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 -23:sc= 0.291 USER MOD Single : A 1 G O5' : rot 23:sc= 1.15 USER MOD Single : A 2 G O2' : rot -9:sc= -1.07 USER MOD Single : A 3 C O2' : rot -15:sc= 0.333 USER MOD Single : A 4 U O2' : rot 9:sc= -7.37! USER MOD Single : A 5 C O2' : rot 8:sc= -2.71! USER MOD Single : A 6 U O2' : rot 123:sc= 0.612 USER MOD Single : A 7 C O2' : rot 138:sc= 0.583 USER MOD Single : A 8 A O2' : rot 27:sc= 0.246 USER MOD Single : A 9 G O2' : rot -13:sc= 0.562 USER MOD Single : A 10 U O2' : rot 25:sc= 0.241 USER MOD Single : A 11 G O2' : rot -20:sc= 0.277 USER MOD Single : A 12 A O2' : rot -17:sc= 0.221 USER MOD Single : A 13 G O2' : rot -30:sc= 0.28 USER MOD Single : A 14 C O2' : rot -1:sc= -4.23! USER MOD Single : A 15 C O2' : rot -14:sc= 0.154 USER MOD Single : A 15 C O3' : rot 180:sc= 0.168 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -9.048 2.327 6.104 1.00 0.00 O ATOM 2 C5' G A 1 -10.384 1.821 6.177 1.00 0.00 C ATOM 3 C4' G A 1 -11.378 2.766 5.506 1.00 0.00 C ATOM 4 O4' G A 1 -11.353 4.066 6.117 1.00 0.00 O ATOM 5 C3' G A 1 -11.019 2.987 4.043 1.00 0.00 C ATOM 6 O3' G A 1 -11.801 2.094 3.245 1.00 0.00 O ATOM 7 C2' G A 1 -11.504 4.406 3.790 1.00 0.00 C ATOM 8 O2' G A 1 -12.906 4.440 3.500 1.00 0.00 O ATOM 9 C1' G A 1 -11.197 5.077 5.109 1.00 0.00 C ATOM 10 N9 G A 1 -9.831 5.641 5.107 1.00 0.00 N ATOM 11 C8 G A 1 -8.805 5.441 5.972 1.00 0.00 C ATOM 12 N7 G A 1 -7.695 6.056 5.735 1.00 0.00 N ATOM 13 C5 G A 1 -8.003 6.761 4.567 1.00 0.00 C ATOM 14 C6 G A 1 -7.195 7.636 3.794 1.00 0.00 C ATOM 15 O6 G A 1 -6.028 7.966 3.987 1.00 0.00 O ATOM 16 N1 G A 1 -7.889 8.135 2.697 1.00 0.00 N ATOM 17 C2 G A 1 -9.198 7.833 2.379 1.00 0.00 C ATOM 18 N2 G A 1 -9.688 8.413 1.284 1.00 0.00 N ATOM 19 N3 G A 1 -9.964 7.011 3.103 1.00 0.00 N ATOM 20 C4 G A 1 -9.310 6.512 4.176 1.00 0.00 C ATOM 0 H5' G A 1 -10.664 1.679 7.221 1.00 0.00 H new ATOM 0 H5'' G A 1 -10.430 0.843 5.698 1.00 0.00 H new ATOM 0 H4' G A 1 -12.357 2.299 5.610 1.00 0.00 H new ATOM 0 H3' G A 1 -9.964 2.830 3.816 1.00 0.00 H new ATOM 0 H2' G A 1 -11.034 4.884 2.930 1.00 0.00 H new ATOM 0 HO2' G A 1 -13.193 3.563 3.171 1.00 0.00 H new ATOM 0 HO5' G A 1 -9.073 3.300 5.988 1.00 0.00 H new ATOM 0 H1' G A 1 -11.867 5.916 5.297 1.00 0.00 H new ATOM 0 H8 G A 1 -8.913 4.791 6.828 1.00 0.00 H new ATOM 0 H1 G A 1 -7.391 8.775 2.078 1.00 0.00 H new ATOM 0 H21 G A 1 -10.649 8.230 0.996 1.00 0.00 H new ATOM 0 H22 G A 1 -9.102 9.040 0.733 1.00 0.00 H new ATOM 33 P G A 2 -11.111 1.231 2.075 1.00 0.00 P ATOM 34 OP1 G A 2 -12.011 0.106 1.736 1.00 0.00 O ATOM 35 OP2 G A 2 -9.708 0.963 2.463 1.00 0.00 O ATOM 36 O5' G A 2 -11.104 2.262 0.837 1.00 0.00 O ATOM 37 C5' G A 2 -12.268 2.422 0.023 1.00 0.00 C ATOM 38 C4' G A 2 -12.113 3.577 -0.960 1.00 0.00 C ATOM 39 O4' G A 2 -11.647 4.763 -0.302 1.00 0.00 O ATOM 40 C3' G A 2 -11.077 3.253 -2.026 1.00 0.00 C ATOM 41 O3' G A 2 -11.759 2.753 -3.180 1.00 0.00 O ATOM 42 C2' G A 2 -10.496 4.612 -2.365 1.00 0.00 C ATOM 43 O2' G A 2 -11.290 5.288 -3.346 1.00 0.00 O ATOM 44 C1' G A 2 -10.542 5.329 -1.025 1.00 0.00 C ATOM 45 N9 G A 2 -9.279 5.168 -0.273 1.00 0.00 N ATOM 46 C8 G A 2 -9.039 4.539 0.909 1.00 0.00 C ATOM 47 N7 G A 2 -7.833 4.566 1.366 1.00 0.00 N ATOM 48 C5 G A 2 -7.169 5.303 0.380 1.00 0.00 C ATOM 49 C6 G A 2 -5.803 5.688 0.294 1.00 0.00 C ATOM 50 O6 G A 2 -4.893 5.449 1.086 1.00 0.00 O ATOM 51 N1 G A 2 -5.552 6.422 -0.859 1.00 0.00 N ATOM 52 C2 G A 2 -6.493 6.748 -1.815 1.00 0.00 C ATOM 53 N2 G A 2 -6.059 7.464 -2.854 1.00 0.00 N ATOM 54 N3 G A 2 -7.779 6.391 -1.742 1.00 0.00 N ATOM 55 C4 G A 2 -8.049 5.674 -0.627 1.00 0.00 C ATOM 0 H5' G A 2 -13.135 2.599 0.659 1.00 0.00 H new ATOM 0 H5'' G A 2 -12.458 1.500 -0.526 1.00 0.00 H new ATOM 0 H4' G A 2 -13.098 3.733 -1.399 1.00 0.00 H new ATOM 0 H3' G A 2 -10.332 2.523 -1.709 1.00 0.00 H new ATOM 0 H2' G A 2 -9.497 4.563 -2.798 1.00 0.00 H new ATOM 0 HO2' G A 2 -11.969 4.674 -3.697 1.00 0.00 H new ATOM 0 H1' G A 2 -10.669 6.402 -1.169 1.00 0.00 H new ATOM 0 H8 G A 2 -9.830 4.035 1.445 1.00 0.00 H new ATOM 0 H1 G A 2 -4.597 6.746 -1.011 1.00 0.00 H new ATOM 0 H21 G A 2 -6.708 7.735 -3.593 1.00 0.00 H new ATOM 0 H22 G A 2 -5.079 7.740 -2.909 1.00 0.00 H new ATOM 67 P C A 3 -11.084 1.616 -4.097 1.00 0.00 P ATOM 68 OP1 C A 3 -12.043 1.251 -5.165 1.00 0.00 O ATOM 69 OP2 C A 3 -10.536 0.567 -3.208 1.00 0.00 O ATOM 70 O5' C A 3 -9.852 2.398 -4.776 1.00 0.00 O ATOM 71 C5' C A 3 -10.095 3.488 -5.668 1.00 0.00 C ATOM 72 C4' C A 3 -8.796 4.070 -6.218 1.00 0.00 C ATOM 73 O4' C A 3 -8.123 4.864 -5.243 1.00 0.00 O ATOM 74 C3' C A 3 -7.802 2.983 -6.575 1.00 0.00 C ATOM 75 O3' C A 3 -8.052 2.543 -7.912 1.00 0.00 O ATOM 76 C2' C A 3 -6.484 3.733 -6.554 1.00 0.00 C ATOM 77 O2' C A 3 -6.226 4.374 -7.810 1.00 0.00 O ATOM 78 C1' C A 3 -6.703 4.756 -5.437 1.00 0.00 C ATOM 79 N1 C A 3 -6.024 4.321 -4.204 1.00 0.00 N ATOM 80 C2 C A 3 -4.670 4.584 -4.104 1.00 0.00 C ATOM 81 O2 C A 3 -4.095 5.187 -5.008 1.00 0.00 O ATOM 82 N3 C A 3 -4.009 4.159 -2.991 1.00 0.00 N ATOM 83 C4 C A 3 -4.656 3.506 -2.017 1.00 0.00 C ATOM 84 N4 C A 3 -3.980 3.098 -0.941 1.00 0.00 N ATOM 85 C5 C A 3 -6.059 3.237 -2.118 1.00 0.00 C ATOM 86 C6 C A 3 -6.698 3.661 -3.222 1.00 0.00 C ATOM 0 H5' C A 3 -10.651 4.268 -5.147 1.00 0.00 H new ATOM 0 H5'' C A 3 -10.720 3.149 -6.494 1.00 0.00 H new ATOM 0 H4' C A 3 -9.094 4.654 -7.089 1.00 0.00 H new ATOM 0 H3' C A 3 -7.839 2.115 -5.917 1.00 0.00 H new ATOM 0 H2' C A 3 -5.621 3.089 -6.388 1.00 0.00 H new ATOM 0 HO2' C A 3 -6.828 4.011 -8.492 1.00 0.00 H new ATOM 0 H1' C A 3 -6.283 5.727 -5.701 1.00 0.00 H new ATOM 0 H41 C A 3 -4.463 2.600 -0.194 1.00 0.00 H new ATOM 0 H42 C A 3 -2.980 3.284 -0.866 1.00 0.00 H new ATOM 0 H5 C A 3 -6.585 2.712 -1.335 1.00 0.00 H new ATOM 0 H6 C A 3 -7.756 3.476 -3.331 1.00 0.00 H new ATOM 98 P U A 4 -7.621 1.059 -8.367 1.00 0.00 P ATOM 99 OP1 U A 4 -8.073 0.850 -9.761 1.00 0.00 O ATOM 100 OP2 U A 4 -8.039 0.114 -7.307 1.00 0.00 O ATOM 101 O5' U A 4 -6.011 1.138 -8.367 1.00 0.00 O ATOM 102 C5' U A 4 -5.314 1.635 -9.512 1.00 0.00 C ATOM 103 C4' U A 4 -3.836 1.889 -9.221 1.00 0.00 C ATOM 104 O4' U A 4 -3.633 2.440 -7.924 1.00 0.00 O ATOM 105 C3' U A 4 -3.039 0.601 -9.207 1.00 0.00 C ATOM 106 O3' U A 4 -2.626 0.297 -10.543 1.00 0.00 O ATOM 107 C2' U A 4 -1.805 0.980 -8.403 1.00 0.00 C ATOM 108 O2' U A 4 -0.758 1.468 -9.251 1.00 0.00 O ATOM 109 C1' U A 4 -2.319 2.078 -7.465 1.00 0.00 C ATOM 110 N1 U A 4 -2.349 1.588 -6.075 1.00 0.00 N ATOM 111 C2 U A 4 -1.177 1.677 -5.352 1.00 0.00 C ATOM 112 O2 U A 4 -0.157 2.176 -5.820 1.00 0.00 O ATOM 113 N3 U A 4 -1.215 1.170 -4.067 1.00 0.00 N ATOM 114 C4 U A 4 -2.310 0.592 -3.450 1.00 0.00 C ATOM 115 O4 U A 4 -2.232 0.170 -2.299 1.00 0.00 O ATOM 116 C5 U A 4 -3.493 0.542 -4.278 1.00 0.00 C ATOM 117 C6 U A 4 -3.480 1.032 -5.542 1.00 0.00 C ATOM 0 H5' U A 4 -5.781 2.561 -9.846 1.00 0.00 H new ATOM 0 H5'' U A 4 -5.404 0.919 -10.329 1.00 0.00 H new ATOM 0 H4' U A 4 -3.513 2.569 -10.009 1.00 0.00 H new ATOM 0 H3' U A 4 -3.590 -0.251 -8.809 1.00 0.00 H new ATOM 0 H2' U A 4 -1.369 0.134 -7.871 1.00 0.00 H new ATOM 0 HO2' U A 4 -1.104 1.593 -10.159 1.00 0.00 H new ATOM 0 H1' U A 4 -1.664 2.949 -7.478 1.00 0.00 H new ATOM 0 H3 U A 4 -0.355 1.227 -3.522 1.00 0.00 H new ATOM 0 H5 U A 4 -4.400 0.108 -3.884 1.00 0.00 H new ATOM 0 H6 U A 4 -4.379 0.983 -6.139 1.00 0.00 H new ATOM 128 P C A 5 -1.927 -1.116 -10.877 1.00 0.00 P ATOM 129 OP1 C A 5 -1.392 -1.054 -12.255 1.00 0.00 O ATOM 130 OP2 C A 5 -2.865 -2.196 -10.498 1.00 0.00 O ATOM 131 O5' C A 5 -0.682 -1.147 -9.852 1.00 0.00 O ATOM 132 C5' C A 5 0.513 -0.419 -10.145 1.00 0.00 C ATOM 133 C4' C A 5 1.636 -0.740 -9.161 1.00 0.00 C ATOM 134 O4' C A 5 1.322 -0.326 -7.839 1.00 0.00 O ATOM 135 C3' C A 5 1.862 -2.232 -9.042 1.00 0.00 C ATOM 136 O3' C A 5 2.765 -2.643 -10.070 1.00 0.00 O ATOM 137 C2' C A 5 2.572 -2.355 -7.702 1.00 0.00 C ATOM 138 O2' C A 5 3.993 -2.278 -7.855 1.00 0.00 O ATOM 139 C1' C A 5 2.033 -1.160 -6.908 1.00 0.00 C ATOM 140 N1 C A 5 1.153 -1.615 -5.818 1.00 0.00 N ATOM 141 C2 C A 5 1.707 -1.713 -4.553 1.00 0.00 C ATOM 142 O2 C A 5 2.887 -1.419 -4.375 1.00 0.00 O ATOM 143 N3 C A 5 0.915 -2.141 -3.533 1.00 0.00 N ATOM 144 C4 C A 5 -0.369 -2.459 -3.745 1.00 0.00 C ATOM 145 N4 C A 5 -1.115 -2.876 -2.722 1.00 0.00 N ATOM 146 C5 C A 5 -0.945 -2.358 -5.052 1.00 0.00 C ATOM 147 C6 C A 5 -0.152 -1.934 -6.054 1.00 0.00 C ATOM 0 H5' C A 5 0.302 0.650 -10.118 1.00 0.00 H new ATOM 0 H5'' C A 5 0.841 -0.653 -11.158 1.00 0.00 H new ATOM 0 H4' C A 5 2.508 -0.217 -9.555 1.00 0.00 H new ATOM 0 H3' C A 5 0.951 -2.824 -9.121 1.00 0.00 H new ATOM 0 H2' C A 5 2.390 -3.311 -7.211 1.00 0.00 H new ATOM 0 HO2' C A 5 4.210 -2.032 -8.779 1.00 0.00 H new ATOM 0 H1' C A 5 2.845 -0.602 -6.441 1.00 0.00 H new ATOM 0 H41 C A 5 -2.094 -3.121 -2.871 1.00 0.00 H new ATOM 0 H42 C A 5 -0.707 -2.950 -1.790 1.00 0.00 H new ATOM 0 H5 C A 5 -1.980 -2.613 -5.228 1.00 0.00 H new ATOM 0 H6 C A 5 -0.553 -1.846 -7.053 1.00 0.00 H new ATOM 159 P U A 6 2.809 -4.182 -10.542 1.00 0.00 P ATOM 160 OP1 U A 6 3.907 -4.333 -11.525 1.00 0.00 O ATOM 161 OP2 U A 6 1.434 -4.595 -10.902 1.00 0.00 O ATOM 162 O5' U A 6 3.231 -4.953 -9.192 1.00 0.00 O ATOM 163 C5' U A 6 4.572 -4.873 -8.701 1.00 0.00 C ATOM 164 C4' U A 6 4.696 -5.433 -7.285 1.00 0.00 C ATOM 165 O4' U A 6 3.578 -5.082 -6.476 1.00 0.00 O ATOM 166 C3' U A 6 4.705 -6.948 -7.286 1.00 0.00 C ATOM 167 O3' U A 6 6.051 -7.396 -7.465 1.00 0.00 O ATOM 168 C2' U A 6 4.262 -7.290 -5.871 1.00 0.00 C ATOM 169 O2' U A 6 5.383 -7.415 -4.988 1.00 0.00 O ATOM 170 C1' U A 6 3.376 -6.100 -5.480 1.00 0.00 C ATOM 171 N1 U A 6 1.960 -6.509 -5.410 1.00 0.00 N ATOM 172 C2 U A 6 1.541 -7.148 -4.259 1.00 0.00 C ATOM 173 O2 U A 6 2.297 -7.349 -3.312 1.00 0.00 O ATOM 174 N3 U A 6 0.218 -7.548 -4.233 1.00 0.00 N ATOM 175 C4 U A 6 -0.711 -7.365 -5.243 1.00 0.00 C ATOM 176 O4 U A 6 -1.865 -7.769 -5.112 1.00 0.00 O ATOM 177 C5 U A 6 -0.187 -6.686 -6.407 1.00 0.00 C ATOM 178 C6 U A 6 1.106 -6.285 -6.456 1.00 0.00 C ATOM 0 H5' U A 6 4.900 -3.834 -8.710 1.00 0.00 H new ATOM 0 H5'' U A 6 5.236 -5.423 -9.368 1.00 0.00 H new ATOM 0 H4' U A 6 5.625 -5.015 -6.897 1.00 0.00 H new ATOM 0 H3' U A 6 4.084 -7.394 -8.063 1.00 0.00 H new ATOM 0 H2' U A 6 3.742 -8.246 -5.810 1.00 0.00 H new ATOM 0 HO2' U A 6 5.283 -6.788 -4.241 1.00 0.00 H new ATOM 0 H1' U A 6 3.641 -5.721 -4.493 1.00 0.00 H new ATOM 0 H3 U A 6 -0.104 -8.023 -3.390 1.00 0.00 H new ATOM 0 H5 U A 6 -0.836 -6.496 -7.249 1.00 0.00 H new ATOM 0 H6 U A 6 1.470 -5.779 -7.338 1.00 0.00 H new ATOM 189 P C A 7 6.404 -8.458 -8.622 1.00 0.00 P ATOM 190 OP1 C A 7 6.314 -7.767 -9.928 1.00 0.00 O ATOM 191 OP2 C A 7 5.611 -9.685 -8.381 1.00 0.00 O ATOM 192 O5' C A 7 7.952 -8.793 -8.335 1.00 0.00 O ATOM 193 C5' C A 7 8.923 -7.746 -8.300 1.00 0.00 C ATOM 194 C4' C A 7 9.548 -7.610 -6.916 1.00 0.00 C ATOM 195 O4' C A 7 10.389 -6.458 -6.847 1.00 0.00 O ATOM 196 C3' C A 7 8.466 -7.438 -5.849 1.00 0.00 C ATOM 197 O3' C A 7 8.710 -8.398 -4.816 1.00 0.00 O ATOM 198 C2' C A 7 8.695 -6.044 -5.272 1.00 0.00 C ATOM 199 O2' C A 7 8.495 -6.025 -3.855 1.00 0.00 O ATOM 200 C1' C A 7 10.144 -5.754 -5.633 1.00 0.00 C ATOM 201 N1 C A 7 10.368 -4.308 -5.809 1.00 0.00 N ATOM 202 C2 C A 7 10.197 -3.493 -4.700 1.00 0.00 C ATOM 203 O2 C A 7 9.868 -3.982 -3.623 1.00 0.00 O ATOM 204 N3 C A 7 10.402 -2.155 -4.846 1.00 0.00 N ATOM 205 C4 C A 7 10.760 -1.638 -6.030 1.00 0.00 C ATOM 206 N4 C A 7 10.955 -0.324 -6.136 1.00 0.00 N ATOM 207 C5 C A 7 10.937 -2.477 -7.176 1.00 0.00 C ATOM 208 C6 C A 7 10.731 -3.798 -7.020 1.00 0.00 C ATOM 0 H5' C A 7 8.454 -6.804 -8.583 1.00 0.00 H new ATOM 0 H5'' C A 7 9.703 -7.947 -9.035 1.00 0.00 H new ATOM 0 H4' C A 7 10.126 -8.517 -6.739 1.00 0.00 H new ATOM 0 H3' C A 7 7.458 -7.566 -6.243 1.00 0.00 H new ATOM 0 H2' C A 7 8.001 -5.301 -5.664 1.00 0.00 H new ATOM 0 HO2' C A 7 9.193 -5.482 -3.433 1.00 0.00 H new ATOM 0 H1' C A 7 10.822 -6.073 -4.841 1.00 0.00 H new ATOM 0 H41 C A 7 11.228 0.080 -7.032 1.00 0.00 H new ATOM 0 H42 C A 7 10.832 0.277 -5.321 1.00 0.00 H new ATOM 0 H5 C A 7 11.226 -2.065 -8.132 1.00 0.00 H new ATOM 0 H6 C A 7 10.855 -4.461 -7.863 1.00 0.00 H new ATOM 220 P A A 8 8.252 -9.931 -5.005 1.00 0.00 P ATOM 221 OP1 A A 8 9.118 -10.781 -4.157 1.00 0.00 O ATOM 222 OP2 A A 8 8.141 -10.206 -6.455 1.00 0.00 O ATOM 223 O5' A A 8 6.770 -9.940 -4.377 1.00 0.00 O ATOM 224 C5' A A 8 6.474 -10.753 -3.238 1.00 0.00 C ATOM 225 C4' A A 8 5.047 -10.526 -2.740 1.00 0.00 C ATOM 226 O4' A A 8 4.215 -9.975 -3.775 1.00 0.00 O ATOM 227 C3' A A 8 4.391 -11.842 -2.317 1.00 0.00 C ATOM 228 O3' A A 8 3.530 -11.573 -1.205 1.00 0.00 O ATOM 229 C2' A A 8 3.521 -12.220 -3.507 1.00 0.00 C ATOM 230 O2' A A 8 2.374 -12.976 -3.100 1.00 0.00 O ATOM 231 C1' A A 8 3.123 -10.864 -4.067 1.00 0.00 C ATOM 232 N9 A A 8 2.866 -10.944 -5.519 1.00 0.00 N ATOM 233 C8 A A 8 3.694 -10.713 -6.568 1.00 0.00 C ATOM 234 N7 A A 8 3.203 -10.853 -7.756 1.00 0.00 N ATOM 235 C5 A A 8 1.882 -11.223 -7.474 1.00 0.00 C ATOM 236 C6 A A 8 0.786 -11.533 -8.288 1.00 0.00 C ATOM 237 N6 A A 8 0.840 -11.519 -9.621 1.00 0.00 N ATOM 238 N1 A A 8 -0.370 -11.856 -7.676 1.00 0.00 N ATOM 239 C2 A A 8 -0.444 -11.875 -6.344 1.00 0.00 C ATOM 240 N3 A A 8 0.530 -11.600 -5.482 1.00 0.00 N ATOM 241 C4 A A 8 1.674 -11.280 -6.116 1.00 0.00 C ATOM 0 H5' A A 8 7.179 -10.529 -2.438 1.00 0.00 H new ATOM 0 H5'' A A 8 6.607 -11.804 -3.496 1.00 0.00 H new ATOM 0 H4' A A 8 5.128 -9.840 -1.897 1.00 0.00 H new ATOM 0 H3' A A 8 5.110 -12.615 -2.045 1.00 0.00 H new ATOM 0 H2' A A 8 4.030 -12.856 -4.231 1.00 0.00 H new ATOM 0 HO2' A A 8 2.145 -12.750 -2.174 1.00 0.00 H new ATOM 0 H1' A A 8 2.197 -10.506 -3.617 1.00 0.00 H new ATOM 0 H8 A A 8 4.723 -10.423 -6.417 1.00 0.00 H new ATOM 0 H61 A A 8 0.011 -11.753 -10.167 1.00 0.00 H new ATOM 0 H62 A A 8 1.710 -11.274 -10.094 1.00 0.00 H new ATOM 0 H2 A A 8 -1.400 -12.143 -5.919 1.00 0.00 H new ATOM 253 P G A 9 3.838 -12.211 0.242 1.00 0.00 P ATOM 254 OP1 G A 9 4.825 -13.300 0.067 1.00 0.00 O ATOM 255 OP2 G A 9 2.546 -12.487 0.910 1.00 0.00 O ATOM 256 O5' G A 9 4.558 -10.997 1.016 1.00 0.00 O ATOM 257 C5' G A 9 3.824 -10.177 1.932 1.00 0.00 C ATOM 258 C4' G A 9 4.694 -9.754 3.118 1.00 0.00 C ATOM 259 O4' G A 9 6.074 -9.773 2.741 1.00 0.00 O ATOM 260 C3' G A 9 4.376 -8.327 3.588 1.00 0.00 C ATOM 261 O3' G A 9 3.819 -8.418 4.903 1.00 0.00 O ATOM 262 C2' G A 9 5.741 -7.642 3.730 1.00 0.00 C ATOM 263 O2' G A 9 6.185 -7.654 5.091 1.00 0.00 O ATOM 264 C1' G A 9 6.657 -8.472 2.851 1.00 0.00 C ATOM 265 N9 G A 9 6.836 -7.832 1.532 1.00 0.00 N ATOM 266 C8 G A 9 7.929 -7.215 1.031 1.00 0.00 C ATOM 267 N7 G A 9 7.849 -6.716 -0.157 1.00 0.00 N ATOM 268 C5 G A 9 6.535 -7.030 -0.509 1.00 0.00 C ATOM 269 C6 G A 9 5.823 -6.752 -1.707 1.00 0.00 C ATOM 270 O6 G A 9 6.221 -6.164 -2.711 1.00 0.00 O ATOM 271 N1 G A 9 4.525 -7.242 -1.655 1.00 0.00 N ATOM 272 C2 G A 9 3.973 -7.916 -0.586 1.00 0.00 C ATOM 273 N2 G A 9 2.706 -8.308 -0.727 1.00 0.00 N ATOM 274 N3 G A 9 4.636 -8.182 0.547 1.00 0.00 N ATOM 275 C4 G A 9 5.903 -7.715 0.521 1.00 0.00 C ATOM 0 H5' G A 9 2.952 -10.722 2.294 1.00 0.00 H new ATOM 0 H5'' G A 9 3.454 -9.291 1.415 1.00 0.00 H new ATOM 0 H4' G A 9 4.486 -10.458 3.924 1.00 0.00 H new ATOM 0 H3' G A 9 3.699 -7.804 2.913 1.00 0.00 H new ATOM 0 H2' G A 9 5.716 -6.592 3.438 1.00 0.00 H new ATOM 0 HO2' G A 9 5.439 -7.901 5.676 1.00 0.00 H new ATOM 0 H1' G A 9 7.653 -8.551 3.288 1.00 0.00 H new ATOM 0 H8 G A 9 8.840 -7.142 1.606 1.00 0.00 H new ATOM 0 H1 G A 9 3.933 -7.092 -2.472 1.00 0.00 H new ATOM 0 H21 G A 9 2.241 -8.811 0.028 1.00 0.00 H new ATOM 0 H22 G A 9 2.202 -8.104 -1.590 1.00 0.00 H new ATOM 287 P U A 10 2.224 -8.353 5.124 1.00 0.00 P ATOM 288 OP1 U A 10 1.743 -9.715 5.443 1.00 0.00 O ATOM 289 OP2 U A 10 1.630 -7.608 3.991 1.00 0.00 O ATOM 290 O5' U A 10 2.086 -7.448 6.450 1.00 0.00 O ATOM 291 C5' U A 10 0.798 -7.026 6.910 1.00 0.00 C ATOM 292 C4' U A 10 0.671 -5.506 6.902 1.00 0.00 C ATOM 293 O4' U A 10 -0.689 -5.101 6.703 1.00 0.00 O ATOM 294 C3' U A 10 1.104 -4.915 8.238 1.00 0.00 C ATOM 295 O3' U A 10 1.673 -3.626 7.992 1.00 0.00 O ATOM 296 C2' U A 10 -0.203 -4.721 8.993 1.00 0.00 C ATOM 297 O2' U A 10 -0.124 -3.619 9.905 1.00 0.00 O ATOM 298 C1' U A 10 -1.196 -4.443 7.873 1.00 0.00 C ATOM 299 N1 U A 10 -2.533 -4.954 8.221 1.00 0.00 N ATOM 300 C2 U A 10 -3.385 -4.103 8.896 1.00 0.00 C ATOM 301 O2 U A 10 -3.062 -2.955 9.195 1.00 0.00 O ATOM 302 N3 U A 10 -4.630 -4.617 9.217 1.00 0.00 N ATOM 303 C4 U A 10 -5.085 -5.891 8.925 1.00 0.00 C ATOM 304 O4 U A 10 -6.213 -6.244 9.259 1.00 0.00 O ATOM 305 C5 U A 10 -4.127 -6.710 8.217 1.00 0.00 C ATOM 306 C6 U A 10 -2.905 -6.228 7.893 1.00 0.00 C ATOM 0 H5' U A 10 0.631 -7.401 7.920 1.00 0.00 H new ATOM 0 H5'' U A 10 0.024 -7.460 6.277 1.00 0.00 H new ATOM 0 H4' U A 10 1.306 -5.150 6.091 1.00 0.00 H new ATOM 0 H3' U A 10 1.824 -5.534 8.772 1.00 0.00 H new ATOM 0 H2' U A 10 -0.475 -5.577 9.611 1.00 0.00 H new ATOM 0 HO2' U A 10 0.556 -2.985 9.594 1.00 0.00 H new ATOM 0 H1' U A 10 -1.302 -3.372 7.703 1.00 0.00 H new ATOM 0 H3 U A 10 -5.271 -3.999 9.715 1.00 0.00 H new ATOM 0 H5 U A 10 -4.390 -7.721 7.943 1.00 0.00 H new ATOM 0 H6 U A 10 -2.209 -6.863 7.364 1.00 0.00 H new ATOM 317 P G A 11 3.197 -3.318 8.406 1.00 0.00 P ATOM 318 OP1 G A 11 3.653 -4.389 9.321 1.00 0.00 O ATOM 319 OP2 G A 11 3.285 -1.902 8.824 1.00 0.00 O ATOM 320 O5' G A 11 3.980 -3.482 7.010 1.00 0.00 O ATOM 321 C5' G A 11 4.095 -2.378 6.107 1.00 0.00 C ATOM 322 C4' G A 11 5.301 -2.535 5.185 1.00 0.00 C ATOM 323 O4' G A 11 5.286 -3.812 4.528 1.00 0.00 O ATOM 324 C3' G A 11 5.284 -1.487 4.071 1.00 0.00 C ATOM 325 O3' G A 11 6.176 -0.425 4.424 1.00 0.00 O ATOM 326 C2' G A 11 5.873 -2.239 2.893 1.00 0.00 C ATOM 327 O2' G A 11 7.304 -2.262 2.940 1.00 0.00 O ATOM 328 C1' G A 11 5.284 -3.618 3.109 1.00 0.00 C ATOM 329 N9 G A 11 3.916 -3.694 2.563 1.00 0.00 N ATOM 330 C8 G A 11 2.765 -4.093 3.161 1.00 0.00 C ATOM 331 N7 G A 11 1.685 -4.067 2.456 1.00 0.00 N ATOM 332 C5 G A 11 2.156 -3.591 1.228 1.00 0.00 C ATOM 333 C6 G A 11 1.453 -3.335 0.020 1.00 0.00 C ATOM 334 O6 G A 11 0.255 -3.481 -0.211 1.00 0.00 O ATOM 335 N1 G A 11 2.303 -2.864 -0.975 1.00 0.00 N ATOM 336 C2 G A 11 3.661 -2.662 -0.831 1.00 0.00 C ATOM 337 N2 G A 11 4.307 -2.202 -1.902 1.00 0.00 N ATOM 338 N3 G A 11 4.329 -2.901 0.302 1.00 0.00 N ATOM 339 C4 G A 11 3.523 -3.361 1.286 1.00 0.00 C ATOM 0 H5' G A 11 4.186 -1.451 6.673 1.00 0.00 H new ATOM 0 H5'' G A 11 3.187 -2.298 5.510 1.00 0.00 H new ATOM 0 H4' G A 11 6.183 -2.425 5.817 1.00 0.00 H new ATOM 0 H3' G A 11 4.298 -1.064 3.880 1.00 0.00 H new ATOM 0 H2' G A 11 5.646 -1.800 1.922 1.00 0.00 H new ATOM 0 HO2' G A 11 7.624 -1.537 3.517 1.00 0.00 H new ATOM 0 H1' G A 11 5.858 -4.391 2.598 1.00 0.00 H new ATOM 0 H8 G A 11 2.754 -4.421 4.190 1.00 0.00 H new ATOM 0 H1 G A 11 1.890 -2.651 -1.883 1.00 0.00 H new ATOM 0 H21 G A 11 5.312 -2.033 -1.858 1.00 0.00 H new ATOM 0 H22 G A 11 3.797 -2.019 -2.766 1.00 0.00 H new ATOM 351 P A A 12 5.611 1.058 4.712 1.00 0.00 P ATOM 352 OP1 A A 12 6.529 1.725 5.662 1.00 0.00 O ATOM 353 OP2 A A 12 4.170 0.951 5.033 1.00 0.00 O ATOM 354 O5' A A 12 5.756 1.785 3.280 1.00 0.00 O ATOM 355 C5' A A 12 6.977 2.441 2.927 1.00 0.00 C ATOM 356 C4' A A 12 7.224 2.420 1.418 1.00 0.00 C ATOM 357 O4' A A 12 6.837 1.167 0.839 1.00 0.00 O ATOM 358 C3' A A 12 6.384 3.458 0.694 1.00 0.00 C ATOM 359 O3' A A 12 7.111 4.691 0.656 1.00 0.00 O ATOM 360 C2' A A 12 6.330 2.885 -0.711 1.00 0.00 C ATOM 361 O2' A A 12 7.533 3.162 -1.438 1.00 0.00 O ATOM 362 C1' A A 12 6.184 1.397 -0.425 1.00 0.00 C ATOM 363 N9 A A 12 4.758 1.010 -0.370 1.00 0.00 N ATOM 364 C8 A A 12 4.076 0.358 0.601 1.00 0.00 C ATOM 365 N7 A A 12 2.827 0.104 0.389 1.00 0.00 N ATOM 366 C5 A A 12 2.640 0.655 -0.882 1.00 0.00 C ATOM 367 C6 A A 12 1.525 0.740 -1.724 1.00 0.00 C ATOM 368 N6 A A 12 0.329 0.242 -1.407 1.00 0.00 N ATOM 369 N1 A A 12 1.691 1.353 -2.910 1.00 0.00 N ATOM 370 C2 A A 12 2.880 1.854 -3.250 1.00 0.00 C ATOM 371 N3 A A 12 4.000 1.829 -2.532 1.00 0.00 N ATOM 372 C4 A A 12 3.809 1.211 -1.350 1.00 0.00 C ATOM 0 H5' A A 12 7.809 1.956 3.437 1.00 0.00 H new ATOM 0 H5'' A A 12 6.947 3.474 3.275 1.00 0.00 H new ATOM 0 H4' A A 12 8.291 2.612 1.303 1.00 0.00 H new ATOM 0 H3' A A 12 5.410 3.648 1.145 1.00 0.00 H new ATOM 0 H2' A A 12 5.534 3.300 -1.329 1.00 0.00 H new ATOM 0 HO2' A A 12 8.025 3.884 -0.993 1.00 0.00 H new ATOM 0 H1' A A 12 6.635 0.794 -1.213 1.00 0.00 H new ATOM 0 H8 A A 12 4.559 0.061 1.520 1.00 0.00 H new ATOM 0 H61 A A 12 -0.450 0.332 -2.059 1.00 0.00 H new ATOM 0 H62 A A 12 0.194 -0.229 -0.512 1.00 0.00 H new ATOM 0 H2 A A 12 2.940 2.333 -4.216 1.00 0.00 H new ATOM 384 P G A 13 6.400 6.070 1.089 1.00 0.00 P ATOM 385 OP1 G A 13 7.456 7.079 1.329 1.00 0.00 O ATOM 386 OP2 G A 13 5.412 5.769 2.150 1.00 0.00 O ATOM 387 O5' G A 13 5.598 6.489 -0.241 1.00 0.00 O ATOM 388 C5' G A 13 6.213 7.326 -1.223 1.00 0.00 C ATOM 389 C4' G A 13 5.379 7.412 -2.497 1.00 0.00 C ATOM 390 O4' G A 13 4.951 6.118 -2.935 1.00 0.00 O ATOM 391 C3' G A 13 4.102 8.203 -2.266 1.00 0.00 C ATOM 392 O3' G A 13 4.352 9.575 -2.581 1.00 0.00 O ATOM 393 C2' G A 13 3.166 7.630 -3.312 1.00 0.00 C ATOM 394 O2' G A 13 3.367 8.242 -4.591 1.00 0.00 O ATOM 395 C1' G A 13 3.565 6.164 -3.323 1.00 0.00 C ATOM 396 N9 G A 13 2.722 5.397 -2.385 1.00 0.00 N ATOM 397 C8 G A 13 3.043 4.824 -1.198 1.00 0.00 C ATOM 398 N7 G A 13 2.100 4.236 -0.543 1.00 0.00 N ATOM 399 C5 G A 13 1.002 4.429 -1.385 1.00 0.00 C ATOM 400 C6 G A 13 -0.349 4.016 -1.230 1.00 0.00 C ATOM 401 O6 G A 13 -0.854 3.387 -0.303 1.00 0.00 O ATOM 402 N1 G A 13 -1.130 4.417 -2.305 1.00 0.00 N ATOM 403 C2 G A 13 -0.674 5.126 -3.398 1.00 0.00 C ATOM 404 N2 G A 13 -1.580 5.418 -4.327 1.00 0.00 N ATOM 405 N3 G A 13 0.595 5.519 -3.553 1.00 0.00 N ATOM 406 C4 G A 13 1.375 5.140 -2.517 1.00 0.00 C ATOM 0 H5' G A 13 7.203 6.938 -1.462 1.00 0.00 H new ATOM 0 H5'' G A 13 6.353 8.326 -0.812 1.00 0.00 H new ATOM 0 H4' G A 13 6.022 7.889 -3.237 1.00 0.00 H new ATOM 0 H3' G A 13 3.720 8.144 -1.247 1.00 0.00 H new ATOM 0 H2' G A 13 2.111 7.795 -3.094 1.00 0.00 H new ATOM 0 HO2' G A 13 3.680 9.162 -4.468 1.00 0.00 H new ATOM 0 H1' G A 13 3.426 5.718 -4.308 1.00 0.00 H new ATOM 0 H8 G A 13 4.052 4.859 -0.815 1.00 0.00 H new ATOM 0 H1 G A 13 -2.119 4.168 -2.286 1.00 0.00 H new ATOM 0 H21 G A 13 -1.307 5.940 -5.159 1.00 0.00 H new ATOM 0 H22 G A 13 -2.548 5.120 -4.207 1.00 0.00 H new ATOM 418 P C A 14 3.735 10.744 -1.662 1.00 0.00 P ATOM 419 OP1 C A 14 4.400 12.016 -2.022 1.00 0.00 O ATOM 420 OP2 C A 14 3.740 10.279 -0.257 1.00 0.00 O ATOM 421 O5' C A 14 2.207 10.814 -2.164 1.00 0.00 O ATOM 422 C5' C A 14 1.878 11.477 -3.388 1.00 0.00 C ATOM 423 C4' C A 14 0.530 11.018 -3.937 1.00 0.00 C ATOM 424 O4' C A 14 0.359 9.607 -3.801 1.00 0.00 O ATOM 425 C3' C A 14 -0.619 11.627 -3.157 1.00 0.00 C ATOM 426 O3' C A 14 -0.963 12.879 -3.761 1.00 0.00 O ATOM 427 C2' C A 14 -1.753 10.646 -3.404 1.00 0.00 C ATOM 428 O2' C A 14 -2.483 10.976 -4.591 1.00 0.00 O ATOM 429 C1' C A 14 -1.025 9.308 -3.552 1.00 0.00 C ATOM 430 N1 C A 14 -1.185 8.493 -2.334 1.00 0.00 N ATOM 431 C2 C A 14 -2.420 7.902 -2.124 1.00 0.00 C ATOM 432 O2 C A 14 -3.324 8.063 -2.939 1.00 0.00 O ATOM 433 N3 C A 14 -2.595 7.151 -1.004 1.00 0.00 N ATOM 434 C4 C A 14 -1.599 6.985 -0.124 1.00 0.00 C ATOM 435 N4 C A 14 -1.806 6.243 0.964 1.00 0.00 N ATOM 436 C5 C A 14 -0.321 7.593 -0.336 1.00 0.00 C ATOM 437 C6 C A 14 -0.158 8.335 -1.449 1.00 0.00 C ATOM 0 H5' C A 14 2.656 11.284 -4.127 1.00 0.00 H new ATOM 0 H5'' C A 14 1.856 12.554 -3.223 1.00 0.00 H new ATOM 0 H4' C A 14 0.524 11.326 -4.982 1.00 0.00 H new ATOM 0 H3' C A 14 -0.399 11.793 -2.102 1.00 0.00 H new ATOM 0 H2' C A 14 -2.497 10.644 -2.607 1.00 0.00 H new ATOM 0 HO2' C A 14 -2.104 11.785 -4.994 1.00 0.00 H new ATOM 0 H1' C A 14 -1.441 8.727 -4.375 1.00 0.00 H new ATOM 0 H41 C A 14 -1.055 6.110 1.641 1.00 0.00 H new ATOM 0 H42 C A 14 -2.716 5.809 1.119 1.00 0.00 H new ATOM 0 H5 C A 14 0.485 7.462 0.371 1.00 0.00 H new ATOM 0 H6 C A 14 0.793 8.809 -1.642 1.00 0.00 H new ATOM 449 P C A 15 -1.458 14.115 -2.855 1.00 0.00 P ATOM 450 OP1 C A 15 -1.275 15.360 -3.634 1.00 0.00 O ATOM 451 OP2 C A 15 -0.843 13.986 -1.515 1.00 0.00 O ATOM 452 O5' C A 15 -3.038 13.838 -2.712 1.00 0.00 O ATOM 453 C5' C A 15 -3.792 13.363 -3.829 1.00 0.00 C ATOM 454 C4' C A 15 -5.290 13.367 -3.540 1.00 0.00 C ATOM 455 O4' C A 15 -5.747 12.062 -3.177 1.00 0.00 O ATOM 456 C3' C A 15 -5.619 14.274 -2.363 1.00 0.00 C ATOM 457 O3' C A 15 -5.873 15.617 -2.791 1.00 0.00 O ATOM 458 C2' C A 15 -6.869 13.625 -1.796 1.00 0.00 C ATOM 459 O2' C A 15 -8.046 14.073 -2.477 1.00 0.00 O ATOM 460 C1' C A 15 -6.616 12.142 -2.040 1.00 0.00 C ATOM 461 N1 C A 15 -6.005 11.504 -0.860 1.00 0.00 N ATOM 462 C2 C A 15 -6.834 10.758 -0.038 1.00 0.00 C ATOM 463 O2 C A 15 -8.030 10.654 -0.301 1.00 0.00 O ATOM 464 N3 C A 15 -6.289 10.154 1.052 1.00 0.00 N ATOM 465 C4 C A 15 -4.984 10.277 1.325 1.00 0.00 C ATOM 466 N4 C A 15 -4.480 9.670 2.400 1.00 0.00 N ATOM 467 C5 C A 15 -4.123 11.045 0.482 1.00 0.00 C ATOM 468 C6 C A 15 -4.671 11.639 -0.596 1.00 0.00 C ATOM 0 H5' C A 15 -3.472 12.352 -4.080 1.00 0.00 H new ATOM 0 H5'' C A 15 -3.587 13.988 -4.699 1.00 0.00 H new ATOM 0 H4' C A 15 -5.775 13.715 -4.452 1.00 0.00 H new ATOM 0 H3' C A 15 -4.808 14.363 -1.640 1.00 0.00 H new ATOM 0 H2' C A 15 -7.043 13.867 -0.747 1.00 0.00 H new ATOM 0 HO2' C A 15 -7.833 14.866 -3.012 1.00 0.00 H new ATOM 0 HO3' C A 15 -6.083 16.174 -2.013 1.00 0.00 H new ATOM 0 H1' C A 15 -7.551 11.612 -2.223 1.00 0.00 H new ATOM 0 H41 C A 15 -3.487 9.758 2.617 1.00 0.00 H new ATOM 0 H42 C A 15 -5.087 9.118 3.006 1.00 0.00 H new ATOM 0 H5 C A 15 -3.070 11.146 0.701 1.00 0.00 H new ATOM 0 H6 C A 15 -4.051 12.227 -1.257 1.00 0.00 H new TER 481 C A 15