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= -0.507 USER MOD Single : A 2 G O2' : rot -19:sc= 0.0854 USER MOD Single : A 3 C O2' : rot -74:sc= 1.16 USER MOD Single : A 4 A O2' : rot -121:sc= 0.217 USER MOD Single : A 5 C O2' : rot -18:sc= 0.103 USER MOD Single : A 6 U O2' : rot 165:sc= 1.22 USER MOD Single : A 7 U O2' : rot -86:sc= 1.32 USER MOD Single : A 8 C O2' : rot 14:sc= 0.238 USER MOD Single : A 9 G O2' : rot -17:sc= 0.173 USER MOD Single : A 10 G O2' : rot -21:sc= 0.0643 USER MOD Single : A 11 U O2' : rot -17:sc= 0.186 USER MOD Single : A 12 G O2' : rot -25:sc= 0.102 USER MOD Single : A 13 C O2' : rot -16:sc= 0.264 USER MOD Single : A 14 C O2' : rot -25:sc= 0.266 USER MOD Single : A 14 C O3' : rot 180:sc= 0.232 USER MOD ----------------------------------------------------------------- ATOM 1 OP3 G A 1 -10.755 -4.640 10.348 1.00 10.00 O ATOM 2 P G A 1 -12.237 -5.158 10.093 1.00 10.00 P ATOM 3 OP1 G A 1 -13.179 -4.082 10.479 1.00 10.00 O ATOM 4 OP2 G A 1 -12.377 -6.500 10.708 1.00 10.00 O ATOM 5 O5' G A 1 -12.281 -5.304 8.508 1.00 10.00 O ATOM 6 C5' G A 1 -12.391 -6.580 7.887 1.00 10.00 C ATOM 7 C4' G A 1 -12.804 -6.429 6.438 1.00 10.00 C ATOM 8 O4' G A 1 -13.546 -5.187 6.261 1.00 10.00 O ATOM 9 C3' G A 1 -11.671 -6.328 5.424 1.00 10.00 C ATOM 10 O3' G A 1 -11.152 -7.615 5.079 1.00 10.00 O ATOM 11 C2' G A 1 -12.402 -5.678 4.257 1.00 10.00 C ATOM 12 O2' G A 1 -13.287 -6.575 3.617 1.00 10.00 O ATOM 13 C1' G A 1 -13.216 -4.627 5.002 1.00 10.00 C ATOM 14 N9 G A 1 -12.493 -3.373 5.184 1.00 10.00 N ATOM 15 C8 G A 1 -11.932 -2.869 6.332 1.00 10.00 C ATOM 16 N7 G A 1 -11.386 -1.695 6.163 1.00 10.00 N ATOM 17 C5 G A 1 -11.593 -1.407 4.821 1.00 10.00 C ATOM 18 C6 G A 1 -11.223 -0.272 4.048 1.00 10.00 C ATOM 19 O6 G A 1 -10.626 0.753 4.415 1.00 10.00 O ATOM 20 N1 G A 1 -11.632 -0.391 2.723 1.00 10.00 N ATOM 21 C2 G A 1 -12.313 -1.471 2.212 1.00 10.00 C ATOM 22 N2 G A 1 -12.632 -1.411 0.911 1.00 10.00 N ATOM 23 N3 G A 1 -12.662 -2.531 2.918 1.00 10.00 N ATOM 24 C4 G A 1 -12.275 -2.433 4.205 1.00 10.00 C ATOM 0 H5' G A 1 -13.123 -7.188 8.419 1.00 10.00 H new ATOM 0 H5'' G A 1 -11.437 -7.104 7.947 1.00 10.00 H new ATOM 0 H4' G A 1 -13.369 -7.341 6.248 1.00 10.00 H new ATOM 0 H3' G A 1 -10.796 -5.779 5.772 1.00 10.00 H new ATOM 0 H2' G A 1 -11.737 -5.315 3.473 1.00 10.00 H new ATOM 0 HO2' G A 1 -13.736 -6.118 2.876 1.00 10.00 H new ATOM 0 H1' G A 1 -14.102 -4.376 4.419 1.00 10.00 H new ATOM 0 H8 G A 1 -11.942 -3.390 7.278 1.00 10.00 H new ATOM 0 H1 G A 1 -11.411 0.376 2.087 1.00 10.00 H new ATOM 0 H21 G A 1 -13.137 -2.182 0.474 1.00 10.00 H new ATOM 0 H22 G A 1 -12.369 -0.595 0.359 1.00 10.00 H new ATOM 37 P G A 2 -9.594 -7.841 4.737 1.00 10.00 P ATOM 38 OP1 G A 2 -9.272 -9.238 5.101 1.00 10.00 O ATOM 39 OP2 G A 2 -8.816 -6.737 5.348 1.00 10.00 O ATOM 40 O5' G A 2 -9.475 -7.716 3.152 1.00 10.00 O ATOM 41 C5' G A 2 -10.565 -8.100 2.323 1.00 10.00 C ATOM 42 C4' G A 2 -10.521 -7.452 0.958 1.00 10.00 C ATOM 43 O4' G A 2 -11.112 -6.135 1.077 1.00 10.00 O ATOM 44 C3' G A 2 -9.161 -7.197 0.319 1.00 10.00 C ATOM 45 O3' G A 2 -8.716 -8.336 -0.407 1.00 10.00 O ATOM 46 C2' G A 2 -9.480 -6.036 -0.615 1.00 10.00 C ATOM 47 O2' G A 2 -10.197 -6.473 -1.753 1.00 10.00 O ATOM 48 C1' G A 2 -10.398 -5.211 0.285 1.00 10.00 C ATOM 49 N9 G A 2 -9.700 -4.311 1.195 1.00 10.00 N ATOM 50 C8 G A 2 -9.505 -4.501 2.540 1.00 10.00 C ATOM 51 N7 G A 2 -8.905 -3.496 3.121 1.00 10.00 N ATOM 52 C5 G A 2 -8.680 -2.591 2.092 1.00 10.00 C ATOM 53 C6 G A 2 -8.060 -1.305 2.104 1.00 10.00 C ATOM 54 O6 G A 2 -7.573 -0.683 3.060 1.00 10.00 O ATOM 55 N1 G A 2 -8.037 -0.730 0.837 1.00 10.00 N ATOM 56 C2 G A 2 -8.552 -1.319 -0.295 1.00 10.00 C ATOM 57 N2 G A 2 -8.406 -0.635 -1.438 1.00 10.00 N ATOM 58 N3 G A 2 -9.130 -2.508 -0.322 1.00 10.00 N ATOM 59 C4 G A 2 -9.164 -3.082 0.897 1.00 10.00 C ATOM 0 H5' G A 2 -11.501 -7.835 2.816 1.00 10.00 H new ATOM 0 H5'' G A 2 -10.562 -9.184 2.206 1.00 10.00 H new ATOM 0 H4' G A 2 -11.031 -8.178 0.324 1.00 10.00 H new ATOM 0 H3' G A 2 -8.363 -6.988 1.031 1.00 10.00 H new ATOM 0 H2' G A 2 -8.603 -5.518 -1.003 1.00 10.00 H new ATOM 0 HO2' G A 2 -10.079 -7.440 -1.862 1.00 10.00 H new ATOM 0 H1' G A 2 -11.018 -4.587 -0.359 1.00 10.00 H new ATOM 0 H8 G A 2 -9.816 -5.392 3.066 1.00 10.00 H new ATOM 0 H1 G A 2 -7.609 0.191 0.741 1.00 10.00 H new ATOM 0 H21 G A 2 -8.767 -1.019 -2.312 1.00 10.00 H new ATOM 0 H22 G A 2 -7.934 0.269 -1.434 1.00 10.00 H new ATOM 71 P C A 3 -7.160 -8.508 -0.754 1.00 10.00 P ATOM 72 OP1 C A 3 -7.023 -9.794 -1.473 1.00 10.00 O ATOM 73 OP2 C A 3 -6.378 -8.277 0.485 1.00 10.00 O ATOM 74 O5' C A 3 -6.857 -7.331 -1.782 1.00 10.00 O ATOM 75 C5' C A 3 -7.054 -7.510 -3.184 1.00 10.00 C ATOM 76 C4' C A 3 -6.656 -6.264 -3.938 1.00 10.00 C ATOM 77 O4' C A 3 -7.080 -5.097 -3.189 1.00 10.00 O ATOM 78 C3' C A 3 -5.160 -6.072 -4.146 1.00 10.00 C ATOM 79 O3' C A 3 -4.745 -6.734 -5.339 1.00 10.00 O ATOM 80 C2' C A 3 -5.022 -4.557 -4.274 1.00 10.00 C ATOM 81 O2' C A 3 -5.204 -4.147 -5.614 1.00 10.00 O ATOM 82 C1' C A 3 -6.182 -4.031 -3.427 1.00 10.00 C ATOM 83 N1 C A 3 -5.765 -3.468 -2.130 1.00 10.00 N ATOM 84 C2 C A 3 -5.329 -2.143 -2.086 1.00 10.00 C ATOM 85 O2 C A 3 -5.230 -1.506 -3.143 1.00 10.00 O ATOM 86 N3 C A 3 -5.016 -1.583 -0.895 1.00 10.00 N ATOM 87 C4 C A 3 -5.124 -2.296 0.227 1.00 10.00 C ATOM 88 N4 C A 3 -4.833 -1.690 1.377 1.00 10.00 N ATOM 89 C5 C A 3 -5.553 -3.655 0.214 1.00 10.00 C ATOM 90 C6 C A 3 -5.857 -4.194 -0.974 1.00 10.00 C ATOM 0 H5' C A 3 -8.100 -7.744 -3.383 1.00 10.00 H new ATOM 0 H5'' C A 3 -6.465 -8.358 -3.534 1.00 10.00 H new ATOM 0 H4' C A 3 -7.129 -6.381 -4.913 1.00 10.00 H new ATOM 0 H3' C A 3 -4.546 -6.483 -3.345 1.00 10.00 H new ATOM 0 H2' C A 3 -4.041 -4.198 -3.962 1.00 10.00 H new ATOM 0 HO2' C A 3 -4.415 -4.392 -6.141 1.00 10.00 H new ATOM 0 H1' C A 3 -6.643 -3.218 -3.988 1.00 10.00 H new ATOM 0 H41 C A 3 -4.904 -2.203 2.256 1.00 10.00 H new ATOM 0 H42 C A 3 -4.539 -0.713 1.379 1.00 10.00 H new ATOM 0 H5 C A 3 -5.630 -4.228 1.126 1.00 10.00 H new ATOM 0 H6 C A 3 -6.181 -5.223 -1.020 1.00 10.00 H new ATOM 102 P A A 4 -3.199 -6.784 -5.770 1.00 10.00 P ATOM 103 OP1 A A 4 -3.064 -7.808 -6.835 1.00 10.00 O ATOM 104 OP2 A A 4 -2.382 -6.898 -4.541 1.00 10.00 O ATOM 105 O5' A A 4 -2.915 -5.356 -6.414 1.00 10.00 O ATOM 106 C5' A A 4 -2.339 -5.241 -7.711 1.00 10.00 C ATOM 107 C4' A A 4 -1.553 -3.955 -7.838 1.00 10.00 C ATOM 108 O4' A A 4 -2.100 -2.949 -6.941 1.00 10.00 O ATOM 109 C3' A A 4 -0.077 -4.028 -7.465 1.00 10.00 C ATOM 110 O3' A A 4 0.694 -4.486 -8.568 1.00 10.00 O ATOM 111 C2' A A 4 0.230 -2.581 -7.122 1.00 10.00 C ATOM 112 O2' A A 4 0.424 -1.808 -8.289 1.00 10.00 O ATOM 113 C1' A A 4 -1.052 -2.152 -6.413 1.00 10.00 C ATOM 114 N9 A A 4 -1.019 -2.330 -4.961 1.00 10.00 N ATOM 115 C8 A A 4 -1.408 -3.433 -4.241 1.00 10.00 C ATOM 116 N7 A A 4 -1.276 -3.296 -2.945 1.00 10.00 N ATOM 117 C5 A A 4 -0.759 -2.018 -2.800 1.00 10.00 C ATOM 118 C6 A A 4 -0.398 -1.276 -1.665 1.00 10.00 C ATOM 119 N6 A A 4 -0.510 -1.735 -0.417 1.00 10.00 N ATOM 120 N1 A A 4 0.087 -0.034 -1.858 1.00 10.00 N ATOM 121 C2 A A 4 0.192 0.429 -3.110 1.00 10.00 C ATOM 122 N3 A A 4 -0.114 -0.173 -4.260 1.00 10.00 N ATOM 123 C4 A A 4 -0.593 -1.410 -4.032 1.00 10.00 C ATOM 0 H5' A A 4 -3.124 -5.268 -8.466 1.00 10.00 H new ATOM 0 H5'' A A 4 -1.685 -6.092 -7.900 1.00 10.00 H new ATOM 0 H4' A A 4 -1.635 -3.723 -8.900 1.00 10.00 H new ATOM 0 H3' A A 4 0.151 -4.720 -6.654 1.00 10.00 H new ATOM 0 H2' A A 4 1.138 -2.456 -6.532 1.00 10.00 H new ATOM 0 HO2' A A 4 1.317 -1.405 -8.270 1.00 10.00 H new ATOM 0 H1' A A 4 -1.189 -1.084 -6.585 1.00 10.00 H new ATOM 0 H8 A A 4 -1.789 -4.332 -4.702 1.00 10.00 H new ATOM 0 H61 A A 4 -0.231 -1.148 0.369 1.00 10.00 H new ATOM 0 H62 A A 4 -0.875 -2.673 -0.249 1.00 10.00 H new ATOM 0 H2 A A 4 0.580 1.433 -3.202 1.00 10.00 H new ATOM 135 P C A 5 2.154 -5.104 -8.329 1.00 10.00 P ATOM 136 OP1 C A 5 2.715 -5.411 -9.665 1.00 10.00 O ATOM 137 OP2 C A 5 2.059 -6.171 -7.305 1.00 10.00 O ATOM 138 O5' C A 5 2.973 -3.891 -7.710 1.00 10.00 O ATOM 139 C5' C A 5 3.726 -3.013 -8.534 1.00 10.00 C ATOM 140 C4' C A 5 3.971 -1.707 -7.819 1.00 10.00 C ATOM 141 O4' C A 5 2.918 -1.498 -6.847 1.00 10.00 O ATOM 142 C3' C A 5 5.245 -1.624 -6.994 1.00 10.00 C ATOM 143 O3' C A 5 6.349 -1.252 -7.814 1.00 10.00 O ATOM 144 C2' C A 5 4.900 -0.534 -5.985 1.00 10.00 C ATOM 145 O2' C A 5 5.004 0.752 -6.562 1.00 10.00 O ATOM 146 C1' C A 5 3.431 -0.853 -5.697 1.00 10.00 C ATOM 147 N1 C A 5 3.239 -1.710 -4.511 1.00 10.00 N ATOM 148 C2 C A 5 3.483 -1.160 -3.245 1.00 10.00 C ATOM 149 O2 C A 5 3.900 0.004 -3.163 1.00 10.00 O ATOM 150 N3 C A 5 3.265 -1.909 -2.139 1.00 10.00 N ATOM 151 C4 C A 5 2.818 -3.162 -2.255 1.00 10.00 C ATOM 152 N4 C A 5 2.622 -3.855 -1.128 1.00 10.00 N ATOM 153 C5 C A 5 2.564 -3.752 -3.528 1.00 10.00 C ATOM 154 C6 C A 5 2.792 -3.002 -4.617 1.00 10.00 C ATOM 0 H5' C A 5 3.192 -2.831 -9.466 1.00 10.00 H new ATOM 0 H5'' C A 5 4.677 -3.476 -8.797 1.00 10.00 H new ATOM 0 H4' C A 5 4.027 -0.978 -8.628 1.00 10.00 H new ATOM 0 H3' C A 5 5.540 -2.564 -6.528 1.00 10.00 H new ATOM 0 H2' C A 5 5.553 -0.521 -5.112 1.00 10.00 H new ATOM 0 HO2' C A 5 5.548 0.702 -7.376 1.00 10.00 H new ATOM 0 H1' C A 5 2.907 0.077 -5.475 1.00 10.00 H new ATOM 0 H41 C A 5 2.281 -4.815 -1.173 1.00 10.00 H new ATOM 0 H42 C A 5 2.813 -3.423 -0.224 1.00 10.00 H new ATOM 0 H5 C A 5 2.201 -4.766 -3.613 1.00 10.00 H new ATOM 0 H6 C A 5 2.620 -3.424 -5.596 1.00 10.00 H new ATOM 166 P U A 6 7.832 -1.758 -7.463 1.00 10.00 P ATOM 167 OP1 U A 6 8.785 -1.042 -8.342 1.00 10.00 O ATOM 168 OP2 U A 6 7.806 -3.239 -7.467 1.00 10.00 O ATOM 169 O5' U A 6 8.066 -1.271 -5.967 1.00 10.00 O ATOM 170 C5' U A 6 8.534 0.043 -5.677 1.00 10.00 C ATOM 171 C4' U A 6 8.843 0.168 -4.204 1.00 10.00 C ATOM 172 O4' U A 6 7.663 -0.167 -3.428 1.00 10.00 O ATOM 173 C3' U A 6 9.903 -0.785 -3.672 1.00 10.00 C ATOM 174 O3' U A 6 11.215 -0.304 -3.949 1.00 10.00 O ATOM 175 C2' U A 6 9.595 -0.781 -2.180 1.00 10.00 C ATOM 176 O2' U A 6 10.096 0.383 -1.554 1.00 10.00 O ATOM 177 C1' U A 6 8.064 -0.731 -2.191 1.00 10.00 C ATOM 178 N1 U A 6 7.420 -2.046 -2.039 1.00 10.00 N ATOM 179 C2 U A 6 7.227 -2.524 -0.757 1.00 10.00 C ATOM 180 O2 U A 6 7.589 -1.920 0.238 1.00 10.00 O ATOM 181 N3 U A 6 6.598 -3.741 -0.675 1.00 10.00 N ATOM 182 C4 U A 6 6.150 -4.514 -1.722 1.00 10.00 C ATOM 183 O4 U A 6 5.591 -5.588 -1.490 1.00 10.00 O ATOM 184 C5 U A 6 6.389 -3.957 -3.016 1.00 10.00 C ATOM 185 C6 U A 6 7.000 -2.774 -3.134 1.00 10.00 C ATOM 0 H5' U A 6 7.781 0.777 -5.963 1.00 10.00 H new ATOM 0 H5'' U A 6 9.427 0.258 -6.264 1.00 10.00 H new ATOM 0 H4' U A 6 9.194 1.195 -4.104 1.00 10.00 H new ATOM 0 H3' U A 6 9.880 -1.779 -4.119 1.00 10.00 H new ATOM 0 H2' U A 6 10.032 -1.623 -1.644 1.00 10.00 H new ATOM 0 HO2' U A 6 9.689 0.479 -0.668 1.00 10.00 H new ATOM 0 H1' U A 6 7.750 -0.137 -1.333 1.00 10.00 H new ATOM 0 H3 U A 6 6.446 -4.113 0.263 1.00 10.00 H new ATOM 0 H5 U A 6 6.076 -4.493 -3.900 1.00 10.00 H new ATOM 0 H6 U A 6 7.171 -2.373 -4.122 1.00 10.00 H new ATOM 196 P U A 7 12.496 -1.253 -3.749 1.00 10.00 P ATOM 197 OP1 U A 7 13.553 -0.794 -4.681 1.00 10.00 O ATOM 198 OP2 U A 7 12.032 -2.662 -3.817 1.00 10.00 O ATOM 199 O5' U A 7 12.981 -0.959 -2.261 1.00 10.00 O ATOM 200 C5' U A 7 14.304 -1.300 -1.839 1.00 10.00 C ATOM 201 C4' U A 7 14.805 -0.301 -0.825 1.00 10.00 C ATOM 202 O4' U A 7 14.826 1.011 -1.452 1.00 10.00 O ATOM 203 C3' U A 7 13.946 -0.164 0.435 1.00 10.00 C ATOM 204 O3' U A 7 14.740 -0.208 1.618 1.00 10.00 O ATOM 205 C2' U A 7 13.251 1.186 0.286 1.00 10.00 C ATOM 206 O2' U A 7 13.129 1.866 1.518 1.00 10.00 O ATOM 207 C1' U A 7 14.243 1.950 -0.582 1.00 10.00 C ATOM 208 N1 U A 7 13.619 3.017 -1.375 1.00 10.00 N ATOM 209 C2 U A 7 13.993 4.326 -1.127 1.00 10.00 C ATOM 210 O2 U A 7 14.827 4.638 -0.294 1.00 10.00 O ATOM 211 N3 U A 7 13.351 5.268 -1.894 1.00 10.00 N ATOM 212 C4 U A 7 12.395 5.042 -2.862 1.00 10.00 C ATOM 213 O4 U A 7 11.904 6.001 -3.465 1.00 10.00 O ATOM 214 C5 U A 7 12.064 3.667 -3.060 1.00 10.00 C ATOM 215 C6 U A 7 12.666 2.722 -2.329 1.00 10.00 C ATOM 0 H5' U A 7 14.973 -1.322 -2.699 1.00 10.00 H new ATOM 0 H5'' U A 7 14.308 -2.301 -1.407 1.00 10.00 H new ATOM 0 H4' U A 7 15.783 -0.668 -0.513 1.00 10.00 H new ATOM 0 H3' U A 7 13.235 -0.984 0.532 1.00 10.00 H new ATOM 0 H2' U A 7 12.240 1.089 -0.110 1.00 10.00 H new ATOM 0 HO2' U A 7 12.317 1.566 1.978 1.00 10.00 H new ATOM 0 H1' U A 7 14.971 2.437 0.066 1.00 10.00 H new ATOM 0 H3 U A 7 13.610 6.241 -1.729 1.00 10.00 H new ATOM 0 H5 U A 7 11.328 3.390 -3.800 1.00 10.00 H new ATOM 0 H6 U A 7 12.396 1.689 -2.491 1.00 10.00 H new ATOM 226 P C A 8 15.075 -1.624 2.299 1.00 10.00 P ATOM 227 OP1 C A 8 15.918 -1.381 3.497 1.00 10.00 O ATOM 228 OP2 C A 8 15.586 -2.517 1.230 1.00 10.00 O ATOM 229 O5' C A 8 13.665 -2.186 2.780 1.00 10.00 O ATOM 230 C5' C A 8 13.165 -1.923 4.089 1.00 10.00 C ATOM 231 C4' C A 8 11.974 -2.807 4.376 1.00 10.00 C ATOM 232 O4' C A 8 11.137 -2.862 3.188 1.00 10.00 O ATOM 233 C3' C A 8 12.295 -4.262 4.716 1.00 10.00 C ATOM 234 O3' C A 8 11.415 -4.771 5.714 1.00 10.00 O ATOM 235 C2' C A 8 12.073 -4.995 3.400 1.00 10.00 C ATOM 236 O2' C A 8 11.691 -6.339 3.616 1.00 10.00 O ATOM 237 C1' C A 8 10.882 -4.211 2.862 1.00 10.00 C ATOM 238 N1 C A 8 10.715 -4.319 1.404 1.00 10.00 N ATOM 239 C2 C A 8 9.670 -5.081 0.875 1.00 10.00 C ATOM 240 O2 C A 8 8.883 -5.647 1.642 1.00 10.00 O ATOM 241 N3 C A 8 9.539 -5.170 -0.472 1.00 10.00 N ATOM 242 C4 C A 8 10.404 -4.534 -1.266 1.00 10.00 C ATOM 243 N4 C A 8 10.230 -4.602 -2.579 1.00 10.00 N ATOM 244 C5 C A 8 11.472 -3.764 -0.751 1.00 10.00 C ATOM 245 C6 C A 8 11.590 -3.678 0.574 1.00 10.00 C ATOM 0 H5' C A 8 12.879 -0.875 4.174 1.00 10.00 H new ATOM 0 H5'' C A 8 13.946 -2.101 4.828 1.00 10.00 H new ATOM 0 H4' C A 8 11.503 -2.356 5.250 1.00 10.00 H new ATOM 0 H3' C A 8 13.302 -4.379 5.116 1.00 10.00 H new ATOM 0 H2' C A 8 12.951 -5.039 2.756 1.00 10.00 H new ATOM 0 HO2' C A 8 11.429 -6.458 4.553 1.00 10.00 H new ATOM 0 H1' C A 8 9.967 -4.608 3.301 1.00 10.00 H new ATOM 0 H41 C A 8 10.878 -4.124 -3.205 1.00 10.00 H new ATOM 0 H42 C A 8 9.448 -5.132 -2.963 1.00 10.00 H new ATOM 0 H5 C A 8 12.168 -3.263 -1.408 1.00 10.00 H new ATOM 0 H6 C A 8 12.391 -3.091 0.998 1.00 10.00 H new ATOM 257 P G A 9 11.814 -4.730 7.268 1.00 10.00 P ATOM 258 OP1 G A 9 13.264 -5.013 7.399 1.00 10.00 O ATOM 259 OP2 G A 9 10.835 -5.583 7.985 1.00 10.00 O ATOM 260 O5' G A 9 11.558 -3.221 7.707 1.00 10.00 O ATOM 261 C5' G A 9 10.259 -2.776 8.091 1.00 10.00 C ATOM 262 C4' G A 9 10.256 -1.270 8.212 1.00 10.00 C ATOM 263 O4' G A 9 11.158 -0.722 7.223 1.00 10.00 O ATOM 264 C3' G A 9 8.940 -0.563 7.926 1.00 10.00 C ATOM 265 O3' G A 9 8.075 -0.572 9.053 1.00 10.00 O ATOM 266 C2' G A 9 9.412 0.851 7.619 1.00 10.00 C ATOM 267 O2' G A 9 9.627 1.588 8.807 1.00 10.00 O ATOM 268 C1' G A 9 10.750 0.594 6.926 1.00 10.00 C ATOM 269 N9 G A 9 10.708 0.760 5.478 1.00 10.00 N ATOM 270 C8 G A 9 11.451 1.668 4.776 1.00 10.00 C ATOM 271 N7 G A 9 11.276 1.598 3.486 1.00 10.00 N ATOM 272 C5 G A 9 10.352 0.576 3.323 1.00 10.00 C ATOM 273 C6 G A 9 9.781 0.046 2.144 1.00 10.00 C ATOM 274 O6 G A 9 9.993 0.384 0.972 1.00 10.00 O ATOM 275 N1 G A 9 8.891 -0.987 2.408 1.00 10.00 N ATOM 276 C2 G A 9 8.586 -1.443 3.670 1.00 10.00 C ATOM 277 N2 G A 9 7.697 -2.444 3.743 1.00 10.00 N ATOM 278 N3 G A 9 9.112 -0.955 4.786 1.00 10.00 N ATOM 279 C4 G A 9 9.985 0.045 4.543 1.00 10.00 C ATOM 0 H5' G A 9 9.975 -3.228 9.041 1.00 10.00 H new ATOM 0 H5'' G A 9 9.522 -3.093 7.354 1.00 10.00 H new ATOM 0 H4' G A 9 10.519 -1.102 9.256 1.00 10.00 H new ATOM 0 H3' G A 9 8.361 -1.031 7.130 1.00 10.00 H new ATOM 0 H2' G A 9 8.696 1.426 7.032 1.00 10.00 H new ATOM 0 HO2' G A 9 9.174 1.144 9.554 1.00 10.00 H new ATOM 0 H1' G A 9 11.452 1.338 7.302 1.00 10.00 H new ATOM 0 H8 G A 9 12.119 2.375 5.245 1.00 10.00 H new ATOM 0 H1 G A 9 8.434 -1.437 1.615 1.00 10.00 H new ATOM 0 H21 G A 9 7.431 -2.824 4.651 1.00 10.00 H new ATOM 0 H22 G A 9 7.287 -2.825 2.890 1.00 10.00 H new ATOM 291 P G A 10 6.482 -0.538 8.845 1.00 10.00 P ATOM 292 OP1 G A 10 5.878 0.096 10.042 1.00 10.00 O ATOM 293 OP2 G A 10 6.068 -1.912 8.470 1.00 10.00 O ATOM 294 O5' G A 10 6.248 0.430 7.599 1.00 10.00 O ATOM 295 C5' G A 10 6.138 1.841 7.781 1.00 10.00 C ATOM 296 C4' G A 10 6.334 2.614 6.495 1.00 10.00 C ATOM 297 O4' G A 10 6.948 1.746 5.503 1.00 10.00 O ATOM 298 C3' G A 10 5.080 3.122 5.791 1.00 10.00 C ATOM 299 O3' G A 10 4.674 4.372 6.343 1.00 10.00 O ATOM 300 C2' G A 10 5.584 3.281 4.363 1.00 10.00 C ATOM 301 O2' G A 10 6.471 4.377 4.253 1.00 10.00 O ATOM 302 C1' G A 10 6.360 1.976 4.234 1.00 10.00 C ATOM 303 N9 G A 10 5.508 0.839 3.902 1.00 10.00 N ATOM 304 C8 G A 10 4.971 -0.062 4.781 1.00 10.00 C ATOM 305 N7 G A 10 4.284 -1.006 4.194 1.00 10.00 N ATOM 306 C5 G A 10 4.368 -0.697 2.840 1.00 10.00 C ATOM 307 C6 G A 10 3.822 -1.358 1.702 1.00 10.00 C ATOM 308 O6 G A 10 3.132 -2.389 1.660 1.00 10.00 O ATOM 309 N1 G A 10 4.148 -0.706 0.515 1.00 10.00 N ATOM 310 C2 G A 10 4.906 0.438 0.440 1.00 10.00 C ATOM 311 N2 G A 10 5.113 0.932 -0.790 1.00 10.00 N ATOM 312 N3 G A 10 5.420 1.065 1.488 1.00 10.00 N ATOM 313 C4 G A 10 5.116 0.444 2.647 1.00 10.00 C ATOM 0 H5' G A 10 6.877 2.167 8.512 1.00 10.00 H new ATOM 0 H5'' G A 10 5.157 2.074 8.194 1.00 10.00 H new ATOM 0 H4' G A 10 6.921 3.473 6.821 1.00 10.00 H new ATOM 0 H3' G A 10 4.209 2.472 5.880 1.00 10.00 H new ATOM 0 H2' G A 10 4.809 3.460 3.617 1.00 10.00 H new ATOM 0 HO2' G A 10 6.323 4.994 5.000 1.00 10.00 H new ATOM 0 H1' G A 10 7.087 2.067 3.427 1.00 10.00 H new ATOM 0 H8 G A 10 5.102 0.001 5.851 1.00 10.00 H new ATOM 0 H1 G A 10 3.801 -1.104 -0.357 1.00 10.00 H new ATOM 0 H21 G A 10 5.668 1.779 -0.913 1.00 10.00 H new ATOM 0 H22 G A 10 4.716 0.460 -1.602 1.00 10.00 H new ATOM 325 P U A 11 3.227 4.984 6.004 1.00 10.00 P ATOM 326 OP1 U A 11 3.163 6.358 6.556 1.00 10.00 O ATOM 327 OP2 U A 11 2.212 3.984 6.416 1.00 10.00 O ATOM 328 O5' U A 11 3.203 5.091 4.417 1.00 10.00 O ATOM 329 C5' U A 11 3.722 6.232 3.740 1.00 10.00 C ATOM 330 C4' U A 11 3.421 6.135 2.260 1.00 10.00 C ATOM 331 O4' U A 11 3.646 4.774 1.805 1.00 10.00 O ATOM 332 C3' U A 11 1.980 6.428 1.873 1.00 10.00 C ATOM 333 O3' U A 11 1.784 7.827 1.688 1.00 10.00 O ATOM 334 C2' U A 11 1.805 5.662 0.567 1.00 10.00 C ATOM 335 O2' U A 11 2.260 6.431 -0.526 1.00 10.00 O ATOM 336 C1' U A 11 2.731 4.458 0.769 1.00 10.00 C ATOM 337 N1 U A 11 2.028 3.216 1.119 1.00 10.00 N ATOM 338 C2 U A 11 1.504 2.466 0.083 1.00 10.00 C ATOM 339 O2 U A 11 1.559 2.821 -1.083 1.00 10.00 O ATOM 340 N3 U A 11 0.901 1.294 0.460 1.00 10.00 N ATOM 341 C4 U A 11 0.774 0.798 1.739 1.00 10.00 C ATOM 342 O4 U A 11 0.205 -0.279 1.921 1.00 10.00 O ATOM 343 C5 U A 11 1.338 1.629 2.752 1.00 10.00 C ATOM 344 C6 U A 11 1.925 2.782 2.424 1.00 10.00 C ATOM 0 H5' U A 11 4.798 6.300 3.897 1.00 10.00 H new ATOM 0 H5'' U A 11 3.282 7.141 4.151 1.00 10.00 H new ATOM 0 H4' U A 11 4.074 6.883 1.809 1.00 10.00 H new ATOM 0 H3' U A 11 1.258 6.130 2.633 1.00 10.00 H new ATOM 0 H2' U A 11 0.768 5.402 0.353 1.00 10.00 H new ATOM 0 HO2' U A 11 2.334 7.370 -0.257 1.00 10.00 H new ATOM 0 H1' U A 11 3.228 4.272 -0.183 1.00 10.00 H new ATOM 0 H3 U A 11 0.503 0.727 -0.289 1.00 10.00 H new ATOM 0 H5 U A 11 1.290 1.324 3.787 1.00 10.00 H new ATOM 0 H6 U A 11 2.335 3.398 3.210 1.00 10.00 H new ATOM 355 P G A 12 0.368 8.492 2.043 1.00 10.00 P ATOM 356 OP1 G A 12 0.489 9.960 1.853 1.00 10.00 O ATOM 357 OP2 G A 12 -0.053 7.961 3.363 1.00 10.00 O ATOM 358 O5' G A 12 -0.603 7.910 0.926 1.00 10.00 O ATOM 359 C5' G A 12 -1.049 8.740 -0.139 1.00 10.00 C ATOM 360 C4' G A 12 -1.658 7.920 -1.249 1.00 10.00 C ATOM 361 O4' G A 12 -1.096 6.581 -1.251 1.00 10.00 O ATOM 362 C3' G A 12 -3.154 7.681 -1.130 1.00 10.00 C ATOM 363 O3' G A 12 -3.893 8.799 -1.603 1.00 10.00 O ATOM 364 C2' G A 12 -3.348 6.464 -2.018 1.00 10.00 C ATOM 365 O2' G A 12 -3.340 6.818 -3.389 1.00 10.00 O ATOM 366 C1' G A 12 -2.092 5.663 -1.674 1.00 10.00 C ATOM 367 N9 G A 12 -2.326 4.688 -0.614 1.00 10.00 N ATOM 368 C8 G A 12 -2.093 4.834 0.731 1.00 10.00 C ATOM 369 N7 G A 12 -2.428 3.780 1.427 1.00 10.00 N ATOM 370 C5 G A 12 -2.917 2.885 0.484 1.00 10.00 C ATOM 371 C6 G A 12 -3.434 1.567 0.636 1.00 10.00 C ATOM 372 O6 G A 12 -3.563 0.899 1.676 1.00 10.00 O ATOM 373 N1 G A 12 -3.822 1.020 -0.585 1.00 10.00 N ATOM 374 C2 G A 12 -3.718 1.665 -1.797 1.00 10.00 C ATOM 375 N2 G A 12 -4.144 0.994 -2.874 1.00 10.00 N ATOM 376 N3 G A 12 -3.238 2.888 -1.951 1.00 10.00 N ATOM 377 C4 G A 12 -2.859 3.433 -0.778 1.00 10.00 C ATOM 0 H5' G A 12 -0.211 9.319 -0.528 1.00 10.00 H new ATOM 0 H5'' G A 12 -1.783 9.453 0.235 1.00 10.00 H new ATOM 0 H4' G A 12 -1.445 8.508 -2.142 1.00 10.00 H new ATOM 0 H3' G A 12 -3.500 7.534 -0.107 1.00 10.00 H new ATOM 0 H2' G A 12 -4.292 5.943 -1.861 1.00 10.00 H new ATOM 0 HO2' G A 12 -3.610 7.755 -3.486 1.00 10.00 H new ATOM 0 H1' G A 12 -1.782 5.107 -2.559 1.00 10.00 H new ATOM 0 H8 G A 12 -1.676 5.729 1.169 1.00 10.00 H new ATOM 0 H1 G A 12 -4.210 0.077 -0.581 1.00 10.00 H new ATOM 0 H21 G A 12 -4.090 1.424 -3.797 1.00 10.00 H new ATOM 0 H22 G A 12 -4.522 0.052 -2.771 1.00 10.00 H new ATOM 389 P C A 13 -5.364 9.083 -1.029 1.00 10.00 P ATOM 390 OP1 C A 13 -5.796 10.412 -1.524 1.00 10.00 O ATOM 391 OP2 C A 13 -5.333 8.825 0.428 1.00 10.00 O ATOM 392 O5' C A 13 -6.274 7.968 -1.707 1.00 10.00 O ATOM 393 C5' C A 13 -6.647 8.057 -3.079 1.00 10.00 C ATOM 394 C4' C A 13 -7.125 6.710 -3.576 1.00 10.00 C ATOM 395 O4' C A 13 -6.383 5.660 -2.903 1.00 10.00 O ATOM 396 C3' C A 13 -8.582 6.384 -3.279 1.00 10.00 C ATOM 397 O3' C A 13 -9.427 6.886 -4.309 1.00 10.00 O ATOM 398 C2' C A 13 -8.604 4.860 -3.256 1.00 10.00 C ATOM 399 O2' C A 13 -8.822 4.347 -4.553 1.00 10.00 O ATOM 400 C1' C A 13 -7.190 4.500 -2.796 1.00 10.00 C ATOM 401 N1 C A 13 -7.124 3.987 -1.416 1.00 10.00 N ATOM 402 C2 C A 13 -7.487 2.656 -1.181 1.00 10.00 C ATOM 403 O2 C A 13 -7.892 1.971 -2.135 1.00 10.00 O ATOM 404 N3 C A 13 -7.406 2.153 0.074 1.00 10.00 N ATOM 405 C4 C A 13 -6.980 2.927 1.077 1.00 10.00 C ATOM 406 N4 C A 13 -6.917 2.397 2.300 1.00 10.00 N ATOM 407 C5 C A 13 -6.606 4.285 0.869 1.00 10.00 C ATOM 408 C6 C A 13 -6.694 4.771 -0.379 1.00 10.00 C ATOM 0 H5' C A 13 -5.797 8.392 -3.674 1.00 10.00 H new ATOM 0 H5'' C A 13 -7.435 8.800 -3.202 1.00 10.00 H new ATOM 0 H4' C A 13 -6.983 6.762 -4.655 1.00 10.00 H new ATOM 0 H3' C A 13 -8.941 6.829 -2.351 1.00 10.00 H new ATOM 0 H2' C A 13 -9.392 4.457 -2.620 1.00 10.00 H new ATOM 0 HO2' C A 13 -9.169 5.058 -5.132 1.00 10.00 H new ATOM 0 H1' C A 13 -6.835 3.693 -3.437 1.00 10.00 H new ATOM 0 H41 C A 13 -6.596 2.963 3.085 1.00 10.00 H new ATOM 0 H42 C A 13 -7.190 1.426 2.450 1.00 10.00 H new ATOM 0 H5 C A 13 -6.264 4.902 1.687 1.00 10.00 H new ATOM 0 H6 C A 13 -6.421 5.799 -0.569 1.00 10.00 H new ATOM 420 P C A 14 -10.846 7.547 -3.957 1.00 10.00 P ATOM 421 OP1 C A 14 -11.395 8.146 -5.197 1.00 10.00 O ATOM 422 OP2 C A 14 -10.673 8.397 -2.758 1.00 10.00 O ATOM 423 O5' C A 14 -11.762 6.310 -3.555 1.00 10.00 O ATOM 424 C5' C A 14 -12.517 5.615 -4.545 1.00 10.00 C ATOM 425 C4' C A 14 -12.906 4.250 -4.040 1.00 10.00 C ATOM 426 O4' C A 14 -11.849 3.742 -3.198 1.00 10.00 O ATOM 427 C3' C A 14 -14.124 4.215 -3.129 1.00 10.00 C ATOM 428 O3' C A 14 -15.343 4.176 -3.874 1.00 10.00 O ATOM 429 C2' C A 14 -13.923 2.925 -2.342 1.00 10.00 C ATOM 430 O2' C A 14 -14.521 1.827 -3.006 1.00 10.00 O ATOM 431 C1' C A 14 -12.398 2.768 -2.334 1.00 10.00 C ATOM 432 N1 C A 14 -11.799 2.946 -1.002 1.00 10.00 N ATOM 433 C2 C A 14 -11.667 1.832 -0.178 1.00 10.00 C ATOM 434 O2 C A 14 -12.062 0.733 -0.587 1.00 10.00 O ATOM 435 N3 C A 14 -11.125 1.976 1.052 1.00 10.00 N ATOM 436 C4 C A 14 -10.722 3.175 1.467 1.00 10.00 C ATOM 437 N4 C A 14 -10.207 3.266 2.695 1.00 10.00 N ATOM 438 C5 C A 14 -10.843 4.335 0.647 1.00 10.00 C ATOM 439 C6 C A 14 -11.384 4.176 -0.569 1.00 10.00 C ATOM 0 H5' C A 14 -11.931 5.519 -5.459 1.00 10.00 H new ATOM 0 H5'' C A 14 -13.411 6.185 -4.798 1.00 10.00 H new ATOM 0 H4' C A 14 -13.109 3.681 -4.947 1.00 10.00 H new ATOM 0 H3' C A 14 -14.207 5.101 -2.500 1.00 10.00 H new ATOM 0 H2' C A 14 -14.370 2.957 -1.348 1.00 10.00 H new ATOM 0 HO2' C A 14 -15.248 2.148 -3.579 1.00 10.00 H new ATOM 0 HO3' C A 14 -16.103 4.153 -3.256 1.00 10.00 H new ATOM 0 H1' C A 14 -12.176 1.751 -2.656 1.00 10.00 H new ATOM 0 H41 C A 14 -9.887 4.168 3.048 1.00 10.00 H new ATOM 0 H42 C A 14 -10.133 2.434 3.280 1.00 10.00 H new ATOM 0 H5 C A 14 -10.512 5.303 0.992 1.00 10.00 H new ATOM 0 H6 C A 14 -11.494 5.033 -1.218 1.00 10.00 H new TER 452 C A 14