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 -18:sc= 0.0888 USER MOD Single : A 1 G O5' : rot 12:sc= 0.893 USER MOD Single : A 2 A O2' : rot -20:sc= -0.0657 USER MOD Single : A 3 G O2' : rot -16:sc= 0.0743 USER MOD Single : A 4 A O2' : rot 180:sc= -2.77! USER MOD Single : A 5 G O2' : rot -28:sc= 0.103 USER MOD Single : A 6 U O2' : rot -128:sc= -1 USER MOD Single : A 7 U O2' : rot 180:sc= -1.28! USER MOD Single : A 8 G O2' : rot 16:sc= 0.249 USER MOD Single : A 9 G O2' : rot 180:sc= -0.506 USER MOD Single : A 10 G O2' : rot -178:sc= -1.53! USER MOD Single : A 11 C O2' : rot -136:sc= 0.865 USER MOD Single : A 12 U O2' : rot 180:sc= -2.96! USER MOD Single : A 13 C O2' : rot -23:sc= 0.102 USER MOD Single : A 14 U O2' : rot -18:sc= 0.098 USER MOD Single : A 15 C O2' : rot -22:sc= 0.126 USER MOD Single : A 15 C O3' : rot 180:sc= 0.124 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -2.921 -7.374 -6.964 1.00 0.00 O ATOM 2 C5' G A 1 -4.015 -8.132 -7.488 1.00 0.00 C ATOM 3 C4' G A 1 -4.812 -8.767 -6.372 1.00 0.00 C ATOM 4 O4' G A 1 -3.943 -9.679 -5.647 1.00 0.00 O ATOM 5 C3' G A 1 -5.345 -7.800 -5.324 1.00 0.00 C ATOM 6 O3' G A 1 -6.640 -7.326 -5.682 1.00 0.00 O ATOM 7 C2' G A 1 -5.363 -8.643 -4.053 1.00 0.00 C ATOM 8 O2' G A 1 -6.507 -9.474 -4.003 1.00 0.00 O ATOM 9 C1' G A 1 -4.133 -9.525 -4.254 1.00 0.00 C ATOM 10 N9 G A 1 -2.900 -8.987 -3.687 1.00 0.00 N ATOM 11 C8 G A 1 -2.414 -7.706 -3.795 1.00 0.00 C ATOM 12 N7 G A 1 -1.253 -7.547 -3.223 1.00 0.00 N ATOM 13 C5 G A 1 -0.970 -8.792 -2.675 1.00 0.00 C ATOM 14 C6 G A 1 0.149 -9.234 -1.920 1.00 0.00 C ATOM 15 O6 G A 1 1.154 -8.598 -1.587 1.00 0.00 O ATOM 16 N1 G A 1 0.022 -10.568 -1.552 1.00 0.00 N ATOM 17 C2 G A 1 -1.039 -11.374 -1.874 1.00 0.00 C ATOM 18 N2 G A 1 -0.979 -12.630 -1.431 1.00 0.00 N ATOM 19 N3 G A 1 -2.082 -10.980 -2.579 1.00 0.00 N ATOM 20 C4 G A 1 -1.983 -9.685 -2.942 1.00 0.00 C ATOM 0 H5' G A 1 -3.639 -8.905 -8.158 1.00 0.00 H new ATOM 0 H5'' G A 1 -4.662 -7.484 -8.080 1.00 0.00 H new ATOM 0 H4' G A 1 -5.663 -9.237 -6.865 1.00 0.00 H new ATOM 0 H3' G A 1 -4.743 -6.898 -5.212 1.00 0.00 H new ATOM 0 H2' G A 1 -5.372 -8.043 -3.143 1.00 0.00 H new ATOM 0 HO2' G A 1 -7.181 -9.141 -4.632 1.00 0.00 H new ATOM 0 HO5' G A 1 -2.803 -7.583 -6.014 1.00 0.00 H new ATOM 0 H1' G A 1 -4.327 -10.463 -3.733 1.00 0.00 H new ATOM 0 H8 G A 1 -2.941 -6.911 -4.302 1.00 0.00 H new ATOM 0 H1 G A 1 0.775 -10.979 -1.000 1.00 0.00 H new ATOM 0 H21 G A 1 -1.737 -13.280 -1.637 1.00 0.00 H new ATOM 0 H22 G A 1 -0.175 -12.941 -0.886 1.00 0.00 H new ATOM 33 P A A 2 -7.211 -5.980 -5.013 1.00 0.00 P ATOM 34 OP1 A A 2 -8.632 -5.857 -5.427 1.00 0.00 O ATOM 35 OP2 A A 2 -6.265 -4.872 -5.300 1.00 0.00 O ATOM 36 O5' A A 2 -7.179 -6.285 -3.451 1.00 0.00 O ATOM 37 C5' A A 2 -6.067 -5.894 -2.648 1.00 0.00 C ATOM 38 C4' A A 2 -6.032 -6.711 -1.380 1.00 0.00 C ATOM 39 O4' A A 2 -4.924 -7.651 -1.436 1.00 0.00 O ATOM 40 C3' A A 2 -5.779 -5.904 -0.119 1.00 0.00 C ATOM 41 O3' A A 2 -6.993 -5.361 0.395 1.00 0.00 O ATOM 42 C2' A A 2 -5.156 -6.935 0.814 1.00 0.00 C ATOM 43 O2' A A 2 -6.141 -7.789 1.363 1.00 0.00 O ATOM 44 C1' A A 2 -4.300 -7.733 -0.165 1.00 0.00 C ATOM 45 N9 A A 2 -2.937 -7.221 -0.286 1.00 0.00 N ATOM 46 C8 A A 2 -2.496 -6.232 -1.124 1.00 0.00 C ATOM 47 N7 A A 2 -1.217 -5.970 -1.008 1.00 0.00 N ATOM 48 C5 A A 2 -0.786 -6.853 -0.028 1.00 0.00 C ATOM 49 C6 A A 2 0.474 -7.082 0.550 1.00 0.00 C ATOM 50 N6 A A 2 1.574 -6.406 0.212 1.00 0.00 N ATOM 51 N1 A A 2 0.566 -8.039 1.500 1.00 0.00 N ATOM 52 C2 A A 2 -0.542 -8.710 1.841 1.00 0.00 C ATOM 53 N3 A A 2 -1.781 -8.585 1.369 1.00 0.00 N ATOM 54 C4 A A 2 -1.835 -7.629 0.426 1.00 0.00 C ATOM 0 H5' A A 2 -6.138 -4.834 -2.405 1.00 0.00 H new ATOM 0 H5'' A A 2 -5.140 -6.032 -3.205 1.00 0.00 H new ATOM 0 H4' A A 2 -7.017 -7.175 -1.327 1.00 0.00 H new ATOM 0 H3' A A 2 -5.139 -5.035 -0.269 1.00 0.00 H new ATOM 0 H2' A A 2 -4.625 -6.496 1.659 1.00 0.00 H new ATOM 0 HO2' A A 2 -7.020 -7.361 1.294 1.00 0.00 H new ATOM 0 H1' A A 2 -4.225 -8.755 0.205 1.00 0.00 H new ATOM 0 H8 A A 2 -3.143 -5.715 -1.817 1.00 0.00 H new ATOM 0 H61 A A 2 2.462 -6.617 0.667 1.00 0.00 H new ATOM 0 H62 A A 2 1.526 -5.679 -0.501 1.00 0.00 H new ATOM 0 H2 A A 2 -0.412 -9.459 2.608 1.00 0.00 H new ATOM 66 P G A 3 -7.058 -3.820 0.852 1.00 0.00 P ATOM 67 OP1 G A 3 -8.354 -3.277 0.372 1.00 0.00 O ATOM 68 OP2 G A 3 -5.794 -3.143 0.467 1.00 0.00 O ATOM 69 O5' G A 3 -7.122 -3.894 2.443 1.00 0.00 O ATOM 70 C5' G A 3 -6.741 -5.078 3.141 1.00 0.00 C ATOM 71 C4' G A 3 -5.914 -4.725 4.357 1.00 0.00 C ATOM 72 O4' G A 3 -4.655 -5.451 4.292 1.00 0.00 O ATOM 73 C3' G A 3 -5.518 -3.259 4.472 1.00 0.00 C ATOM 74 O3' G A 3 -6.517 -2.499 5.146 1.00 0.00 O ATOM 75 C2' G A 3 -4.210 -3.332 5.250 1.00 0.00 C ATOM 76 O2' G A 3 -4.446 -3.541 6.630 1.00 0.00 O ATOM 77 C1' G A 3 -3.588 -4.594 4.660 1.00 0.00 C ATOM 78 N9 G A 3 -2.765 -4.353 3.479 1.00 0.00 N ATOM 79 C8 G A 3 -3.203 -4.002 2.228 1.00 0.00 C ATOM 80 N7 G A 3 -2.234 -3.870 1.362 1.00 0.00 N ATOM 81 C5 G A 3 -1.084 -4.142 2.092 1.00 0.00 C ATOM 82 C6 G A 3 0.278 -4.153 1.694 1.00 0.00 C ATOM 83 O6 G A 3 0.759 -3.914 0.580 1.00 0.00 O ATOM 84 N1 G A 3 1.118 -4.483 2.753 1.00 0.00 N ATOM 85 C2 G A 3 0.701 -4.762 4.030 1.00 0.00 C ATOM 86 N2 G A 3 1.661 -5.057 4.913 1.00 0.00 N ATOM 87 N3 G A 3 -0.563 -4.753 4.415 1.00 0.00 N ATOM 88 C4 G A 3 -1.396 -4.439 3.402 1.00 0.00 C ATOM 0 H5' G A 3 -6.170 -5.730 2.481 1.00 0.00 H new ATOM 0 H5'' G A 3 -7.630 -5.632 3.445 1.00 0.00 H new ATOM 0 H4' G A 3 -6.549 -4.978 5.206 1.00 0.00 H new ATOM 0 H3' G A 3 -5.409 -2.755 3.512 1.00 0.00 H new ATOM 0 H2' G A 3 -3.607 -2.427 5.174 1.00 0.00 H new ATOM 0 HO2' G A 3 -5.383 -3.341 6.836 1.00 0.00 H new ATOM 0 H1' G A 3 -2.928 -5.023 5.414 1.00 0.00 H new ATOM 0 H8 G A 3 -4.244 -3.850 1.983 1.00 0.00 H new ATOM 0 H1 G A 3 2.120 -4.520 2.566 1.00 0.00 H new ATOM 0 H21 G A 3 1.416 -5.274 5.879 1.00 0.00 H new ATOM 0 H22 G A 3 2.638 -5.065 4.620 1.00 0.00 H new ATOM 100 P A A 4 -6.861 -1.006 4.648 1.00 0.00 P ATOM 101 OP1 A A 4 -8.002 -0.507 5.456 1.00 0.00 O ATOM 102 OP2 A A 4 -6.969 -1.034 3.167 1.00 0.00 O ATOM 103 O5' A A 4 -5.565 -0.168 5.044 1.00 0.00 O ATOM 104 C5' A A 4 -4.398 -0.182 4.225 1.00 0.00 C ATOM 105 C4' A A 4 -3.165 -0.276 5.090 1.00 0.00 C ATOM 106 O4' A A 4 -2.342 -1.371 4.609 1.00 0.00 O ATOM 107 C3' A A 4 -2.253 0.944 5.079 1.00 0.00 C ATOM 108 O3' A A 4 -2.656 1.890 6.070 1.00 0.00 O ATOM 109 C2' A A 4 -0.881 0.343 5.370 1.00 0.00 C ATOM 110 O2' A A 4 -0.709 0.107 6.755 1.00 0.00 O ATOM 111 C1' A A 4 -0.976 -1.006 4.659 1.00 0.00 C ATOM 112 N9 A A 4 -0.464 -1.009 3.290 1.00 0.00 N ATOM 113 C8 A A 4 -1.213 -1.019 2.144 1.00 0.00 C ATOM 114 N7 A A 4 -0.502 -1.057 1.044 1.00 0.00 N ATOM 115 C5 A A 4 0.809 -1.065 1.499 1.00 0.00 C ATOM 116 C6 A A 4 2.042 -1.104 0.826 1.00 0.00 C ATOM 117 N6 A A 4 2.158 -1.152 -0.503 1.00 0.00 N ATOM 118 N1 A A 4 3.166 -1.097 1.575 1.00 0.00 N ATOM 119 C2 A A 4 3.047 -1.051 2.910 1.00 0.00 C ATOM 120 N3 A A 4 1.945 -1.016 3.655 1.00 0.00 N ATOM 121 C4 A A 4 0.848 -1.027 2.881 1.00 0.00 C ATOM 0 H5' A A 4 -4.359 0.722 3.617 1.00 0.00 H new ATOM 0 H5'' A A 4 -4.436 -1.027 3.537 1.00 0.00 H new ATOM 0 H4' A A 4 -3.552 -0.397 6.102 1.00 0.00 H new ATOM 0 H3' A A 4 -2.272 1.503 4.143 1.00 0.00 H new ATOM 0 H2' A A 4 -0.059 0.985 5.054 1.00 0.00 H new ATOM 0 HO2' A A 4 0.178 -0.280 6.913 1.00 0.00 H new ATOM 0 H1' A A 4 -0.358 -1.702 5.225 1.00 0.00 H new ATOM 0 H8 A A 4 -2.293 -0.998 2.146 1.00 0.00 H new ATOM 0 H61 A A 4 3.082 -1.179 -0.934 1.00 0.00 H new ATOM 0 H62 A A 4 1.322 -1.162 -1.088 1.00 0.00 H new ATOM 0 H2 A A 4 3.977 -1.041 3.458 1.00 0.00 H new ATOM 133 P G A 5 -2.351 3.457 5.858 1.00 0.00 P ATOM 134 OP1 G A 5 -3.156 4.224 6.842 1.00 0.00 O ATOM 135 OP2 G A 5 -2.484 3.755 4.409 1.00 0.00 O ATOM 136 O5' G A 5 -0.813 3.606 6.246 1.00 0.00 O ATOM 137 C5' G A 5 -0.297 3.032 7.446 1.00 0.00 C ATOM 138 C4' G A 5 1.171 3.357 7.583 1.00 0.00 C ATOM 139 O4' G A 5 1.936 2.324 6.900 1.00 0.00 O ATOM 140 C3' G A 5 1.593 4.675 6.945 1.00 0.00 C ATOM 141 O3' G A 5 1.560 5.736 7.895 1.00 0.00 O ATOM 142 C2' G A 5 3.003 4.384 6.445 1.00 0.00 C ATOM 143 O2' G A 5 3.949 4.480 7.494 1.00 0.00 O ATOM 144 C1' G A 5 2.877 2.921 6.030 1.00 0.00 C ATOM 145 N9 G A 5 2.424 2.718 4.657 1.00 0.00 N ATOM 146 C8 G A 5 1.127 2.691 4.201 1.00 0.00 C ATOM 147 N7 G A 5 1.034 2.440 2.927 1.00 0.00 N ATOM 148 C5 G A 5 2.348 2.311 2.508 1.00 0.00 C ATOM 149 C6 G A 5 2.872 2.042 1.225 1.00 0.00 C ATOM 150 O6 G A 5 2.260 1.837 0.178 1.00 0.00 O ATOM 151 N1 G A 5 4.259 2.014 1.233 1.00 0.00 N ATOM 152 C2 G A 5 5.045 2.202 2.342 1.00 0.00 C ATOM 153 N2 G A 5 6.368 2.126 2.152 1.00 0.00 N ATOM 154 N3 G A 5 4.568 2.446 3.551 1.00 0.00 N ATOM 155 C4 G A 5 3.220 2.489 3.560 1.00 0.00 C ATOM 0 H5' G A 5 -0.439 1.951 7.433 1.00 0.00 H new ATOM 0 H5'' G A 5 -0.845 3.415 8.307 1.00 0.00 H new ATOM 0 H4' G A 5 1.357 3.423 8.655 1.00 0.00 H new ATOM 0 H3' G A 5 0.932 5.004 6.144 1.00 0.00 H new ATOM 0 H2' G A 5 3.335 5.069 5.665 1.00 0.00 H new ATOM 0 HO2' G A 5 3.625 5.112 8.170 1.00 0.00 H new ATOM 0 H1' G A 5 3.871 2.479 6.089 1.00 0.00 H new ATOM 0 H8 G A 5 0.271 2.861 4.837 1.00 0.00 H new ATOM 0 H1 G A 5 4.731 1.840 0.346 1.00 0.00 H new ATOM 0 H21 G A 5 7.004 2.257 2.938 1.00 0.00 H new ATOM 0 H22 G A 5 6.739 1.937 1.221 1.00 0.00 H new ATOM 167 P U A 6 0.430 6.873 7.783 1.00 0.00 P ATOM 168 OP1 U A 6 0.822 8.005 8.660 1.00 0.00 O ATOM 169 OP2 U A 6 -0.886 6.216 7.978 1.00 0.00 O ATOM 170 O5' U A 6 0.523 7.357 6.267 1.00 0.00 O ATOM 171 C5' U A 6 1.785 7.621 5.659 1.00 0.00 C ATOM 172 C4' U A 6 1.597 8.028 4.218 1.00 0.00 C ATOM 173 O4' U A 6 1.984 6.942 3.346 1.00 0.00 O ATOM 174 C3' U A 6 0.167 8.317 3.793 1.00 0.00 C ATOM 175 O3' U A 6 -0.218 9.645 4.143 1.00 0.00 O ATOM 176 C2' U A 6 0.203 8.115 2.276 1.00 0.00 C ATOM 177 O2' U A 6 0.533 9.321 1.618 1.00 0.00 O ATOM 178 C1' U A 6 1.358 7.124 2.093 1.00 0.00 C ATOM 179 N1 U A 6 0.900 5.825 1.580 1.00 0.00 N ATOM 180 C2 U A 6 1.615 5.252 0.543 1.00 0.00 C ATOM 181 O2 U A 6 2.631 5.745 0.085 1.00 0.00 O ATOM 182 N3 U A 6 1.098 4.079 0.062 1.00 0.00 N ATOM 183 C4 U A 6 -0.038 3.432 0.497 1.00 0.00 C ATOM 184 O4 U A 6 -0.398 2.398 -0.064 1.00 0.00 O ATOM 185 C5 U A 6 -0.708 4.076 1.586 1.00 0.00 C ATOM 186 C6 U A 6 -0.226 5.216 2.087 1.00 0.00 C ATOM 0 H5' U A 6 2.416 6.734 5.714 1.00 0.00 H new ATOM 0 H5'' U A 6 2.300 8.412 6.203 1.00 0.00 H new ATOM 0 H4' U A 6 2.196 8.935 4.139 1.00 0.00 H new ATOM 0 H3' U A 6 -0.565 7.675 4.284 1.00 0.00 H new ATOM 0 H2' U A 6 -0.753 7.779 1.873 1.00 0.00 H new ATOM 0 HO2' U A 6 -0.135 9.510 0.927 1.00 0.00 H new ATOM 0 H1' U A 6 2.052 7.533 1.359 1.00 0.00 H new ATOM 0 H3 U A 6 1.609 3.636 -0.701 1.00 0.00 H new ATOM 0 H5 U A 6 -1.604 3.640 2.003 1.00 0.00 H new ATOM 0 H6 U A 6 -0.737 5.677 2.919 1.00 0.00 H new ATOM 197 P U A 7 -1.692 9.928 4.728 1.00 0.00 P ATOM 198 OP1 U A 7 -1.523 10.465 6.102 1.00 0.00 O ATOM 199 OP2 U A 7 -2.538 8.726 4.511 1.00 0.00 O ATOM 200 O5' U A 7 -2.253 11.102 3.807 1.00 0.00 O ATOM 201 C5' U A 7 -2.259 10.976 2.385 1.00 0.00 C ATOM 202 C4' U A 7 -1.989 12.314 1.732 1.00 0.00 C ATOM 203 O4' U A 7 -1.318 13.196 2.682 1.00 0.00 O ATOM 204 C3' U A 7 -1.041 12.237 0.541 1.00 0.00 C ATOM 205 O3' U A 7 -1.308 13.256 -0.419 1.00 0.00 O ATOM 206 C2' U A 7 0.318 12.422 1.199 1.00 0.00 C ATOM 207 O2' U A 7 1.278 12.921 0.286 1.00 0.00 O ATOM 208 C1' U A 7 -0.024 13.513 2.201 1.00 0.00 C ATOM 209 N1 U A 7 0.891 13.616 3.347 1.00 0.00 N ATOM 210 C2 U A 7 1.658 14.762 3.457 1.00 0.00 C ATOM 211 O2 U A 7 1.603 15.675 2.652 1.00 0.00 O ATOM 212 N3 U A 7 2.491 14.802 4.545 1.00 0.00 N ATOM 213 C4 U A 7 2.634 13.835 5.516 1.00 0.00 C ATOM 214 O4 U A 7 3.425 14.018 6.440 1.00 0.00 O ATOM 215 C5 U A 7 1.809 12.682 5.332 1.00 0.00 C ATOM 216 C6 U A 7 0.985 12.608 4.280 1.00 0.00 C ATOM 0 H5' U A 7 -3.223 10.591 2.052 1.00 0.00 H new ATOM 0 H5'' U A 7 -1.503 10.255 2.075 1.00 0.00 H new ATOM 0 H4' U A 7 -2.966 12.671 1.406 1.00 0.00 H new ATOM 0 H3' U A 7 -1.129 11.309 -0.024 1.00 0.00 H new ATOM 0 H2' U A 7 0.744 11.504 1.604 1.00 0.00 H new ATOM 0 HO2' U A 7 2.138 13.029 0.743 1.00 0.00 H new ATOM 0 H1' U A 7 0.049 14.475 1.693 1.00 0.00 H new ATOM 0 H3 U A 7 3.067 15.638 4.647 1.00 0.00 H new ATOM 0 H5 U A 7 1.851 11.870 6.043 1.00 0.00 H new ATOM 0 H6 U A 7 0.372 11.727 4.159 1.00 0.00 H new ATOM 227 P G A 8 -1.184 12.931 -1.990 1.00 0.00 P ATOM 228 OP1 G A 8 0.017 13.634 -2.510 1.00 0.00 O ATOM 229 OP2 G A 8 -2.510 13.195 -2.601 1.00 0.00 O ATOM 230 O5' G A 8 -0.915 11.361 -2.053 1.00 0.00 O ATOM 231 C5' G A 8 0.330 10.802 -1.630 1.00 0.00 C ATOM 232 C4' G A 8 0.215 9.297 -1.533 1.00 0.00 C ATOM 233 O4' G A 8 -0.856 8.990 -0.596 1.00 0.00 O ATOM 234 C3' G A 8 -0.145 8.572 -2.828 1.00 0.00 C ATOM 235 O3' G A 8 0.476 7.291 -2.899 1.00 0.00 O ATOM 236 C2' G A 8 -1.667 8.472 -2.762 1.00 0.00 C ATOM 237 O2' G A 8 -2.128 7.309 -3.421 1.00 0.00 O ATOM 238 C1' G A 8 -1.898 8.306 -1.262 1.00 0.00 C ATOM 239 N9 G A 8 -3.173 8.852 -0.805 1.00 0.00 N ATOM 240 C8 G A 8 -3.553 10.171 -0.794 1.00 0.00 C ATOM 241 N7 G A 8 -4.759 10.357 -0.335 1.00 0.00 N ATOM 242 C5 G A 8 -5.207 9.080 -0.024 1.00 0.00 C ATOM 243 C6 G A 8 -6.448 8.646 0.512 1.00 0.00 C ATOM 244 O6 G A 8 -7.434 9.326 0.826 1.00 0.00 O ATOM 245 N1 G A 8 -6.481 7.266 0.673 1.00 0.00 N ATOM 246 C2 G A 8 -5.454 6.411 0.359 1.00 0.00 C ATOM 247 N2 G A 8 -5.680 5.113 0.589 1.00 0.00 N ATOM 248 N3 G A 8 -4.293 6.801 -0.142 1.00 0.00 N ATOM 249 C4 G A 8 -4.239 8.140 -0.306 1.00 0.00 C ATOM 0 H5' G A 8 0.614 11.216 -0.663 1.00 0.00 H new ATOM 0 H5'' G A 8 1.117 11.070 -2.335 1.00 0.00 H new ATOM 0 H4' G A 8 1.206 8.954 -1.236 1.00 0.00 H new ATOM 0 H3' G A 8 0.201 9.092 -3.722 1.00 0.00 H new ATOM 0 H2' G A 8 -2.175 9.318 -3.225 1.00 0.00 H new ATOM 0 HO2' G A 8 -1.380 6.690 -3.553 1.00 0.00 H new ATOM 0 H1' G A 8 -1.915 7.238 -1.043 1.00 0.00 H new ATOM 0 H8 G A 8 -2.916 10.975 -1.132 1.00 0.00 H new ATOM 0 H1 G A 8 -7.334 6.857 1.054 1.00 0.00 H new ATOM 0 H21 G A 8 -4.958 4.424 0.378 1.00 0.00 H new ATOM 0 H22 G A 8 -6.574 4.812 0.976 1.00 0.00 H new ATOM 261 P G A 9 1.869 7.116 -3.690 1.00 0.00 P ATOM 262 OP1 G A 9 2.893 6.725 -2.690 1.00 0.00 O ATOM 263 OP2 G A 9 2.094 8.315 -4.537 1.00 0.00 O ATOM 264 O5' G A 9 1.611 5.866 -4.646 1.00 0.00 O ATOM 265 C5' G A 9 2.260 5.756 -5.913 1.00 0.00 C ATOM 266 C4' G A 9 1.329 5.115 -6.916 1.00 0.00 C ATOM 267 O4' G A 9 0.455 6.146 -7.453 1.00 0.00 O ATOM 268 C3' G A 9 1.994 4.496 -8.139 1.00 0.00 C ATOM 269 O3' G A 9 1.181 3.449 -8.671 1.00 0.00 O ATOM 270 C2' G A 9 2.121 5.689 -9.082 1.00 0.00 C ATOM 271 O2' G A 9 2.105 5.291 -10.441 1.00 0.00 O ATOM 272 C1' G A 9 0.824 6.441 -8.787 1.00 0.00 C ATOM 273 N9 G A 9 0.940 7.891 -8.919 1.00 0.00 N ATOM 274 C8 G A 9 1.734 8.732 -8.179 1.00 0.00 C ATOM 275 N7 G A 9 1.626 9.984 -8.529 1.00 0.00 N ATOM 276 C5 G A 9 0.703 9.970 -9.566 1.00 0.00 C ATOM 277 C6 G A 9 0.181 11.033 -10.347 1.00 0.00 C ATOM 278 O6 G A 9 0.439 12.241 -10.277 1.00 0.00 O ATOM 279 N1 G A 9 -0.732 10.576 -11.290 1.00 0.00 N ATOM 280 C2 G A 9 -1.097 9.265 -11.461 1.00 0.00 C ATOM 281 N2 G A 9 -1.992 9.022 -12.424 1.00 0.00 N ATOM 282 N3 G A 9 -0.620 8.263 -10.742 1.00 0.00 N ATOM 283 C4 G A 9 0.269 8.685 -9.819 1.00 0.00 C ATOM 0 H5' G A 9 3.168 5.161 -5.815 1.00 0.00 H new ATOM 0 H5'' G A 9 2.562 6.743 -6.263 1.00 0.00 H new ATOM 0 H4' G A 9 0.834 4.319 -6.359 1.00 0.00 H new ATOM 0 H3' G A 9 2.956 4.022 -7.943 1.00 0.00 H new ATOM 0 H2' G A 9 3.045 6.248 -8.936 1.00 0.00 H new ATOM 0 HO2' G A 9 2.187 6.082 -11.014 1.00 0.00 H new ATOM 0 H1' G A 9 0.084 6.117 -9.518 1.00 0.00 H new ATOM 0 H8 G A 9 2.383 8.391 -7.386 1.00 0.00 H new ATOM 0 H1 G A 9 -1.164 11.269 -11.902 1.00 0.00 H new ATOM 0 H21 G A 9 -2.304 8.067 -12.601 1.00 0.00 H new ATOM 0 H22 G A 9 -2.362 9.791 -12.982 1.00 0.00 H new ATOM 295 P G A 10 1.799 2.408 -9.732 1.00 0.00 P ATOM 296 OP1 G A 10 1.176 2.711 -11.046 1.00 0.00 O ATOM 297 OP2 G A 10 1.681 1.040 -9.164 1.00 0.00 O ATOM 298 O5' G A 10 3.341 2.798 -9.819 1.00 0.00 O ATOM 299 C5' G A 10 4.358 1.797 -9.862 1.00 0.00 C ATOM 300 C4' G A 10 5.577 2.267 -9.104 1.00 0.00 C ATOM 301 O4' G A 10 5.136 3.124 -8.016 1.00 0.00 O ATOM 302 C3' G A 10 6.396 1.168 -8.437 1.00 0.00 C ATOM 303 O3' G A 10 7.768 1.533 -8.324 1.00 0.00 O ATOM 304 C2' G A 10 5.718 1.022 -7.080 1.00 0.00 C ATOM 305 O2' G A 10 6.622 0.576 -6.089 1.00 0.00 O ATOM 306 C1' G A 10 5.341 2.471 -6.778 1.00 0.00 C ATOM 307 N9 G A 10 4.122 2.583 -5.988 1.00 0.00 N ATOM 308 C8 G A 10 2.876 2.105 -6.312 1.00 0.00 C ATOM 309 N7 G A 10 1.985 2.321 -5.386 1.00 0.00 N ATOM 310 C5 G A 10 2.685 2.991 -4.392 1.00 0.00 C ATOM 311 C6 G A 10 2.248 3.491 -3.146 1.00 0.00 C ATOM 312 O6 G A 10 1.116 3.447 -2.654 1.00 0.00 O ATOM 313 N1 G A 10 3.286 4.101 -2.448 1.00 0.00 N ATOM 314 C2 G A 10 4.574 4.224 -2.900 1.00 0.00 C ATOM 315 N2 G A 10 5.432 4.842 -2.082 1.00 0.00 N ATOM 316 N3 G A 10 4.992 3.771 -4.066 1.00 0.00 N ATOM 317 C4 G A 10 4.003 3.167 -4.754 1.00 0.00 C ATOM 0 H5' G A 10 4.624 1.581 -10.897 1.00 0.00 H new ATOM 0 H5'' G A 10 3.985 0.869 -9.428 1.00 0.00 H new ATOM 0 H4' G A 10 6.204 2.751 -9.853 1.00 0.00 H new ATOM 0 H3' G A 10 6.416 0.235 -9.000 1.00 0.00 H new ATOM 0 H2' G A 10 4.896 0.306 -7.088 1.00 0.00 H new ATOM 0 HO2' G A 10 6.147 0.466 -5.239 1.00 0.00 H new ATOM 0 H1' G A 10 6.146 2.920 -6.197 1.00 0.00 H new ATOM 0 H8 G A 10 2.657 1.601 -7.241 1.00 0.00 H new ATOM 0 H1 G A 10 3.072 4.487 -1.528 1.00 0.00 H new ATOM 0 H21 G A 10 6.405 4.964 -2.362 1.00 0.00 H new ATOM 0 H22 G A 10 5.113 5.191 -1.178 1.00 0.00 H new ATOM 329 P C A 11 8.879 0.399 -8.063 1.00 0.00 P ATOM 330 OP1 C A 11 10.095 0.791 -8.820 1.00 0.00 O ATOM 331 OP2 C A 11 8.265 -0.931 -8.301 1.00 0.00 O ATOM 332 O5' C A 11 9.196 0.519 -6.506 1.00 0.00 O ATOM 333 C5' C A 11 10.046 1.549 -6.008 1.00 0.00 C ATOM 334 C4' C A 11 10.142 1.470 -4.501 1.00 0.00 C ATOM 335 O4' C A 11 9.046 2.204 -3.904 1.00 0.00 O ATOM 336 C3' C A 11 9.990 0.090 -3.877 1.00 0.00 C ATOM 337 O3' C A 11 11.181 -0.685 -3.979 1.00 0.00 O ATOM 338 C2' C A 11 9.647 0.431 -2.429 1.00 0.00 C ATOM 339 O2' C A 11 10.808 0.753 -1.686 1.00 0.00 O ATOM 340 C1' C A 11 8.813 1.704 -2.600 1.00 0.00 C ATOM 341 N1 C A 11 7.368 1.478 -2.422 1.00 0.00 N ATOM 342 C2 C A 11 6.845 1.490 -1.126 1.00 0.00 C ATOM 343 O2 C A 11 7.607 1.702 -0.172 1.00 0.00 O ATOM 344 N3 C A 11 5.525 1.269 -0.944 1.00 0.00 N ATOM 345 C4 C A 11 4.737 1.044 -1.996 1.00 0.00 C ATOM 346 N4 C A 11 3.448 0.811 -1.773 1.00 0.00 N ATOM 347 C5 C A 11 5.236 1.044 -3.326 1.00 0.00 C ATOM 348 C6 C A 11 6.549 1.258 -3.494 1.00 0.00 C ATOM 0 H5' C A 11 9.658 2.524 -6.304 1.00 0.00 H new ATOM 0 H5'' C A 11 11.039 1.454 -6.448 1.00 0.00 H new ATOM 0 H4' C A 11 11.146 1.849 -4.311 1.00 0.00 H new ATOM 0 H3' C A 11 9.240 -0.528 -4.370 1.00 0.00 H new ATOM 0 H2' C A 11 9.156 -0.388 -1.904 1.00 0.00 H new ATOM 0 HO2' C A 11 10.768 0.315 -0.810 1.00 0.00 H new ATOM 0 H1' C A 11 9.117 2.411 -1.829 1.00 0.00 H new ATOM 0 H41 C A 11 2.819 0.635 -2.556 1.00 0.00 H new ATOM 0 H42 C A 11 3.088 0.808 -0.819 1.00 0.00 H new ATOM 0 H5 C A 11 4.583 0.878 -4.170 1.00 0.00 H new ATOM 0 H6 C A 11 6.965 1.257 -4.491 1.00 0.00 H new ATOM 360 P U A 12 11.145 -2.254 -3.621 1.00 0.00 P ATOM 361 OP1 U A 12 12.507 -2.795 -3.865 1.00 0.00 O ATOM 362 OP2 U A 12 9.979 -2.864 -4.309 1.00 0.00 O ATOM 363 O5' U A 12 10.862 -2.292 -2.052 1.00 0.00 O ATOM 364 C5' U A 12 11.909 -2.065 -1.109 1.00 0.00 C ATOM 365 C4' U A 12 11.346 -1.999 0.292 1.00 0.00 C ATOM 366 O4' U A 12 10.228 -1.074 0.311 1.00 0.00 O ATOM 367 C3' U A 12 10.766 -3.300 0.827 1.00 0.00 C ATOM 368 O3' U A 12 11.786 -4.125 1.385 1.00 0.00 O ATOM 369 C2' U A 12 9.763 -2.815 1.872 1.00 0.00 C ATOM 370 O2' U A 12 10.406 -2.480 3.088 1.00 0.00 O ATOM 371 C1' U A 12 9.250 -1.524 1.232 1.00 0.00 C ATOM 372 N1 U A 12 7.976 -1.675 0.513 1.00 0.00 N ATOM 373 C2 U A 12 6.808 -1.429 1.213 1.00 0.00 C ATOM 374 O2 U A 12 6.795 -1.112 2.389 1.00 0.00 O ATOM 375 N3 U A 12 5.655 -1.565 0.484 1.00 0.00 N ATOM 376 C4 U A 12 5.549 -1.913 -0.845 1.00 0.00 C ATOM 377 O4 U A 12 4.438 -1.965 -1.371 1.00 0.00 O ATOM 378 C5 U A 12 6.798 -2.159 -1.495 1.00 0.00 C ATOM 379 C6 U A 12 7.942 -2.041 -0.814 1.00 0.00 C ATOM 0 H5' U A 12 12.425 -1.135 -1.345 1.00 0.00 H new ATOM 0 H5'' U A 12 12.647 -2.865 -1.175 1.00 0.00 H new ATOM 0 H4' U A 12 12.199 -1.713 0.908 1.00 0.00 H new ATOM 0 H3' U A 12 10.302 -3.926 0.064 1.00 0.00 H new ATOM 0 H2' U A 12 9.005 -3.561 2.110 1.00 0.00 H new ATOM 0 HO2' U A 12 9.739 -2.172 3.737 1.00 0.00 H new ATOM 0 H1' U A 12 9.071 -0.817 2.042 1.00 0.00 H new ATOM 0 H3 U A 12 4.781 -1.390 0.979 1.00 0.00 H new ATOM 0 H5 U A 12 6.817 -2.441 -2.537 1.00 0.00 H new ATOM 0 H6 U A 12 8.874 -2.240 -1.323 1.00 0.00 H new ATOM 390 P C A 13 11.482 -5.673 1.698 1.00 0.00 P ATOM 391 OP1 C A 13 12.679 -6.237 2.371 1.00 0.00 O ATOM 392 OP2 C A 13 10.968 -6.312 0.461 1.00 0.00 O ATOM 393 O5' C A 13 10.295 -5.625 2.761 1.00 0.00 O ATOM 394 C5' C A 13 10.528 -5.201 4.102 1.00 0.00 C ATOM 395 C4' C A 13 9.354 -5.570 4.979 1.00 0.00 C ATOM 396 O4' C A 13 8.261 -4.648 4.737 1.00 0.00 O ATOM 397 C3' C A 13 8.736 -6.932 4.710 1.00 0.00 C ATOM 398 O3' C A 13 9.479 -7.970 5.343 1.00 0.00 O ATOM 399 C2' C A 13 7.334 -6.774 5.289 1.00 0.00 C ATOM 400 O2' C A 13 7.347 -6.920 6.696 1.00 0.00 O ATOM 401 C1' C A 13 7.027 -5.312 4.952 1.00 0.00 C ATOM 402 N1 C A 13 6.192 -5.136 3.752 1.00 0.00 N ATOM 403 C2 C A 13 4.809 -4.993 3.907 1.00 0.00 C ATOM 404 O2 C A 13 4.325 -5.037 5.047 1.00 0.00 O ATOM 405 N3 C A 13 4.036 -4.812 2.812 1.00 0.00 N ATOM 406 C4 C A 13 4.594 -4.776 1.601 1.00 0.00 C ATOM 407 N4 C A 13 3.791 -4.588 0.552 1.00 0.00 N ATOM 408 C5 C A 13 5.998 -4.930 1.412 1.00 0.00 C ATOM 409 C6 C A 13 6.753 -5.105 2.505 1.00 0.00 C ATOM 0 H5' C A 13 10.685 -4.123 4.128 1.00 0.00 H new ATOM 0 H5'' C A 13 11.437 -5.665 4.485 1.00 0.00 H new ATOM 0 H4' C A 13 9.772 -5.552 5.986 1.00 0.00 H new ATOM 0 H3' C A 13 8.727 -7.217 3.658 1.00 0.00 H new ATOM 0 H2' C A 13 6.623 -7.504 4.903 1.00 0.00 H new ATOM 0 HO2' C A 13 8.133 -7.440 6.964 1.00 0.00 H new ATOM 0 H1' C A 13 6.462 -4.901 5.789 1.00 0.00 H new ATOM 0 H41 C A 13 4.182 -4.555 -0.390 1.00 0.00 H new ATOM 0 H42 C A 13 2.787 -4.478 0.692 1.00 0.00 H new ATOM 0 H5 C A 13 6.437 -4.907 0.425 1.00 0.00 H new ATOM 0 H6 C A 13 7.821 -5.223 2.400 1.00 0.00 H new ATOM 421 P U A 14 9.659 -9.387 4.604 1.00 0.00 P ATOM 422 OP1 U A 14 10.691 -10.166 5.335 1.00 0.00 O ATOM 423 OP2 U A 14 9.831 -9.126 3.152 1.00 0.00 O ATOM 424 O5' U A 14 8.251 -10.105 4.810 1.00 0.00 O ATOM 425 C5' U A 14 7.827 -10.531 6.103 1.00 0.00 C ATOM 426 C4' U A 14 6.505 -11.256 6.006 1.00 0.00 C ATOM 427 O4' U A 14 5.442 -10.281 5.843 1.00 0.00 O ATOM 428 C3' U A 14 6.353 -12.179 4.806 1.00 0.00 C ATOM 429 O3' U A 14 6.916 -13.463 5.058 1.00 0.00 O ATOM 430 C2' U A 14 4.841 -12.232 4.618 1.00 0.00 C ATOM 431 O2' U A 14 4.238 -13.129 5.533 1.00 0.00 O ATOM 432 C1' U A 14 4.437 -10.805 4.994 1.00 0.00 C ATOM 433 N1 U A 14 4.290 -9.909 3.837 1.00 0.00 N ATOM 434 C2 U A 14 3.045 -9.831 3.238 1.00 0.00 C ATOM 435 O2 U A 14 2.083 -10.472 3.621 1.00 0.00 O ATOM 436 N3 U A 14 2.970 -8.974 2.169 1.00 0.00 N ATOM 437 C4 U A 14 3.990 -8.205 1.650 1.00 0.00 C ATOM 438 O4 U A 14 3.771 -7.483 0.678 1.00 0.00 O ATOM 439 C5 U A 14 5.243 -8.345 2.322 1.00 0.00 C ATOM 440 C6 U A 14 5.353 -9.170 3.366 1.00 0.00 C ATOM 0 H5' U A 14 7.730 -9.670 6.764 1.00 0.00 H new ATOM 0 H5'' U A 14 8.578 -11.187 6.542 1.00 0.00 H new ATOM 0 H4' U A 14 6.458 -11.850 6.919 1.00 0.00 H new ATOM 0 H3' U A 14 6.878 -11.831 3.916 1.00 0.00 H new ATOM 0 H2' U A 14 4.545 -12.560 3.622 1.00 0.00 H new ATOM 0 HO2' U A 14 4.918 -13.738 5.890 1.00 0.00 H new ATOM 0 H1' U A 14 3.461 -10.857 5.477 1.00 0.00 H new ATOM 0 H3 U A 14 2.063 -8.898 1.709 1.00 0.00 H new ATOM 0 H5 U A 14 6.102 -7.783 1.985 1.00 0.00 H new ATOM 0 H6 U A 14 6.310 -9.261 3.859 1.00 0.00 H new ATOM 451 P C A 15 7.062 -14.520 3.856 1.00 0.00 P ATOM 452 OP1 C A 15 7.711 -15.735 4.411 1.00 0.00 O ATOM 453 OP2 C A 15 7.672 -13.828 2.693 1.00 0.00 O ATOM 454 O5' C A 15 5.556 -14.884 3.480 1.00 0.00 O ATOM 455 C5' C A 15 4.914 -16.032 4.033 1.00 0.00 C ATOM 456 C4' C A 15 3.636 -16.324 3.282 1.00 0.00 C ATOM 457 O4' C A 15 2.820 -15.124 3.258 1.00 0.00 O ATOM 458 C3' C A 15 3.812 -16.693 1.816 1.00 0.00 C ATOM 459 O3' C A 15 4.082 -18.084 1.634 1.00 0.00 O ATOM 460 C2' C A 15 2.475 -16.287 1.207 1.00 0.00 C ATOM 461 O2' C A 15 1.487 -17.275 1.438 1.00 0.00 O ATOM 462 C1' C A 15 2.125 -15.044 2.028 1.00 0.00 C ATOM 463 N1 C A 15 2.487 -13.778 1.369 1.00 0.00 N ATOM 464 C2 C A 15 1.511 -13.104 0.634 1.00 0.00 C ATOM 465 O2 C A 15 0.376 -13.596 0.558 1.00 0.00 O ATOM 466 N3 C A 15 1.825 -11.937 0.027 1.00 0.00 N ATOM 467 C4 C A 15 3.059 -11.440 0.140 1.00 0.00 C ATOM 468 N4 C A 15 3.324 -10.286 -0.474 1.00 0.00 N ATOM 469 C5 C A 15 4.075 -12.106 0.884 1.00 0.00 C ATOM 470 C6 C A 15 3.749 -13.264 1.474 1.00 0.00 C ATOM 0 H5' C A 15 4.695 -15.863 5.087 1.00 0.00 H new ATOM 0 H5'' C A 15 5.581 -16.892 3.980 1.00 0.00 H new ATOM 0 H4' C A 15 3.200 -17.173 3.809 1.00 0.00 H new ATOM 0 H3' C A 15 4.666 -16.199 1.352 1.00 0.00 H new ATOM 0 H2' C A 15 2.523 -16.138 0.128 1.00 0.00 H new ATOM 0 HO2' C A 15 1.920 -18.138 1.608 1.00 0.00 H new ATOM 0 HO3' C A 15 4.186 -18.275 0.678 1.00 0.00 H new ATOM 0 H1' C A 15 1.043 -15.034 2.157 1.00 0.00 H new ATOM 0 H41 C A 15 4.256 -9.876 -0.410 1.00 0.00 H new ATOM 0 H42 C A 15 2.595 -9.813 -1.008 1.00 0.00 H new ATOM 0 H5 C A 15 5.069 -11.694 0.969 1.00 0.00 H new ATOM 0 H6 C A 15 4.495 -13.800 2.042 1.00 0.00 H new TER 483 C A 15