USER MOD reduce.3.24.130724 H: found=0, std=0, add=133, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 133 hydrogens (42 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 -10:sc= 0.157 USER MOD Single : A 1 G O5' : rot 180:sc= -0.0295 USER MOD Single : A 2 G O2' : rot -112:sc= 1.17 USER MOD Single : A 3 A O2' : rot -13:sc= 0.133 USER MOD Single : A 4 C O2' : rot -7:sc= 0.295 USER MOD Single : A 5 DT C7 :methyl -30:sc= -0.101 (180deg=-2.92!) USER MOD Single : A 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 12 CFL O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 5.297 -6.719 2.933 1.00 0.00 O ATOM 2 C5' G A 1 6.565 -7.386 2.815 1.00 0.00 C ATOM 3 C4' G A 1 7.679 -6.464 2.344 1.00 0.00 C ATOM 4 O4' G A 1 7.405 -5.919 1.034 1.00 0.00 O ATOM 5 C3' G A 1 7.836 -5.283 3.274 1.00 0.00 C ATOM 6 O3' G A 1 8.732 -5.580 4.355 1.00 0.00 O ATOM 7 C2' G A 1 8.356 -4.190 2.386 1.00 0.00 C ATOM 8 O2' G A 1 9.793 -4.193 2.342 1.00 0.00 O ATOM 9 C1' G A 1 7.773 -4.512 1.021 1.00 0.00 C ATOM 10 N9 G A 1 6.585 -3.680 0.757 1.00 0.00 N ATOM 11 C8 G A 1 5.277 -4.030 0.745 1.00 0.00 C ATOM 12 N7 G A 1 4.414 -3.109 0.489 1.00 0.00 N ATOM 13 C5 G A 1 5.238 -1.992 0.303 1.00 0.00 C ATOM 14 C6 G A 1 4.899 -0.651 -0.011 1.00 0.00 C ATOM 15 O6 G A 1 3.787 -0.167 -0.190 1.00 0.00 O ATOM 16 N1 G A 1 6.026 0.147 -0.109 1.00 0.00 N ATOM 17 C2 G A 1 7.321 -0.280 0.072 1.00 0.00 C ATOM 18 N2 G A 1 8.268 0.637 -0.062 1.00 0.00 N ATOM 19 N3 G A 1 7.653 -1.534 0.366 1.00 0.00 N ATOM 20 C4 G A 1 6.570 -2.336 0.467 1.00 0.00 C ATOM 0 H5' G A 1 6.469 -8.217 2.116 1.00 0.00 H new ATOM 0 H5'' G A 1 6.837 -7.812 3.781 1.00 0.00 H new ATOM 0 H4' G A 1 8.582 -7.074 2.324 1.00 0.00 H new ATOM 0 H3' G A 1 6.903 -5.003 3.762 1.00 0.00 H new ATOM 0 H2' G A 1 8.073 -3.199 2.741 1.00 0.00 H new ATOM 0 HO2' G A 1 10.140 -4.800 3.029 1.00 0.00 H new ATOM 0 HO5' G A 1 4.618 -7.358 3.237 1.00 0.00 H new ATOM 0 H1' G A 1 8.500 -4.306 0.236 1.00 0.00 H new ATOM 0 H8 G A 1 4.968 -5.046 0.943 1.00 0.00 H new ATOM 0 H1 G A 1 5.885 1.132 -0.334 1.00 0.00 H new ATOM 0 H21 G A 1 9.248 0.380 0.061 1.00 0.00 H new ATOM 0 H22 G A 1 8.017 1.600 -0.288 1.00 0.00 H new ATOM 33 P G A 2 8.419 -5.049 5.843 1.00 0.00 P ATOM 34 OP1 G A 2 9.384 -5.679 6.771 1.00 0.00 O ATOM 35 OP2 G A 2 6.965 -5.179 6.087 1.00 0.00 O ATOM 36 O5' G A 2 8.776 -3.485 5.722 1.00 0.00 O ATOM 37 C5' G A 2 10.137 -3.072 5.510 1.00 0.00 C ATOM 38 C4' G A 2 10.256 -1.648 4.994 1.00 0.00 C ATOM 39 O4' G A 2 9.543 -1.449 3.750 1.00 0.00 O ATOM 40 C3' G A 2 9.672 -0.662 5.972 1.00 0.00 C ATOM 41 O3' G A 2 10.609 -0.318 7.001 1.00 0.00 O ATOM 42 C2' G A 2 9.302 0.508 5.110 1.00 0.00 C ATOM 43 O2' G A 2 10.397 1.432 4.989 1.00 0.00 O ATOM 44 C1' G A 2 8.956 -0.113 3.765 1.00 0.00 C ATOM 45 N9 G A 2 7.487 -0.164 3.596 1.00 0.00 N ATOM 46 C8 G A 2 6.608 -1.144 3.922 1.00 0.00 C ATOM 47 N7 G A 2 5.356 -0.922 3.703 1.00 0.00 N ATOM 48 C5 G A 2 5.385 0.369 3.162 1.00 0.00 C ATOM 49 C6 G A 2 4.321 1.198 2.708 1.00 0.00 C ATOM 50 O6 G A 2 3.115 0.958 2.685 1.00 0.00 O ATOM 51 N1 G A 2 4.792 2.414 2.244 1.00 0.00 N ATOM 52 C2 G A 2 6.116 2.794 2.215 1.00 0.00 C ATOM 53 N2 G A 2 6.376 3.999 1.738 1.00 0.00 N ATOM 54 N3 G A 2 7.116 2.030 2.633 1.00 0.00 N ATOM 55 C4 G A 2 6.689 0.836 3.093 1.00 0.00 C ATOM 0 H5' G A 2 10.609 -3.750 4.799 1.00 0.00 H new ATOM 0 H5'' G A 2 10.687 -3.159 6.447 1.00 0.00 H new ATOM 0 H4' G A 2 11.324 -1.486 4.850 1.00 0.00 H new ATOM 0 H3' G A 2 8.815 -1.056 6.518 1.00 0.00 H new ATOM 0 H2' G A 2 8.476 1.085 5.526 1.00 0.00 H new ATOM 0 HO2' G A 2 10.173 2.267 5.452 1.00 0.00 H new ATOM 0 H1' G A 2 9.351 0.477 2.938 1.00 0.00 H new ATOM 0 H8 G A 2 6.944 -2.077 4.350 1.00 0.00 H new ATOM 0 H1 G A 2 4.104 3.082 1.896 1.00 0.00 H new ATOM 0 H21 G A 2 7.339 4.333 1.693 1.00 0.00 H new ATOM 0 H22 G A 2 5.614 4.595 1.415 1.00 0.00 H new ATOM 67 P A A 3 10.115 -0.159 8.527 1.00 0.00 P ATOM 68 OP1 A A 3 11.306 -0.177 9.408 1.00 0.00 O ATOM 69 OP2 A A 3 9.006 -1.113 8.762 1.00 0.00 O ATOM 70 O5' A A 3 9.502 1.330 8.525 1.00 0.00 O ATOM 71 C5' A A 3 10.352 2.453 8.273 1.00 0.00 C ATOM 72 C4' A A 3 9.605 3.610 7.611 1.00 0.00 C ATOM 73 O4' A A 3 8.952 3.211 6.379 1.00 0.00 O ATOM 74 C3' A A 3 8.506 4.157 8.488 1.00 0.00 C ATOM 75 O3' A A 3 8.981 5.079 9.475 1.00 0.00 O ATOM 76 C2' A A 3 7.598 4.813 7.509 1.00 0.00 C ATOM 77 O2' A A 3 8.056 6.137 7.199 1.00 0.00 O ATOM 78 C1' A A 3 7.675 3.909 6.294 1.00 0.00 C ATOM 79 N9 A A 3 6.535 2.967 6.307 1.00 0.00 N ATOM 80 C8 A A 3 6.441 1.723 6.837 1.00 0.00 C ATOM 81 N7 A A 3 5.303 1.124 6.754 1.00 0.00 N ATOM 82 C5 A A 3 4.529 2.079 6.084 1.00 0.00 C ATOM 83 C6 A A 3 3.193 2.095 5.666 1.00 0.00 C ATOM 84 N6 A A 3 2.353 1.084 5.871 1.00 0.00 N ATOM 85 N1 A A 3 2.753 3.198 5.034 1.00 0.00 N ATOM 86 C2 A A 3 3.579 4.230 4.824 1.00 0.00 C ATOM 87 N3 A A 3 4.859 4.319 5.178 1.00 0.00 N ATOM 88 C4 A A 3 5.273 3.202 5.808 1.00 0.00 C ATOM 0 H5' A A 3 11.178 2.144 7.633 1.00 0.00 H new ATOM 0 H5'' A A 3 10.787 2.795 9.212 1.00 0.00 H new ATOM 0 H4' A A 3 10.376 4.358 7.427 1.00 0.00 H new ATOM 0 H3' A A 3 8.022 3.380 9.080 1.00 0.00 H new ATOM 0 H2' A A 3 6.581 4.932 7.882 1.00 0.00 H new ATOM 0 HO2' A A 3 8.743 6.405 7.845 1.00 0.00 H new ATOM 0 H1' A A 3 7.617 4.468 5.360 1.00 0.00 H new ATOM 0 H8 A A 3 7.289 1.251 7.311 1.00 0.00 H new ATOM 0 H61 A A 3 1.389 1.148 5.545 1.00 0.00 H new ATOM 0 H62 A A 3 2.673 0.245 6.354 1.00 0.00 H new ATOM 0 H2 A A 3 3.161 5.084 4.311 1.00 0.00 H new ATOM 100 P C A 4 8.322 5.082 10.950 1.00 0.00 P ATOM 101 OP1 C A 4 9.072 6.042 11.790 1.00 0.00 O ATOM 102 OP2 C A 4 8.171 3.676 11.393 1.00 0.00 O ATOM 103 O5' C A 4 6.848 5.692 10.671 1.00 0.00 O ATOM 104 C5' C A 4 6.707 7.022 10.149 1.00 0.00 C ATOM 105 C4' C A 4 5.358 7.255 9.456 1.00 0.00 C ATOM 106 O4' C A 4 5.042 6.205 8.511 1.00 0.00 O ATOM 107 C3' C A 4 4.196 7.290 10.429 1.00 0.00 C ATOM 108 O3' C A 4 3.995 8.593 10.998 1.00 0.00 O ATOM 109 C2' C A 4 3.021 6.885 9.600 1.00 0.00 C ATOM 110 O2' C A 4 2.347 8.038 9.081 1.00 0.00 O ATOM 111 C1' C A 4 3.596 6.042 8.480 1.00 0.00 C ATOM 112 N1 C A 4 3.175 4.631 8.655 1.00 0.00 N ATOM 113 C2 C A 4 1.863 4.336 8.324 1.00 0.00 C ATOM 114 O2 C A 4 1.146 5.202 7.851 1.00 0.00 O ATOM 115 N3 C A 4 1.400 3.082 8.529 1.00 0.00 N ATOM 116 C4 C A 4 2.187 2.141 9.041 1.00 0.00 C ATOM 117 N4 C A 4 1.687 0.923 9.233 1.00 0.00 N ATOM 118 C5 C A 4 3.553 2.426 9.387 1.00 0.00 C ATOM 119 C6 C A 4 4.006 3.678 9.174 1.00 0.00 C ATOM 0 H5' C A 4 7.512 7.215 9.439 1.00 0.00 H new ATOM 0 H5'' C A 4 6.820 7.739 10.962 1.00 0.00 H new ATOM 0 H4' C A 4 5.477 8.218 8.959 1.00 0.00 H new ATOM 0 H3' C A 4 4.367 6.635 11.284 1.00 0.00 H new ATOM 0 H2' C A 4 2.282 6.333 10.181 1.00 0.00 H new ATOM 0 HO2' C A 4 2.736 8.848 9.473 1.00 0.00 H new ATOM 0 H1' C A 4 3.229 6.357 7.503 1.00 0.00 H new ATOM 0 H41 C A 4 2.274 0.187 9.625 1.00 0.00 H new ATOM 0 H42 C A 4 0.717 0.726 8.988 1.00 0.00 H new ATOM 0 H5 C A 4 4.194 1.663 9.803 1.00 0.00 H new ATOM 0 H6 C A 4 5.029 3.929 9.414 1.00 0.00 H new ATOM 131 P DT A 5 3.505 8.749 12.527 1.00 0.00 P ATOM 132 OP1 DT A 5 3.416 10.193 12.838 1.00 0.00 O ATOM 133 OP2 DT A 5 4.334 7.863 13.375 1.00 0.00 O ATOM 134 O5' DT A 5 2.005 8.144 12.483 1.00 0.00 O ATOM 135 C5' DT A 5 0.922 8.879 11.882 1.00 0.00 C ATOM 136 C4' DT A 5 -0.287 7.984 11.576 1.00 0.00 C ATOM 137 O4' DT A 5 0.115 6.837 10.795 1.00 0.00 O ATOM 138 C3' DT A 5 -0.920 7.449 12.854 1.00 0.00 C ATOM 139 O3' DT A 5 -2.035 8.266 13.259 1.00 0.00 O ATOM 140 C2' DT A 5 -1.384 6.084 12.480 1.00 0.00 C ATOM 141 C1' DT A 5 -0.577 5.660 11.282 1.00 0.00 C ATOM 142 N1 DT A 5 0.387 4.617 11.646 1.00 0.00 N ATOM 143 C2 DT A 5 0.051 3.302 11.397 1.00 0.00 C ATOM 144 O2 DT A 5 -1.029 2.982 10.927 1.00 0.00 O ATOM 145 N3 DT A 5 0.998 2.364 11.716 1.00 0.00 N ATOM 146 C4 DT A 5 2.239 2.613 12.253 1.00 0.00 C ATOM 147 O4 DT A 5 3.005 1.688 12.496 1.00 0.00 O ATOM 148 C5 DT A 5 2.510 4.015 12.483 1.00 0.00 C ATOM 149 C7 DT A 5 3.868 4.428 13.037 1.00 0.00 C ATOM 150 C6 DT A 5 1.586 4.959 12.182 1.00 0.00 C ATOM 0 H5' DT A 5 1.269 9.345 10.960 1.00 0.00 H new ATOM 0 H5'' DT A 5 0.616 9.684 12.551 1.00 0.00 H new ATOM 0 H4' DT A 5 -1.001 8.601 11.030 1.00 0.00 H new ATOM 0 H3' DT A 5 -0.225 7.447 13.693 1.00 0.00 H new ATOM 0 H2' DT A 5 -1.242 5.388 13.307 1.00 0.00 H new ATOM 0 H2'' DT A 5 -2.449 6.089 12.246 1.00 0.00 H new ATOM 0 H1' DT A 5 -1.228 5.245 10.512 1.00 0.00 H new ATOM 0 H3 DT A 5 0.759 1.388 11.538 1.00 0.00 H new ATOM 0 H71 DT A 5 4.262 3.630 13.666 1.00 0.00 H new ATOM 0 H72 DT A 5 4.556 4.613 12.212 1.00 0.00 H new ATOM 0 H73 DT A 5 3.758 5.336 13.629 1.00 0.00 H new ATOM 0 H6 DT A 5 1.807 5.999 12.371 1.00 0.00 H new ATOM 163 P DT A 6 -2.586 8.262 14.783 1.00 0.00 P ATOM 164 OP1 DT A 6 -3.732 9.196 14.865 1.00 0.00 O ATOM 165 OP2 DT A 6 -1.430 8.445 15.691 1.00 0.00 O ATOM 166 O5' DT A 6 -3.144 6.759 14.985 1.00 0.00 O ATOM 167 C5' DT A 6 -4.275 6.262 14.243 1.00 0.00 C ATOM 168 C4' DT A 6 -4.386 4.740 14.369 1.00 0.00 C ATOM 169 O4' DT A 6 -3.111 4.134 14.055 1.00 0.00 O ATOM 170 C3' DT A 6 -4.742 4.332 15.802 1.00 0.00 C ATOM 171 O3' DT A 6 -5.786 3.341 15.816 1.00 0.00 O ATOM 172 C2' DT A 6 -3.487 3.748 16.344 1.00 0.00 C ATOM 173 C1' DT A 6 -2.723 3.277 15.141 1.00 0.00 C ATOM 174 N1 DT A 6 -1.265 3.337 15.340 1.00 0.00 N ATOM 175 C2 DT A 6 -0.530 2.250 14.910 1.00 0.00 C ATOM 176 O2 DT A 6 -1.056 1.258 14.403 1.00 0.00 O ATOM 177 N3 DT A 6 0.832 2.338 15.077 1.00 0.00 N ATOM 178 C4 DT A 6 1.519 3.399 15.626 1.00 0.00 C ATOM 179 O4 DT A 6 2.739 3.363 15.721 1.00 0.00 O ATOM 180 C5 DT A 6 0.676 4.495 16.051 1.00 0.00 C ATOM 181 C7 DT A 6 1.310 5.739 16.673 1.00 0.00 C ATOM 182 C6 DT A 6 -0.662 4.436 15.900 1.00 0.00 C ATOM 0 H5' DT A 6 -4.176 6.538 13.193 1.00 0.00 H new ATOM 0 H5'' DT A 6 -5.189 6.729 14.610 1.00 0.00 H new ATOM 0 H4' DT A 6 -5.165 4.407 13.683 1.00 0.00 H new ATOM 0 H3' DT A 6 -5.107 5.178 16.385 1.00 0.00 H new ATOM 0 H2' DT A 6 -2.919 4.488 16.907 1.00 0.00 H new ATOM 0 H2'' DT A 6 -3.698 2.923 17.025 1.00 0.00 H new ATOM 0 H1' DT A 6 -2.955 2.231 14.942 1.00 0.00 H new ATOM 0 H3 DT A 6 1.387 1.541 14.765 1.00 0.00 H new ATOM 0 H71 DT A 6 0.695 6.611 16.450 1.00 0.00 H new ATOM 0 H72 DT A 6 1.379 5.611 17.753 1.00 0.00 H new ATOM 0 H73 DT A 6 2.308 5.884 16.260 1.00 0.00 H new ATOM 0 H6 DT A 6 -1.270 5.267 16.225 1.00 0.00 H new ATOM 195 P DC A 7 -7.289 3.691 15.346 1.00 0.00 P ATOM 196 OP1 DC A 7 -8.100 2.457 15.441 1.00 0.00 O ATOM 197 OP2 DC A 7 -7.220 4.433 14.068 1.00 0.00 O ATOM 198 O5' DC A 7 -7.775 4.714 16.495 1.00 0.00 O ATOM 199 C5' DC A 7 -8.906 4.417 17.329 1.00 0.00 C ATOM 200 C4' DC A 7 -10.019 5.438 17.114 1.00 0.00 C ATOM 201 O4' DC A 7 -9.566 6.771 17.459 1.00 0.00 O ATOM 202 C3' DC A 7 -10.436 5.466 15.646 1.00 0.00 C ATOM 203 O3' DC A 7 -11.855 5.355 15.495 1.00 0.00 O ATOM 204 C2' DC A 7 -9.942 6.763 15.133 1.00 0.00 C ATOM 205 C1' DC A 7 -9.777 7.647 16.330 1.00 0.00 C ATOM 206 N1 DC A 7 -8.625 8.550 16.147 1.00 0.00 N ATOM 207 C2 DC A 7 -8.869 9.900 15.915 1.00 0.00 C ATOM 208 O2 DC A 7 -10.022 10.331 15.895 1.00 0.00 O ATOM 209 N3 DC A 7 -7.799 10.718 15.715 1.00 0.00 N ATOM 210 C4 DC A 7 -6.550 10.234 15.741 1.00 0.00 C ATOM 211 N4 DC A 7 -5.530 11.053 15.522 1.00 0.00 N ATOM 212 C5 DC A 7 -6.299 8.853 15.982 1.00 0.00 C ATOM 213 C6 DC A 7 -7.356 8.051 16.179 1.00 0.00 C ATOM 0 H5' DC A 7 -8.602 4.418 18.376 1.00 0.00 H new ATOM 0 H5'' DC A 7 -9.276 3.416 17.106 1.00 0.00 H new ATOM 0 H4' DC A 7 -10.856 5.146 17.748 1.00 0.00 H new ATOM 0 H3' DC A 7 -10.021 4.622 15.095 1.00 0.00 H new ATOM 0 H2' DC A 7 -8.996 6.639 14.607 1.00 0.00 H new ATOM 0 H2'' DC A 7 -10.647 7.196 14.423 1.00 0.00 H new ATOM 0 H1' DC A 7 -10.655 8.275 16.483 1.00 0.00 H new ATOM 0 H41 DC A 7 -4.575 10.695 15.540 1.00 0.00 H new ATOM 0 H42 DC A 7 -5.700 12.041 15.336 1.00 0.00 H new ATOM 0 H5 DC A 7 -5.292 8.465 16.005 1.00 0.00 H new ATOM 0 H6 DC A 7 -7.201 6.999 16.365 1.00 0.00 H new ATOM 225 P DG A 8 -12.483 4.128 14.661 1.00 0.00 P ATOM 226 OP1 DG A 8 -13.893 4.449 14.360 1.00 0.00 O ATOM 227 OP2 DG A 8 -12.146 2.870 15.362 1.00 0.00 O ATOM 228 O5' DG A 8 -11.650 4.182 13.283 1.00 0.00 O ATOM 229 C5' DG A 8 -11.615 3.059 12.378 1.00 0.00 C ATOM 230 C4' DG A 8 -10.386 3.096 11.493 1.00 0.00 C ATOM 231 O4' DG A 8 -9.187 2.934 12.291 1.00 0.00 O ATOM 232 C3' DG A 8 -10.395 1.989 10.435 1.00 0.00 C ATOM 233 O3' DG A 8 -10.204 2.558 9.128 1.00 0.00 O ATOM 234 C2' DG A 8 -9.265 1.098 10.822 1.00 0.00 C ATOM 235 C1' DG A 8 -8.361 1.928 11.686 1.00 0.00 C ATOM 236 N9 DG A 8 -7.710 1.095 12.693 1.00 0.00 N ATOM 237 C8 DG A 8 -8.257 0.236 13.565 1.00 0.00 C ATOM 238 N7 DG A 8 -7.463 -0.413 14.348 1.00 0.00 N ATOM 239 C5 DG A 8 -6.215 0.079 13.948 1.00 0.00 C ATOM 240 C6 DG A 8 -4.910 -0.230 14.416 1.00 0.00 C ATOM 241 O6 DG A 8 -4.577 -1.021 15.295 1.00 0.00 O ATOM 242 N1 DG A 8 -3.945 0.495 13.734 1.00 0.00 N ATOM 243 C2 DG A 8 -4.200 1.402 12.729 1.00 0.00 C ATOM 244 N2 DG A 8 -3.154 2.001 12.195 1.00 0.00 N ATOM 245 N3 DG A 8 -5.412 1.695 12.286 1.00 0.00 N ATOM 246 C4 DG A 8 -6.368 1.006 12.931 1.00 0.00 C ATOM 0 H5' DG A 8 -12.511 3.062 11.758 1.00 0.00 H new ATOM 0 H5'' DG A 8 -11.626 2.130 12.949 1.00 0.00 H new ATOM 0 H4' DG A 8 -10.397 4.064 10.993 1.00 0.00 H new ATOM 0 H3' DG A 8 -11.337 1.442 10.391 1.00 0.00 H new ATOM 0 H2' DG A 8 -9.626 0.223 11.362 1.00 0.00 H new ATOM 0 H2'' DG A 8 -8.736 0.733 9.941 1.00 0.00 H new ATOM 0 H1' DG A 8 -7.564 2.388 11.103 1.00 0.00 H new ATOM 0 H8 DG A 8 -9.326 0.092 13.611 1.00 0.00 H new ATOM 0 H1 DG A 8 -2.971 0.345 13.997 1.00 0.00 H new ATOM 0 H21 DG A 8 -3.283 2.682 11.447 1.00 0.00 H new ATOM 0 H22 DG A 8 -2.216 1.783 12.530 1.00 0.00 H new HETATM 258 P GFL A 9 -9.951 1.667 7.796 1.00 0.00 P HETATM 259 O1P GFL A 9 -11.149 0.830 7.554 1.00 0.00 O HETATM 260 O2P GFL A 9 -8.613 1.037 7.895 1.00 0.00 O HETATM 261 O5' GFL A 9 -9.891 2.809 6.650 1.00 0.00 O HETATM 262 C5' GFL A 9 -9.937 4.200 7.030 1.00 0.00 C HETATM 263 C4' GFL A 9 -8.574 4.763 7.422 1.00 0.00 C HETATM 264 O4' GFL A 9 -7.773 3.783 8.138 1.00 0.00 O HETATM 265 C3' GFL A 9 -7.751 5.177 6.192 1.00 0.00 C HETATM 266 O3' GFL A 9 -7.667 6.617 6.113 1.00 0.00 O HETATM 267 C2' GFL A 9 -6.397 4.572 6.431 1.00 0.00 C HETATM 268 C1' GFL A 9 -6.425 4.148 7.872 1.00 0.00 C HETATM 269 N9 GFL A 9 -5.425 3.096 8.116 1.00 0.00 N HETATM 270 C8 GFL A 9 -5.543 1.766 8.346 1.00 0.00 C HETATM 271 N7 GFL A 9 -4.444 1.096 8.531 1.00 0.00 N HETATM 272 C5 GFL A 9 -3.473 2.106 8.405 1.00 0.00 C HETATM 273 C6 GFL A 9 -2.044 2.053 8.495 1.00 0.00 C HETATM 274 O6 GFL A 9 -1.314 1.085 8.715 1.00 0.00 O HETATM 275 N1 GFL A 9 -1.481 3.308 8.298 1.00 0.00 N HETATM 276 C2 GFL A 9 -2.188 4.464 8.050 1.00 0.00 C HETATM 277 N2 GFL A 9 -1.487 5.570 7.883 1.00 0.00 N HETATM 278 N3 GFL A 9 -3.503 4.519 7.967 1.00 0.00 N HETATM 279 C4 GFL A 9 -4.081 3.321 8.152 1.00 0.00 C HETATM 280 F GFL A 9 -6.209 3.493 5.612 1.00 0.00 F HETATM 0 HN22 GFL A 9 -1.963 6.453 7.697 1.00 0.00 H new HETATM 0 HN21 GFL A 9 -0.469 5.542 7.940 1.00 0.00 H new HETATM 0 H5'2 GFL A 9 -10.339 4.783 6.201 1.00 0.00 H new HETATM 0 H5'1 GFL A 9 -10.626 4.319 7.866 1.00 0.00 H new HETATM 0 HN1 GFL A 9 -0.464 3.379 8.340 1.00 0.00 H new HETATM 0 H8 GFL A 9 -6.517 1.278 8.375 1.00 0.00 H new HETATM 0 H4' GFL A 9 -8.789 5.626 8.052 1.00 0.00 H new HETATM 0 H3' GFL A 9 -8.191 4.840 5.253 1.00 0.00 H new HETATM 0 H2' GFL A 9 -5.584 5.267 6.222 1.00 0.00 H new HETATM 0 H1' GFL A 9 -6.138 4.938 8.567 1.00 0.00 H new HETATM 291 P TAF A 10 -6.990 7.372 4.850 1.00 0.00 P HETATM 292 OP1 TAF A 10 -7.660 8.680 4.688 1.00 0.00 O HETATM 293 OP2 TAF A 10 -6.950 6.425 3.715 1.00 0.00 O HETATM 294 O5' TAF A 10 -5.467 7.635 5.339 1.00 0.00 O HETATM 295 N1 TAF A 10 -1.527 5.415 4.841 1.00 0.00 N HETATM 296 C6 TAF A 10 -2.559 4.498 4.938 1.00 0.00 C HETATM 297 C2 TAF A 10 -0.204 5.017 4.961 1.00 0.00 C HETATM 298 O2 TAF A 10 0.732 5.805 4.869 1.00 0.00 O HETATM 299 N3 TAF A 10 0.014 3.680 5.179 1.00 0.00 N HETATM 300 C4 TAF A 10 -0.946 2.702 5.284 1.00 0.00 C HETATM 301 O4 TAF A 10 -0.621 1.535 5.478 1.00 0.00 O HETATM 302 C5 TAF A 10 -2.305 3.187 5.146 1.00 0.00 C HETATM 303 C5M TAF A 10 -3.467 2.197 5.206 1.00 0.00 C HETATM 304 F2' TAF A 10 -2.897 6.086 2.640 1.00 0.00 F HETATM 305 C2' TAF A 10 -2.169 7.132 3.139 1.00 0.00 C HETATM 306 C5' TAF A 10 -4.754 8.864 5.029 1.00 0.00 C HETATM 307 C4' TAF A 10 -3.273 8.591 4.710 1.00 0.00 C HETATM 308 O4' TAF A 10 -2.820 7.393 5.381 1.00 0.00 O HETATM 309 C1' TAF A 10 -1.769 6.863 4.585 1.00 0.00 C HETATM 310 C3' TAF A 10 -3.028 8.382 3.204 1.00 0.00 C HETATM 311 O3' TAF A 10 -2.346 9.544 2.641 1.00 0.00 O HETATM 0 H5'' TAF A 10 -5.226 9.355 4.178 1.00 0.00 H new HETATM 0 H73 TAF A 10 -4.138 2.473 6.019 1.00 0.00 H new HETATM 0 H72 TAF A 10 -4.012 2.218 4.262 1.00 0.00 H new HETATM 0 H71 TAF A 10 -3.081 1.193 5.379 1.00 0.00 H new HETATM 0 H6 TAF A 10 -3.591 4.838 4.845 1.00 0.00 H new HETATM 0 H5' TAF A 10 -4.825 9.550 5.873 1.00 0.00 H new HETATM 0 H4' TAF A 10 -2.726 9.470 5.052 1.00 0.00 H new HETATM 0 H3' TAF A 10 -3.946 8.269 2.627 1.00 0.00 H new HETATM 0 H3 TAF A 10 0.985 3.382 5.272 1.00 0.00 H new HETATM 0 H2' TAF A 10 -1.303 7.254 2.489 1.00 0.00 H new HETATM 0 H1' TAF A 10 -0.820 7.340 4.830 1.00 0.00 H new HETATM 323 P CFL A 11 -2.195 9.781 1.037 1.00 0.00 P HETATM 324 O1P CFL A 11 -2.371 11.225 0.771 1.00 0.00 O HETATM 325 O2P CFL A 11 -3.065 8.801 0.352 1.00 0.00 O HETATM 326 O5' CFL A 11 -0.653 9.394 0.721 1.00 0.00 O HETATM 327 C5' CFL A 11 0.420 10.378 0.636 1.00 0.00 C HETATM 328 C4' CFL A 11 1.782 9.675 0.748 1.00 0.00 C HETATM 329 O4' CFL A 11 1.627 8.473 1.504 1.00 0.00 O HETATM 330 C3' CFL A 11 2.345 9.280 -0.621 1.00 0.00 C HETATM 331 O3' CFL A 11 3.454 10.136 -0.982 1.00 0.00 O HETATM 332 C2' CFL A 11 2.794 7.853 -0.459 1.00 0.00 C HETATM 333 C1' CFL A 11 2.551 7.519 1.008 1.00 0.00 C HETATM 334 N1 CFL A 11 2.023 6.147 1.200 1.00 0.00 N HETATM 335 C2 CFL A 11 2.905 5.179 1.651 1.00 0.00 C HETATM 336 O2 CFL A 11 4.090 5.451 1.813 1.00 0.00 O HETATM 337 N3 CFL A 11 2.427 3.930 1.899 1.00 0.00 N HETATM 338 C4 CFL A 11 1.137 3.637 1.714 1.00 0.00 C HETATM 339 N4 CFL A 11 0.706 2.409 1.985 1.00 0.00 N HETATM 340 C5 CFL A 11 0.216 4.624 1.244 1.00 0.00 C HETATM 341 C6 CFL A 11 0.695 5.859 0.995 1.00 0.00 C HETATM 342 F CFL A 11 2.079 7.026 -1.279 1.00 0.00 F HETATM 0 HN42 CFL A 11 -0.277 2.172 1.848 1.00 0.00 H new HETATM 0 HN41 CFL A 11 1.358 1.704 2.330 1.00 0.00 H new HETATM 0 H5'2 CFL A 11 0.356 10.918 -0.308 1.00 0.00 H new HETATM 0 H5'1 CFL A 11 0.314 11.115 1.432 1.00 0.00 H new HETATM 0 H6 CFL A 11 0.024 6.635 0.628 1.00 0.00 H new HETATM 0 H5 CFL A 11 -0.837 4.386 1.092 1.00 0.00 H new HETATM 0 H4' CFL A 11 2.467 10.376 1.225 1.00 0.00 H new HETATM 0 H3' CFL A 11 1.607 9.385 -1.416 1.00 0.00 H new HETATM 0 H2' CFL A 11 3.841 7.721 -0.731 1.00 0.00 H new HETATM 0 H1' CFL A 11 3.498 7.556 1.547 1.00 0.00 H new HETATM 353 P CFL A 12 4.140 10.063 -2.447 1.00 0.00 P HETATM 354 O1P CFL A 12 4.778 11.368 -2.720 1.00 0.00 O HETATM 355 O2P CFL A 12 3.137 9.523 -3.389 1.00 0.00 O HETATM 356 O5' CFL A 12 5.306 8.955 -2.264 1.00 0.00 O HETATM 357 C5' CFL A 12 6.628 9.308 -1.795 1.00 0.00 C HETATM 358 C4' CFL A 12 7.511 8.064 -1.649 1.00 0.00 C HETATM 359 O4' CFL A 12 6.788 7.031 -0.987 1.00 0.00 O HETATM 360 C3' CFL A 12 7.945 7.512 -3.004 1.00 0.00 C HETATM 361 O3' CFL A 12 9.325 7.809 -3.264 1.00 0.00 O HETATM 362 C2' CFL A 12 7.712 6.030 -2.931 1.00 0.00 C HETATM 363 C1' CFL A 12 7.221 5.775 -1.511 1.00 0.00 C HETATM 364 N1 CFL A 12 6.087 4.829 -1.498 1.00 0.00 N HETATM 365 C2 CFL A 12 6.317 3.521 -1.098 1.00 0.00 C HETATM 366 O2 CFL A 12 7.443 3.158 -0.761 1.00 0.00 O HETATM 367 N3 CFL A 12 5.264 2.660 -1.091 1.00 0.00 N HETATM 368 C4 CFL A 12 4.042 3.061 -1.462 1.00 0.00 C HETATM 369 N4 CFL A 12 3.037 2.194 -1.437 1.00 0.00 N HETATM 370 C5 CFL A 12 3.801 4.402 -1.875 1.00 0.00 C HETATM 371 C6 CFL A 12 4.835 5.249 -1.878 1.00 0.00 C HETATM 372 F CFL A 12 6.777 5.645 -3.850 1.00 0.00 F HETATM 0 HO3' CFL A 12 9.579 7.444 -4.137 1.00 0.00 H new HETATM 0 HN42 CFL A 12 2.102 2.489 -1.718 1.00 0.00 H new HETATM 0 HN41 CFL A 12 3.200 1.233 -1.137 1.00 0.00 H new HETATM 0 H5'2 CFL A 12 7.090 10.006 -2.493 1.00 0.00 H new HETATM 0 H5'1 CFL A 12 6.553 9.819 -0.835 1.00 0.00 H new HETATM 0 H6 CFL A 12 4.684 6.284 -2.185 1.00 0.00 H new HETATM 0 H5 CFL A 12 2.806 4.727 -2.179 1.00 0.00 H new HETATM 0 H4' CFL A 12 8.390 8.367 -1.079 1.00 0.00 H new HETATM 0 H3' CFL A 12 7.381 7.964 -3.820 1.00 0.00 H new HETATM 0 H2' CFL A 12 8.614 5.460 -3.154 1.00 0.00 H new HETATM 0 H1' CFL A 12 8.023 5.340 -0.915 1.00 0.00 H new TER 384 CFL A 12