USER MOD reduce.3.24.130724 H: found=0, std=0, add=163, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 163 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= 0.0881 USER MOD Single : A 1 G O5' : rot -34:sc= 0.0722 USER MOD Single : A 2 A O2' : rot -19:sc= -0.105 USER MOD Single : A 3 G O2' : rot -22:sc= 0.0776 USER MOD Single : A 4 A O2' : rot 180:sc= -2.48! USER MOD Single : A 5 G O2' : rot -19:sc= 0.082 USER MOD Single : A 6 U O2' : rot -157:sc= -2.81! USER MOD Single : A 7 U O2' : rot 180:sc= -0.549 USER MOD Single : A 8 G O2' : rot 23:sc= 0.233 USER MOD Single : A 9 G O2' : rot 180:sc= -0.476 USER MOD Single : A 10 G O2' : rot 180:sc= -2.8! USER MOD Single : A 11 C O2' : rot -131:sc= 0.986 USER MOD Single : A 12 U O2' : rot -161:sc= -3.8! USER MOD Single : A 13 C O2' : rot 180:sc= -0.585 USER MOD Single : A 14 U O2' : rot 180:sc= -0.101 USER MOD Single : A 15 C O2' : rot -16:sc= 0.0897 USER MOD Single : A 15 C O3' : rot 180:sc= 0.089 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -3.393 -10.343 -8.014 1.00 0.00 O ATOM 2 C5' G A 1 -4.052 -9.270 -7.338 1.00 0.00 C ATOM 3 C4' G A 1 -4.758 -9.772 -6.101 1.00 0.00 C ATOM 4 O4' G A 1 -3.827 -10.567 -5.321 1.00 0.00 O ATOM 5 C3' G A 1 -5.240 -8.692 -5.142 1.00 0.00 C ATOM 6 O3' G A 1 -6.534 -8.220 -5.503 1.00 0.00 O ATOM 7 C2' G A 1 -5.238 -9.413 -3.799 1.00 0.00 C ATOM 8 O2' G A 1 -6.385 -10.228 -3.654 1.00 0.00 O ATOM 9 C1' G A 1 -4.014 -10.313 -3.939 1.00 0.00 C ATOM 10 N9 G A 1 -2.779 -9.737 -3.415 1.00 0.00 N ATOM 11 C8 G A 1 -2.300 -8.464 -3.611 1.00 0.00 C ATOM 12 N7 G A 1 -1.134 -8.264 -3.059 1.00 0.00 N ATOM 13 C5 G A 1 -0.844 -9.468 -2.430 1.00 0.00 C ATOM 14 C6 G A 1 0.281 -9.853 -1.653 1.00 0.00 C ATOM 15 O6 G A 1 1.287 -9.194 -1.369 1.00 0.00 O ATOM 16 N1 G A 1 0.161 -11.159 -1.195 1.00 0.00 N ATOM 17 C2 G A 1 -0.899 -11.989 -1.452 1.00 0.00 C ATOM 18 N2 G A 1 -0.830 -13.207 -0.918 1.00 0.00 N ATOM 19 N3 G A 1 -1.948 -11.648 -2.177 1.00 0.00 N ATOM 20 C4 G A 1 -1.857 -10.381 -2.628 1.00 0.00 C ATOM 0 H5' G A 1 -4.772 -8.799 -8.008 1.00 0.00 H new ATOM 0 H5'' G A 1 -3.325 -8.506 -7.063 1.00 0.00 H new ATOM 0 H4' G A 1 -5.625 -10.312 -6.482 1.00 0.00 H new ATOM 0 H3' G A 1 -4.618 -7.797 -5.140 1.00 0.00 H new ATOM 0 H2' G A 1 -5.228 -8.734 -2.946 1.00 0.00 H new ATOM 0 HO2' G A 1 -7.065 -9.954 -4.304 1.00 0.00 H new ATOM 0 HO5' G A 1 -3.063 -10.990 -7.356 1.00 0.00 H new ATOM 0 H1' G A 1 -4.210 -11.212 -3.354 1.00 0.00 H new ATOM 0 H8 G A 1 -2.834 -7.706 -4.165 1.00 0.00 H new ATOM 0 H1 G A 1 0.920 -11.529 -0.623 1.00 0.00 H new ATOM 0 H21 G A 1 -1.586 -13.874 -1.071 1.00 0.00 H new ATOM 0 H22 G A 1 -0.021 -13.472 -0.356 1.00 0.00 H new ATOM 33 P A A 2 -7.004 -6.752 -5.047 1.00 0.00 P ATOM 34 OP1 A A 2 -8.380 -6.551 -5.566 1.00 0.00 O ATOM 35 OP2 A A 2 -5.935 -5.786 -5.410 1.00 0.00 O ATOM 36 O5' A A 2 -7.083 -6.852 -3.460 1.00 0.00 O ATOM 37 C5' A A 2 -5.967 -6.503 -2.647 1.00 0.00 C ATOM 38 C4' A A 2 -5.989 -7.302 -1.366 1.00 0.00 C ATOM 39 O4' A A 2 -4.906 -8.274 -1.391 1.00 0.00 O ATOM 40 C3' A A 2 -5.748 -6.481 -0.109 1.00 0.00 C ATOM 41 O3' A A 2 -6.970 -5.954 0.404 1.00 0.00 O ATOM 42 C2' A A 2 -5.109 -7.495 0.832 1.00 0.00 C ATOM 43 O2' A A 2 -6.076 -8.366 1.385 1.00 0.00 O ATOM 44 C1' A A 2 -4.238 -8.279 -0.142 1.00 0.00 C ATOM 45 N9 A A 2 -2.913 -7.692 -0.325 1.00 0.00 N ATOM 46 C8 A A 2 -2.554 -6.715 -1.216 1.00 0.00 C ATOM 47 N7 A A 2 -1.290 -6.378 -1.149 1.00 0.00 N ATOM 48 C5 A A 2 -0.780 -7.195 -0.149 1.00 0.00 C ATOM 49 C6 A A 2 0.504 -7.330 0.396 1.00 0.00 C ATOM 50 N6 A A 2 1.555 -6.612 -0.004 1.00 0.00 N ATOM 51 N1 A A 2 0.678 -8.238 1.381 1.00 0.00 N ATOM 52 C2 A A 2 -0.381 -8.955 1.784 1.00 0.00 C ATOM 53 N3 A A 2 -1.636 -8.918 1.348 1.00 0.00 N ATOM 54 C4 A A 2 -1.770 -8.007 0.369 1.00 0.00 C ATOM 0 H5' A A 2 -5.991 -5.437 -2.420 1.00 0.00 H new ATOM 0 H5'' A A 2 -5.040 -6.693 -3.188 1.00 0.00 H new ATOM 0 H4' A A 2 -6.987 -7.739 -1.324 1.00 0.00 H new ATOM 0 H3' A A 2 -5.122 -5.603 -0.267 1.00 0.00 H new ATOM 0 H2' A A 2 -4.590 -7.041 1.677 1.00 0.00 H new ATOM 0 HO2' A A 2 -6.965 -7.963 1.301 1.00 0.00 H new ATOM 0 H1' A A 2 -4.090 -9.282 0.259 1.00 0.00 H new ATOM 0 H8 A A 2 -3.249 -6.264 -1.909 1.00 0.00 H new ATOM 0 H61 A A 2 2.466 -6.755 0.431 1.00 0.00 H new ATOM 0 H62 A A 2 1.447 -5.920 -0.745 1.00 0.00 H new ATOM 0 H2 A A 2 -0.186 -9.663 2.576 1.00 0.00 H new ATOM 66 P G A 3 -7.034 -4.436 0.936 1.00 0.00 P ATOM 67 OP1 G A 3 -8.318 -3.861 0.459 1.00 0.00 O ATOM 68 OP2 G A 3 -5.759 -3.751 0.601 1.00 0.00 O ATOM 69 O5' G A 3 -7.129 -4.583 2.520 1.00 0.00 O ATOM 70 C5' G A 3 -6.697 -5.774 3.181 1.00 0.00 C ATOM 71 C4' G A 3 -5.958 -5.425 4.453 1.00 0.00 C ATOM 72 O4' G A 3 -4.667 -6.101 4.445 1.00 0.00 O ATOM 73 C3' G A 3 -5.634 -3.947 4.624 1.00 0.00 C ATOM 74 O3' G A 3 -6.687 -3.261 5.296 1.00 0.00 O ATOM 75 C2' G A 3 -4.343 -3.976 5.433 1.00 0.00 C ATOM 76 O2' G A 3 -4.600 -4.229 6.801 1.00 0.00 O ATOM 77 C1' G A 3 -3.649 -5.194 4.830 1.00 0.00 C ATOM 78 N9 G A 3 -2.835 -4.896 3.657 1.00 0.00 N ATOM 79 C8 G A 3 -3.288 -4.560 2.408 1.00 0.00 C ATOM 80 N7 G A 3 -2.328 -4.362 1.546 1.00 0.00 N ATOM 81 C5 G A 3 -1.167 -4.575 2.277 1.00 0.00 C ATOM 82 C6 G A 3 0.195 -4.501 1.882 1.00 0.00 C ATOM 83 O6 G A 3 0.663 -4.222 0.772 1.00 0.00 O ATOM 84 N1 G A 3 1.052 -4.792 2.940 1.00 0.00 N ATOM 85 C2 G A 3 0.650 -5.109 4.213 1.00 0.00 C ATOM 86 N2 G A 3 1.626 -5.357 5.094 1.00 0.00 N ATOM 87 N3 G A 3 -0.614 -5.179 4.595 1.00 0.00 N ATOM 88 C4 G A 3 -1.462 -4.902 3.583 1.00 0.00 C ATOM 0 H5' G A 3 -6.048 -6.350 2.521 1.00 0.00 H new ATOM 0 H5'' G A 3 -7.557 -6.403 3.412 1.00 0.00 H new ATOM 0 H4' G A 3 -6.627 -5.728 5.259 1.00 0.00 H new ATOM 0 H3' G A 3 -5.524 -3.409 3.682 1.00 0.00 H new ATOM 0 H2' G A 3 -3.783 -3.042 5.393 1.00 0.00 H new ATOM 0 HO2' G A 3 -5.527 -3.990 7.009 1.00 0.00 H new ATOM 0 H1' G A 3 -2.969 -5.594 5.582 1.00 0.00 H new ATOM 0 H8 G A 3 -4.335 -4.468 2.161 1.00 0.00 H new ATOM 0 H1 G A 3 2.055 -4.768 2.755 1.00 0.00 H new ATOM 0 H21 G A 3 1.394 -5.599 6.057 1.00 0.00 H new ATOM 0 H22 G A 3 2.602 -5.304 4.802 1.00 0.00 H new ATOM 100 P A A 4 -7.140 -1.802 4.791 1.00 0.00 P ATOM 101 OP1 A A 4 -8.308 -1.377 5.605 1.00 0.00 O ATOM 102 OP2 A A 4 -7.258 -1.849 3.311 1.00 0.00 O ATOM 103 O5' A A 4 -5.903 -0.870 5.168 1.00 0.00 O ATOM 104 C5' A A 4 -4.740 -0.814 4.340 1.00 0.00 C ATOM 105 C4' A A 4 -3.498 -0.801 5.199 1.00 0.00 C ATOM 106 O4' A A 4 -2.601 -1.852 4.749 1.00 0.00 O ATOM 107 C3' A A 4 -2.666 0.472 5.145 1.00 0.00 C ATOM 108 O3' A A 4 -3.146 1.437 6.078 1.00 0.00 O ATOM 109 C2' A A 4 -1.268 -0.030 5.487 1.00 0.00 C ATOM 110 O2' A A 4 -1.122 -0.230 6.882 1.00 0.00 O ATOM 111 C1' A A 4 -1.262 -1.397 4.804 1.00 0.00 C ATOM 112 N9 A A 4 -0.737 -1.387 3.439 1.00 0.00 N ATOM 113 C8 A A 4 -1.466 -1.495 2.285 1.00 0.00 C ATOM 114 N7 A A 4 -0.739 -1.483 1.195 1.00 0.00 N ATOM 115 C5 A A 4 0.560 -1.352 1.665 1.00 0.00 C ATOM 116 C6 A A 4 1.799 -1.282 1.008 1.00 0.00 C ATOM 117 N6 A A 4 1.933 -1.339 -0.317 1.00 0.00 N ATOM 118 N1 A A 4 2.908 -1.153 1.767 1.00 0.00 N ATOM 119 C2 A A 4 2.767 -1.094 3.099 1.00 0.00 C ATOM 120 N3 A A 4 1.658 -1.154 3.832 1.00 0.00 N ATOM 121 C4 A A 4 0.576 -1.285 3.045 1.00 0.00 C ATOM 0 H5' A A 4 -4.770 0.079 3.715 1.00 0.00 H new ATOM 0 H5'' A A 4 -4.719 -1.672 3.668 1.00 0.00 H new ATOM 0 H4' A A 4 -3.877 -0.917 6.214 1.00 0.00 H new ATOM 0 H3' A A 4 -2.701 0.986 4.184 1.00 0.00 H new ATOM 0 H2' A A 4 -0.479 0.658 5.182 1.00 0.00 H new ATOM 0 HO2' A A 4 -0.217 -0.553 7.073 1.00 0.00 H new ATOM 0 H1' A A 4 -0.605 -2.042 5.388 1.00 0.00 H new ATOM 0 H8 A A 4 -2.542 -1.582 2.274 1.00 0.00 H new ATOM 0 H61 A A 4 2.860 -1.283 -0.739 1.00 0.00 H new ATOM 0 H62 A A 4 1.108 -1.439 -0.909 1.00 0.00 H new ATOM 0 H2 A A 4 3.685 -0.982 3.657 1.00 0.00 H new ATOM 133 P G A 5 -3.023 3.008 5.747 1.00 0.00 P ATOM 134 OP1 G A 5 -3.992 3.740 6.602 1.00 0.00 O ATOM 135 OP2 G A 5 -3.079 3.169 4.271 1.00 0.00 O ATOM 136 O5' G A 5 -1.552 3.388 6.223 1.00 0.00 O ATOM 137 C5' G A 5 -0.971 2.783 7.376 1.00 0.00 C ATOM 138 C4' G A 5 0.519 3.023 7.391 1.00 0.00 C ATOM 139 O4' G A 5 1.169 1.992 6.597 1.00 0.00 O ATOM 140 C3' G A 5 0.965 4.339 6.767 1.00 0.00 C ATOM 141 O3' G A 5 0.962 5.391 7.727 1.00 0.00 O ATOM 142 C2' G A 5 2.362 4.012 6.255 1.00 0.00 C ATOM 143 O2' G A 5 3.311 4.022 7.305 1.00 0.00 O ATOM 144 C1' G A 5 2.171 2.572 5.784 1.00 0.00 C ATOM 145 N9 G A 5 1.758 2.452 4.389 1.00 0.00 N ATOM 146 C8 G A 5 0.476 2.482 3.892 1.00 0.00 C ATOM 147 N7 G A 5 0.420 2.294 2.605 1.00 0.00 N ATOM 148 C5 G A 5 1.746 2.157 2.220 1.00 0.00 C ATOM 149 C6 G A 5 2.309 1.944 0.941 1.00 0.00 C ATOM 150 O6 G A 5 1.730 1.808 -0.138 1.00 0.00 O ATOM 151 N1 G A 5 3.695 1.884 0.993 1.00 0.00 N ATOM 152 C2 G A 5 4.445 1.998 2.137 1.00 0.00 C ATOM 153 N2 G A 5 5.772 1.903 1.988 1.00 0.00 N ATOM 154 N3 G A 5 3.932 2.190 3.341 1.00 0.00 N ATOM 155 C4 G A 5 2.585 2.262 3.308 1.00 0.00 C ATOM 0 H5' G A 5 -1.175 1.712 7.376 1.00 0.00 H new ATOM 0 H5'' G A 5 -1.423 3.194 8.279 1.00 0.00 H new ATOM 0 H4' G A 5 0.790 3.027 8.447 1.00 0.00 H new ATOM 0 H3' G A 5 0.307 4.699 5.976 1.00 0.00 H new ATOM 0 H2' G A 5 2.724 4.715 5.505 1.00 0.00 H new ATOM 0 HO2' G A 5 2.949 4.518 8.069 1.00 0.00 H new ATOM 0 H1' G A 5 3.135 2.070 5.865 1.00 0.00 H new ATOM 0 H8 G A 5 -0.396 2.645 4.507 1.00 0.00 H new ATOM 0 H1 G A 5 4.194 1.745 0.114 1.00 0.00 H new ATOM 0 H21 G A 5 6.383 1.980 2.801 1.00 0.00 H new ATOM 0 H22 G A 5 6.172 1.754 1.062 1.00 0.00 H new ATOM 167 P U A 6 -0.137 6.561 7.623 1.00 0.00 P ATOM 168 OP1 U A 6 0.202 7.605 8.624 1.00 0.00 O ATOM 169 OP2 U A 6 -1.478 5.926 7.650 1.00 0.00 O ATOM 170 O5' U A 6 0.095 7.170 6.169 1.00 0.00 O ATOM 171 C5' U A 6 1.411 7.326 5.642 1.00 0.00 C ATOM 172 C4' U A 6 1.353 7.821 4.216 1.00 0.00 C ATOM 173 O4' U A 6 1.698 6.749 3.308 1.00 0.00 O ATOM 174 C3' U A 6 -0.008 8.278 3.718 1.00 0.00 C ATOM 175 O3' U A 6 -0.264 9.626 4.093 1.00 0.00 O ATOM 176 C2' U A 6 0.084 8.119 2.199 1.00 0.00 C ATOM 177 O2' U A 6 0.532 9.310 1.580 1.00 0.00 O ATOM 178 C1' U A 6 1.168 7.049 2.033 1.00 0.00 C ATOM 179 N1 U A 6 0.641 5.823 1.417 1.00 0.00 N ATOM 180 C2 U A 6 1.354 5.267 0.369 1.00 0.00 C ATOM 181 O2 U A 6 2.419 5.714 -0.024 1.00 0.00 O ATOM 182 N3 U A 6 0.774 4.167 -0.205 1.00 0.00 N ATOM 183 C4 U A 6 -0.418 3.575 0.152 1.00 0.00 C ATOM 184 O4 U A 6 -0.829 2.608 -0.490 1.00 0.00 O ATOM 185 C5 U A 6 -1.079 4.192 1.259 1.00 0.00 C ATOM 186 C6 U A 6 -0.541 5.264 1.846 1.00 0.00 C ATOM 0 H5' U A 6 1.941 6.374 5.682 1.00 0.00 H new ATOM 0 H5'' U A 6 1.974 8.030 6.255 1.00 0.00 H new ATOM 0 H4' U A 6 2.037 8.670 4.229 1.00 0.00 H new ATOM 0 H3' U A 6 -0.830 7.703 4.143 1.00 0.00 H new ATOM 0 H2' U A 6 -0.879 7.872 1.752 1.00 0.00 H new ATOM 0 HO2' U A 6 0.249 9.317 0.642 1.00 0.00 H new ATOM 0 H1' U A 6 1.941 7.439 1.371 1.00 0.00 H new ATOM 0 H3 U A 6 1.279 3.740 -0.981 1.00 0.00 H new ATOM 0 H5 U A 6 -2.014 3.791 1.621 1.00 0.00 H new ATOM 0 H6 U A 6 -1.052 5.708 2.688 1.00 0.00 H new ATOM 197 P U A 7 -1.754 10.084 4.486 1.00 0.00 P ATOM 198 OP1 U A 7 -1.744 10.461 5.923 1.00 0.00 O ATOM 199 OP2 U A 7 -2.720 9.066 3.999 1.00 0.00 O ATOM 200 O5' U A 7 -1.948 11.408 3.621 1.00 0.00 O ATOM 201 C5' U A 7 -1.598 11.423 2.237 1.00 0.00 C ATOM 202 C4' U A 7 -0.969 12.747 1.868 1.00 0.00 C ATOM 203 O4' U A 7 -0.307 13.311 3.042 1.00 0.00 O ATOM 204 C3' U A 7 0.139 12.636 0.830 1.00 0.00 C ATOM 205 O3' U A 7 0.302 13.835 0.077 1.00 0.00 O ATOM 206 C2' U A 7 1.357 12.348 1.690 1.00 0.00 C ATOM 207 O2' U A 7 2.558 12.730 1.043 1.00 0.00 O ATOM 208 C1' U A 7 1.097 13.307 2.844 1.00 0.00 C ATOM 209 N1 U A 7 1.749 12.934 4.108 1.00 0.00 N ATOM 210 C2 U A 7 2.741 13.770 4.588 1.00 0.00 C ATOM 211 O2 U A 7 3.088 14.787 4.014 1.00 0.00 O ATOM 212 N3 U A 7 3.312 13.370 5.769 1.00 0.00 N ATOM 213 C4 U A 7 3.001 12.249 6.505 1.00 0.00 C ATOM 214 O4 U A 7 3.606 12.026 7.554 1.00 0.00 O ATOM 215 C5 U A 7 1.967 11.438 5.943 1.00 0.00 C ATOM 216 C6 U A 7 1.389 11.796 4.791 1.00 0.00 C ATOM 0 H5' U A 7 -2.486 11.253 1.629 1.00 0.00 H new ATOM 0 H5'' U A 7 -0.904 10.611 2.022 1.00 0.00 H new ATOM 0 H4' U A 7 -1.788 13.350 1.476 1.00 0.00 H new ATOM 0 H3' U A 7 -0.059 11.876 0.075 1.00 0.00 H new ATOM 0 H2' U A 7 1.478 11.295 1.946 1.00 0.00 H new ATOM 0 HO2' U A 7 3.321 12.532 1.626 1.00 0.00 H new ATOM 0 H1' U A 7 1.512 14.279 2.577 1.00 0.00 H new ATOM 0 H3 U A 7 4.048 13.969 6.143 1.00 0.00 H new ATOM 0 H5 U A 7 1.653 10.537 6.448 1.00 0.00 H new ATOM 0 H6 U A 7 0.611 11.168 4.382 1.00 0.00 H new ATOM 227 P G A 8 0.667 13.755 -1.487 1.00 0.00 P ATOM 228 OP1 G A 8 2.095 14.129 -1.644 1.00 0.00 O ATOM 229 OP2 G A 8 -0.376 14.512 -2.226 1.00 0.00 O ATOM 230 O5' G A 8 0.507 12.212 -1.851 1.00 0.00 O ATOM 231 C5' G A 8 1.476 11.246 -1.439 1.00 0.00 C ATOM 232 C4' G A 8 1.037 9.865 -1.863 1.00 0.00 C ATOM 233 O4' G A 8 -0.184 9.536 -1.146 1.00 0.00 O ATOM 234 C3' G A 8 0.691 9.714 -3.339 1.00 0.00 C ATOM 235 O3' G A 8 0.941 8.391 -3.811 1.00 0.00 O ATOM 236 C2' G A 8 -0.793 10.069 -3.385 1.00 0.00 C ATOM 237 O2' G A 8 -1.453 9.356 -4.412 1.00 0.00 O ATOM 238 C1' G A 8 -1.283 9.541 -2.036 1.00 0.00 C ATOM 239 N9 G A 8 -2.350 10.347 -1.449 1.00 0.00 N ATOM 240 C8 G A 8 -2.319 11.695 -1.185 1.00 0.00 C ATOM 241 N7 G A 8 -3.425 12.144 -0.661 1.00 0.00 N ATOM 242 C5 G A 8 -4.241 11.024 -0.573 1.00 0.00 C ATOM 243 C6 G A 8 -5.568 10.889 -0.086 1.00 0.00 C ATOM 244 O6 G A 8 -6.312 11.759 0.381 1.00 0.00 O ATOM 245 N1 G A 8 -6.015 9.575 -0.181 1.00 0.00 N ATOM 246 C2 G A 8 -5.284 8.528 -0.683 1.00 0.00 C ATOM 247 N2 G A 8 -5.895 7.337 -0.696 1.00 0.00 N ATOM 248 N3 G A 8 -4.048 8.639 -1.139 1.00 0.00 N ATOM 249 C4 G A 8 -3.592 9.907 -1.055 1.00 0.00 C ATOM 0 H5' G A 8 1.600 11.281 -0.357 1.00 0.00 H new ATOM 0 H5'' G A 8 2.445 11.480 -1.879 1.00 0.00 H new ATOM 0 H4' G A 8 1.888 9.219 -1.649 1.00 0.00 H new ATOM 0 H3' G A 8 1.297 10.348 -3.986 1.00 0.00 H new ATOM 0 H2' G A 8 -0.974 11.128 -3.567 1.00 0.00 H new ATOM 0 HO2' G A 8 -0.943 8.548 -4.629 1.00 0.00 H new ATOM 0 H1' G A 8 -1.692 8.544 -2.202 1.00 0.00 H new ATOM 0 H8 G A 8 -1.463 12.321 -1.391 1.00 0.00 H new ATOM 0 H1 G A 8 -6.959 9.374 0.148 1.00 0.00 H new ATOM 0 H21 G A 8 -5.407 6.517 -1.057 1.00 0.00 H new ATOM 0 H22 G A 8 -6.849 7.249 -0.345 1.00 0.00 H new ATOM 261 P G A 9 2.401 8.001 -4.368 1.00 0.00 P ATOM 262 OP1 G A 9 2.926 6.925 -3.488 1.00 0.00 O ATOM 263 OP2 G A 9 3.191 9.245 -4.553 1.00 0.00 O ATOM 264 O5' G A 9 2.112 7.380 -5.809 1.00 0.00 O ATOM 265 C5' G A 9 2.486 6.039 -6.127 1.00 0.00 C ATOM 266 C4' G A 9 1.465 5.414 -7.056 1.00 0.00 C ATOM 267 O4' G A 9 0.504 6.429 -7.454 1.00 0.00 O ATOM 268 C3' G A 9 2.007 4.877 -8.375 1.00 0.00 C ATOM 269 O3' G A 9 1.158 3.856 -8.898 1.00 0.00 O ATOM 270 C2' G A 9 2.035 6.127 -9.246 1.00 0.00 C ATOM 271 O2' G A 9 1.903 5.816 -10.620 1.00 0.00 O ATOM 272 C1' G A 9 0.760 6.835 -8.786 1.00 0.00 C ATOM 273 N9 G A 9 0.853 8.293 -8.808 1.00 0.00 N ATOM 274 C8 G A 9 1.717 9.079 -8.085 1.00 0.00 C ATOM 275 N7 G A 9 1.568 10.354 -8.315 1.00 0.00 N ATOM 276 C5 G A 9 0.541 10.415 -9.248 1.00 0.00 C ATOM 277 C6 G A 9 -0.065 11.532 -9.879 1.00 0.00 C ATOM 278 O6 G A 9 0.193 12.733 -9.736 1.00 0.00 O ATOM 279 N1 G A 9 -1.071 11.141 -10.756 1.00 0.00 N ATOM 280 C2 G A 9 -1.446 9.843 -10.998 1.00 0.00 C ATOM 281 N2 G A 9 -2.438 9.669 -11.878 1.00 0.00 N ATOM 282 N3 G A 9 -0.890 8.793 -10.420 1.00 0.00 N ATOM 283 C4 G A 9 0.089 9.150 -9.562 1.00 0.00 C ATOM 0 H5' G A 9 2.565 5.450 -5.213 1.00 0.00 H new ATOM 0 H5'' G A 9 3.469 6.030 -6.598 1.00 0.00 H new ATOM 0 H4' G A 9 1.061 4.582 -6.479 1.00 0.00 H new ATOM 0 H3' G A 9 2.983 4.398 -8.299 1.00 0.00 H new ATOM 0 H2' G A 9 2.962 6.693 -9.149 1.00 0.00 H new ATOM 0 HO2' G A 9 1.924 6.643 -11.146 1.00 0.00 H new ATOM 0 H1' G A 9 -0.035 6.560 -9.479 1.00 0.00 H new ATOM 0 H8 G A 9 2.447 8.681 -7.395 1.00 0.00 H new ATOM 0 H1 G A 9 -1.569 11.876 -11.258 1.00 0.00 H new ATOM 0 H21 G A 9 -2.763 8.728 -12.101 1.00 0.00 H new ATOM 0 H22 G A 9 -2.870 10.477 -12.326 1.00 0.00 H new ATOM 295 P G A 10 1.695 2.872 -10.055 1.00 0.00 P ATOM 296 OP1 G A 10 1.065 3.310 -11.326 1.00 0.00 O ATOM 297 OP2 G A 10 1.512 1.472 -9.592 1.00 0.00 O ATOM 298 O5' G A 10 3.256 3.182 -10.145 1.00 0.00 O ATOM 299 C5' G A 10 4.226 2.135 -10.084 1.00 0.00 C ATOM 300 C4' G A 10 5.451 2.612 -9.339 1.00 0.00 C ATOM 301 O4' G A 10 5.012 3.448 -8.236 1.00 0.00 O ATOM 302 C3' G A 10 6.296 1.521 -8.690 1.00 0.00 C ATOM 303 O3' G A 10 7.659 1.921 -8.562 1.00 0.00 O ATOM 304 C2' G A 10 5.614 1.333 -7.341 1.00 0.00 C ATOM 305 O2' G A 10 6.516 0.890 -6.345 1.00 0.00 O ATOM 306 C1' G A 10 5.200 2.766 -7.013 1.00 0.00 C ATOM 307 N9 G A 10 3.960 2.825 -6.249 1.00 0.00 N ATOM 308 C8 G A 10 2.735 2.328 -6.617 1.00 0.00 C ATOM 309 N7 G A 10 1.819 2.494 -5.704 1.00 0.00 N ATOM 310 C5 G A 10 2.480 3.147 -4.674 1.00 0.00 C ATOM 311 C6 G A 10 2.005 3.597 -3.421 1.00 0.00 C ATOM 312 O6 G A 10 0.863 3.511 -2.957 1.00 0.00 O ATOM 313 N1 G A 10 3.013 4.207 -2.681 1.00 0.00 N ATOM 314 C2 G A 10 4.307 4.375 -3.101 1.00 0.00 C ATOM 315 N2 G A 10 5.129 4.989 -2.244 1.00 0.00 N ATOM 316 N3 G A 10 4.761 3.971 -4.271 1.00 0.00 N ATOM 317 C4 G A 10 3.801 3.366 -5.000 1.00 0.00 C ATOM 0 H5' G A 10 4.501 1.823 -11.092 1.00 0.00 H new ATOM 0 H5'' G A 10 3.802 1.264 -9.585 1.00 0.00 H new ATOM 0 H4' G A 10 6.061 3.109 -10.094 1.00 0.00 H new ATOM 0 H3' G A 10 6.345 0.600 -9.271 1.00 0.00 H new ATOM 0 H2' G A 10 4.812 0.596 -7.374 1.00 0.00 H new ATOM 0 HO2' G A 10 6.040 0.790 -5.494 1.00 0.00 H new ATOM 0 H1' G A 10 5.981 3.221 -6.404 1.00 0.00 H new ATOM 0 H8 G A 10 2.549 1.848 -7.566 1.00 0.00 H new ATOM 0 H1 G A 10 2.770 4.556 -1.754 1.00 0.00 H new ATOM 0 H21 G A 10 6.105 5.145 -2.496 1.00 0.00 H new ATOM 0 H22 G A 10 4.780 5.302 -1.338 1.00 0.00 H new ATOM 329 P C A 11 8.795 0.815 -8.285 1.00 0.00 P ATOM 330 OP1 C A 11 10.030 1.269 -8.974 1.00 0.00 O ATOM 331 OP2 C A 11 8.237 -0.528 -8.588 1.00 0.00 O ATOM 332 O5' C A 11 9.040 0.898 -6.712 1.00 0.00 O ATOM 333 C5' C A 11 9.650 2.043 -6.124 1.00 0.00 C ATOM 334 C4' C A 11 9.734 1.884 -4.621 1.00 0.00 C ATOM 335 O4' C A 11 8.609 2.550 -3.996 1.00 0.00 O ATOM 336 C3' C A 11 9.621 0.470 -4.073 1.00 0.00 C ATOM 337 O3' C A 11 10.833 -0.267 -4.203 1.00 0.00 O ATOM 338 C2' C A 11 9.259 0.723 -2.614 1.00 0.00 C ATOM 339 O2' C A 11 10.406 1.060 -1.857 1.00 0.00 O ATOM 340 C1' C A 11 8.373 1.966 -2.726 1.00 0.00 C ATOM 341 N1 C A 11 6.935 1.670 -2.597 1.00 0.00 N ATOM 342 C2 C A 11 6.371 1.634 -1.317 1.00 0.00 C ATOM 343 O2 C A 11 7.091 1.859 -0.334 1.00 0.00 O ATOM 344 N3 C A 11 5.055 1.355 -1.184 1.00 0.00 N ATOM 345 C4 C A 11 4.311 1.117 -2.265 1.00 0.00 C ATOM 346 N4 C A 11 3.026 0.826 -2.086 1.00 0.00 N ATOM 347 C5 C A 11 4.854 1.161 -3.577 1.00 0.00 C ATOM 348 C6 C A 11 6.160 1.434 -3.699 1.00 0.00 C ATOM 0 H5' C A 11 9.075 2.936 -6.370 1.00 0.00 H new ATOM 0 H5'' C A 11 10.649 2.183 -6.537 1.00 0.00 H new ATOM 0 H4' C A 11 10.724 2.283 -4.401 1.00 0.00 H new ATOM 0 H3' C A 11 8.894 -0.142 -4.607 1.00 0.00 H new ATOM 0 H2' C A 11 8.801 -0.140 -2.131 1.00 0.00 H new ATOM 0 HO2' C A 11 10.433 0.515 -1.043 1.00 0.00 H new ATOM 0 H1' C A 11 8.630 2.636 -1.906 1.00 0.00 H new ATOM 0 H41 C A 11 2.429 0.639 -2.891 1.00 0.00 H new ATOM 0 H42 C A 11 2.638 0.790 -1.143 1.00 0.00 H new ATOM 0 H5 C A 11 4.236 0.981 -4.445 1.00 0.00 H new ATOM 0 H6 C A 11 6.607 1.468 -4.681 1.00 0.00 H new ATOM 360 P U A 12 10.837 -1.852 -3.923 1.00 0.00 P ATOM 361 OP1 U A 12 12.199 -2.353 -4.239 1.00 0.00 O ATOM 362 OP2 U A 12 9.659 -2.449 -4.601 1.00 0.00 O ATOM 363 O5' U A 12 10.611 -1.969 -2.348 1.00 0.00 O ATOM 364 C5' U A 12 11.697 -1.819 -1.436 1.00 0.00 C ATOM 365 C4' U A 12 11.187 -1.800 -0.012 1.00 0.00 C ATOM 366 O4' U A 12 10.052 -0.901 0.081 1.00 0.00 O ATOM 367 C3' U A 12 10.652 -3.125 0.511 1.00 0.00 C ATOM 368 O3' U A 12 11.707 -3.959 0.981 1.00 0.00 O ATOM 369 C2' U A 12 9.706 -2.684 1.624 1.00 0.00 C ATOM 370 O2' U A 12 10.412 -2.368 2.810 1.00 0.00 O ATOM 371 C1' U A 12 9.138 -1.385 1.049 1.00 0.00 C ATOM 372 N1 U A 12 7.825 -1.544 0.405 1.00 0.00 N ATOM 373 C2 U A 12 6.696 -1.362 1.186 1.00 0.00 C ATOM 374 O2 U A 12 6.750 -1.093 2.373 1.00 0.00 O ATOM 375 N3 U A 12 5.504 -1.508 0.525 1.00 0.00 N ATOM 376 C4 U A 12 5.327 -1.810 -0.808 1.00 0.00 C ATOM 377 O4 U A 12 4.187 -1.896 -1.262 1.00 0.00 O ATOM 378 C5 U A 12 6.538 -1.989 -1.544 1.00 0.00 C ATOM 379 C6 U A 12 7.719 -1.857 -0.931 1.00 0.00 C ATOM 0 H5' U A 12 12.235 -0.895 -1.649 1.00 0.00 H new ATOM 0 H5'' U A 12 12.405 -2.638 -1.565 1.00 0.00 H new ATOM 0 H4' U A 12 12.060 -1.511 0.573 1.00 0.00 H new ATOM 0 H3' U A 12 10.153 -3.732 -0.245 1.00 0.00 H new ATOM 0 H2' U A 12 8.976 -3.450 1.886 1.00 0.00 H new ATOM 0 HO2' U A 12 9.796 -2.385 3.572 1.00 0.00 H new ATOM 0 H1' U A 12 8.999 -0.697 1.883 1.00 0.00 H new ATOM 0 H3 U A 12 4.657 -1.379 1.079 1.00 0.00 H new ATOM 0 H5 U A 12 6.500 -2.231 -2.596 1.00 0.00 H new ATOM 0 H6 U A 12 8.622 -2.001 -1.505 1.00 0.00 H new ATOM 390 P C A 13 11.423 -5.510 1.292 1.00 0.00 P ATOM 391 OP1 C A 13 12.653 -6.077 1.901 1.00 0.00 O ATOM 392 OP2 C A 13 10.855 -6.139 0.071 1.00 0.00 O ATOM 393 O5' C A 13 10.285 -5.478 2.406 1.00 0.00 O ATOM 394 C5' C A 13 10.572 -5.039 3.733 1.00 0.00 C ATOM 395 C4' C A 13 9.452 -5.435 4.667 1.00 0.00 C ATOM 396 O4' C A 13 8.324 -4.544 4.481 1.00 0.00 O ATOM 397 C3' C A 13 8.854 -6.812 4.430 1.00 0.00 C ATOM 398 O3' C A 13 9.659 -7.836 5.006 1.00 0.00 O ATOM 399 C2' C A 13 7.487 -6.691 5.093 1.00 0.00 C ATOM 400 O2' C A 13 7.587 -6.838 6.497 1.00 0.00 O ATOM 401 C1' C A 13 7.122 -5.237 4.780 1.00 0.00 C ATOM 402 N1 C A 13 6.201 -5.086 3.640 1.00 0.00 N ATOM 403 C2 C A 13 4.824 -5.022 3.884 1.00 0.00 C ATOM 404 O2 C A 13 4.415 -5.108 5.052 1.00 0.00 O ATOM 405 N3 C A 13 3.974 -4.869 2.844 1.00 0.00 N ATOM 406 C4 C A 13 4.451 -4.780 1.601 1.00 0.00 C ATOM 407 N4 C A 13 3.575 -4.617 0.609 1.00 0.00 N ATOM 408 C5 C A 13 5.847 -4.855 1.322 1.00 0.00 C ATOM 409 C6 C A 13 6.678 -5.005 2.361 1.00 0.00 C ATOM 0 H5' C A 13 10.701 -3.957 3.746 1.00 0.00 H new ATOM 0 H5'' C A 13 11.511 -5.476 4.073 1.00 0.00 H new ATOM 0 H4' C A 13 9.921 -5.403 5.650 1.00 0.00 H new ATOM 0 H3' C A 13 8.789 -7.093 3.379 1.00 0.00 H new ATOM 0 H2' C A 13 6.774 -7.440 4.748 1.00 0.00 H new ATOM 0 HO2' C A 13 6.697 -6.755 6.899 1.00 0.00 H new ATOM 0 H1' C A 13 6.607 -4.836 5.653 1.00 0.00 H new ATOM 0 H41 C A 13 3.903 -4.545 -0.354 1.00 0.00 H new ATOM 0 H42 C A 13 2.577 -4.564 0.813 1.00 0.00 H new ATOM 0 H5 C A 13 6.220 -4.793 0.310 1.00 0.00 H new ATOM 0 H6 C A 13 7.742 -5.063 2.186 1.00 0.00 H new ATOM 421 P U A 14 9.664 -9.306 4.356 1.00 0.00 P ATOM 422 OP1 U A 14 10.716 -10.111 5.029 1.00 0.00 O ATOM 423 OP2 U A 14 9.695 -9.146 2.880 1.00 0.00 O ATOM 424 O5' U A 14 8.241 -9.902 4.755 1.00 0.00 O ATOM 425 C5' U A 14 7.884 -10.093 6.123 1.00 0.00 C ATOM 426 C4' U A 14 6.540 -10.776 6.218 1.00 0.00 C ATOM 427 O4' U A 14 5.492 -9.803 5.965 1.00 0.00 O ATOM 428 C3' U A 14 6.296 -11.873 5.193 1.00 0.00 C ATOM 429 O3' U A 14 6.829 -13.118 5.631 1.00 0.00 O ATOM 430 C2' U A 14 4.776 -11.893 5.082 1.00 0.00 C ATOM 431 O2' U A 14 4.194 -12.599 6.160 1.00 0.00 O ATOM 432 C1' U A 14 4.441 -10.409 5.235 1.00 0.00 C ATOM 433 N1 U A 14 4.293 -9.696 3.958 1.00 0.00 N ATOM 434 C2 U A 14 3.050 -9.709 3.352 1.00 0.00 C ATOM 435 O2 U A 14 2.088 -10.294 3.821 1.00 0.00 O ATOM 436 N3 U A 14 2.973 -9.010 2.175 1.00 0.00 N ATOM 437 C4 U A 14 3.988 -8.315 1.554 1.00 0.00 C ATOM 438 O4 U A 14 3.762 -7.724 0.498 1.00 0.00 O ATOM 439 C5 U A 14 5.240 -8.357 2.238 1.00 0.00 C ATOM 440 C6 U A 14 5.354 -9.030 3.384 1.00 0.00 C ATOM 0 H5' U A 14 7.849 -9.132 6.635 1.00 0.00 H new ATOM 0 H5'' U A 14 8.642 -10.694 6.624 1.00 0.00 H new ATOM 0 H4' U A 14 6.532 -11.215 7.216 1.00 0.00 H new ATOM 0 H3' U A 14 6.784 -11.697 4.234 1.00 0.00 H new ATOM 0 H2' U A 14 4.418 -12.366 4.168 1.00 0.00 H new ATOM 0 HO2' U A 14 3.219 -12.595 6.065 1.00 0.00 H new ATOM 0 H1' U A 14 3.478 -10.345 5.742 1.00 0.00 H new ATOM 0 H3 U A 14 2.066 -9.004 1.708 1.00 0.00 H new ATOM 0 H5 U A 14 6.096 -7.843 1.827 1.00 0.00 H new ATOM 0 H6 U A 14 6.313 -9.054 3.880 1.00 0.00 H new ATOM 451 P C A 15 7.270 -14.225 4.550 1.00 0.00 P ATOM 452 OP1 C A 15 8.040 -15.268 5.273 1.00 0.00 O ATOM 453 OP2 C A 15 7.884 -13.534 3.387 1.00 0.00 O ATOM 454 O5' C A 15 5.892 -14.867 4.076 1.00 0.00 O ATOM 455 C5' C A 15 5.080 -15.612 4.980 1.00 0.00 C ATOM 456 C4' C A 15 3.878 -16.171 4.258 1.00 0.00 C ATOM 457 O4' C A 15 2.909 -15.104 4.071 1.00 0.00 O ATOM 458 C3' C A 15 4.148 -16.704 2.857 1.00 0.00 C ATOM 459 O3' C A 15 4.565 -18.071 2.869 1.00 0.00 O ATOM 460 C2' C A 15 2.805 -16.516 2.162 1.00 0.00 C ATOM 461 O2' C A 15 1.900 -17.547 2.514 1.00 0.00 O ATOM 462 C1' C A 15 2.322 -15.208 2.787 1.00 0.00 C ATOM 463 N1 C A 15 2.680 -14.007 2.013 1.00 0.00 N ATOM 464 C2 C A 15 1.714 -13.431 1.188 1.00 0.00 C ATOM 465 O2 C A 15 0.591 -13.949 1.132 1.00 0.00 O ATOM 466 N3 C A 15 2.026 -12.326 0.474 1.00 0.00 N ATOM 467 C4 C A 15 3.247 -11.797 0.564 1.00 0.00 C ATOM 468 N4 C A 15 3.511 -10.710 -0.160 1.00 0.00 N ATOM 469 C5 C A 15 4.255 -12.363 1.401 1.00 0.00 C ATOM 470 C6 C A 15 3.931 -13.460 2.099 1.00 0.00 C ATOM 0 H5' C A 15 4.756 -14.973 5.801 1.00 0.00 H new ATOM 0 H5'' C A 15 5.661 -16.424 5.418 1.00 0.00 H new ATOM 0 H4' C A 15 3.542 -16.998 4.883 1.00 0.00 H new ATOM 0 H3' C A 15 4.966 -16.189 2.353 1.00 0.00 H new ATOM 0 H2' C A 15 2.877 -16.521 1.074 1.00 0.00 H new ATOM 0 HO2' C A 15 2.393 -18.291 2.918 1.00 0.00 H new ATOM 0 HO3' C A 15 4.725 -18.372 1.950 1.00 0.00 H new ATOM 0 H1' C A 15 1.233 -15.245 2.818 1.00 0.00 H new ATOM 0 H41 C A 15 4.435 -10.279 -0.115 1.00 0.00 H new ATOM 0 H42 C A 15 2.790 -10.309 -0.759 1.00 0.00 H new ATOM 0 H5 C A 15 5.240 -11.925 1.469 1.00 0.00 H new ATOM 0 H6 C A 15 4.669 -13.920 2.740 1.00 0.00 H new TER 483 C A 15