USER MOD reduce.3.24.130724 H: found=0, std=0, add=153, rem=0, adj=16 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 -17:sc= 0.407 USER MOD Single : A 1 G O5' : rot 180:sc= -0.323 USER MOD Single : A 2 G O2' : rot -10:sc= -0.358 USER MOD Single : A 3 C O2' : rot -22:sc= 0.414 USER MOD Single : A 4 C O2' : rot -21:sc= 0.289 USER MOD Single : A 5 U O2' : rot -13:sc= 0.413 USER MOD Single : A 6 G O2' : rot -124:sc= -6.42! USER MOD Single : A 7 A O2' : rot 153:sc= -6.39! USER MOD Single : A 8 U O2' : rot 144:sc= 0.715 USER MOD Single : A 9 A O2' : rot -80:sc= 0.659 USER MOD Single : A 10 G O2' : rot -72:sc= 0.995 USER MOD Single : A 11 G O2' : rot -17:sc= 0.394 USER MOD Single : A 12 G O2' : rot -68:sc= 0.445 USER MOD Single : A 13 U O2' : rot -20:sc= 0.49 USER MOD Single : A 14 C O2' : rot -26:sc= 0.204 USER MOD Single : A 14 C O3' : rot 180:sc= 0.2 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -5.158 -2.255 9.506 1.00 0.00 O ATOM 2 C5' G A 1 -4.863 -2.565 10.870 1.00 0.00 C ATOM 3 C4' G A 1 -3.545 -3.323 11.000 1.00 0.00 C ATOM 4 O4' G A 1 -3.667 -4.592 10.347 1.00 0.00 O ATOM 5 C3' G A 1 -2.360 -2.660 10.322 1.00 0.00 C ATOM 6 O3' G A 1 -1.685 -1.886 11.320 1.00 0.00 O ATOM 7 C2' G A 1 -1.455 -3.831 9.968 1.00 0.00 C ATOM 8 O2' G A 1 -0.656 -4.215 11.091 1.00 0.00 O ATOM 9 C1' G A 1 -2.466 -4.926 9.632 1.00 0.00 C ATOM 10 N9 G A 1 -2.775 -4.983 8.189 1.00 0.00 N ATOM 11 C8 G A 1 -3.593 -4.161 7.454 1.00 0.00 C ATOM 12 N7 G A 1 -3.659 -4.479 6.192 1.00 0.00 N ATOM 13 C5 G A 1 -2.828 -5.590 6.080 1.00 0.00 C ATOM 14 C6 G A 1 -2.503 -6.375 4.940 1.00 0.00 C ATOM 15 O6 G A 1 -2.893 -6.236 3.784 1.00 0.00 O ATOM 16 N1 G A 1 -1.630 -7.401 5.261 1.00 0.00 N ATOM 17 C2 G A 1 -1.128 -7.648 6.518 1.00 0.00 C ATOM 18 N2 G A 1 -0.297 -8.683 6.644 1.00 0.00 N ATOM 19 N3 G A 1 -1.426 -6.919 7.594 1.00 0.00 N ATOM 20 C4 G A 1 -2.280 -5.907 7.301 1.00 0.00 C ATOM 0 H5' G A 1 -5.671 -3.164 11.291 1.00 0.00 H new ATOM 0 H5'' G A 1 -4.813 -1.644 11.451 1.00 0.00 H new ATOM 0 H4' G A 1 -3.362 -3.375 12.073 1.00 0.00 H new ATOM 0 H3' G A 1 -2.627 -2.036 9.469 1.00 0.00 H new ATOM 0 H2' G A 1 -0.752 -3.614 9.164 1.00 0.00 H new ATOM 0 HO2' G A 1 -0.654 -3.492 11.753 1.00 0.00 H new ATOM 0 HO5' G A 1 -6.009 -1.771 9.457 1.00 0.00 H new ATOM 0 H1' G A 1 -2.057 -5.898 9.909 1.00 0.00 H new ATOM 0 H8 G A 1 -4.132 -3.328 7.882 1.00 0.00 H new ATOM 0 H1 G A 1 -1.336 -8.022 4.507 1.00 0.00 H new ATOM 0 H21 G A 1 0.103 -8.908 7.555 1.00 0.00 H new ATOM 0 H22 G A 1 -0.061 -9.250 5.829 1.00 0.00 H new ATOM 33 P G A 2 -0.650 -0.725 10.900 1.00 0.00 P ATOM 34 OP1 G A 2 -0.349 0.083 12.103 1.00 0.00 O ATOM 35 OP2 G A 2 -1.164 -0.063 9.679 1.00 0.00 O ATOM 36 O5' G A 2 0.672 -1.559 10.510 1.00 0.00 O ATOM 37 C5' G A 2 1.263 -1.434 9.213 1.00 0.00 C ATOM 38 C4' G A 2 2.420 -2.409 9.030 1.00 0.00 C ATOM 39 O4' G A 2 1.896 -3.733 8.859 1.00 0.00 O ATOM 40 C3' G A 2 3.258 -2.179 7.785 1.00 0.00 C ATOM 41 O3' G A 2 4.351 -1.336 8.160 1.00 0.00 O ATOM 42 C2' G A 2 3.825 -3.561 7.496 1.00 0.00 C ATOM 43 O2' G A 2 4.951 -3.832 8.334 1.00 0.00 O ATOM 44 C1' G A 2 2.649 -4.459 7.870 1.00 0.00 C ATOM 45 N9 G A 2 1.770 -4.736 6.716 1.00 0.00 N ATOM 46 C8 G A 2 0.500 -4.279 6.476 1.00 0.00 C ATOM 47 N7 G A 2 -0.005 -4.699 5.351 1.00 0.00 N ATOM 48 C5 G A 2 1.000 -5.490 4.806 1.00 0.00 C ATOM 49 C6 G A 2 1.024 -6.215 3.584 1.00 0.00 C ATOM 50 O6 G A 2 0.145 -6.299 2.730 1.00 0.00 O ATOM 51 N1 G A 2 2.228 -6.879 3.411 1.00 0.00 N ATOM 52 C2 G A 2 3.278 -6.855 4.298 1.00 0.00 C ATOM 53 N2 G A 2 4.363 -7.555 3.966 1.00 0.00 N ATOM 54 N3 G A 2 3.265 -6.178 5.448 1.00 0.00 N ATOM 55 C4 G A 2 2.095 -5.520 5.635 1.00 0.00 C ATOM 0 H5' G A 2 1.620 -0.414 9.071 1.00 0.00 H new ATOM 0 H5'' G A 2 0.508 -1.617 8.449 1.00 0.00 H new ATOM 0 H4' G A 2 3.039 -2.266 9.916 1.00 0.00 H new ATOM 0 H3' G A 2 2.711 -1.739 6.951 1.00 0.00 H new ATOM 0 H2' G A 2 4.181 -3.691 6.474 1.00 0.00 H new ATOM 0 HO2' G A 2 5.219 -3.011 8.798 1.00 0.00 H new ATOM 0 H1' G A 2 3.018 -5.419 8.230 1.00 0.00 H new ATOM 0 H8 G A 2 -0.032 -3.631 7.156 1.00 0.00 H new ATOM 0 H1 G A 2 2.344 -7.428 2.559 1.00 0.00 H new ATOM 0 H21 G A 2 5.170 -7.571 4.589 1.00 0.00 H new ATOM 0 H22 G A 2 4.386 -8.075 3.089 1.00 0.00 H new ATOM 67 P C A 3 4.957 -0.266 7.119 1.00 0.00 P ATOM 68 OP1 C A 3 6.039 0.483 7.799 1.00 0.00 O ATOM 69 OP2 C A 3 3.832 0.467 6.498 1.00 0.00 O ATOM 70 O5' C A 3 5.624 -1.207 5.995 1.00 0.00 O ATOM 71 C5' C A 3 6.770 -2.007 6.301 1.00 0.00 C ATOM 72 C4' C A 3 7.197 -2.857 5.107 1.00 0.00 C ATOM 73 O4' C A 3 6.263 -3.929 4.934 1.00 0.00 O ATOM 74 C3' C A 3 7.183 -2.135 3.770 1.00 0.00 C ATOM 75 O3' C A 3 8.499 -1.614 3.559 1.00 0.00 O ATOM 76 C2' C A 3 6.975 -3.265 2.773 1.00 0.00 C ATOM 77 O2' C A 3 8.208 -3.937 2.501 1.00 0.00 O ATOM 78 C1' C A 3 6.022 -4.182 3.539 1.00 0.00 C ATOM 79 N1 C A 3 4.602 -3.895 3.234 1.00 0.00 N ATOM 80 C2 C A 3 3.998 -4.637 2.230 1.00 0.00 C ATOM 81 O2 C A 3 4.639 -5.492 1.620 1.00 0.00 O ATOM 82 N3 C A 3 2.691 -4.397 1.935 1.00 0.00 N ATOM 83 C4 C A 3 2.001 -3.464 2.603 1.00 0.00 C ATOM 84 N4 C A 3 0.722 -3.282 2.274 1.00 0.00 N ATOM 85 C5 C A 3 2.614 -2.696 3.637 1.00 0.00 C ATOM 86 C6 C A 3 3.906 -2.940 3.921 1.00 0.00 C ATOM 0 H5' C A 3 6.546 -2.655 7.148 1.00 0.00 H new ATOM 0 H5'' C A 3 7.595 -1.362 6.603 1.00 0.00 H new ATOM 0 H4' C A 3 8.216 -3.164 5.344 1.00 0.00 H new ATOM 0 H3' C A 3 6.443 -1.338 3.698 1.00 0.00 H new ATOM 0 H2' C A 3 6.599 -2.937 1.804 1.00 0.00 H new ATOM 0 HO2' C A 3 8.958 -3.344 2.716 1.00 0.00 H new ATOM 0 H1' C A 3 6.202 -5.220 3.258 1.00 0.00 H new ATOM 0 H41 C A 3 0.165 -2.580 2.761 1.00 0.00 H new ATOM 0 H42 C A 3 0.301 -3.845 1.535 1.00 0.00 H new ATOM 0 H5 C A 3 2.058 -1.942 4.175 1.00 0.00 H new ATOM 0 H6 C A 3 4.398 -2.376 4.699 1.00 0.00 H new ATOM 98 P C A 4 8.708 -0.131 2.965 1.00 0.00 P ATOM 99 OP1 C A 4 10.140 0.220 3.088 1.00 0.00 O ATOM 100 OP2 C A 4 7.678 0.755 3.556 1.00 0.00 O ATOM 101 O5' C A 4 8.368 -0.326 1.404 1.00 0.00 O ATOM 102 C5' C A 4 9.258 -1.052 0.549 1.00 0.00 C ATOM 103 C4' C A 4 8.763 -1.066 -0.896 1.00 0.00 C ATOM 104 O4' C A 4 7.794 -2.108 -1.055 1.00 0.00 O ATOM 105 C3' C A 4 8.019 0.184 -1.333 1.00 0.00 C ATOM 106 O3' C A 4 8.984 1.089 -1.878 1.00 0.00 O ATOM 107 C2' C A 4 7.166 -0.328 -2.478 1.00 0.00 C ATOM 108 O2' C A 4 7.950 -0.498 -3.662 1.00 0.00 O ATOM 109 C1' C A 4 6.728 -1.680 -1.923 1.00 0.00 C ATOM 110 N1 C A 4 5.495 -1.554 -1.119 1.00 0.00 N ATOM 111 C2 C A 4 4.282 -1.798 -1.744 1.00 0.00 C ATOM 112 O2 C A 4 4.248 -2.141 -2.925 1.00 0.00 O ATOM 113 N3 C A 4 3.138 -1.647 -1.022 1.00 0.00 N ATOM 114 C4 C A 4 3.184 -1.273 0.263 1.00 0.00 C ATOM 115 N4 C A 4 2.030 -1.135 0.912 1.00 0.00 N ATOM 116 C5 C A 4 4.432 -1.023 0.911 1.00 0.00 C ATOM 117 C6 C A 4 5.552 -1.176 0.190 1.00 0.00 C ATOM 0 H5' C A 4 9.356 -2.076 0.910 1.00 0.00 H new ATOM 0 H5'' C A 4 10.250 -0.603 0.590 1.00 0.00 H new ATOM 0 H4' C A 4 9.672 -1.179 -1.487 1.00 0.00 H new ATOM 0 H3' C A 4 7.456 0.677 -0.540 1.00 0.00 H new ATOM 0 H2' C A 4 6.349 0.334 -2.766 1.00 0.00 H new ATOM 0 HO2' C A 4 8.762 0.047 -3.598 1.00 0.00 H new ATOM 0 H1' C A 4 6.528 -2.379 -2.735 1.00 0.00 H new ATOM 0 H41 C A 4 2.027 -0.852 1.892 1.00 0.00 H new ATOM 0 H42 C A 4 1.149 -1.313 0.429 1.00 0.00 H new ATOM 0 H5 C A 4 4.472 -0.721 1.947 1.00 0.00 H new ATOM 0 H6 C A 4 6.512 -0.998 0.652 1.00 0.00 H new ATOM 129 P U A 5 8.871 2.672 -1.598 1.00 0.00 P ATOM 130 OP1 U A 5 10.109 3.317 -2.089 1.00 0.00 O ATOM 131 OP2 U A 5 8.446 2.866 -0.193 1.00 0.00 O ATOM 132 O5' U A 5 7.656 3.111 -2.558 1.00 0.00 O ATOM 133 C5' U A 5 7.794 3.058 -3.982 1.00 0.00 C ATOM 134 C4' U A 5 6.445 3.088 -4.677 1.00 0.00 C ATOM 135 O4' U A 5 5.658 1.997 -4.206 1.00 0.00 O ATOM 136 C3' U A 5 5.607 4.318 -4.375 1.00 0.00 C ATOM 137 O3' U A 5 5.873 5.268 -5.413 1.00 0.00 O ATOM 138 C2' U A 5 4.182 3.824 -4.566 1.00 0.00 C ATOM 139 O2' U A 5 3.808 3.878 -5.946 1.00 0.00 O ATOM 140 C1' U A 5 4.279 2.372 -4.095 1.00 0.00 C ATOM 141 N1 U A 5 3.851 2.203 -2.688 1.00 0.00 N ATOM 142 C2 U A 5 2.496 2.043 -2.443 1.00 0.00 C ATOM 143 O2 U A 5 1.654 2.049 -3.340 1.00 0.00 O ATOM 144 N3 U A 5 2.138 1.879 -1.119 1.00 0.00 N ATOM 145 C4 U A 5 2.999 1.864 -0.038 1.00 0.00 C ATOM 146 O4 U A 5 2.557 1.705 1.097 1.00 0.00 O ATOM 147 C5 U A 5 4.393 2.039 -0.374 1.00 0.00 C ATOM 148 C6 U A 5 4.766 2.201 -1.666 1.00 0.00 C ATOM 0 H5' U A 5 8.328 2.150 -4.263 1.00 0.00 H new ATOM 0 H5'' U A 5 8.397 3.900 -4.321 1.00 0.00 H new ATOM 0 H4' U A 5 6.677 3.061 -5.742 1.00 0.00 H new ATOM 0 H3' U A 5 5.794 4.758 -3.395 1.00 0.00 H new ATOM 0 H2' U A 5 3.438 4.414 -4.032 1.00 0.00 H new ATOM 0 HO2' U A 5 4.461 4.416 -6.441 1.00 0.00 H new ATOM 0 H1' U A 5 3.621 1.753 -4.705 1.00 0.00 H new ATOM 0 H3 U A 5 1.145 1.758 -0.920 1.00 0.00 H new ATOM 0 H5 U A 5 5.139 2.041 0.407 1.00 0.00 H new ATOM 0 H6 U A 5 5.813 2.332 -1.898 1.00 0.00 H new ATOM 159 P G A 6 6.209 6.803 -5.057 1.00 0.00 P ATOM 160 OP1 G A 6 6.655 7.479 -6.295 1.00 0.00 O ATOM 161 OP2 G A 6 7.073 6.822 -3.855 1.00 0.00 O ATOM 162 O5' G A 6 4.767 7.393 -4.650 1.00 0.00 O ATOM 163 C5' G A 6 3.685 7.391 -5.587 1.00 0.00 C ATOM 164 C4' G A 6 2.338 7.263 -4.884 1.00 0.00 C ATOM 165 O4' G A 6 2.375 6.147 -4.005 1.00 0.00 O ATOM 166 C3' G A 6 1.978 8.426 -3.971 1.00 0.00 C ATOM 167 O3' G A 6 1.123 9.300 -4.715 1.00 0.00 O ATOM 168 C2' G A 6 1.134 7.795 -2.853 1.00 0.00 C ATOM 169 O2' G A 6 -0.245 8.075 -3.035 1.00 0.00 O ATOM 170 C1' G A 6 1.364 6.295 -3.009 1.00 0.00 C ATOM 171 N9 G A 6 1.830 5.688 -1.748 1.00 0.00 N ATOM 172 C8 G A 6 3.109 5.379 -1.365 1.00 0.00 C ATOM 173 N7 G A 6 3.196 4.902 -0.157 1.00 0.00 N ATOM 174 C5 G A 6 1.881 4.892 0.297 1.00 0.00 C ATOM 175 C6 G A 6 1.349 4.478 1.548 1.00 0.00 C ATOM 176 O6 G A 6 1.952 4.032 2.522 1.00 0.00 O ATOM 177 N1 G A 6 -0.026 4.630 1.594 1.00 0.00 N ATOM 178 C2 G A 6 -0.803 5.122 0.570 1.00 0.00 C ATOM 179 N2 G A 6 -2.115 5.203 0.786 1.00 0.00 N ATOM 180 N3 G A 6 -0.314 5.516 -0.609 1.00 0.00 N ATOM 181 C4 G A 6 1.033 5.371 -0.673 1.00 0.00 C ATOM 0 H5' G A 6 3.811 6.566 -6.288 1.00 0.00 H new ATOM 0 H5'' G A 6 3.706 8.311 -6.171 1.00 0.00 H new ATOM 0 H4' G A 6 1.615 7.195 -5.697 1.00 0.00 H new ATOM 0 H3' G A 6 2.848 8.965 -3.596 1.00 0.00 H new ATOM 0 H2' G A 6 1.412 8.179 -1.872 1.00 0.00 H new ATOM 0 HO2' G A 6 -0.598 8.515 -2.234 1.00 0.00 H new ATOM 0 H1' G A 6 0.434 5.797 -3.285 1.00 0.00 H new ATOM 0 H8 G A 6 3.966 5.518 -2.007 1.00 0.00 H new ATOM 0 H1 G A 6 -0.501 4.356 2.454 1.00 0.00 H new ATOM 0 H21 G A 6 -2.731 5.561 0.056 1.00 0.00 H new ATOM 0 H22 G A 6 -2.504 4.907 1.681 1.00 0.00 H new ATOM 193 P A A 7 0.862 10.816 -4.221 1.00 0.00 P ATOM 194 OP1 A A 7 0.990 11.713 -5.392 1.00 0.00 O ATOM 195 OP2 A A 7 1.679 11.062 -3.012 1.00 0.00 O ATOM 196 O5' A A 7 -0.688 10.780 -3.782 1.00 0.00 O ATOM 197 C5' A A 7 -1.539 9.731 -4.248 1.00 0.00 C ATOM 198 C4' A A 7 -2.769 9.554 -3.388 1.00 0.00 C ATOM 199 O4' A A 7 -2.405 8.811 -2.212 1.00 0.00 O ATOM 200 C3' A A 7 -3.365 10.831 -2.844 1.00 0.00 C ATOM 201 O3' A A 7 -4.662 10.415 -2.404 1.00 0.00 O ATOM 202 C2' A A 7 -2.473 11.069 -1.632 1.00 0.00 C ATOM 203 O2' A A 7 -3.050 11.986 -0.721 1.00 0.00 O ATOM 204 C1' A A 7 -2.415 9.662 -1.058 1.00 0.00 C ATOM 205 N9 A A 7 -1.195 9.405 -0.267 1.00 0.00 N ATOM 206 C8 A A 7 0.101 9.767 -0.538 1.00 0.00 C ATOM 207 N7 A A 7 0.957 9.365 0.360 1.00 0.00 N ATOM 208 C5 A A 7 0.174 8.689 1.287 1.00 0.00 C ATOM 209 C6 A A 7 0.480 8.021 2.484 1.00 0.00 C ATOM 210 N6 A A 7 1.715 7.916 2.974 1.00 0.00 N ATOM 211 N1 A A 7 -0.532 7.458 3.162 1.00 0.00 N ATOM 212 C2 A A 7 -1.765 7.556 2.680 1.00 0.00 C ATOM 213 N3 A A 7 -2.182 8.152 1.573 1.00 0.00 N ATOM 214 C4 A A 7 -1.140 8.706 0.917 1.00 0.00 C ATOM 0 H5' A A 7 -0.978 8.796 -4.270 1.00 0.00 H new ATOM 0 H5'' A A 7 -1.844 9.944 -5.272 1.00 0.00 H new ATOM 0 H4' A A 7 -3.494 9.073 -4.045 1.00 0.00 H new ATOM 0 H3' A A 7 -3.430 11.698 -3.501 1.00 0.00 H new ATOM 0 H2' A A 7 -1.503 11.510 -1.861 1.00 0.00 H new ATOM 0 HO2' A A 7 -2.716 11.804 0.182 1.00 0.00 H new ATOM 0 H1' A A 7 -3.251 9.496 -0.378 1.00 0.00 H new ATOM 0 H8 A A 7 0.385 10.332 -1.413 1.00 0.00 H new ATOM 0 H61 A A 7 1.876 7.418 3.849 1.00 0.00 H new ATOM 0 H62 A A 7 2.499 8.334 2.473 1.00 0.00 H new ATOM 0 H2 A A 7 -2.535 7.084 3.273 1.00 0.00 H new ATOM 226 P U A 8 -5.821 11.380 -1.845 1.00 0.00 P ATOM 227 OP1 U A 8 -6.825 11.570 -2.916 1.00 0.00 O ATOM 228 OP2 U A 8 -5.227 12.554 -1.173 1.00 0.00 O ATOM 229 O5' U A 8 -6.450 10.405 -0.729 1.00 0.00 O ATOM 230 C5' U A 8 -6.315 8.983 -0.897 1.00 0.00 C ATOM 231 C4' U A 8 -5.759 8.291 0.348 1.00 0.00 C ATOM 232 O4' U A 8 -4.684 9.064 0.896 1.00 0.00 O ATOM 233 C3' U A 8 -6.758 8.141 1.487 1.00 0.00 C ATOM 234 O3' U A 8 -6.356 7.003 2.262 1.00 0.00 O ATOM 235 C2' U A 8 -6.485 9.377 2.317 1.00 0.00 C ATOM 236 O2' U A 8 -6.939 9.214 3.662 1.00 0.00 O ATOM 237 C1' U A 8 -4.977 9.429 2.247 1.00 0.00 C ATOM 238 N1 U A 8 -4.450 10.779 2.500 1.00 0.00 N ATOM 239 C2 U A 8 -4.341 11.195 3.817 1.00 0.00 C ATOM 240 O2 U A 8 -4.646 10.477 4.768 1.00 0.00 O ATOM 241 N3 U A 8 -3.865 12.477 4.006 1.00 0.00 N ATOM 242 C4 U A 8 -3.495 13.362 3.013 1.00 0.00 C ATOM 243 O4 U A 8 -3.085 14.483 3.308 1.00 0.00 O ATOM 244 C5 U A 8 -3.636 12.853 1.668 1.00 0.00 C ATOM 245 C6 U A 8 -4.101 11.593 1.461 1.00 0.00 C ATOM 0 H5' U A 8 -5.658 8.782 -1.743 1.00 0.00 H new ATOM 0 H5'' U A 8 -7.288 8.556 -1.141 1.00 0.00 H new ATOM 0 H4' U A 8 -5.461 7.303 -0.002 1.00 0.00 H new ATOM 0 H3' U A 8 -7.795 8.028 1.171 1.00 0.00 H new ATOM 0 H2' U A 8 -6.988 10.279 1.968 1.00 0.00 H new ATOM 0 HO2' U A 8 -6.318 9.662 4.273 1.00 0.00 H new ATOM 0 H1' U A 8 -4.527 8.780 2.998 1.00 0.00 H new ATOM 0 H3 U A 8 -3.779 12.801 4.969 1.00 0.00 H new ATOM 0 H5 U A 8 -3.371 13.475 0.826 1.00 0.00 H new ATOM 0 H6 U A 8 -4.197 11.227 0.450 1.00 0.00 H new ATOM 256 P A A 9 -7.450 6.061 2.984 1.00 0.00 P ATOM 257 OP1 A A 9 -7.896 6.734 4.222 1.00 0.00 O ATOM 258 OP2 A A 9 -6.904 4.686 3.047 1.00 0.00 O ATOM 259 O5' A A 9 -8.673 6.076 1.935 1.00 0.00 O ATOM 260 C5' A A 9 -9.052 4.891 1.223 1.00 0.00 C ATOM 261 C4' A A 9 -9.595 5.227 -0.164 1.00 0.00 C ATOM 262 O4' A A 9 -9.005 6.464 -0.606 1.00 0.00 O ATOM 263 C3' A A 9 -9.243 4.219 -1.261 1.00 0.00 C ATOM 264 O3' A A 9 -10.389 3.385 -1.473 1.00 0.00 O ATOM 265 C2' A A 9 -9.082 5.100 -2.492 1.00 0.00 C ATOM 266 O2' A A 9 -10.355 5.480 -3.022 1.00 0.00 O ATOM 267 C1' A A 9 -8.379 6.297 -1.884 1.00 0.00 C ATOM 268 N9 A A 9 -6.934 6.055 -1.691 1.00 0.00 N ATOM 269 C8 A A 9 -6.290 5.545 -0.595 1.00 0.00 C ATOM 270 N7 A A 9 -4.999 5.438 -0.750 1.00 0.00 N ATOM 271 C5 A A 9 -4.778 5.916 -2.036 1.00 0.00 C ATOM 272 C6 A A 9 -3.616 6.073 -2.806 1.00 0.00 C ATOM 273 N6 A A 9 -2.396 5.753 -2.376 1.00 0.00 N ATOM 274 N1 A A 9 -3.749 6.575 -4.043 1.00 0.00 N ATOM 275 C2 A A 9 -4.959 6.899 -4.478 1.00 0.00 C ATOM 276 N3 A A 9 -6.124 6.802 -3.857 1.00 0.00 N ATOM 277 C4 A A 9 -5.952 6.295 -2.619 1.00 0.00 C ATOM 0 H5' A A 9 -9.809 4.349 1.791 1.00 0.00 H new ATOM 0 H5'' A A 9 -8.191 4.230 1.128 1.00 0.00 H new ATOM 0 H4' A A 9 -10.678 5.248 -0.039 1.00 0.00 H new ATOM 0 H3' A A 9 -8.373 3.602 -1.035 1.00 0.00 H new ATOM 0 H2' A A 9 -8.556 4.628 -3.322 1.00 0.00 H new ATOM 0 HO2' A A 9 -10.717 4.746 -3.561 1.00 0.00 H new ATOM 0 H1' A A 9 -8.459 7.170 -2.532 1.00 0.00 H new ATOM 0 H8 A A 9 -6.802 5.259 0.312 1.00 0.00 H new ATOM 0 H61 A A 9 -1.589 5.891 -2.984 1.00 0.00 H new ATOM 0 H62 A A 9 -2.270 5.370 -1.439 1.00 0.00 H new ATOM 0 H2 A A 9 -5.000 7.298 -5.481 1.00 0.00 H new ATOM 289 P G A 10 -10.345 2.188 -2.557 1.00 0.00 P ATOM 290 OP1 G A 10 -11.708 1.625 -2.681 1.00 0.00 O ATOM 291 OP2 G A 10 -9.207 1.302 -2.228 1.00 0.00 O ATOM 292 O5' G A 10 -9.997 2.975 -3.921 1.00 0.00 O ATOM 293 C5' G A 10 -10.264 2.402 -5.205 1.00 0.00 C ATOM 294 C4' G A 10 -8.998 1.882 -5.886 1.00 0.00 C ATOM 295 O4' G A 10 -7.940 2.833 -5.720 1.00 0.00 O ATOM 296 C3' G A 10 -8.421 0.602 -5.314 1.00 0.00 C ATOM 297 O3' G A 10 -9.034 -0.492 -6.003 1.00 0.00 O ATOM 298 C2' G A 10 -6.969 0.675 -5.766 1.00 0.00 C ATOM 299 O2' G A 10 -6.842 0.285 -7.135 1.00 0.00 O ATOM 300 C1' G A 10 -6.669 2.164 -5.602 1.00 0.00 C ATOM 301 N9 G A 10 -6.091 2.463 -4.281 1.00 0.00 N ATOM 302 C8 G A 10 -6.742 2.656 -3.093 1.00 0.00 C ATOM 303 N7 G A 10 -5.946 2.859 -2.083 1.00 0.00 N ATOM 304 C5 G A 10 -4.673 2.798 -2.641 1.00 0.00 C ATOM 305 C6 G A 10 -3.401 2.947 -2.027 1.00 0.00 C ATOM 306 O6 G A 10 -3.145 3.157 -0.844 1.00 0.00 O ATOM 307 N1 G A 10 -2.371 2.817 -2.944 1.00 0.00 N ATOM 308 C2 G A 10 -2.540 2.575 -4.290 1.00 0.00 C ATOM 309 N2 G A 10 -1.435 2.479 -5.029 1.00 0.00 N ATOM 310 N3 G A 10 -3.730 2.434 -4.877 1.00 0.00 N ATOM 311 C4 G A 10 -4.750 2.559 -3.991 1.00 0.00 C ATOM 0 H5' G A 10 -10.735 3.150 -5.843 1.00 0.00 H new ATOM 0 H5'' G A 10 -10.976 1.584 -5.094 1.00 0.00 H new ATOM 0 H4' G A 10 -9.317 1.707 -6.914 1.00 0.00 H new ATOM 0 H3' G A 10 -8.556 0.483 -4.239 1.00 0.00 H new ATOM 0 H2' G A 10 -6.298 0.019 -5.211 1.00 0.00 H new ATOM 0 HO2' G A 10 -6.972 -0.683 -7.213 1.00 0.00 H new ATOM 0 H1' G A 10 -5.945 2.489 -6.349 1.00 0.00 H new ATOM 0 H8 G A 10 -7.818 2.641 -3.002 1.00 0.00 H new ATOM 0 H1 G A 10 -1.416 2.907 -2.597 1.00 0.00 H new ATOM 0 H21 G A 10 -1.505 2.301 -6.031 1.00 0.00 H new ATOM 0 H22 G A 10 -0.519 2.584 -4.593 1.00 0.00 H new ATOM 323 P G A 11 -8.698 -2.016 -5.594 1.00 0.00 P ATOM 324 OP1 G A 11 -9.700 -2.897 -6.231 1.00 0.00 O ATOM 325 OP2 G A 11 -8.495 -2.069 -4.128 1.00 0.00 O ATOM 326 O5' G A 11 -7.277 -2.266 -6.316 1.00 0.00 O ATOM 327 C5' G A 11 -6.093 -2.514 -5.548 1.00 0.00 C ATOM 328 C4' G A 11 -4.848 -1.992 -6.259 1.00 0.00 C ATOM 329 O4' G A 11 -4.459 -0.745 -5.671 1.00 0.00 O ATOM 330 C3' G A 11 -3.619 -2.875 -6.128 1.00 0.00 C ATOM 331 O3' G A 11 -3.583 -3.708 -7.290 1.00 0.00 O ATOM 332 C2' G A 11 -2.464 -1.889 -6.239 1.00 0.00 C ATOM 333 O2' G A 11 -2.167 -1.610 -7.610 1.00 0.00 O ATOM 334 C1' G A 11 -3.032 -0.648 -5.553 1.00 0.00 C ATOM 335 N9 G A 11 -2.681 -0.578 -4.117 1.00 0.00 N ATOM 336 C8 G A 11 -3.513 -0.398 -3.042 1.00 0.00 C ATOM 337 N7 G A 11 -2.890 -0.350 -1.898 1.00 0.00 N ATOM 338 C5 G A 11 -1.552 -0.508 -2.237 1.00 0.00 C ATOM 339 C6 G A 11 -0.400 -0.538 -1.404 1.00 0.00 C ATOM 340 O6 G A 11 -0.342 -0.425 -0.183 1.00 0.00 O ATOM 341 N1 G A 11 0.760 -0.718 -2.142 1.00 0.00 N ATOM 342 C2 G A 11 0.810 -0.854 -3.510 1.00 0.00 C ATOM 343 N2 G A 11 2.012 -1.035 -4.055 1.00 0.00 N ATOM 344 N3 G A 11 -0.266 -0.828 -4.302 1.00 0.00 N ATOM 345 C4 G A 11 -1.410 -0.650 -3.597 1.00 0.00 C ATOM 0 H5' G A 11 -5.990 -3.585 -5.371 1.00 0.00 H new ATOM 0 H5'' G A 11 -6.184 -2.036 -4.572 1.00 0.00 H new ATOM 0 H4' G A 11 -5.137 -1.934 -7.309 1.00 0.00 H new ATOM 0 H3' G A 11 -3.595 -3.479 -5.221 1.00 0.00 H new ATOM 0 H2' G A 11 -1.535 -2.251 -5.799 1.00 0.00 H new ATOM 0 HO2' G A 11 -2.574 -2.296 -8.179 1.00 0.00 H new ATOM 0 H1' G A 11 -2.619 0.244 -6.023 1.00 0.00 H new ATOM 0 H8 G A 11 -4.585 -0.305 -3.135 1.00 0.00 H new ATOM 0 H1 G A 11 1.643 -0.752 -1.632 1.00 0.00 H new ATOM 0 H21 G A 11 2.103 -1.141 -5.065 1.00 0.00 H new ATOM 0 H22 G A 11 2.841 -1.067 -3.462 1.00 0.00 H new ATOM 357 P G A 12 -2.973 -5.198 -7.223 1.00 0.00 P ATOM 358 OP1 G A 12 -3.559 -5.987 -8.330 1.00 0.00 O ATOM 359 OP2 G A 12 -3.087 -5.685 -5.830 1.00 0.00 O ATOM 360 O5' G A 12 -1.414 -4.952 -7.546 1.00 0.00 O ATOM 361 C5' G A 12 -0.607 -5.995 -8.104 1.00 0.00 C ATOM 362 C4' G A 12 0.850 -5.879 -7.663 1.00 0.00 C ATOM 363 O4' G A 12 1.038 -4.633 -6.985 1.00 0.00 O ATOM 364 C3' G A 12 1.286 -6.933 -6.656 1.00 0.00 C ATOM 365 O3' G A 12 1.920 -7.980 -7.398 1.00 0.00 O ATOM 366 C2' G A 12 2.368 -6.229 -5.850 1.00 0.00 C ATOM 367 O2' G A 12 3.629 -6.298 -6.524 1.00 0.00 O ATOM 368 C1' G A 12 1.860 -4.791 -5.820 1.00 0.00 C ATOM 369 N9 G A 12 1.038 -4.509 -4.625 1.00 0.00 N ATOM 370 C8 G A 12 -0.304 -4.229 -4.555 1.00 0.00 C ATOM 371 N7 G A 12 -0.732 -4.006 -3.345 1.00 0.00 N ATOM 372 C5 G A 12 0.404 -4.148 -2.556 1.00 0.00 C ATOM 373 C6 G A 12 0.555 -4.022 -1.150 1.00 0.00 C ATOM 374 O6 G A 12 -0.303 -3.754 -0.312 1.00 0.00 O ATOM 375 N1 G A 12 1.863 -4.244 -0.756 1.00 0.00 N ATOM 376 C2 G A 12 2.903 -4.553 -1.605 1.00 0.00 C ATOM 377 N2 G A 12 4.102 -4.736 -1.053 1.00 0.00 N ATOM 378 N3 G A 12 2.772 -4.674 -2.928 1.00 0.00 N ATOM 379 C4 G A 12 1.496 -4.459 -3.330 1.00 0.00 C ATOM 0 H5' G A 12 -0.662 -5.955 -9.192 1.00 0.00 H new ATOM 0 H5'' G A 12 -1.003 -6.964 -7.800 1.00 0.00 H new ATOM 0 H4' G A 12 1.430 -5.989 -8.579 1.00 0.00 H new ATOM 0 H3' G A 12 0.474 -7.330 -6.047 1.00 0.00 H new ATOM 0 H2' G A 12 2.532 -6.663 -4.864 1.00 0.00 H new ATOM 0 HO2' G A 12 3.947 -7.225 -6.530 1.00 0.00 H new ATOM 0 H1' G A 12 2.708 -4.107 -5.795 1.00 0.00 H new ATOM 0 H8 G A 12 -0.946 -4.197 -5.423 1.00 0.00 H new ATOM 0 H1 G A 12 2.073 -4.173 0.240 1.00 0.00 H new ATOM 0 H21 G A 12 4.904 -4.967 -1.640 1.00 0.00 H new ATOM 0 H22 G A 12 4.218 -4.645 -0.044 1.00 0.00 H new ATOM 391 P U A 13 2.246 -9.397 -6.706 1.00 0.00 P ATOM 392 OP1 U A 13 2.756 -10.315 -7.750 1.00 0.00 O ATOM 393 OP2 U A 13 1.082 -9.792 -5.882 1.00 0.00 O ATOM 394 O5' U A 13 3.463 -9.032 -5.717 1.00 0.00 O ATOM 395 C5' U A 13 4.072 -10.041 -4.907 1.00 0.00 C ATOM 396 C4' U A 13 4.613 -9.468 -3.598 1.00 0.00 C ATOM 397 O4' U A 13 3.919 -8.260 -3.282 1.00 0.00 O ATOM 398 C3' U A 13 4.390 -10.350 -2.382 1.00 0.00 C ATOM 399 O3' U A 13 5.569 -11.149 -2.235 1.00 0.00 O ATOM 400 C2' U A 13 4.365 -9.364 -1.219 1.00 0.00 C ATOM 401 O2' U A 13 5.688 -9.129 -0.729 1.00 0.00 O ATOM 402 C1' U A 13 3.802 -8.091 -1.860 1.00 0.00 C ATOM 403 N1 U A 13 2.380 -7.856 -1.517 1.00 0.00 N ATOM 404 C2 U A 13 2.092 -7.474 -0.217 1.00 0.00 C ATOM 405 O2 U A 13 2.958 -7.357 0.647 1.00 0.00 O ATOM 406 N3 U A 13 0.762 -7.235 0.063 1.00 0.00 N ATOM 407 C4 U A 13 -0.291 -7.343 -0.827 1.00 0.00 C ATOM 408 O4 U A 13 -1.436 -7.100 -0.455 1.00 0.00 O ATOM 409 C5 U A 13 0.087 -7.748 -2.160 1.00 0.00 C ATOM 410 C6 U A 13 1.388 -7.988 -2.458 1.00 0.00 C ATOM 0 H5' U A 13 4.884 -10.511 -5.461 1.00 0.00 H new ATOM 0 H5'' U A 13 3.343 -10.821 -4.688 1.00 0.00 H new ATOM 0 H4' U A 13 5.682 -9.349 -3.777 1.00 0.00 H new ATOM 0 H3' U A 13 3.499 -10.975 -2.442 1.00 0.00 H new ATOM 0 H2' U A 13 3.782 -9.718 -0.368 1.00 0.00 H new ATOM 0 HO2' U A 13 6.274 -9.865 -1.003 1.00 0.00 H new ATOM 0 H1' U A 13 4.359 -7.230 -1.490 1.00 0.00 H new ATOM 0 H3 U A 13 0.534 -6.952 1.016 1.00 0.00 H new ATOM 0 H5 U A 13 -0.669 -7.860 -2.923 1.00 0.00 H new ATOM 0 H6 U A 13 1.651 -8.291 -3.461 1.00 0.00 H new ATOM 421 P C A 14 5.480 -12.756 -2.176 1.00 0.00 P ATOM 422 OP1 C A 14 6.793 -13.307 -2.576 1.00 0.00 O ATOM 423 OP2 C A 14 4.254 -13.183 -2.888 1.00 0.00 O ATOM 424 O5' C A 14 5.276 -13.036 -0.603 1.00 0.00 O ATOM 425 C5' C A 14 3.993 -12.876 0.006 1.00 0.00 C ATOM 426 C4' C A 14 4.112 -12.501 1.479 1.00 0.00 C ATOM 427 O4' C A 14 3.808 -11.113 1.635 1.00 0.00 O ATOM 428 C3' C A 14 3.128 -13.212 2.394 1.00 0.00 C ATOM 429 O3' C A 14 3.665 -14.463 2.831 1.00 0.00 O ATOM 430 C2' C A 14 3.015 -12.239 3.562 1.00 0.00 C ATOM 431 O2' C A 14 4.085 -12.437 4.490 1.00 0.00 O ATOM 432 C1' C A 14 3.138 -10.878 2.882 1.00 0.00 C ATOM 433 N1 C A 14 1.811 -10.287 2.619 1.00 0.00 N ATOM 434 C2 C A 14 1.179 -9.628 3.666 1.00 0.00 C ATOM 435 O2 C A 14 1.741 -9.506 4.753 1.00 0.00 O ATOM 436 N3 C A 14 -0.068 -9.124 3.459 1.00 0.00 N ATOM 437 C4 C A 14 -0.671 -9.261 2.273 1.00 0.00 C ATOM 438 N4 C A 14 -1.892 -8.746 2.133 1.00 0.00 N ATOM 439 C5 C A 14 -0.024 -9.938 1.193 1.00 0.00 C ATOM 440 C6 C A 14 1.207 -10.428 1.405 1.00 0.00 C ATOM 0 H5' C A 14 3.427 -13.802 -0.089 1.00 0.00 H new ATOM 0 H5'' C A 14 3.433 -12.104 -0.522 1.00 0.00 H new ATOM 0 H4' C A 14 5.129 -12.780 1.756 1.00 0.00 H new ATOM 0 H3' C A 14 2.174 -13.444 1.921 1.00 0.00 H new ATOM 0 H2' C A 14 2.095 -12.356 4.135 1.00 0.00 H new ATOM 0 HO2' C A 14 4.402 -13.362 4.431 1.00 0.00 H new ATOM 0 HO3' C A 14 3.021 -14.908 3.420 1.00 0.00 H new ATOM 0 H1' C A 14 3.682 -10.182 3.521 1.00 0.00 H new ATOM 0 H41 C A 14 -2.382 -8.831 1.243 1.00 0.00 H new ATOM 0 H42 C A 14 -2.336 -8.266 2.916 1.00 0.00 H new ATOM 0 H5 C A 14 -0.511 -10.052 0.236 1.00 0.00 H new ATOM 0 H6 C A 14 1.724 -10.939 0.606 1.00 0.00 H new TER 453 C A 14