USER MOD reduce.3.24.130724 H: found=0, std=0, add=164, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 164 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 -24:sc= 0.283 USER MOD Single : A 1 G O5' : rot 32:sc= 0.618 USER MOD Single : A 2 G O2' : rot 4:sc= -3.15! USER MOD Single : A 3 C O2' : rot -158:sc= 0.207 USER MOD Single : A 4 U O2' : rot -3:sc= -7.44! USER MOD Single : A 5 C O2' : rot -0:sc= -6.57! USER MOD Single : A 6 U O2' : rot -80:sc= 1.09 USER MOD Single : A 7 C O2' : rot 12:sc= 0.507 USER MOD Single : A 8 A O2' : rot 153:sc= 0.25 USER MOD Single : A 9 G O2' : rot -19:sc= 1.25 USER MOD Single : A 10 U O2' : rot 146:sc= 0.343 USER MOD Single : A 11 G O2' : rot -16:sc= 0.219 USER MOD Single : A 12 A O2' : rot -30:sc= 0.357 USER MOD Single : A 13 G O2' : rot -18:sc= 0.229 USER MOD Single : A 14 C O2' : rot -1:sc= -4.3! USER MOD Single : A 15 C O2' : rot -21:sc= 0.186 USER MOD Single : A 15 C O3' : rot 180:sc= 0.187 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -9.567 3.867 6.172 1.00 0.00 O ATOM 2 C5' G A 1 -10.962 3.650 6.399 1.00 0.00 C ATOM 3 C4' G A 1 -11.820 4.625 5.597 1.00 0.00 C ATOM 4 O4' G A 1 -11.633 5.975 6.045 1.00 0.00 O ATOM 5 C3' G A 1 -11.426 4.621 4.127 1.00 0.00 C ATOM 6 O3' G A 1 -12.285 3.712 3.435 1.00 0.00 O ATOM 7 C2' G A 1 -11.766 6.037 3.690 1.00 0.00 C ATOM 8 O2' G A 1 -13.156 6.173 3.379 1.00 0.00 O ATOM 9 C1' G A 1 -11.396 6.838 4.920 1.00 0.00 C ATOM 10 N9 G A 1 -9.987 7.276 4.859 1.00 0.00 N ATOM 11 C8 G A 1 -8.982 7.091 5.750 1.00 0.00 C ATOM 12 N7 G A 1 -7.823 7.578 5.457 1.00 0.00 N ATOM 13 C5 G A 1 -8.069 8.168 4.214 1.00 0.00 C ATOM 14 C6 G A 1 -7.187 8.876 3.353 1.00 0.00 C ATOM 15 O6 G A 1 -5.995 9.127 3.521 1.00 0.00 O ATOM 16 N1 G A 1 -7.833 9.302 2.201 1.00 0.00 N ATOM 17 C2 G A 1 -9.163 9.077 1.906 1.00 0.00 C ATOM 18 N2 G A 1 -9.599 9.568 0.747 1.00 0.00 N ATOM 19 N3 G A 1 -9.999 8.412 2.710 1.00 0.00 N ATOM 20 C4 G A 1 -9.392 7.987 3.841 1.00 0.00 C ATOM 0 H5' G A 1 -11.180 3.761 7.461 1.00 0.00 H new ATOM 0 H5'' G A 1 -11.221 2.627 6.126 1.00 0.00 H new ATOM 0 H4' G A 1 -12.851 4.300 5.736 1.00 0.00 H new ATOM 0 H3' G A 1 -10.390 4.336 3.941 1.00 0.00 H new ATOM 0 H2' G A 1 -11.249 6.352 2.784 1.00 0.00 H new ATOM 0 HO2' G A 1 -13.526 5.297 3.143 1.00 0.00 H new ATOM 0 HO5' G A 1 -9.408 4.818 5.999 1.00 0.00 H new ATOM 0 H1' G A 1 -11.991 7.748 4.998 1.00 0.00 H new ATOM 0 H8 G A 1 -9.145 6.555 6.673 1.00 0.00 H new ATOM 0 H1 G A 1 -7.282 9.822 1.518 1.00 0.00 H new ATOM 0 H21 G A 1 -10.572 9.436 0.471 1.00 0.00 H new ATOM 0 H22 G A 1 -8.960 10.076 0.136 1.00 0.00 H new ATOM 33 P G A 2 -11.669 2.482 2.599 1.00 0.00 P ATOM 34 OP1 G A 2 -12.623 1.352 2.664 1.00 0.00 O ATOM 35 OP2 G A 2 -10.265 2.288 3.026 1.00 0.00 O ATOM 36 O5' G A 2 -11.662 3.049 1.094 1.00 0.00 O ATOM 37 C5' G A 2 -12.888 3.366 0.435 1.00 0.00 C ATOM 38 C4' G A 2 -12.651 4.228 -0.798 1.00 0.00 C ATOM 39 O4' G A 2 -12.126 5.514 -0.438 1.00 0.00 O ATOM 40 C3' G A 2 -11.627 3.582 -1.724 1.00 0.00 C ATOM 41 O3' G A 2 -12.334 2.963 -2.801 1.00 0.00 O ATOM 42 C2' G A 2 -10.845 4.761 -2.281 1.00 0.00 C ATOM 43 O2' G A 2 -11.448 5.264 -3.479 1.00 0.00 O ATOM 44 C1' G A 2 -10.916 5.782 -1.155 1.00 0.00 C ATOM 45 N9 G A 2 -9.738 5.705 -0.260 1.00 0.00 N ATOM 46 C8 G A 2 -9.644 5.265 1.024 1.00 0.00 C ATOM 47 N7 G A 2 -8.490 5.337 1.598 1.00 0.00 N ATOM 48 C5 G A 2 -7.702 5.893 0.586 1.00 0.00 C ATOM 49 C6 G A 2 -6.320 6.227 0.589 1.00 0.00 C ATOM 50 O6 G A 2 -5.506 6.095 1.502 1.00 0.00 O ATOM 51 N1 G A 2 -5.921 6.764 -0.629 1.00 0.00 N ATOM 52 C2 G A 2 -6.744 6.957 -1.720 1.00 0.00 C ATOM 53 N2 G A 2 -6.173 7.486 -2.803 1.00 0.00 N ATOM 54 N3 G A 2 -8.046 6.645 -1.732 1.00 0.00 N ATOM 55 C4 G A 2 -8.458 6.120 -0.555 1.00 0.00 C ATOM 0 H5' G A 2 -13.549 3.890 1.125 1.00 0.00 H new ATOM 0 H5'' G A 2 -13.395 2.446 0.145 1.00 0.00 H new ATOM 0 H4' G A 2 -13.616 4.330 -1.294 1.00 0.00 H new ATOM 0 H3' G A 2 -10.997 2.842 -1.229 1.00 0.00 H new ATOM 0 H2' G A 2 -9.824 4.504 -2.562 1.00 0.00 H new ATOM 0 HO2' G A 2 -12.278 4.775 -3.658 1.00 0.00 H new ATOM 0 H1' G A 2 -10.912 6.794 -1.561 1.00 0.00 H new ATOM 0 H8 G A 2 -10.504 4.870 1.544 1.00 0.00 H new ATOM 0 H1 G A 2 -4.943 7.037 -0.724 1.00 0.00 H new ATOM 0 H21 G A 2 -6.728 7.653 -3.642 1.00 0.00 H new ATOM 0 H22 G A 2 -5.181 7.723 -2.792 1.00 0.00 H new ATOM 67 P C A 3 -11.784 1.605 -3.469 1.00 0.00 P ATOM 68 OP1 C A 3 -12.773 1.149 -4.473 1.00 0.00 O ATOM 69 OP2 C A 3 -11.359 0.691 -2.386 1.00 0.00 O ATOM 70 O5' C A 3 -10.471 2.109 -4.251 1.00 0.00 O ATOM 71 C5' C A 3 -10.579 3.108 -5.266 1.00 0.00 C ATOM 72 C4' C A 3 -9.217 3.476 -5.848 1.00 0.00 C ATOM 73 O4' C A 3 -8.482 4.327 -4.976 1.00 0.00 O ATOM 74 C3' C A 3 -8.336 2.257 -6.024 1.00 0.00 C ATOM 75 O3' C A 3 -8.601 1.683 -7.306 1.00 0.00 O ATOM 76 C2' C A 3 -6.937 2.853 -6.045 1.00 0.00 C ATOM 77 O2' C A 3 -6.535 3.191 -7.377 1.00 0.00 O ATOM 78 C1' C A 3 -7.077 4.104 -5.169 1.00 0.00 C ATOM 79 N1 C A 3 -6.393 3.912 -3.881 1.00 0.00 N ATOM 80 C2 C A 3 -5.033 4.167 -3.835 1.00 0.00 C ATOM 81 O2 C A 3 -4.443 4.548 -4.843 1.00 0.00 O ATOM 82 N3 C A 3 -4.384 3.982 -2.652 1.00 0.00 N ATOM 83 C4 C A 3 -5.045 3.566 -1.564 1.00 0.00 C ATOM 84 N4 C A 3 -4.381 3.391 -0.421 1.00 0.00 N ATOM 85 C5 C A 3 -6.451 3.304 -1.615 1.00 0.00 C ATOM 86 C6 C A 3 -7.079 3.491 -2.786 1.00 0.00 C ATOM 0 H5' C A 3 -11.049 3.999 -4.850 1.00 0.00 H new ATOM 0 H5'' C A 3 -11.229 2.747 -6.063 1.00 0.00 H new ATOM 0 H4' C A 3 -9.440 3.961 -6.798 1.00 0.00 H new ATOM 0 H3' C A 3 -8.483 1.493 -5.261 1.00 0.00 H new ATOM 0 H2' C A 3 -6.174 2.163 -5.684 1.00 0.00 H new ATOM 0 HO2' C A 3 -5.557 3.239 -7.421 1.00 0.00 H new ATOM 0 H1' C A 3 -6.616 4.968 -5.648 1.00 0.00 H new ATOM 0 H41 C A 3 -4.876 3.074 0.413 1.00 0.00 H new ATOM 0 H42 C A 3 -3.378 3.574 -0.381 1.00 0.00 H new ATOM 0 H5 C A 3 -6.988 2.967 -0.741 1.00 0.00 H new ATOM 0 H6 C A 3 -8.140 3.305 -2.859 1.00 0.00 H new ATOM 98 P U A 4 -8.185 0.159 -7.618 1.00 0.00 P ATOM 99 OP1 U A 4 -8.757 -0.218 -8.930 1.00 0.00 O ATOM 100 OP2 U A 4 -8.484 -0.655 -6.420 1.00 0.00 O ATOM 101 O5' U A 4 -6.584 0.256 -7.776 1.00 0.00 O ATOM 102 C5' U A 4 -6.011 0.840 -8.948 1.00 0.00 C ATOM 103 C4' U A 4 -4.583 1.322 -8.706 1.00 0.00 C ATOM 104 O4' U A 4 -4.434 1.911 -7.415 1.00 0.00 O ATOM 105 C3' U A 4 -3.599 0.170 -8.712 1.00 0.00 C ATOM 106 O3' U A 4 -3.180 -0.065 -10.059 1.00 0.00 O ATOM 107 C2' U A 4 -2.423 0.736 -7.935 1.00 0.00 C ATOM 108 O2' U A 4 -1.527 1.453 -8.792 1.00 0.00 O ATOM 109 C1' U A 4 -3.099 1.671 -6.930 1.00 0.00 C ATOM 110 N1 U A 4 -3.119 1.063 -5.587 1.00 0.00 N ATOM 111 C2 U A 4 -2.024 1.289 -4.774 1.00 0.00 C ATOM 112 O2 U A 4 -1.070 1.972 -5.139 1.00 0.00 O ATOM 113 N3 U A 4 -2.062 0.700 -3.525 1.00 0.00 N ATOM 114 C4 U A 4 -3.088 -0.087 -3.024 1.00 0.00 C ATOM 115 O4 U A 4 -3.019 -0.565 -1.894 1.00 0.00 O ATOM 116 C5 U A 4 -4.191 -0.268 -3.940 1.00 0.00 C ATOM 117 C6 U A 4 -4.176 0.301 -5.170 1.00 0.00 C ATOM 0 H5' U A 4 -6.627 1.679 -9.273 1.00 0.00 H new ATOM 0 H5'' U A 4 -6.015 0.109 -9.757 1.00 0.00 H new ATOM 0 H4' U A 4 -4.387 2.036 -9.506 1.00 0.00 H new ATOM 0 H3' U A 4 -3.999 -0.758 -8.304 1.00 0.00 H new ATOM 0 H2' U A 4 -1.809 -0.032 -7.464 1.00 0.00 H new ATOM 0 HO2' U A 4 -1.841 1.392 -9.718 1.00 0.00 H new ATOM 0 H1' U A 4 -2.553 2.610 -6.839 1.00 0.00 H new ATOM 0 H3 U A 4 -1.261 0.859 -2.914 1.00 0.00 H new ATOM 0 H5 U A 4 -5.039 -0.865 -3.640 1.00 0.00 H new ATOM 0 H6 U A 4 -5.015 0.150 -5.834 1.00 0.00 H new ATOM 128 P C A 5 -2.191 -1.288 -10.401 1.00 0.00 P ATOM 129 OP1 C A 5 -1.643 -1.075 -11.760 1.00 0.00 O ATOM 130 OP2 C A 5 -2.886 -2.553 -10.077 1.00 0.00 O ATOM 131 O5' C A 5 -1.000 -1.083 -9.336 1.00 0.00 O ATOM 132 C5' C A 5 0.084 -0.193 -9.616 1.00 0.00 C ATOM 133 C4' C A 5 1.333 -0.568 -8.823 1.00 0.00 C ATOM 134 O4' C A 5 1.192 -0.256 -7.440 1.00 0.00 O ATOM 135 C3' C A 5 1.574 -2.062 -8.856 1.00 0.00 C ATOM 136 O3' C A 5 2.368 -2.376 -10.002 1.00 0.00 O ATOM 137 C2' C A 5 2.412 -2.303 -7.610 1.00 0.00 C ATOM 138 O2' C A 5 3.811 -2.222 -7.899 1.00 0.00 O ATOM 139 C1' C A 5 1.971 -1.182 -6.663 1.00 0.00 C ATOM 140 N1 C A 5 1.186 -1.733 -5.541 1.00 0.00 N ATOM 141 C2 C A 5 1.805 -1.792 -4.304 1.00 0.00 C ATOM 142 O2 C A 5 2.950 -1.368 -4.166 1.00 0.00 O ATOM 143 N3 C A 5 1.113 -2.328 -3.261 1.00 0.00 N ATOM 144 C4 C A 5 -0.135 -2.785 -3.427 1.00 0.00 C ATOM 145 N4 C A 5 -0.782 -3.304 -2.384 1.00 0.00 N ATOM 146 C5 C A 5 -0.779 -2.723 -4.703 1.00 0.00 C ATOM 147 C6 C A 5 -0.086 -2.192 -5.728 1.00 0.00 C ATOM 0 H5' C A 5 -0.210 0.828 -9.373 1.00 0.00 H new ATOM 0 H5'' C A 5 0.308 -0.215 -10.682 1.00 0.00 H new ATOM 0 H4' C A 5 2.146 -0.008 -9.284 1.00 0.00 H new ATOM 0 H3' C A 5 0.658 -2.651 -8.894 1.00 0.00 H new ATOM 0 H2' C A 5 2.266 -3.297 -7.187 1.00 0.00 H new ATOM 0 HO2' C A 5 3.938 -2.034 -8.853 1.00 0.00 H new ATOM 0 H1' C A 5 2.832 -0.677 -6.226 1.00 0.00 H new ATOM 0 H41 C A 5 -1.733 -3.655 -2.497 1.00 0.00 H new ATOM 0 H42 C A 5 -0.326 -3.350 -1.473 1.00 0.00 H new ATOM 0 H5 C A 5 -1.786 -3.089 -4.839 1.00 0.00 H new ATOM 0 H6 C A 5 -0.540 -2.129 -6.706 1.00 0.00 H new ATOM 159 P U A 6 2.452 -3.894 -10.534 1.00 0.00 P ATOM 160 OP1 U A 6 3.510 -3.966 -11.566 1.00 0.00 O ATOM 161 OP2 U A 6 1.081 -4.352 -10.851 1.00 0.00 O ATOM 162 O5' U A 6 2.961 -4.693 -9.231 1.00 0.00 O ATOM 163 C5' U A 6 4.296 -4.514 -8.753 1.00 0.00 C ATOM 164 C4' U A 6 4.496 -5.140 -7.374 1.00 0.00 C ATOM 165 O4' U A 6 3.428 -4.822 -6.483 1.00 0.00 O ATOM 166 C3' U A 6 4.493 -6.653 -7.444 1.00 0.00 C ATOM 167 O3' U A 6 5.816 -7.102 -7.738 1.00 0.00 O ATOM 168 C2' U A 6 4.158 -7.047 -6.016 1.00 0.00 C ATOM 169 O2' U A 6 5.336 -7.123 -5.205 1.00 0.00 O ATOM 170 C1' U A 6 3.238 -5.911 -5.560 1.00 0.00 C ATOM 171 N1 U A 6 1.833 -6.359 -5.539 1.00 0.00 N ATOM 172 C2 U A 6 1.371 -6.935 -4.371 1.00 0.00 C ATOM 173 O2 U A 6 2.081 -7.049 -3.376 1.00 0.00 O ATOM 174 N3 U A 6 0.060 -7.376 -4.387 1.00 0.00 N ATOM 175 C4 U A 6 -0.817 -7.290 -5.453 1.00 0.00 C ATOM 176 O4 U A 6 -1.963 -7.720 -5.358 1.00 0.00 O ATOM 177 C5 U A 6 -0.251 -6.673 -6.632 1.00 0.00 C ATOM 178 C6 U A 6 1.031 -6.232 -6.640 1.00 0.00 C ATOM 0 H5' U A 6 4.525 -3.449 -8.705 1.00 0.00 H new ATOM 0 H5'' U A 6 4.997 -4.959 -9.459 1.00 0.00 H new ATOM 0 H4' U A 6 5.449 -4.744 -7.023 1.00 0.00 H new ATOM 0 H3' U A 6 3.814 -7.061 -8.193 1.00 0.00 H new ATOM 0 H2' U A 6 3.698 -8.032 -5.937 1.00 0.00 H new ATOM 0 HO2' U A 6 5.789 -7.977 -5.365 1.00 0.00 H new ATOM 0 H1' U A 6 3.479 -5.593 -4.546 1.00 0.00 H new ATOM 0 H3 U A 6 -0.293 -7.805 -3.532 1.00 0.00 H new ATOM 0 H5 U A 6 -0.858 -6.562 -7.518 1.00 0.00 H new ATOM 0 H6 U A 6 1.427 -5.771 -7.533 1.00 0.00 H new ATOM 189 P C A 7 6.145 -7.804 -9.149 1.00 0.00 P ATOM 190 OP1 C A 7 5.330 -7.148 -10.196 1.00 0.00 O ATOM 191 OP2 C A 7 6.072 -9.271 -8.965 1.00 0.00 O ATOM 192 O5' C A 7 7.684 -7.400 -9.378 1.00 0.00 O ATOM 193 C5' C A 7 8.363 -6.596 -8.413 1.00 0.00 C ATOM 194 C4' C A 7 9.711 -7.199 -8.029 1.00 0.00 C ATOM 195 O4' C A 7 10.578 -6.205 -7.494 1.00 0.00 O ATOM 196 C3' C A 7 9.554 -8.262 -6.940 1.00 0.00 C ATOM 197 O3' C A 7 9.934 -9.523 -7.496 1.00 0.00 O ATOM 198 C2' C A 7 10.577 -7.895 -5.863 1.00 0.00 C ATOM 199 O2' C A 7 11.376 -9.027 -5.499 1.00 0.00 O ATOM 200 C1' C A 7 11.422 -6.809 -6.523 1.00 0.00 C ATOM 201 N1 C A 7 11.895 -5.812 -5.539 1.00 0.00 N ATOM 202 C2 C A 7 13.255 -5.772 -5.285 1.00 0.00 C ATOM 203 O2 C A 7 14.012 -6.550 -5.861 1.00 0.00 O ATOM 204 N3 C A 7 13.719 -4.855 -4.393 1.00 0.00 N ATOM 205 C4 C A 7 12.884 -4.012 -3.774 1.00 0.00 C ATOM 206 N4 C A 7 13.375 -3.129 -2.906 1.00 0.00 N ATOM 207 C5 C A 7 11.477 -4.047 -4.031 1.00 0.00 C ATOM 208 C6 C A 7 11.025 -4.960 -4.917 1.00 0.00 C ATOM 0 H5' C A 7 7.743 -6.493 -7.523 1.00 0.00 H new ATOM 0 H5'' C A 7 8.513 -5.594 -8.814 1.00 0.00 H new ATOM 0 H4' C A 7 10.122 -7.634 -8.940 1.00 0.00 H new ATOM 0 H3' C A 7 8.537 -8.314 -6.551 1.00 0.00 H new ATOM 0 H2' C A 7 10.112 -7.560 -4.936 1.00 0.00 H new ATOM 0 HO2' C A 7 11.238 -9.747 -6.149 1.00 0.00 H new ATOM 0 H1' C A 7 12.321 -7.230 -6.973 1.00 0.00 H new ATOM 0 H41 C A 7 12.749 -2.481 -2.428 1.00 0.00 H new ATOM 0 H42 C A 7 14.377 -3.101 -2.719 1.00 0.00 H new ATOM 0 H5 C A 7 10.801 -3.367 -3.534 1.00 0.00 H new ATOM 0 H6 C A 7 9.969 -5.018 -5.136 1.00 0.00 H new ATOM 220 P A A 8 8.990 -10.812 -7.308 1.00 0.00 P ATOM 221 OP1 A A 8 9.784 -11.876 -6.654 1.00 0.00 O ATOM 222 OP2 A A 8 8.314 -11.083 -8.598 1.00 0.00 O ATOM 223 O5' A A 8 7.885 -10.288 -6.260 1.00 0.00 O ATOM 224 C5' A A 8 7.980 -10.633 -4.875 1.00 0.00 C ATOM 225 C4' A A 8 6.833 -10.032 -4.064 1.00 0.00 C ATOM 226 O4' A A 8 5.815 -9.492 -4.920 1.00 0.00 O ATOM 227 C3' A A 8 6.145 -11.091 -3.204 1.00 0.00 C ATOM 228 O3' A A 8 5.667 -10.455 -2.019 1.00 0.00 O ATOM 229 C2' A A 8 4.942 -11.504 -4.034 1.00 0.00 C ATOM 230 O2' A A 8 3.868 -11.968 -3.208 1.00 0.00 O ATOM 231 C1' A A 8 4.581 -10.207 -4.742 1.00 0.00 C ATOM 232 N9 A A 8 3.930 -10.475 -6.037 1.00 0.00 N ATOM 233 C8 A A 8 4.421 -10.362 -7.296 1.00 0.00 C ATOM 234 N7 A A 8 3.631 -10.656 -8.273 1.00 0.00 N ATOM 235 C5 A A 8 2.461 -11.011 -7.593 1.00 0.00 C ATOM 236 C6 A A 8 1.202 -11.436 -8.029 1.00 0.00 C ATOM 237 N6 A A 8 0.891 -11.583 -9.317 1.00 0.00 N ATOM 238 N1 A A 8 0.278 -11.702 -7.089 1.00 0.00 N ATOM 239 C2 A A 8 0.570 -11.559 -5.795 1.00 0.00 C ATOM 240 N3 A A 8 1.727 -11.165 -5.272 1.00 0.00 N ATOM 241 C4 A A 8 2.636 -10.904 -6.232 1.00 0.00 C ATOM 0 H5' A A 8 8.931 -10.281 -4.476 1.00 0.00 H new ATOM 0 H5'' A A 8 7.972 -11.718 -4.769 1.00 0.00 H new ATOM 0 H4' A A 8 7.281 -9.254 -3.446 1.00 0.00 H new ATOM 0 H3' A A 8 6.795 -11.924 -2.936 1.00 0.00 H new ATOM 0 H2' A A 8 5.144 -12.332 -4.714 1.00 0.00 H new ATOM 0 HO2' A A 8 3.015 -11.817 -3.666 1.00 0.00 H new ATOM 0 H1' A A 8 3.870 -9.623 -4.158 1.00 0.00 H new ATOM 0 H8 A A 8 5.436 -10.038 -7.474 1.00 0.00 H new ATOM 0 H61 A A 8 -0.042 -11.896 -9.584 1.00 0.00 H new ATOM 0 H62 A A 8 1.586 -11.382 -10.036 1.00 0.00 H new ATOM 0 H2 A A 8 -0.220 -11.789 -5.096 1.00 0.00 H new ATOM 253 P G A 9 5.611 -11.259 -0.628 1.00 0.00 P ATOM 254 OP1 G A 9 6.938 -11.873 -0.394 1.00 0.00 O ATOM 255 OP2 G A 9 4.396 -12.104 -0.631 1.00 0.00 O ATOM 256 O5' G A 9 5.405 -10.080 0.446 1.00 0.00 O ATOM 257 C5' G A 9 4.356 -10.156 1.413 1.00 0.00 C ATOM 258 C4' G A 9 4.791 -9.558 2.751 1.00 0.00 C ATOM 259 O4' G A 9 6.216 -9.431 2.782 1.00 0.00 O ATOM 260 C3' G A 9 4.223 -8.144 2.966 1.00 0.00 C ATOM 261 O3' G A 9 3.304 -8.198 4.060 1.00 0.00 O ATOM 262 C2' G A 9 5.429 -7.321 3.434 1.00 0.00 C ATOM 263 O2' G A 9 5.529 -7.301 4.864 1.00 0.00 O ATOM 264 C1' G A 9 6.586 -8.051 2.812 1.00 0.00 C ATOM 265 N9 G A 9 6.845 -7.506 1.470 1.00 0.00 N ATOM 266 C8 G A 9 7.967 -6.938 0.991 1.00 0.00 C ATOM 267 N7 G A 9 7.950 -6.490 -0.219 1.00 0.00 N ATOM 268 C5 G A 9 6.643 -6.792 -0.613 1.00 0.00 C ATOM 269 C6 G A 9 5.986 -6.554 -1.850 1.00 0.00 C ATOM 270 O6 G A 9 6.435 -6.022 -2.862 1.00 0.00 O ATOM 271 N1 G A 9 4.674 -7.013 -1.826 1.00 0.00 N ATOM 272 C2 G A 9 4.067 -7.626 -0.748 1.00 0.00 C ATOM 273 N2 G A 9 2.798 -8.002 -0.916 1.00 0.00 N ATOM 274 N3 G A 9 4.680 -7.851 0.418 1.00 0.00 N ATOM 275 C4 G A 9 5.958 -7.414 0.418 1.00 0.00 C ATOM 0 H5' G A 9 4.064 -11.196 1.555 1.00 0.00 H new ATOM 0 H5'' G A 9 3.478 -9.626 1.043 1.00 0.00 H new ATOM 0 H4' G A 9 4.419 -10.228 3.527 1.00 0.00 H new ATOM 0 H3' G A 9 3.734 -7.743 2.078 1.00 0.00 H new ATOM 0 H2' G A 9 5.374 -6.272 3.144 1.00 0.00 H new ATOM 0 HO2' G A 9 4.667 -7.554 5.256 1.00 0.00 H new ATOM 0 H1' G A 9 7.511 -7.932 3.375 1.00 0.00 H new ATOM 0 H8 G A 9 8.855 -6.859 1.601 1.00 0.00 H new ATOM 0 H1 G A 9 4.116 -6.887 -2.671 1.00 0.00 H new ATOM 0 H21 G A 9 2.297 -8.460 -0.155 1.00 0.00 H new ATOM 0 H22 G A 9 2.329 -7.831 -1.806 1.00 0.00 H new ATOM 287 P U A 10 1.716 -8.243 3.788 1.00 0.00 P ATOM 288 OP1 U A 10 1.032 -8.498 5.075 1.00 0.00 O ATOM 289 OP2 U A 10 1.471 -9.133 2.630 1.00 0.00 O ATOM 290 O5' U A 10 1.393 -6.731 3.336 1.00 0.00 O ATOM 291 C5' U A 10 0.304 -6.013 3.924 1.00 0.00 C ATOM 292 C4' U A 10 0.780 -5.093 5.043 1.00 0.00 C ATOM 293 O4' U A 10 -0.289 -4.271 5.526 1.00 0.00 O ATOM 294 C3' U A 10 1.279 -5.901 6.235 1.00 0.00 C ATOM 295 O3' U A 10 2.350 -5.179 6.846 1.00 0.00 O ATOM 296 C2' U A 10 0.098 -5.904 7.197 1.00 0.00 C ATOM 297 O2' U A 10 0.535 -5.972 8.560 1.00 0.00 O ATOM 298 C1' U A 10 -0.579 -4.576 6.897 1.00 0.00 C ATOM 299 N1 U A 10 -2.031 -4.670 7.112 1.00 0.00 N ATOM 300 C2 U A 10 -2.499 -4.476 8.397 1.00 0.00 C ATOM 301 O2 U A 10 -1.746 -4.229 9.337 1.00 0.00 O ATOM 302 N3 U A 10 -3.868 -4.575 8.565 1.00 0.00 N ATOM 303 C4 U A 10 -4.794 -4.849 7.572 1.00 0.00 C ATOM 304 O4 U A 10 -5.992 -4.914 7.835 1.00 0.00 O ATOM 305 C5 U A 10 -4.213 -5.037 6.261 1.00 0.00 C ATOM 306 C6 U A 10 -2.876 -4.943 6.074 1.00 0.00 C ATOM 0 H5' U A 10 -0.428 -6.718 4.318 1.00 0.00 H new ATOM 0 H5'' U A 10 -0.201 -5.425 3.158 1.00 0.00 H new ATOM 0 H4' U A 10 1.578 -4.482 4.622 1.00 0.00 H new ATOM 0 H3' U A 10 1.621 -6.901 5.967 1.00 0.00 H new ATOM 0 H2' U A 10 -0.561 -6.763 7.070 1.00 0.00 H new ATOM 0 HO2' U A 10 -0.078 -5.458 9.126 1.00 0.00 H new ATOM 0 H1' U A 10 -0.212 -3.792 7.559 1.00 0.00 H new ATOM 0 H3 U A 10 -4.230 -4.433 9.508 1.00 0.00 H new ATOM 0 H5 U A 10 -4.855 -5.255 5.420 1.00 0.00 H new ATOM 0 H6 U A 10 -2.469 -5.087 5.084 1.00 0.00 H new ATOM 317 P G A 11 3.800 -5.859 7.005 1.00 0.00 P ATOM 318 OP1 G A 11 3.728 -7.232 6.459 1.00 0.00 O ATOM 319 OP2 G A 11 4.265 -5.639 8.393 1.00 0.00 O ATOM 320 O5' G A 11 4.713 -4.970 6.022 1.00 0.00 O ATOM 321 C5' G A 11 5.167 -3.677 6.428 1.00 0.00 C ATOM 322 C4' G A 11 6.099 -3.057 5.388 1.00 0.00 C ATOM 323 O4' G A 11 6.280 -3.928 4.262 1.00 0.00 O ATOM 324 C3' G A 11 5.520 -1.766 4.818 1.00 0.00 C ATOM 325 O3' G A 11 6.048 -0.662 5.555 1.00 0.00 O ATOM 326 C2' G A 11 6.099 -1.738 3.419 1.00 0.00 C ATOM 327 O2' G A 11 7.449 -1.261 3.414 1.00 0.00 O ATOM 328 C1' G A 11 6.022 -3.208 3.046 1.00 0.00 C ATOM 329 N9 G A 11 4.689 -3.537 2.506 1.00 0.00 N ATOM 330 C8 G A 11 3.645 -4.160 3.106 1.00 0.00 C ATOM 331 N7 G A 11 2.561 -4.308 2.419 1.00 0.00 N ATOM 332 C5 G A 11 2.911 -3.713 1.203 1.00 0.00 C ATOM 333 C6 G A 11 2.147 -3.549 0.017 1.00 0.00 C ATOM 334 O6 G A 11 0.989 -3.904 -0.200 1.00 0.00 O ATOM 335 N1 G A 11 2.873 -2.898 -0.973 1.00 0.00 N ATOM 336 C2 G A 11 4.175 -2.456 -0.842 1.00 0.00 C ATOM 337 N2 G A 11 4.701 -1.852 -1.905 1.00 0.00 N ATOM 338 N3 G A 11 4.901 -2.606 0.271 1.00 0.00 N ATOM 339 C4 G A 11 4.213 -3.238 1.249 1.00 0.00 C ATOM 0 H5' G A 11 5.687 -3.756 7.383 1.00 0.00 H new ATOM 0 H5'' G A 11 4.310 -3.022 6.586 1.00 0.00 H new ATOM 0 H4' G A 11 7.039 -2.876 5.908 1.00 0.00 H new ATOM 0 H3' G A 11 4.432 -1.713 4.851 1.00 0.00 H new ATOM 0 H2' G A 11 5.579 -1.072 2.731 1.00 0.00 H new ATOM 0 HO2' G A 11 7.641 -0.813 4.264 1.00 0.00 H new ATOM 0 H1' G A 11 6.742 -3.469 2.270 1.00 0.00 H new ATOM 0 H8 G A 11 3.717 -4.520 4.122 1.00 0.00 H new ATOM 0 H1 G A 11 2.408 -2.734 -1.866 1.00 0.00 H new ATOM 0 H21 G A 11 5.659 -1.503 -1.871 1.00 0.00 H new ATOM 0 H22 G A 11 4.146 -1.738 -2.753 1.00 0.00 H new ATOM 351 P A A 12 5.164 0.667 5.756 1.00 0.00 P ATOM 352 OP1 A A 12 5.898 1.578 6.662 1.00 0.00 O ATOM 353 OP2 A A 12 3.779 0.259 6.080 1.00 0.00 O ATOM 354 O5' A A 12 5.167 1.310 4.281 1.00 0.00 O ATOM 355 C5' A A 12 6.362 1.890 3.753 1.00 0.00 C ATOM 356 C4' A A 12 6.321 1.990 2.232 1.00 0.00 C ATOM 357 O4' A A 12 5.771 0.818 1.638 1.00 0.00 O ATOM 358 C3' A A 12 5.409 3.107 1.771 1.00 0.00 C ATOM 359 O3' A A 12 6.152 4.330 1.749 1.00 0.00 O ATOM 360 C2' A A 12 5.108 2.700 0.335 1.00 0.00 C ATOM 361 O2' A A 12 6.107 3.186 -0.568 1.00 0.00 O ATOM 362 C1' A A 12 5.118 1.174 0.408 1.00 0.00 C ATOM 363 N9 A A 12 3.740 0.657 0.356 1.00 0.00 N ATOM 364 C8 A A 12 3.050 -0.070 1.267 1.00 0.00 C ATOM 365 N7 A A 12 1.836 -0.400 0.969 1.00 0.00 N ATOM 366 C5 A A 12 1.691 0.178 -0.298 1.00 0.00 C ATOM 367 C6 A A 12 0.629 0.215 -1.209 1.00 0.00 C ATOM 368 N6 A A 12 -0.546 -0.369 -0.981 1.00 0.00 N ATOM 369 N1 A A 12 0.828 0.875 -2.366 1.00 0.00 N ATOM 370 C2 A A 12 2.000 1.464 -2.615 1.00 0.00 C ATOM 371 N3 A A 12 3.068 1.490 -1.825 1.00 0.00 N ATOM 372 C4 A A 12 2.845 0.823 -0.674 1.00 0.00 C ATOM 0 H5' A A 12 7.221 1.290 4.054 1.00 0.00 H new ATOM 0 H5'' A A 12 6.502 2.884 4.179 1.00 0.00 H new ATOM 0 H4' A A 12 7.357 2.152 1.935 1.00 0.00 H new ATOM 0 H3' A A 12 4.527 3.251 2.395 1.00 0.00 H new ATOM 0 H2' A A 12 4.169 3.108 -0.040 1.00 0.00 H new ATOM 0 HO2' A A 12 6.485 4.020 -0.220 1.00 0.00 H new ATOM 0 H1' A A 12 5.651 0.737 -0.436 1.00 0.00 H new ATOM 0 H8 A A 12 3.497 -0.363 2.206 1.00 0.00 H new ATOM 0 H61 A A 12 -1.288 -0.312 -1.679 1.00 0.00 H new ATOM 0 H62 A A 12 -0.704 -0.873 -0.109 1.00 0.00 H new ATOM 0 H2 A A 12 2.090 1.975 -3.562 1.00 0.00 H new ATOM 384 P G A 13 5.394 5.743 1.914 1.00 0.00 P ATOM 385 OP1 G A 13 6.401 6.768 2.269 1.00 0.00 O ATOM 386 OP2 G A 13 4.214 5.538 2.785 1.00 0.00 O ATOM 387 O5' G A 13 4.873 6.045 0.419 1.00 0.00 O ATOM 388 C5' G A 13 5.673 6.814 -0.483 1.00 0.00 C ATOM 389 C4' G A 13 5.036 6.918 -1.866 1.00 0.00 C ATOM 390 O4' G A 13 4.550 5.646 -2.320 1.00 0.00 O ATOM 391 C3' G A 13 3.821 7.834 -1.850 1.00 0.00 C ATOM 392 O3' G A 13 4.234 9.158 -2.193 1.00 0.00 O ATOM 393 C2' G A 13 2.981 7.278 -2.982 1.00 0.00 C ATOM 394 O2' G A 13 3.441 7.735 -4.259 1.00 0.00 O ATOM 395 C1' G A 13 3.203 5.789 -2.806 1.00 0.00 C ATOM 396 N9 G A 13 2.231 5.244 -1.844 1.00 0.00 N ATOM 397 C8 G A 13 2.397 4.925 -0.539 1.00 0.00 C ATOM 398 N7 G A 13 1.368 4.496 0.111 1.00 0.00 N ATOM 399 C5 G A 13 0.377 4.527 -0.876 1.00 0.00 C ATOM 400 C6 G A 13 -0.996 4.173 -0.798 1.00 0.00 C ATOM 401 O6 G A 13 -1.623 3.754 0.173 1.00 0.00 O ATOM 402 N1 G A 13 -1.638 4.353 -2.016 1.00 0.00 N ATOM 403 C2 G A 13 -1.039 4.816 -3.170 1.00 0.00 C ATOM 404 N2 G A 13 -1.825 4.921 -4.240 1.00 0.00 N ATOM 405 N3 G A 13 0.253 5.151 -3.253 1.00 0.00 N ATOM 406 C4 G A 13 0.899 4.984 -2.078 1.00 0.00 C ATOM 0 H5' G A 13 6.659 6.358 -0.571 1.00 0.00 H new ATOM 0 H5'' G A 13 5.819 7.814 -0.075 1.00 0.00 H new ATOM 0 H4' G A 13 5.819 7.302 -2.520 1.00 0.00 H new ATOM 0 H3' G A 13 3.308 7.875 -0.889 1.00 0.00 H new ATOM 0 H2' G A 13 1.935 7.581 -2.953 1.00 0.00 H new ATOM 0 HO2' G A 13 4.008 8.525 -4.139 1.00 0.00 H new ATOM 0 H1' G A 13 3.065 5.242 -3.739 1.00 0.00 H new ATOM 0 H8 G A 13 3.359 5.026 -0.058 1.00 0.00 H new ATOM 0 H1 G A 13 -2.631 4.125 -2.061 1.00 0.00 H new ATOM 0 H21 G A 13 -1.442 5.257 -5.123 1.00 0.00 H new ATOM 0 H22 G A 13 -2.810 4.665 -4.176 1.00 0.00 H new ATOM 418 P C A 14 3.634 10.424 -1.400 1.00 0.00 P ATOM 419 OP1 C A 14 4.496 11.596 -1.676 1.00 0.00 O ATOM 420 OP2 C A 14 3.372 10.014 -0.003 1.00 0.00 O ATOM 421 O5' C A 14 2.217 10.657 -2.129 1.00 0.00 O ATOM 422 C5' C A 14 2.161 11.232 -3.437 1.00 0.00 C ATOM 423 C4' C A 14 0.900 10.806 -4.185 1.00 0.00 C ATOM 424 O4' C A 14 0.583 9.436 -3.948 1.00 0.00 O ATOM 425 C3' C A 14 -0.315 11.575 -3.701 1.00 0.00 C ATOM 426 O3' C A 14 -0.431 12.778 -4.464 1.00 0.00 O ATOM 427 C2' C A 14 -1.464 10.656 -4.079 1.00 0.00 C ATOM 428 O2' C A 14 -1.910 10.903 -5.418 1.00 0.00 O ATOM 429 C1' C A 14 -0.846 9.262 -3.947 1.00 0.00 C ATOM 430 N1 C A 14 -1.302 8.600 -2.708 1.00 0.00 N ATOM 431 C2 C A 14 -2.610 8.146 -2.673 1.00 0.00 C ATOM 432 O2 C A 14 -3.342 8.305 -3.646 1.00 0.00 O ATOM 433 N3 C A 14 -3.049 7.527 -1.542 1.00 0.00 N ATOM 434 C4 C A 14 -2.237 7.359 -0.489 1.00 0.00 C ATOM 435 N4 C A 14 -2.697 6.747 0.601 1.00 0.00 N ATOM 436 C5 C A 14 -0.886 7.827 -0.522 1.00 0.00 C ATOM 437 C6 C A 14 -0.461 8.439 -1.646 1.00 0.00 C ATOM 0 H5' C A 14 3.041 10.931 -4.005 1.00 0.00 H new ATOM 0 H5'' C A 14 2.189 12.319 -3.359 1.00 0.00 H new ATOM 0 H4' C A 14 1.113 10.995 -5.237 1.00 0.00 H new ATOM 0 H3' C A 14 -0.280 11.834 -2.643 1.00 0.00 H new ATOM 0 H2' C A 14 -2.347 10.795 -3.455 1.00 0.00 H new ATOM 0 HO2' C A 14 -1.390 11.638 -5.806 1.00 0.00 H new ATOM 0 H1' C A 14 -1.154 8.621 -4.773 1.00 0.00 H new ATOM 0 H41 C A 14 -2.087 6.614 1.407 1.00 0.00 H new ATOM 0 H42 C A 14 -3.660 6.411 0.629 1.00 0.00 H new ATOM 0 H5 C A 14 -0.228 7.695 0.325 1.00 0.00 H new ATOM 0 H6 C A 14 0.553 8.805 -1.706 1.00 0.00 H new ATOM 449 P C A 15 -1.158 14.072 -3.835 1.00 0.00 P ATOM 450 OP1 C A 15 -1.085 15.170 -4.824 1.00 0.00 O ATOM 451 OP2 C A 15 -0.635 14.276 -2.466 1.00 0.00 O ATOM 452 O5' C A 15 -2.693 13.595 -3.723 1.00 0.00 O ATOM 453 C5' C A 15 -3.416 13.201 -4.892 1.00 0.00 C ATOM 454 C4' C A 15 -4.921 13.150 -4.638 1.00 0.00 C ATOM 455 O4' C A 15 -5.298 11.912 -4.031 1.00 0.00 O ATOM 456 C3' C A 15 -5.351 14.246 -3.673 1.00 0.00 C ATOM 457 O3' C A 15 -5.700 15.450 -4.366 1.00 0.00 O ATOM 458 C2' C A 15 -6.559 13.626 -2.994 1.00 0.00 C ATOM 459 O2' C A 15 -7.753 13.831 -3.758 1.00 0.00 O ATOM 460 C1' C A 15 -6.185 12.150 -2.932 1.00 0.00 C ATOM 461 N1 C A 15 -5.539 11.811 -1.649 1.00 0.00 N ATOM 462 C2 C A 15 -6.325 11.208 -0.681 1.00 0.00 C ATOM 463 O2 C A 15 -7.515 10.995 -0.901 1.00 0.00 O ATOM 464 N3 C A 15 -5.745 10.866 0.502 1.00 0.00 N ATOM 465 C4 C A 15 -4.448 11.106 0.727 1.00 0.00 C ATOM 466 N4 C A 15 -3.912 10.752 1.896 1.00 0.00 N ATOM 467 C5 C A 15 -3.630 11.730 -0.269 1.00 0.00 C ATOM 468 C6 C A 15 -4.214 12.065 -1.437 1.00 0.00 C ATOM 0 H5' C A 15 -3.069 12.221 -5.221 1.00 0.00 H new ATOM 0 H5'' C A 15 -3.208 13.901 -5.701 1.00 0.00 H new ATOM 0 H4' C A 15 -5.399 13.273 -5.610 1.00 0.00 H new ATOM 0 H3' C A 15 -4.566 14.544 -2.978 1.00 0.00 H new ATOM 0 H2' C A 15 -6.775 14.059 -2.017 1.00 0.00 H new ATOM 0 HO2' C A 15 -7.627 14.590 -4.365 1.00 0.00 H new ATOM 0 HO3' C A 15 -5.973 16.133 -3.718 1.00 0.00 H new ATOM 0 H1' C A 15 -7.074 11.523 -2.999 1.00 0.00 H new ATOM 0 H41 C A 15 -2.924 10.930 2.079 1.00 0.00 H new ATOM 0 H42 C A 15 -4.490 10.303 2.607 1.00 0.00 H new ATOM 0 H5 C A 15 -2.583 11.925 -0.091 1.00 0.00 H new ATOM 0 H6 C A 15 -3.629 12.538 -2.212 1.00 0.00 H new TER 481 C A 15