USER MOD reduce.3.24.130724 H: found=0, std=0, add=176, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 176 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 180:sc= -0.377 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 A O2' : rot 180:sc= -0.249 USER MOD Single : A 3 G O2' : rot 180:sc= -0.382 USER MOD Single : A 4 G O2' : rot -15:sc= -0.347 USER MOD Single : A 5 U O2' : rot -19:sc= 0.0166 USER MOD Single : A 6 C O2' : rot -23:sc= 0.163 USER MOD Single : A 7 U O2' : rot -19:sc= -0.182 USER MOD Single : A 8 C O2' : rot -27:sc= 0.118 USER MOD Single : A 8 C O3' : rot 180:sc= 0.169 USER MOD Single : B 9 G O2' : rot -13:sc= -0.305 USER MOD Single : B 9 G O5' : rot 23:sc= 0.286 USER MOD Single : B 10 A O2' : rot -9:sc= -0.158 USER MOD Single : B 11 G O2' : rot 180:sc= -0.317 USER MOD Single : B 12 G O2' : rot -23:sc= -0.206 USER MOD Single : B 13 U O2' : rot -17:sc= -0.328 USER MOD Single : B 14 C O2' : rot -14:sc= -0.426 USER MOD Single : B 15 U O2' : rot -73:sc= 0.561 USER MOD Single : B 16 C O2' : rot -28:sc= 0.109 USER MOD Single : B 16 C O3' : rot 180:sc= 0.111 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 6.783 -10.354 3.612 1.00 0.00 O ATOM 2 C5' G A 1 6.549 -9.297 4.517 1.00 0.00 C ATOM 3 C4' G A 1 7.382 -8.081 4.112 1.00 0.00 C ATOM 4 O4' G A 1 6.959 -7.560 2.854 1.00 0.00 O ATOM 5 C3' G A 1 7.216 -6.934 5.088 1.00 0.00 C ATOM 6 O3' G A 1 7.973 -7.115 6.269 1.00 0.00 O ATOM 7 C2' G A 1 7.736 -5.800 4.244 1.00 0.00 C ATOM 8 O2' G A 1 9.144 -5.863 4.168 1.00 0.00 O ATOM 9 C1' G A 1 7.157 -6.139 2.877 1.00 0.00 C ATOM 10 N9 G A 1 5.860 -5.455 2.712 1.00 0.00 N ATOM 11 C8 G A 1 4.602 -5.920 2.985 1.00 0.00 C ATOM 12 N7 G A 1 3.653 -5.064 2.727 1.00 0.00 N ATOM 13 C5 G A 1 4.332 -3.945 2.256 1.00 0.00 C ATOM 14 C6 G A 1 3.830 -2.682 1.825 1.00 0.00 C ATOM 15 O6 G A 1 2.662 -2.309 1.758 1.00 0.00 O ATOM 16 N1 G A 1 4.859 -1.823 1.452 1.00 0.00 N ATOM 17 C2 G A 1 6.201 -2.136 1.485 1.00 0.00 C ATOM 18 N2 G A 1 7.051 -1.181 1.097 1.00 0.00 N ATOM 19 N3 G A 1 6.675 -3.321 1.881 1.00 0.00 N ATOM 20 C4 G A 1 5.687 -4.174 2.253 1.00 0.00 C ATOM 0 H5' G A 1 6.808 -9.607 5.529 1.00 0.00 H new ATOM 0 H5'' G A 1 5.490 -9.039 4.524 1.00 0.00 H new ATOM 0 H4' G A 1 8.412 -8.435 4.083 1.00 0.00 H new ATOM 0 H3' G A 1 6.203 -6.799 5.466 1.00 0.00 H new ATOM 0 H2' G A 1 7.473 -4.812 4.623 1.00 0.00 H new ATOM 0 HO2' G A 1 9.475 -5.123 3.617 1.00 0.00 H new ATOM 0 HO5' G A 1 6.249 -11.133 3.874 1.00 0.00 H new ATOM 0 H1' G A 1 7.822 -5.822 2.073 1.00 0.00 H new ATOM 0 H8 G A 1 4.412 -6.908 3.379 1.00 0.00 H new ATOM 0 H1 G A 1 4.601 -0.890 1.130 1.00 0.00 H new ATOM 0 H21 G A 1 8.055 -1.359 1.102 1.00 0.00 H new ATOM 0 H22 G A 1 6.696 -0.274 0.796 1.00 0.00 H new ATOM 33 P A A 2 7.698 -6.203 7.573 1.00 0.00 P ATOM 34 OP1 A A 2 8.674 -6.586 8.617 1.00 0.00 O ATOM 35 OP2 A A 2 6.249 -6.260 7.868 1.00 0.00 O ATOM 36 O5' A A 2 8.048 -4.710 7.082 1.00 0.00 O ATOM 37 C5' A A 2 9.387 -4.288 6.922 1.00 0.00 C ATOM 38 C4' A A 2 9.399 -2.838 6.437 1.00 0.00 C ATOM 39 O4' A A 2 8.684 -2.698 5.215 1.00 0.00 O ATOM 40 C3' A A 2 8.694 -1.912 7.402 1.00 0.00 C ATOM 41 O3' A A 2 9.490 -1.615 8.538 1.00 0.00 O ATOM 42 C2' A A 2 8.475 -0.713 6.518 1.00 0.00 C ATOM 43 O2' A A 2 9.680 0.010 6.389 1.00 0.00 O ATOM 44 C1' A A 2 8.151 -1.367 5.174 1.00 0.00 C ATOM 45 N9 A A 2 6.686 -1.406 4.966 1.00 0.00 N ATOM 46 C8 A A 2 5.809 -2.449 5.143 1.00 0.00 C ATOM 47 N7 A A 2 4.569 -2.149 4.866 1.00 0.00 N ATOM 48 C5 A A 2 4.627 -0.814 4.475 1.00 0.00 C ATOM 49 C6 A A 2 3.643 0.101 4.049 1.00 0.00 C ATOM 50 N6 A A 2 2.346 -0.209 3.942 1.00 0.00 N ATOM 51 N1 A A 2 4.044 1.348 3.734 1.00 0.00 N ATOM 52 C2 A A 2 5.334 1.656 3.837 1.00 0.00 C ATOM 53 N3 A A 2 6.348 0.891 4.222 1.00 0.00 N ATOM 54 C4 A A 2 5.913 -0.354 4.532 1.00 0.00 C ATOM 0 H5' A A 2 9.900 -4.929 6.205 1.00 0.00 H new ATOM 0 H5'' A A 2 9.924 -4.373 7.867 1.00 0.00 H new ATOM 0 H4' A A 2 10.453 -2.582 6.333 1.00 0.00 H new ATOM 0 H3' A A 2 7.783 -2.318 7.841 1.00 0.00 H new ATOM 0 H2' A A 2 7.714 -0.026 6.888 1.00 0.00 H new ATOM 0 HO2' A A 2 9.534 0.789 5.812 1.00 0.00 H new ATOM 0 H1' A A 2 8.587 -0.801 4.351 1.00 0.00 H new ATOM 0 H8 A A 2 6.117 -3.427 5.480 1.00 0.00 H new ATOM 0 H61 A A 2 1.678 0.495 3.628 1.00 0.00 H new ATOM 0 H62 A A 2 2.026 -1.149 4.174 1.00 0.00 H new ATOM 0 H2 A A 2 5.592 2.670 3.570 1.00 0.00 H new ATOM 66 P G A 3 8.842 -0.941 9.856 1.00 0.00 P ATOM 67 OP1 G A 3 9.923 -0.735 10.846 1.00 0.00 O ATOM 68 OP2 G A 3 7.647 -1.729 10.229 1.00 0.00 O ATOM 69 O5' G A 3 8.346 0.503 9.350 1.00 0.00 O ATOM 70 C5' G A 3 9.261 1.558 9.131 1.00 0.00 C ATOM 71 C4' G A 3 8.489 2.766 8.603 1.00 0.00 C ATOM 72 O4' G A 3 7.795 2.434 7.408 1.00 0.00 O ATOM 73 C3' G A 3 7.419 3.225 9.556 1.00 0.00 C ATOM 74 O3' G A 3 7.949 3.970 10.642 1.00 0.00 O ATOM 75 C2' G A 3 6.610 4.090 8.619 1.00 0.00 C ATOM 76 O2' G A 3 7.243 5.340 8.452 1.00 0.00 O ATOM 77 C1' G A 3 6.690 3.329 7.299 1.00 0.00 C ATOM 78 N9 G A 3 5.428 2.595 7.093 1.00 0.00 N ATOM 79 C8 G A 3 5.125 1.285 7.363 1.00 0.00 C ATOM 80 N7 G A 3 3.884 0.968 7.114 1.00 0.00 N ATOM 81 C5 G A 3 3.323 2.156 6.650 1.00 0.00 C ATOM 82 C6 G A 3 1.991 2.443 6.225 1.00 0.00 C ATOM 83 O6 G A 3 1.028 1.682 6.165 1.00 0.00 O ATOM 84 N1 G A 3 1.852 3.774 5.847 1.00 0.00 N ATOM 85 C2 G A 3 2.862 4.712 5.865 1.00 0.00 C ATOM 86 N2 G A 3 2.552 5.945 5.456 1.00 0.00 N ATOM 87 N3 G A 3 4.109 4.445 6.257 1.00 0.00 N ATOM 88 C4 G A 3 4.266 3.154 6.636 1.00 0.00 C ATOM 0 H5' G A 3 10.025 1.254 8.416 1.00 0.00 H new ATOM 0 H5'' G A 3 9.775 1.812 10.058 1.00 0.00 H new ATOM 0 H4' G A 3 9.239 3.543 8.454 1.00 0.00 H new ATOM 0 H3' G A 3 6.866 2.426 10.049 1.00 0.00 H new ATOM 0 H2' G A 3 5.596 4.272 8.974 1.00 0.00 H new ATOM 0 HO2' G A 3 6.714 5.896 7.843 1.00 0.00 H new ATOM 0 H1' G A 3 6.832 3.994 6.447 1.00 0.00 H new ATOM 0 H8 G A 3 5.848 0.580 7.747 1.00 0.00 H new ATOM 0 H1 G A 3 0.931 4.080 5.532 1.00 0.00 H new ATOM 0 H21 G A 3 3.265 6.675 5.451 1.00 0.00 H new ATOM 0 H22 G A 3 1.603 6.157 5.149 1.00 0.00 H new ATOM 100 P G A 4 6.986 4.539 11.813 1.00 0.00 P ATOM 101 OP1 G A 4 7.847 5.044 12.905 1.00 0.00 O ATOM 102 OP2 G A 4 5.967 3.506 12.102 1.00 0.00 O ATOM 103 O5' G A 4 6.236 5.807 11.142 1.00 0.00 O ATOM 104 C5' G A 4 6.921 7.029 10.920 1.00 0.00 C ATOM 105 C4' G A 4 5.938 8.085 10.394 1.00 0.00 C ATOM 106 O4' G A 4 5.331 7.672 9.167 1.00 0.00 O ATOM 107 C3' G A 4 4.795 8.326 11.361 1.00 0.00 C ATOM 108 O3' G A 4 5.153 9.223 12.396 1.00 0.00 O ATOM 109 C2' G A 4 3.778 8.942 10.433 1.00 0.00 C ATOM 110 O2' G A 4 4.133 10.283 10.164 1.00 0.00 O ATOM 111 C1' G A 4 3.969 8.132 9.163 1.00 0.00 C ATOM 112 N9 G A 4 3.058 6.973 9.142 1.00 0.00 N ATOM 113 C8 G A 4 3.359 5.654 9.327 1.00 0.00 C ATOM 114 N7 G A 4 2.342 4.849 9.186 1.00 0.00 N ATOM 115 C5 G A 4 1.283 5.701 8.888 1.00 0.00 C ATOM 116 C6 G A 4 -0.087 5.402 8.628 1.00 0.00 C ATOM 117 O6 G A 4 -0.636 4.303 8.599 1.00 0.00 O ATOM 118 N1 G A 4 -0.828 6.555 8.394 1.00 0.00 N ATOM 119 C2 G A 4 -0.316 7.835 8.389 1.00 0.00 C ATOM 120 N2 G A 4 -1.182 8.825 8.148 1.00 0.00 N ATOM 121 N3 G A 4 0.972 8.119 8.618 1.00 0.00 N ATOM 122 C4 G A 4 1.711 7.007 8.864 1.00 0.00 C ATOM 0 H5' G A 4 7.728 6.880 10.202 1.00 0.00 H new ATOM 0 H5'' G A 4 7.379 7.374 11.847 1.00 0.00 H new ATOM 0 H4' G A 4 6.533 8.988 10.259 1.00 0.00 H new ATOM 0 H3' G A 4 4.459 7.433 11.888 1.00 0.00 H new ATOM 0 H2' G A 4 2.763 8.935 10.830 1.00 0.00 H new ATOM 0 HO2' G A 4 4.806 10.579 10.811 1.00 0.00 H new ATOM 0 H1' G A 4 3.752 8.741 8.285 1.00 0.00 H new ATOM 0 H8 G A 4 4.353 5.307 9.569 1.00 0.00 H new ATOM 0 H1 G A 4 -1.826 6.446 8.212 1.00 0.00 H new ATOM 0 H21 G A 4 -0.859 9.792 8.132 1.00 0.00 H new ATOM 0 H22 G A 4 -2.165 8.613 7.980 1.00 0.00 H new ATOM 134 P U A 5 4.314 9.278 13.771 1.00 0.00 P ATOM 135 OP1 U A 5 4.737 10.481 14.523 1.00 0.00 O ATOM 136 OP2 U A 5 4.404 7.946 14.409 1.00 0.00 O ATOM 137 O5' U A 5 2.790 9.493 13.292 1.00 0.00 O ATOM 138 C5' U A 5 2.321 10.749 12.851 1.00 0.00 C ATOM 139 C4' U A 5 0.824 10.646 12.517 1.00 0.00 C ATOM 140 O4' U A 5 0.544 9.833 11.370 1.00 0.00 O ATOM 141 C3' U A 5 0.025 10.060 13.648 1.00 0.00 C ATOM 142 O3' U A 5 -0.199 10.992 14.690 1.00 0.00 O ATOM 143 C2' U A 5 -1.237 9.746 12.894 1.00 0.00 C ATOM 144 O2' U A 5 -1.928 10.940 12.593 1.00 0.00 O ATOM 145 C1' U A 5 -0.708 9.159 11.610 1.00 0.00 C ATOM 146 N1 U A 5 -0.458 7.706 11.749 1.00 0.00 N ATOM 147 C2 U A 5 -1.494 6.820 11.476 1.00 0.00 C ATOM 148 O2 U A 5 -2.629 7.196 11.186 1.00 0.00 O ATOM 149 N3 U A 5 -1.174 5.473 11.545 1.00 0.00 N ATOM 150 C4 U A 5 0.068 4.944 11.862 1.00 0.00 C ATOM 151 O4 U A 5 0.242 3.730 11.893 1.00 0.00 O ATOM 152 C5 U A 5 1.079 5.941 12.135 1.00 0.00 C ATOM 153 C6 U A 5 0.786 7.260 12.067 1.00 0.00 C ATOM 0 H5' U A 5 2.880 11.070 11.972 1.00 0.00 H new ATOM 0 H5'' U A 5 2.482 11.501 13.623 1.00 0.00 H new ATOM 0 H4' U A 5 0.537 11.679 12.320 1.00 0.00 H new ATOM 0 H3' U A 5 0.491 9.221 14.165 1.00 0.00 H new ATOM 0 H2' U A 5 -1.920 9.098 13.443 1.00 0.00 H new ATOM 0 HO2' U A 5 -1.615 11.657 13.183 1.00 0.00 H new ATOM 0 H1' U A 5 -1.423 9.289 10.798 1.00 0.00 H new ATOM 0 H3 U A 5 -1.922 4.809 11.344 1.00 0.00 H new ATOM 0 H5 U A 5 2.079 5.629 12.396 1.00 0.00 H new ATOM 0 H6 U A 5 1.564 7.980 12.272 1.00 0.00 H new ATOM 164 P C A 6 -0.683 10.497 16.148 1.00 0.00 P ATOM 165 OP1 C A 6 -0.940 11.694 16.979 1.00 0.00 O ATOM 166 OP2 C A 6 0.269 9.467 16.618 1.00 0.00 O ATOM 167 O5' C A 6 -2.090 9.777 15.855 1.00 0.00 O ATOM 168 C5' C A 6 -3.259 10.528 15.616 1.00 0.00 C ATOM 169 C4' C A 6 -4.416 9.574 15.325 1.00 0.00 C ATOM 170 O4' C A 6 -4.159 8.758 14.187 1.00 0.00 O ATOM 171 C3' C A 6 -4.661 8.619 16.471 1.00 0.00 C ATOM 172 O3' C A 6 -5.378 9.245 17.517 1.00 0.00 O ATOM 173 C2' C A 6 -5.473 7.559 15.774 1.00 0.00 C ATOM 174 O2' C A 6 -6.802 8.010 15.614 1.00 0.00 O ATOM 175 C1' C A 6 -4.801 7.492 14.399 1.00 0.00 C ATOM 176 N1 C A 6 -3.795 6.402 14.375 1.00 0.00 N ATOM 177 C2 C A 6 -4.270 5.107 14.220 1.00 0.00 C ATOM 178 O2 C A 6 -5.474 4.904 14.084 1.00 0.00 O ATOM 179 N3 C A 6 -3.373 4.083 14.227 1.00 0.00 N ATOM 180 C4 C A 6 -2.064 4.317 14.390 1.00 0.00 C ATOM 181 N4 C A 6 -1.220 3.281 14.400 1.00 0.00 N ATOM 182 C5 C A 6 -1.557 5.648 14.540 1.00 0.00 C ATOM 183 C6 C A 6 -2.456 6.655 14.516 1.00 0.00 C ATOM 0 H5' C A 6 -3.107 11.202 14.773 1.00 0.00 H new ATOM 0 H5'' C A 6 -3.491 11.148 16.482 1.00 0.00 H new ATOM 0 H4' C A 6 -5.279 10.219 15.159 1.00 0.00 H new ATOM 0 H3' C A 6 -3.763 8.242 16.960 1.00 0.00 H new ATOM 0 H2' C A 6 -5.509 6.608 16.306 1.00 0.00 H new ATOM 0 HO2' C A 6 -6.993 8.706 16.277 1.00 0.00 H new ATOM 0 H1' C A 6 -5.533 7.288 13.617 1.00 0.00 H new ATOM 0 H41 C A 6 -0.220 3.439 14.523 1.00 0.00 H new ATOM 0 H42 C A 6 -1.576 2.332 14.285 1.00 0.00 H new ATOM 0 H5 C A 6 -0.501 5.838 14.667 1.00 0.00 H new ATOM 0 H6 C A 6 -2.114 7.675 14.609 1.00 0.00 H new ATOM 195 P U A 7 -5.617 8.498 18.919 1.00 0.00 P ATOM 196 OP1 U A 7 -6.337 9.422 19.822 1.00 0.00 O ATOM 197 OP2 U A 7 -4.330 7.905 19.345 1.00 0.00 O ATOM 198 O5' U A 7 -6.617 7.302 18.525 1.00 0.00 O ATOM 199 C5' U A 7 -6.617 6.109 19.271 1.00 0.00 C ATOM 200 C4' U A 7 -7.625 5.117 18.694 1.00 0.00 C ATOM 201 O4' U A 7 -7.310 4.770 17.336 1.00 0.00 O ATOM 202 C3' U A 7 -7.570 3.829 19.493 1.00 0.00 C ATOM 203 O3' U A 7 -8.460 3.847 20.593 1.00 0.00 O ATOM 204 C2' U A 7 -7.969 2.813 18.460 1.00 0.00 C ATOM 205 O2' U A 7 -9.363 2.867 18.239 1.00 0.00 O ATOM 206 C1' U A 7 -7.256 3.340 17.228 1.00 0.00 C ATOM 207 N1 U A 7 -5.836 2.892 17.165 1.00 0.00 N ATOM 208 C2 U A 7 -5.599 1.541 16.946 1.00 0.00 C ATOM 209 O2 U A 7 -6.510 0.723 16.844 1.00 0.00 O ATOM 210 N3 U A 7 -4.271 1.160 16.840 1.00 0.00 N ATOM 211 C4 U A 7 -3.173 2.003 16.906 1.00 0.00 C ATOM 212 O4 U A 7 -2.034 1.552 16.814 1.00 0.00 O ATOM 213 C5 U A 7 -3.511 3.402 17.075 1.00 0.00 C ATOM 214 C6 U A 7 -4.800 3.796 17.193 1.00 0.00 C ATOM 0 H5' U A 7 -6.863 6.323 20.311 1.00 0.00 H new ATOM 0 H5'' U A 7 -5.620 5.669 19.264 1.00 0.00 H new ATOM 0 H4' U A 7 -8.606 5.590 18.738 1.00 0.00 H new ATOM 0 H3' U A 7 -6.599 3.635 19.949 1.00 0.00 H new ATOM 0 H2' U A 7 -7.725 1.786 18.732 1.00 0.00 H new ATOM 0 HO2' U A 7 -9.797 3.314 18.995 1.00 0.00 H new ATOM 0 H1' U A 7 -7.734 2.966 16.322 1.00 0.00 H new ATOM 0 H3 U A 7 -4.084 0.167 16.700 1.00 0.00 H new ATOM 0 H5 U A 7 -2.723 4.140 17.107 1.00 0.00 H new ATOM 0 H6 U A 7 -5.021 4.846 17.312 1.00 0.00 H new ATOM 225 P C A 8 -8.239 2.858 21.848 1.00 0.00 P ATOM 226 OP1 C A 8 -9.383 3.023 22.772 1.00 0.00 O ATOM 227 OP2 C A 8 -6.860 3.059 22.345 1.00 0.00 O ATOM 228 O5' C A 8 -8.323 1.386 21.203 1.00 0.00 O ATOM 229 C5' C A 8 -9.560 0.825 20.819 1.00 0.00 C ATOM 230 C4' C A 8 -9.325 -0.599 20.311 1.00 0.00 C ATOM 231 O4' C A 8 -8.478 -0.616 19.163 1.00 0.00 O ATOM 232 C3' C A 8 -8.608 -1.449 21.336 1.00 0.00 C ATOM 233 O3' C A 8 -9.468 -1.925 22.348 1.00 0.00 O ATOM 234 C2' C A 8 -8.096 -2.563 20.476 1.00 0.00 C ATOM 235 O2' C A 8 -9.145 -3.461 20.174 1.00 0.00 O ATOM 236 C1' C A 8 -7.684 -1.814 19.215 1.00 0.00 C ATOM 237 N1 C A 8 -6.236 -1.484 19.298 1.00 0.00 N ATOM 238 C2 C A 8 -5.331 -2.526 19.135 1.00 0.00 C ATOM 239 O2 C A 8 -5.733 -3.666 18.913 1.00 0.00 O ATOM 240 N3 C A 8 -4.000 -2.248 19.229 1.00 0.00 N ATOM 241 C4 C A 8 -3.573 -1.002 19.474 1.00 0.00 C ATOM 242 N4 C A 8 -2.257 -0.771 19.542 1.00 0.00 N ATOM 243 C5 C A 8 -4.494 0.080 19.654 1.00 0.00 C ATOM 244 C6 C A 8 -5.808 -0.213 19.555 1.00 0.00 C ATOM 0 H5' C A 8 -10.023 1.431 20.040 1.00 0.00 H new ATOM 0 H5'' C A 8 -10.247 0.814 21.665 1.00 0.00 H new ATOM 0 H4' C A 8 -10.319 -0.987 20.088 1.00 0.00 H new ATOM 0 H3' C A 8 -7.839 -0.911 21.890 1.00 0.00 H new ATOM 0 H2' C A 8 -7.300 -3.150 20.933 1.00 0.00 H new ATOM 0 HO2' C A 8 -9.818 -3.429 20.886 1.00 0.00 H new ATOM 0 HO3' C A 8 -8.957 -2.469 22.983 1.00 0.00 H new ATOM 0 H1' C A 8 -7.844 -2.411 18.317 1.00 0.00 H new ATOM 0 H41 C A 8 -1.914 0.171 19.728 1.00 0.00 H new ATOM 0 H42 C A 8 -1.597 -1.537 19.408 1.00 0.00 H new ATOM 0 H5 C A 8 -4.153 1.084 19.859 1.00 0.00 H new ATOM 0 H6 C A 8 -6.536 0.574 19.682 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 3.476 -10.800 15.033 1.00 0.00 O ATOM 259 C5' G B 9 3.288 -10.122 16.256 1.00 0.00 C ATOM 260 C4' G B 9 1.797 -10.058 16.591 1.00 0.00 C ATOM 261 O4' G B 9 1.576 -9.345 17.805 1.00 0.00 O ATOM 262 C3' G B 9 1.003 -9.302 15.544 1.00 0.00 C ATOM 263 O3' G B 9 0.744 -10.078 14.389 1.00 0.00 O ATOM 264 C2' G B 9 -0.254 -9.022 16.327 1.00 0.00 C ATOM 265 O2' G B 9 -1.034 -10.196 16.416 1.00 0.00 O ATOM 266 C1' G B 9 0.298 -8.700 17.709 1.00 0.00 C ATOM 267 N9 G B 9 0.460 -7.240 17.840 1.00 0.00 N ATOM 268 C8 G B 9 1.571 -6.472 17.615 1.00 0.00 C ATOM 269 N7 G B 9 1.385 -5.198 17.818 1.00 0.00 N ATOM 270 C5 G B 9 0.048 -5.113 18.196 1.00 0.00 C ATOM 271 C6 G B 9 -0.739 -3.973 18.536 1.00 0.00 C ATOM 272 O6 G B 9 -0.393 -2.795 18.590 1.00 0.00 O ATOM 273 N1 G B 9 -2.052 -4.327 18.825 1.00 0.00 N ATOM 274 C2 G B 9 -2.548 -5.612 18.803 1.00 0.00 C ATOM 275 N2 G B 9 -3.841 -5.765 19.105 1.00 0.00 N ATOM 276 N3 G B 9 -1.811 -6.684 18.496 1.00 0.00 N ATOM 277 C4 G B 9 -0.527 -6.360 18.202 1.00 0.00 C ATOM 0 H5' G B 9 3.699 -9.114 16.190 1.00 0.00 H new ATOM 0 H5'' G B 9 3.827 -10.635 17.053 1.00 0.00 H new ATOM 0 H4' G B 9 1.476 -11.098 16.654 1.00 0.00 H new ATOM 0 H3' G B 9 1.506 -8.423 15.142 1.00 0.00 H new ATOM 0 H2' G B 9 -0.878 -8.242 15.890 1.00 0.00 H new ATOM 0 HO2' G B 9 -0.695 -10.863 15.783 1.00 0.00 H new ATOM 0 HO5' G B 9 2.654 -10.752 14.502 1.00 0.00 H new ATOM 0 H1' G B 9 -0.371 -9.045 18.497 1.00 0.00 H new ATOM 0 H8 G B 9 2.517 -6.885 17.298 1.00 0.00 H new ATOM 0 H1 G B 9 -2.698 -3.577 19.072 1.00 0.00 H new ATOM 0 H21 G B 9 -4.258 -6.696 19.103 1.00 0.00 H new ATOM 0 H22 G B 9 -4.410 -4.951 19.337 1.00 0.00 H new ATOM 290 P A B 10 0.224 -9.383 13.027 1.00 0.00 P ATOM 291 OP1 A B 10 -0.021 -10.450 12.031 1.00 0.00 O ATOM 292 OP2 A B 10 1.150 -8.275 12.703 1.00 0.00 O ATOM 293 O5' A B 10 -1.197 -8.741 13.434 1.00 0.00 O ATOM 294 C5' A B 10 -2.348 -9.546 13.586 1.00 0.00 C ATOM 295 C4' A B 10 -3.536 -8.656 13.960 1.00 0.00 C ATOM 296 O4' A B 10 -3.282 -7.929 15.156 1.00 0.00 O ATOM 297 C3' A B 10 -3.799 -7.597 12.915 1.00 0.00 C ATOM 298 O3' A B 10 -4.460 -8.120 11.774 1.00 0.00 O ATOM 299 C2' A B 10 -4.665 -6.647 13.699 1.00 0.00 C ATOM 300 O2' A B 10 -5.977 -7.160 13.790 1.00 0.00 O ATOM 301 C1' A B 10 -4.021 -6.701 15.084 1.00 0.00 C ATOM 302 N9 A B 10 -3.116 -5.545 15.269 1.00 0.00 N ATOM 303 C8 A B 10 -1.747 -5.495 15.191 1.00 0.00 C ATOM 304 N7 A B 10 -1.246 -4.311 15.418 1.00 0.00 N ATOM 305 C5 A B 10 -2.364 -3.518 15.664 1.00 0.00 C ATOM 306 C6 A B 10 -2.517 -2.152 15.974 1.00 0.00 C ATOM 307 N6 A B 10 -1.488 -1.307 16.100 1.00 0.00 N ATOM 308 N1 A B 10 -3.769 -1.687 16.151 1.00 0.00 N ATOM 309 C2 A B 10 -4.792 -2.529 16.027 1.00 0.00 C ATOM 310 N3 A B 10 -4.779 -3.826 15.744 1.00 0.00 N ATOM 311 C4 A B 10 -3.508 -4.262 15.572 1.00 0.00 C ATOM 0 H5' A B 10 -2.182 -10.297 14.359 1.00 0.00 H new ATOM 0 H5'' A B 10 -2.557 -10.082 12.660 1.00 0.00 H new ATOM 0 H4' A B 10 -4.380 -9.338 14.063 1.00 0.00 H new ATOM 0 H3' A B 10 -2.902 -7.143 12.493 1.00 0.00 H new ATOM 0 H2' A B 10 -4.730 -5.650 13.263 1.00 0.00 H new ATOM 0 HO2' A B 10 -6.065 -7.939 13.202 1.00 0.00 H new ATOM 0 H1' A B 10 -4.777 -6.659 15.868 1.00 0.00 H new ATOM 0 H8 A B 10 -1.139 -6.358 14.962 1.00 0.00 H new ATOM 0 H61 A B 10 -1.658 -0.327 16.326 1.00 0.00 H new ATOM 0 H62 A B 10 -0.534 -1.643 15.970 1.00 0.00 H new ATOM 0 H2 A B 10 -5.770 -2.097 16.178 1.00 0.00 H new ATOM 323 P G B 11 -4.542 -7.276 10.398 1.00 0.00 P ATOM 324 OP1 G B 11 -5.308 -8.073 9.414 1.00 0.00 O ATOM 325 OP2 G B 11 -3.175 -6.818 10.065 1.00 0.00 O ATOM 326 O5' G B 11 -5.418 -5.984 10.785 1.00 0.00 O ATOM 327 C5' G B 11 -6.822 -6.065 10.931 1.00 0.00 C ATOM 328 C4' G B 11 -7.345 -4.688 11.341 1.00 0.00 C ATOM 329 O4' G B 11 -6.734 -4.261 12.553 1.00 0.00 O ATOM 330 C3' G B 11 -7.006 -3.624 10.333 1.00 0.00 C ATOM 331 O3' G B 11 -7.864 -3.663 9.203 1.00 0.00 O ATOM 332 C2' G B 11 -7.245 -2.397 11.182 1.00 0.00 C ATOM 333 O2' G B 11 -8.630 -2.141 11.276 1.00 0.00 O ATOM 334 C1' G B 11 -6.740 -2.834 12.553 1.00 0.00 C ATOM 335 N9 G B 11 -5.379 -2.301 12.750 1.00 0.00 N ATOM 336 C8 G B 11 -4.166 -2.920 12.589 1.00 0.00 C ATOM 337 N7 G B 11 -3.143 -2.139 12.801 1.00 0.00 N ATOM 338 C5 G B 11 -3.719 -0.913 13.121 1.00 0.00 C ATOM 339 C6 G B 11 -3.108 0.335 13.447 1.00 0.00 C ATOM 340 O6 G B 11 -1.911 0.600 13.531 1.00 0.00 O ATOM 341 N1 G B 11 -4.058 1.321 13.688 1.00 0.00 N ATOM 342 C2 G B 11 -5.423 1.135 13.632 1.00 0.00 C ATOM 343 N2 G B 11 -6.188 2.197 13.896 1.00 0.00 N ATOM 344 N3 G B 11 -5.997 -0.032 13.334 1.00 0.00 N ATOM 345 C4 G B 11 -5.088 -1.007 13.090 1.00 0.00 C ATOM 0 H5' G B 11 -7.083 -6.809 11.684 1.00 0.00 H new ATOM 0 H5'' G B 11 -7.283 -6.383 9.996 1.00 0.00 H new ATOM 0 H4' G B 11 -8.425 -4.804 11.435 1.00 0.00 H new ATOM 0 H3' G B 11 -6.011 -3.702 9.894 1.00 0.00 H new ATOM 0 H2' G B 11 -6.765 -1.501 10.788 1.00 0.00 H new ATOM 0 HO2' G B 11 -8.779 -1.345 11.828 1.00 0.00 H new ATOM 0 H1' G B 11 -7.369 -2.462 13.362 1.00 0.00 H new ATOM 0 H8 G B 11 -4.067 -3.959 12.312 1.00 0.00 H new ATOM 0 H1 G B 11 -3.719 2.254 13.924 1.00 0.00 H new ATOM 0 H21 G B 11 -7.204 2.113 13.868 1.00 0.00 H new ATOM 0 H22 G B 11 -5.756 3.092 14.126 1.00 0.00 H new ATOM 357 P G B 12 -7.669 -2.633 7.970 1.00 0.00 P ATOM 358 OP1 G B 12 -8.534 -3.084 6.858 1.00 0.00 O ATOM 359 OP2 G B 12 -6.216 -2.465 7.745 1.00 0.00 O ATOM 360 O5' G B 12 -8.255 -1.226 8.518 1.00 0.00 O ATOM 361 C5' G B 12 -9.651 -1.018 8.655 1.00 0.00 C ATOM 362 C4' G B 12 -9.923 0.439 9.059 1.00 0.00 C ATOM 363 O4' G B 12 -9.297 0.767 10.303 1.00 0.00 O ATOM 364 C3' G B 12 -9.369 1.420 8.042 1.00 0.00 C ATOM 365 O3' G B 12 -10.251 1.610 6.952 1.00 0.00 O ATOM 366 C2' G B 12 -9.268 2.669 8.883 1.00 0.00 C ATOM 367 O2' G B 12 -10.550 3.241 9.046 1.00 0.00 O ATOM 368 C1' G B 12 -8.810 2.118 10.223 1.00 0.00 C ATOM 369 N9 G B 12 -7.337 2.114 10.307 1.00 0.00 N ATOM 370 C8 G B 12 -6.487 1.051 10.212 1.00 0.00 C ATOM 371 N7 G B 12 -5.231 1.353 10.392 1.00 0.00 N ATOM 372 C5 G B 12 -5.249 2.726 10.620 1.00 0.00 C ATOM 373 C6 G B 12 -4.172 3.623 10.882 1.00 0.00 C ATOM 374 O6 G B 12 -2.975 3.369 10.979 1.00 0.00 O ATOM 375 N1 G B 12 -4.619 4.932 11.027 1.00 0.00 N ATOM 376 C2 G B 12 -5.938 5.329 10.955 1.00 0.00 C ATOM 377 N2 G B 12 -6.181 6.633 11.120 1.00 0.00 N ATOM 378 N3 G B 12 -6.953 4.487 10.726 1.00 0.00 N ATOM 379 C4 G B 12 -6.536 3.204 10.563 1.00 0.00 C ATOM 0 H5' G B 12 -10.057 -1.695 9.407 1.00 0.00 H new ATOM 0 H5'' G B 12 -10.156 -1.245 7.716 1.00 0.00 H new ATOM 0 H4' G B 12 -11.008 0.520 9.129 1.00 0.00 H new ATOM 0 H3' G B 12 -8.435 1.100 7.579 1.00 0.00 H new ATOM 0 H2' G B 12 -8.616 3.431 8.456 1.00 0.00 H new ATOM 0 HO2' G B 12 -11.136 2.942 8.320 1.00 0.00 H new ATOM 0 H1' G B 12 -9.190 2.733 11.039 1.00 0.00 H new ATOM 0 H8 G B 12 -6.825 0.046 10.006 1.00 0.00 H new ATOM 0 H1 G B 12 -3.918 5.653 11.200 1.00 0.00 H new ATOM 0 H21 G B 12 -7.138 6.983 11.077 1.00 0.00 H new ATOM 0 H22 G B 12 -5.409 7.278 11.289 1.00 0.00 H new ATOM 391 P U B 13 -9.713 2.177 5.542 1.00 0.00 P ATOM 392 OP1 U B 13 -10.884 2.545 4.716 1.00 0.00 O ATOM 393 OP2 U B 13 -8.720 1.214 5.018 1.00 0.00 O ATOM 394 O5' U B 13 -8.929 3.528 5.937 1.00 0.00 O ATOM 395 C5' U B 13 -9.616 4.721 6.249 1.00 0.00 C ATOM 396 C4' U B 13 -8.598 5.836 6.536 1.00 0.00 C ATOM 397 O4' U B 13 -7.859 5.637 7.748 1.00 0.00 O ATOM 398 C3' U B 13 -7.575 5.974 5.442 1.00 0.00 C ATOM 399 O3' U B 13 -8.087 6.643 4.304 1.00 0.00 O ATOM 400 C2' U B 13 -6.560 6.805 6.178 1.00 0.00 C ATOM 401 O2' U B 13 -7.025 8.131 6.322 1.00 0.00 O ATOM 402 C1' U B 13 -6.528 6.147 7.535 1.00 0.00 C ATOM 403 N1 U B 13 -5.567 5.022 7.552 1.00 0.00 N ATOM 404 C2 U B 13 -4.239 5.285 7.870 1.00 0.00 C ATOM 405 O2 U B 13 -3.823 6.423 8.086 1.00 0.00 O ATOM 406 N3 U B 13 -3.400 4.183 7.934 1.00 0.00 N ATOM 407 C4 U B 13 -3.767 2.865 7.709 1.00 0.00 C ATOM 408 O4 U B 13 -2.940 1.962 7.797 1.00 0.00 O ATOM 409 C5 U B 13 -5.163 2.692 7.377 1.00 0.00 C ATOM 410 C6 U B 13 -5.997 3.755 7.314 1.00 0.00 C ATOM 0 H5' U B 13 -10.258 4.568 7.116 1.00 0.00 H new ATOM 0 H5'' U B 13 -10.263 5.009 5.420 1.00 0.00 H new ATOM 0 H4' U B 13 -9.216 6.731 6.615 1.00 0.00 H new ATOM 0 H3' U B 13 -7.206 5.036 5.027 1.00 0.00 H new ATOM 0 H2' U B 13 -5.594 6.854 5.675 1.00 0.00 H new ATOM 0 HO2' U B 13 -7.762 8.289 5.695 1.00 0.00 H new ATOM 0 H1' U B 13 -6.220 6.853 8.306 1.00 0.00 H new ATOM 0 H3 U B 13 -2.423 4.358 8.168 1.00 0.00 H new ATOM 0 H5 U B 13 -5.545 1.702 7.177 1.00 0.00 H new ATOM 0 H6 U B 13 -7.036 3.592 7.067 1.00 0.00 H new ATOM 421 P C B 14 -7.308 6.583 2.893 1.00 0.00 P ATOM 422 OP1 C B 14 -7.995 7.488 1.946 1.00 0.00 O ATOM 423 OP2 C B 14 -7.115 5.159 2.540 1.00 0.00 O ATOM 424 O5' C B 14 -5.867 7.209 3.233 1.00 0.00 O ATOM 425 C5' C B 14 -5.702 8.596 3.427 1.00 0.00 C ATOM 426 C4' C B 14 -4.248 8.880 3.806 1.00 0.00 C ATOM 427 O4' C B 14 -3.876 8.215 5.013 1.00 0.00 O ATOM 428 C3' C B 14 -3.278 8.386 2.753 1.00 0.00 C ATOM 429 O3' C B 14 -3.188 9.269 1.652 1.00 0.00 O ATOM 430 C2' C B 14 -2.004 8.360 3.559 1.00 0.00 C ATOM 431 O2' C B 14 -1.515 9.674 3.726 1.00 0.00 O ATOM 432 C1' C B 14 -2.491 7.852 4.912 1.00 0.00 C ATOM 433 N1 C B 14 -2.330 6.380 4.996 1.00 0.00 N ATOM 434 C2 C B 14 -1.053 5.902 5.253 1.00 0.00 C ATOM 435 O2 C B 14 -0.124 6.686 5.421 1.00 0.00 O ATOM 436 N3 C B 14 -0.865 4.556 5.311 1.00 0.00 N ATOM 437 C4 C B 14 -1.884 3.710 5.118 1.00 0.00 C ATOM 438 N4 C B 14 -1.648 2.395 5.175 1.00 0.00 N ATOM 439 C5 C B 14 -3.212 4.186 4.866 1.00 0.00 C ATOM 440 C6 C B 14 -3.386 5.525 4.822 1.00 0.00 C ATOM 0 H5' C B 14 -6.371 8.948 4.213 1.00 0.00 H new ATOM 0 H5'' C B 14 -5.966 9.137 2.518 1.00 0.00 H new ATOM 0 H4' C B 14 -4.193 9.963 3.914 1.00 0.00 H new ATOM 0 H3' C B 14 -3.551 7.436 2.294 1.00 0.00 H new ATOM 0 H2' C B 14 -1.212 7.765 3.103 1.00 0.00 H new ATOM 0 HO2' C B 14 -1.978 10.276 3.107 1.00 0.00 H new ATOM 0 H1' C B 14 -1.915 8.288 5.728 1.00 0.00 H new ATOM 0 H41 C B 14 -2.411 1.733 5.031 1.00 0.00 H new ATOM 0 H42 C B 14 -0.705 2.054 5.363 1.00 0.00 H new ATOM 0 H5 C B 14 -4.037 3.505 4.718 1.00 0.00 H new ATOM 0 H6 C B 14 -4.373 5.927 4.647 1.00 0.00 H new ATOM 452 P U B 15 -2.509 8.796 0.267 1.00 0.00 P ATOM 453 OP1 U B 15 -2.513 9.946 -0.663 1.00 0.00 O ATOM 454 OP2 U B 15 -3.146 7.524 -0.139 1.00 0.00 O ATOM 455 O5' U B 15 -0.980 8.479 0.665 1.00 0.00 O ATOM 456 C5' U B 15 -0.052 9.520 0.897 1.00 0.00 C ATOM 457 C4' U B 15 1.330 8.911 1.143 1.00 0.00 C ATOM 458 O4' U B 15 1.328 8.030 2.263 1.00 0.00 O ATOM 459 C3' U B 15 1.777 8.062 -0.025 1.00 0.00 C ATOM 460 O3' U B 15 2.268 8.853 -1.092 1.00 0.00 O ATOM 461 C2' U B 15 2.857 7.228 0.614 1.00 0.00 C ATOM 462 O2' U B 15 4.058 7.971 0.668 1.00 0.00 O ATOM 463 C1' U B 15 2.342 7.034 2.044 1.00 0.00 C ATOM 464 N1 U B 15 1.787 5.670 2.252 1.00 0.00 N ATOM 465 C2 U B 15 2.693 4.652 2.520 1.00 0.00 C ATOM 466 O2 U B 15 3.907 4.844 2.539 1.00 0.00 O ATOM 467 N3 U B 15 2.156 3.401 2.768 1.00 0.00 N ATOM 468 C4 U B 15 0.810 3.077 2.765 1.00 0.00 C ATOM 469 O4 U B 15 0.446 1.923 2.981 1.00 0.00 O ATOM 470 C5 U B 15 -0.068 4.199 2.500 1.00 0.00 C ATOM 471 C6 U B 15 0.433 5.436 2.263 1.00 0.00 C ATOM 0 H5' U B 15 -0.360 10.114 1.757 1.00 0.00 H new ATOM 0 H5'' U B 15 -0.020 10.193 0.040 1.00 0.00 H new ATOM 0 H4' U B 15 1.992 9.762 1.303 1.00 0.00 H new ATOM 0 H3' U B 15 0.982 7.475 -0.484 1.00 0.00 H new ATOM 0 H2' U B 15 3.055 6.299 0.080 1.00 0.00 H new ATOM 0 HO2' U B 15 4.444 8.034 -0.230 1.00 0.00 H new ATOM 0 H1' U B 15 3.163 7.142 2.753 1.00 0.00 H new ATOM 0 H3 U B 15 2.813 2.648 2.972 1.00 0.00 H new ATOM 0 H5 U B 15 -1.137 4.047 2.491 1.00 0.00 H new ATOM 0 H6 U B 15 -0.246 6.255 2.079 1.00 0.00 H new ATOM 482 P C B 16 2.713 8.174 -2.481 1.00 0.00 P ATOM 483 OP1 C B 16 3.082 9.248 -3.430 1.00 0.00 O ATOM 484 OP2 C B 16 1.684 7.179 -2.856 1.00 0.00 O ATOM 485 O5' C B 16 4.052 7.387 -2.066 1.00 0.00 O ATOM 486 C5' C B 16 4.366 6.149 -2.655 1.00 0.00 C ATOM 487 C4' C B 16 5.624 5.572 -2.006 1.00 0.00 C ATOM 488 O4' C B 16 5.437 5.355 -0.602 1.00 0.00 O ATOM 489 C3' C B 16 5.937 4.212 -2.588 1.00 0.00 C ATOM 490 O3' C B 16 6.662 4.290 -3.797 1.00 0.00 O ATOM 491 C2' C B 16 6.738 3.589 -1.489 1.00 0.00 C ATOM 492 O2' C B 16 8.052 4.108 -1.480 1.00 0.00 O ATOM 493 C1' C B 16 5.986 4.070 -0.262 1.00 0.00 C ATOM 494 N1 C B 16 4.896 3.106 0.035 1.00 0.00 N ATOM 495 C2 C B 16 5.254 1.849 0.509 1.00 0.00 C ATOM 496 O2 C B 16 6.433 1.583 0.731 1.00 0.00 O ATOM 497 N3 C B 16 4.266 0.932 0.715 1.00 0.00 N ATOM 498 C4 C B 16 2.983 1.236 0.473 1.00 0.00 C ATOM 499 N4 C B 16 2.045 0.311 0.697 1.00 0.00 N ATOM 500 C5 C B 16 2.602 2.531 -0.005 1.00 0.00 C ATOM 501 C6 C B 16 3.594 3.425 -0.203 1.00 0.00 C ATOM 0 H5' C B 16 4.523 6.275 -3.726 1.00 0.00 H new ATOM 0 H5'' C B 16 3.533 5.457 -2.534 1.00 0.00 H new ATOM 0 H4' C B 16 6.422 6.292 -2.188 1.00 0.00 H new ATOM 0 H3' C B 16 5.049 3.644 -2.866 1.00 0.00 H new ATOM 0 H2' C B 16 6.837 2.506 -1.568 1.00 0.00 H new ATOM 0 HO2' C B 16 8.301 4.384 -2.387 1.00 0.00 H new ATOM 0 HO3' C B 16 6.840 3.386 -4.130 1.00 0.00 H new ATOM 0 H1' C B 16 6.629 4.145 0.615 1.00 0.00 H new ATOM 0 H41 C B 16 1.064 0.526 0.518 1.00 0.00 H new ATOM 0 H42 C B 16 2.310 -0.610 1.047 1.00 0.00 H new ATOM 0 H5 C B 16 1.569 2.781 -0.198 1.00 0.00 H new ATOM 0 H6 C B 16 3.349 4.415 -0.558 1.00 0.00 H new TER 514 C B 16