O2' A B 11 -10.656 -2.062 12.136 1.00 0.00 O ATOM 335 C1' A B 11 -8.416 -2.706 12.695 1.00 0.00 C ATOM 336 N9 A B 11 -7.050 -2.145 12.565 1.00 0.00 N ATOM 337 C8 A B 11 -5.899 -2.751 12.124 1.00 0.00 C ATOM 338 N7 A B 11 -4.841 -1.991 12.188 1.00 0.00 N ATOM 339 C5 A B 11 -5.325 -0.790 12.691 1.00 0.00 C ATOM 340 C6 A B 11 -4.703 0.437 12.987 1.00 0.00 C ATOM 341 N6 A B 11 -3.391 0.652 12.827 1.00 0.00 N ATOM 342 N1 A B 11 -5.480 1.437 13.441 1.00 0.00 N ATOM 343 C2 A B 11 -6.783 1.221 13.600 1.00 0.00 C ATOM 344 N3 A B 11 -7.480 0.115 13.373 1.00 0.00 N ATOM 345 C4 A B 11 -6.673 -0.868 12.910 1.00 0.00 C ATOM 0 H5' A B 11 -8.685 -6.478 11.063 1.00 0.00 H new ATOM 0 H5'' A B 11 -9.224 -5.717 9.579 1.00 0.00 H new ATOM 0 H4' A B 11 -10.202 -4.703 11.530 1.00 0.00 H new ATOM 0 H3' A B 11 -8.353 -2.930 9.872 1.00 0.00 H new ATOM 0 H2' A B 11 -9.076 -1.063 11.364 1.00 0.00 H new ATOM 0 HO2' A B 11 -11.272 -2.345 11.428 1.00 0.00 H new ATOM 0 H1' A B 11 -8.774 -2.495 13.703 1.00 0.00 H new ATOM 0 H8 A B 11 -5.872 -3.766 11.757 1.00 0.00 H new ATOM 0 H61 A B 11 -2.991 1.562 13.057 1.00 0.00 H new ATOM 0 H62 A B 11 -2.791 -0.094 12.475 1.00 0.00 H new ATOM 0 H2 A B 11 -7.353 2.063 13.965 1.00 0.00 H new ATOM 357 P U B 12 -10.104 -2.650 8.090 1.00 0.00 P ATOM 358 OP1 U B 12 -11.399 -2.799 7.390 1.00 0.00 O ATOM 359 OP2 U B 12 -8.911 -3.379 7.608 1.00 0.00 O ATOM 360 O5' U B 12 -9.750 -1.084 8.182 1.00 0.00 O ATOM 361 C5' U B 12 -10.744 -0.149 8.553 1.00 0.00 C ATOM 362 C4' U B 12 -10.105 1.208 8.848 1.00 0.00 C ATOM 363 O4' U B 12 -9.223 1.124 9.965 1.00 0.00 O ATOM 364 C3' U B 12 -9.258 1.724 7.704 1.00 0.00 C ATOM 365 O3' U B 12 -10.044 2.284 6.668 1.00 0.00 O ATOM 366 C2' U B 12 -8.436 2.765 8.429 1.00 0.00 C ATOM 367 O2' U B 12 -9.215 3.923 8.647 1.00 0.00 O ATOM 368 C1' U B 12 -8.179 2.091 9.780 1.00 0.00 C ATOM 369 N1 U B 12 -6.854 1.424 9.773 1.00 0.00 N ATOM 370 C2 U B 12 -5.748 2.223 10.016 1.00 0.00 C ATOM 371 O2 U B 12 -5.853 3.427 10.239 1.00 0.00 O ATOM 372 N3 U B 12 -4.514 1.592 9.996 1.00 0.00 N ATOM 373 C4 U B 12 -4.296 0.246 9.746 1.00 0.00 C ATOM 374 O4 U B 12 -3.156 -0.211 9.739 1.00 0.00 O ATOM 375 C5 U B 12 -5.506 -0.517 9.519 1.00 0.00 C ATOM 376 C6 U B 12 -6.722 0.078 9.541 1.00 0.00 C ATOM 0 H5' U B 12 -11.280 -0.506 9.432 1.00 0.00 H new ATOM 0 H5'' U B 12 -11.477 -0.048 7.752 1.00 0.00 H new ATOM 0 H4' U B 12 -10.945 1.878 9.031 1.00 0.00 H new ATOM 0 H3' U B 12 -8.673 0.962 7.188 1.00 0.00 H new ATOM 0 H2' U B 12 -7.537 3.064 7.889 1.00 0.00 H new ATOM 0 HO2' U B 12 -8.678 4.594 9.118 1.00 0.00 H new ATOM 0 H1' U B 12 -8.177 2.821 10.590 1.00 0.00 H new ATOM 0 H3 U B 12 -3.694 2.169 10.182 1.00 0.00 H new ATOM 0 H5 U B 12 -5.437 -1.578 9.329 1.00 0.00 H new ATOM 0 H6 U B 12 -7.606 -0.519 9.373 1.00 0.00 H new ATOM 387 P G B 13 -9.375 2.710 5.263 1.00 0.00 P ATOM 388 OP1 G B 13 -10.456 3.152 4.354 1.00 0.00 O ATOM 389 OP2 G B 13 -8.462 1.624 4.844 1.00 0.00 O ATOM 390 O5' G B 13 -8.482 3.996 5.639 1.00 0.00 O ATOM 391 C5' G B 13 -9.080 5.259 5.859 1.00 0.00 C ATOM 392 C4' G B 13 -7.990 6.282 6.186 1.00 0.00 C ATOM 393 O4' G B 13 -7.272 5.914 7.358 1.00 0.00 O ATOM 394 C3' G B 13 -6.939 6.356 5.098 1.00 0.00 C ATOM 395 O3' G B 13 -7.365 7.121 3.982 1.00 0.00 O ATOM 396 C2' G B 13 -5.815 7.029 5.846 1.00 0.00 C ATOM 397 O2' G B 13 -6.009 8.428 5.849 1.00 0.00 O ATOM 398 C1' G B 13 -5.970 6.502 7.268 1.00 0.00 C ATOM 399 N9 G B 13 -4.921 5.501 7.530 1.00 0.00 N ATOM 400 C8 G B 13 -4.988 4.140 7.433 1.00 0.00 C ATOM 401 N7 G B 13 -3.865 3.531 7.705 1.00 0.00 N ATOM 402 C5 G B 13 -2.986 4.569 7.998 1.00 0.00 C ATOM 403 C6 G B 13 -1.605 4.534 8.361 1.00 0.00 C ATOM 404 O6 G B 13 -0.873 3.558 8.520 1.00 0.00 O ATOM 405 N1 G B 13 -1.096 5.810 8.539 1.00 0.00 N ATOM 406 C2 G B 13 -1.809 6.978 8.406 1.00 0.00 C ATOM 407 N2 G B 13 -1.141 8.115 8.629 1.00 0.00 N ATOM 408 N3 G B 13 -3.103 7.019 8.075 1.00 0.00 N ATOM 409 C4 G B 13 -3.625 5.781 7.885 1.00 0.00 C ATOM 0 H5' G B 13 -9.796 5.198 6.679 1.00 0.00 H new ATOM 0 H5'' G B 13 -9.635 5.571 4.974 1.00 0.00 H new ATOM 0 H4' G B 13 -8.515 7.230 6.303 1.00 0.00 H new ATOM 0 H3' G B 13 -6.683 5.392 4.658 1.00 0.00 H new ATOM 0 H2' G B 13 -4.836 6.831 5.409 1.00 0.00 H new ATOM 0 HO2' G B 13 -6.747 8.657 5.246 1.00 0.00 H new ATOM 0 H1' G B 13 -5.868 7.297 8.007 1.00 0.00 H new ATOM 0 H8 G B 13 -5.890 3.614 7.156 1.00 0.00 H new ATOM 0 H1 G B 13 -0.110 5.890 8.790 1.00 0.00 H new ATOM 0 H21 G B 13 -1.619 9.012 8.545 1.00 0.00 H new ATOM 0 H22 G B 13 -0.154 8.085 8.883 1.00 0.00 H new ATOM 421 P U B 14 -6.564 7.059 2.576 1.00 0.00 P ATOM 422 OP1 U B 14 -7.286 7.906 1.601 1.00 0.00 O ATOM 423 OP2 U B 14 -6.314 5.635 2.263 1.00 0.00 O ATOM 424 O5' U B 14 -5.137 7.757 2.881 1.00 0.00 O ATOM 425 C5' U B 14 -4.992 9.164 2.882 1.00 0.00 C ATOM 426 C4' U B 14 -3.516 9.542 3.098 1.00 0.00 C ATOM 427 O4' U B 14 -3.041 9.136 4.389 1.00 0.00 O ATOM 428 C3' U B 14 -2.581 8.870 2.103 1.00 0.00 C ATOM 429 O3' U B 14 -2.557 9.497 0.837 1.00 0.00 O ATOM 430 C2' U B 14 -1.269 9.047 2.821 1.00 0.00 C ATOM 431 O2' U B 14 -0.847 10.393 2.728 1.00 0.00 O ATOM 432 C1' U B 14 -1.654 8.763 4.259 1.00 0.00 C ATOM 433 N1 U B 14 -1.480 7.322 4.573 1.00 0.00 N ATOM 434 C2 U B 14 -0.263 6.921 5.107 1.00 0.00 C ATOM 435 O2 U B 14 0.672 7.702 5.270 1.00 0.00 O ATOM 436 N3 U B 14 -0.156 5.584 5.449 1.00 0.00 N ATOM 437 C4 U B 14 -1.144 4.625 5.306 1.00 0.00 C ATOM 438 O4 U B 14 -0.932 3.458 5.624 1.00 0.00 O ATOM 439 C5 U B 14 -2.385 5.133 4.764 1.00 0.00 C ATOM 440 C6 U B 14 -2.508 6.433 4.415 1.00 0.00 C ATOM 0 H5' U B 14 -5.606 9.600 3.669 1.00 0.00 H new ATOM 0 H5'' U B 14 -5.346 9.575 1.937 1.00 0.00 H new ATOM 0 H4' U B 14 -3.501 10.625 2.980 1.00 0.00 H new ATOM 0 H3' U B 14 -2.861 7.844 1.863 1.00 0.00 H new ATOM 0 H2' U B 14 -0.469 8.420 2.428 1.00 0.00 H new ATOM 0 HO2' U B 14 -1.358 10.848 2.027 1.00 0.00 H new ATOM 0 H1' U B 14 -1.024 9.323 4.950 1.00 0.00 H new ATOM 0 H3 U B 14 0.733 5.277 5.843 1.00 0.00 H new ATOM 0 H5 U B 14 -3.224 4.465 4.637 1.00 0.00 H new ATOM 0 H6 U B 14 -3.443 6.779 4.000 1.00 0.00 H new ATOM 451 P C B 15 -1.866 8.761 -0.430 1.00 0.00 P ATOM 452 OP1 C B 15 -1.875 9.705 -1.570 1.00 0.00 O ATOM 453 OP2 C B 15 -2.496 7.431 -0.576 1.00 0.00 O ATOM 454 O5' C B 15 -0.328 8.535 0.024 1.00 0.00 O ATOM 455 C5' C B 15 0.604 9.598 0.008 1.00 0.00 C ATOM 456 C4' C B 15 1.989 9.092 0.438 1.00 0.00 C ATOM 457 O4' C B 15 1.982 8.550 1.764 1.00 0.00 O ATOM 458 C3' C B 15 2.486 7.960 -0.434 1.00 0.00 C ATOM 459 O3' C B 15 2.950 8.409 -1.694 1.00 0.00 O ATOM 460 C2' C B 15 3.608 7.436 0.432 1.00 0.00 C ATOM 461 O2' C B 15 4.720 8.300 0.341 1.00 0.00 O ATOM 462 C1' C B 15 3.019 7.549 1.839 1.00 0.00 C ATOM 463 N1 C B 15 2.470 6.234 2.268 1.00 0.00 N ATOM 464 C2 C B 15 3.385 5.256 2.649 1.00 0.00 C ATOM 465 O2 C B 15 4.590 5.496 2.638 1.00 0.00 O ATOM 466 N3 C B 15 2.909 4.038 3.030 1.00 0.00 N ATOM 467 C4 C B 15 1.594 3.783 3.031 1.00 0.00 C ATOM 468 N4 C B 15 1.168 2.577 3.416 1.00 0.00 N ATOM 469 C5 C B 15 0.641 4.778 2.644 1.00 0.00 C ATOM 470 C6 C B 15 1.124 5.985 2.279 1.00 0.00 C ATOM 0 H5' C B 15 0.274 10.392 0.678 1.00 0.00 H new ATOM 0 H5'' C B 15 0.660 10.028 -0.992 1.00 0.00 H new ATOM 0 H4' C B 15 2.627 9.972 0.361 1.00 0.00 H new ATOM 0 H3' C B 15 1.727 7.224 -0.700 1.00 0.00 H new ATOM 0 H2' C B 15 3.938 6.434 0.158 1.00 0.00 H new ATOM 0 HO2' C B 15 4.571 8.951 -0.377 1.00 0.00 H new ATOM 0 H1' C B 15 3.773 7.832 2.573 1.00 0.00 H new ATOM 0 H41 C B 15 0.170 2.367 3.422 1.00 0.00 H new ATOM 0 H42 C B 15 1.841 1.866 3.703 1.00 0.00 H new ATOM 0 H5 C B 15 -0.419 4.572 2.644 1.00 0.00 H new ATOM 0 H6 C B 15 0.437 6.767 1.991 1.00 0.00 H new ATOM 482 P C B 16 3.242 7.363 -2.889 1.00 0.00 P ATOM 483 OP1 C B 16 3.721 8.125 -4.063 1.00 0.00 O ATOM 484 OP2 C B 16 2.060 6.482 -3.020 1.00 0.00 O ATOM 485 O5' C B 16 4.466 6.470 -2.339 1.00 0.00 O ATOM 486 C5' C B 16 5.789 6.966 -2.336 1.00 0.00 C ATOM 487 C4' C B 16 6.732 5.876 -1.817 1.00 0.00 C ATOM 488 O4' C B 16 6.407 5.495 -0.484 1.00 0.00 O ATOM 489 C3' C B 16 6.622 4.602 -2.628 1.00 0.00 C ATOM 490 O3' C B 16 7.338 4.676 -3.842 1.00 0.00 O ATOM 491 C2' C B 16 7.238 3.602 -1.679 1.00 0.00 C ATOM 492 O2' C B 16 8.646 3.655 -1.774 1.00 0.00 O ATOM 493 C1' C B 16 6.800 4.123 -0.308 1.00 0.00 C ATOM 494 N1 C B 16 5.650 3.312 0.153 1.00 0.00 N ATOM 495 C2 C B 16 5.927 2.115 0.807 1.00 0.00 C ATOM 496 O2 C B 16 7.088 1.795 1.054 1.00 0.00 O ATOM 497 N3 C B 16 4.881 1.313 1.155 1.00 0.00 N ATOM 498 C4 C B 16 3.621 1.663 0.864 1.00 0.00 C ATOM 499 N4 C B 16 2.624 0.850 1.226 1.00 0.00 N ATOM 500 C5 C B 16 3.327 2.881 0.170 1.00 0.00 C ATOM 501 C6 C B 16 4.370 3.668 -0.158 1.00 0.00 C ATOM 0 H5' C B 16 5.857 7.853 -1.706 1.00 0.00 H new ATOM 0 H5'' C B 16 6.080 7.267 -3.342 1.00 0.00 H new ATOM 0 H4' C B 16 7.730 6.309 -1.884 1.00 0.00 H new ATOM 0 H3' C B 16 5.605 4.364 -2.941 1.00 0.00 H new ATOM 0 H2' C B 16 6.938 2.573 -1.877 1.00 0.00 H new ATOM 0 HO2' C B 16 8.902 3.956 -2.671 1.00 0.00 H new ATOM 0 HO3' C B 16 7.240 3.832 -4.331 1.00 0.00 H new ATOM 0 H1' C B 16 7.598 4.054 0.431 1.00 0.00 H new ATOM 0 H41 C B 16 1.659 1.101 1.013 1.00 0.00 H new ATOM 0 H42 C B 16 2.829 -0.021 1.716 1.00 0.00 H new ATOM 0 H5 C B 16 2.313 3.157 -0.080 1.00 0.00 H new ATOM 0 H6 C B 16 4.190 4.598 -0.677 1.00 0.00 H new TER 514 C B 16