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= -0.258 USER MOD Single : A 1 G O5' : rot 180:sc=-0.00601 USER MOD Single : A 2 G O2' : rot 180:sc= -0.384 USER MOD Single : A 3 A O2' : rot -32:sc= 0.142 USER MOD Single : A 4 U O2' : rot -126:sc= 0.152 USER MOD Single : A 5 G O2' : rot -9:sc= 0.0963 USER MOD Single : A 6 U O2' : rot -16:sc= -0.434 USER MOD Single : A 7 C O2' : rot -11:sc= -0.179 USER MOD Single : A 8 C O2' : rot -21:sc= 0.15 USER MOD Single : A 8 C O3' : rot 180:sc= 0.187 USER MOD Single : B 9 G O2' : rot 180:sc= -0.24 USER MOD Single : B 9 G O5' : rot 180:sc= 0 USER MOD Single : B 10 G O2' : rot 180:sc= -0.379 USER MOD Single : B 11 A O2' : rot -25:sc= 0.149 USER MOD Single : B 12 U O2' : rot -1:sc= -0.197 USER MOD Single : B 13 G O2' : rot -16:sc= 0.188 USER MOD Single : B 14 U O2' : rot -15:sc= -0.431 USER MOD Single : B 15 C O2' : rot 180:sc= -0.282 USER MOD Single : B 16 C O2' : rot -28:sc= 0.112 USER MOD Single : B 16 C O3' : rot 180:sc= 0.142 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 5.207 -8.071 5.910 1.00 0.00 O ATOM 2 C5' G A 1 6.553 -8.487 5.996 1.00 0.00 C ATOM 3 C4' G A 1 7.476 -7.377 5.488 1.00 0.00 C ATOM 4 O4' G A 1 7.222 -7.076 4.117 1.00 0.00 O ATOM 5 C3' G A 1 7.277 -6.069 6.226 1.00 0.00 C ATOM 6 O3' G A 1 7.877 -6.069 7.508 1.00 0.00 O ATOM 7 C2' G A 1 7.966 -5.132 5.264 1.00 0.00 C ATOM 8 O2' G A 1 9.366 -5.289 5.361 1.00 0.00 O ATOM 9 C1' G A 1 7.501 -5.681 3.916 1.00 0.00 C ATOM 10 N9 G A 1 6.268 -4.979 3.502 1.00 0.00 N ATOM 11 C8 G A 1 4.970 -5.422 3.531 1.00 0.00 C ATOM 12 N7 G A 1 4.100 -4.546 3.112 1.00 0.00 N ATOM 13 C5 G A 1 4.875 -3.438 2.781 1.00 0.00 C ATOM 14 C6 G A 1 4.482 -2.166 2.270 1.00 0.00 C ATOM 15 O6 G A 1 3.350 -1.766 2.009 1.00 0.00 O ATOM 16 N1 G A 1 5.577 -1.333 2.071 1.00 0.00 N ATOM 17 C2 G A 1 6.887 -1.674 2.331 1.00 0.00 C ATOM 18 N2 G A 1 7.813 -0.741 2.083 1.00 0.00 N ATOM 19 N3 G A 1 7.260 -2.865 2.813 1.00 0.00 N ATOM 20 C4 G A 1 6.204 -3.695 3.013 1.00 0.00 C ATOM 0 H5' G A 1 6.701 -9.392 5.407 1.00 0.00 H new ATOM 0 H5'' G A 1 6.801 -8.734 7.028 1.00 0.00 H new ATOM 0 H4' G A 1 8.483 -7.762 5.645 1.00 0.00 H new ATOM 0 H3' G A 1 6.240 -5.820 6.450 1.00 0.00 H new ATOM 0 H2' G A 1 7.743 -4.079 5.434 1.00 0.00 H new ATOM 0 HO2' G A 1 9.808 -4.679 4.734 1.00 0.00 H new ATOM 0 HO5' G A 1 4.622 -8.787 6.235 1.00 0.00 H new ATOM 0 H1' G A 1 8.256 -5.539 3.143 1.00 0.00 H new ATOM 0 H8 G A 1 4.693 -6.409 3.871 1.00 0.00 H new ATOM 0 H1 G A 1 5.397 -0.398 1.705 1.00 0.00 H new ATOM 0 H21 G A 1 8.798 -0.941 2.258 1.00 0.00 H new ATOM 0 H22 G A 1 7.534 0.170 1.719 1.00 0.00 H new ATOM 33 P G A 2 7.530 -4.913 8.587 1.00 0.00 P ATOM 34 OP1 G A 2 8.284 -5.202 9.827 1.00 0.00 O ATOM 35 OP2 G A 2 6.058 -4.771 8.641 1.00 0.00 O ATOM 36 O5' G A 2 8.137 -3.571 7.934 1.00 0.00 O ATOM 37 C5' G A 2 9.530 -3.346 7.902 1.00 0.00 C ATOM 38 C4' G A 2 9.821 -2.010 7.213 1.00 0.00 C ATOM 39 O4' G A 2 9.299 -1.990 5.881 1.00 0.00 O ATOM 40 C3' G A 2 9.173 -0.829 7.911 1.00 0.00 C ATOM 41 O3' G A 2 9.879 -0.419 9.068 1.00 0.00 O ATOM 42 C2' G A 2 9.251 0.194 6.802 1.00 0.00 C ATOM 43 O2' G A 2 10.581 0.647 6.643 1.00 0.00 O ATOM 44 C1' G A 2 8.867 -0.648 5.592 1.00 0.00 C ATOM 45 N9 G A 2 7.395 -0.610 5.427 1.00 0.00 N ATOM 46 C8 G A 2 6.463 -1.561 5.758 1.00 0.00 C ATOM 47 N7 G A 2 5.234 -1.213 5.496 1.00 0.00 N ATOM 48 C5 G A 2 5.354 0.063 4.960 1.00 0.00 C ATOM 49 C6 G A 2 4.346 0.957 4.494 1.00 0.00 C ATOM 50 O6 G A 2 3.131 0.780 4.455 1.00 0.00 O ATOM 51 N1 G A 2 4.890 2.156 4.048 1.00 0.00 N ATOM 52 C2 G A 2 6.234 2.459 4.040 1.00 0.00 C ATOM 53 N2 G A 2 6.575 3.665 3.575 1.00 0.00 N ATOM 54 N3 G A 2 7.185 1.621 4.470 1.00 0.00 N ATOM 55 C4 G A 2 6.674 0.444 4.917 1.00 0.00 C ATOM 0 H5' G A 2 10.027 -4.157 7.369 1.00 0.00 H new ATOM 0 H5'' G A 2 9.930 -3.338 8.916 1.00 0.00 H new ATOM 0 H4' G A 2 10.907 -1.921 7.236 1.00 0.00 H new ATOM 0 H3' G A 2 8.172 -1.022 8.297 1.00 0.00 H new ATOM 0 H2' G A 2 8.633 1.076 6.970 1.00 0.00 H new ATOM 0 HO2' G A 2 10.617 1.308 5.920 1.00 0.00 H new ATOM 0 H1' G A 2 9.325 -0.280 4.674 1.00 0.00 H new ATOM 0 H8 G A 2 6.724 -2.513 6.196 1.00 0.00 H new ATOM 0 H1 G A 2 4.245 2.866 3.700 1.00 0.00 H new ATOM 0 H21 G A 2 7.556 3.942 3.546 1.00 0.00 H new ATOM 0 H22 G A 2 5.854 4.308 3.249 1.00 0.00 H new ATOM 67 P A A 3 9.182 0.547 10.170 1.00 0.00 P ATOM 68 OP1 A A 3 10.177 0.820 11.231 1.00 0.00 O ATOM 69 OP2 A A 3 7.874 -0.044 10.528 1.00 0.00 O ATOM 70 O5' A A 3 8.905 1.925 9.377 1.00 0.00 O ATOM 71 C5' A A 3 9.969 2.776 9.010 1.00 0.00 C ATOM 72 C4' A A 3 9.427 3.982 8.238 1.00 0.00 C ATOM 73 O4' A A 3 8.678 3.569 7.092 1.00 0.00 O ATOM 74 C3' A A 3 8.474 4.844 9.040 1.00 0.00 C ATOM 75 O3' A A 3 9.148 5.714 9.926 1.00 0.00 O ATOM 76 C2' A A 3 7.780 5.603 7.943 1.00 0.00 C ATOM 77 O2' A A 3 8.628 6.623 7.457 1.00 0.00 O ATOM 78 C1' A A 3 7.627 4.527 6.874 1.00 0.00 C ATOM 79 N9 A A 3 6.304 3.870 7.007 1.00 0.00 N ATOM 80 C8 A A 3 6.005 2.599 7.431 1.00 0.00 C ATOM 81 N7 A A 3 4.735 2.308 7.379 1.00 0.00 N ATOM 82 C5 A A 3 4.146 3.473 6.903 1.00 0.00 C ATOM 83 C6 A A 3 2.811 3.822 6.629 1.00 0.00 C ATOM 84 N6 A A 3 1.784 2.979 6.791 1.00 0.00 N ATOM 85 N1 A A 3 2.570 5.073 6.195 1.00 0.00 N ATOM 86 C2 A A 3 3.592 5.910 6.035 1.00 0.00 C ATOM 87 N3 A A 3 4.885 5.698 6.243 1.00 0.00 N ATOM 88 C4 A A 3 5.094 4.436 6.686 1.00 0.00 C ATOM 0 H5' A A 3 10.686 2.232 8.396 1.00 0.00 H new ATOM 0 H5'' A A 3 10.502 3.112 9.900 1.00 0.00 H new ATOM 0 H4' A A 3 10.321 4.550 7.978 1.00 0.00 H new ATOM 0 H3' A A 3 7.810 4.276 9.691 1.00 0.00 H new ATOM 0 H2' A A 3 6.847 6.077 8.249 1.00 0.00 H new ATOM 0 HO2' A A 3 9.194 6.953 8.186 1.00 0.00 H new ATOM 0 H1' A A 3 7.692 4.955 5.874 1.00 0.00 H new ATOM 0 H8 A A 3 6.755 1.902 7.777 1.00 0.00 H new ATOM 0 H61 A A 3 0.835 3.285 6.577 1.00 0.00 H new ATOM 0 H62 A A 3 1.951 2.031 7.129 1.00 0.00 H new ATOM 0 H2 A A 3 3.333 6.899 5.688 1.00 0.00 H new ATOM 100 P U A 4 8.775 5.745 11.487 1.00 0.00 P ATOM 101 OP1 U A 4 9.752 6.607 12.189 1.00 0.00 O ATOM 102 OP2 U A 4 8.544 4.358 11.945 1.00 0.00 O ATOM 103 O5' U A 4 7.364 6.513 11.432 1.00 0.00 O ATOM 104 C5' U A 4 7.310 7.883 11.089 1.00 0.00 C ATOM 105 C4' U A 4 5.865 8.297 10.814 1.00 0.00 C ATOM 106 O4' U A 4 5.339 7.583 9.697 1.00 0.00 O ATOM 107 C3' U A 4 4.930 7.988 11.964 1.00 0.00 C ATOM 108 O3' U A 4 5.038 8.938 13.012 1.00 0.00 O ATOM 109 C2' U A 4 3.603 8.069 11.247 1.00 0.00 C ATOM 110 O2' U A 4 3.268 9.420 11.028 1.00 0.00 O ATOM 111 C1' U A 4 3.927 7.434 9.893 1.00 0.00 C ATOM 112 N1 U A 4 3.552 5.999 9.895 1.00 0.00 N ATOM 113 C2 U A 4 2.219 5.701 9.671 1.00 0.00 C ATOM 114 O2 U A 4 1.382 6.581 9.484 1.00 0.00 O ATOM 115 N3 U A 4 1.878 4.357 9.668 1.00 0.00 N ATOM 116 C4 U A 4 2.749 3.300 9.879 1.00 0.00 C ATOM 117 O4 U A 4 2.340 2.142 9.867 1.00 0.00 O ATOM 118 C5 U A 4 4.125 3.702 10.093 1.00 0.00 C ATOM 119 C6 U A 4 4.480 5.008 10.092 1.00 0.00 C ATOM 0 H5' U A 4 7.924 8.070 10.208 1.00 0.00 H new ATOM 0 H5'' U A 4 7.722 8.485 11.899 1.00 0.00 H new ATOM 0 H4' U A 4 5.910 9.372 10.642 1.00 0.00 H new ATOM 0 H3' U A 4 5.119 7.041 12.470 1.00 0.00 H new ATOM 0 H2' U A 4 2.784 7.598 11.790 1.00 0.00 H new ATOM 0 HO2' U A 4 2.378 9.600 11.397 1.00 0.00 H new ATOM 0 H1' U A 4 3.369 7.915 9.090 1.00 0.00 H new ATOM 0 H3 U A 4 0.900 4.126 9.495 1.00 0.00 H new ATOM 0 H5 U A 4 4.880 2.947 10.256 1.00 0.00 H new ATOM 0 H6 U A 4 5.514 5.275 10.249 1.00 0.00 H new ATOM 130 P G A 5 4.303 8.695 14.431 1.00 0.00 P ATOM 131 OP1 G A 5 4.726 9.769 15.357 1.00 0.00 O ATOM 132 OP2 G A 5 4.503 7.279 14.809 1.00 0.00 O ATOM 133 O5' G A 5 2.742 8.909 14.098 1.00 0.00 O ATOM 134 C5' G A 5 2.179 10.206 14.025 1.00 0.00 C ATOM 135 C4' G A 5 0.693 10.084 13.687 1.00 0.00 C ATOM 136 O4' G A 5 0.496 9.352 12.482 1.00 0.00 O ATOM 137 C3' G A 5 -0.057 9.297 14.739 1.00 0.00 C ATOM 138 O3' G A 5 -0.341 10.071 15.894 1.00 0.00 O ATOM 139 C2' G A 5 -1.307 8.940 13.975 1.00 0.00 C ATOM 140 O2' G A 5 -2.221 10.016 14.017 1.00 0.00 O ATOM 141 C1' G A 5 -0.811 8.768 12.545 1.00 0.00 C ATOM 142 N9 G A 5 -0.771 7.330 12.221 1.00 0.00 N ATOM 143 C8 G A 5 0.283 6.464 12.280 1.00 0.00 C ATOM 144 N7 G A 5 -0.022 5.233 11.968 1.00 0.00 N ATOM 145 C5 G A 5 -1.384 5.288 11.687 1.00 0.00 C ATOM 146 C6 G A 5 -2.289 4.253 11.297 1.00 0.00 C ATOM 147 O6 G A 5 -2.058 3.060 11.103 1.00 0.00 O ATOM 148 N1 G A 5 -3.576 4.739 11.137 1.00 0.00 N ATOM 149 C2 G A 5 -3.962 6.047 11.318 1.00 0.00 C ATOM 150 N2 G A 5 -5.254 6.322 11.110 1.00 0.00 N ATOM 151 N3 G A 5 -3.122 7.021 11.679 1.00 0.00 N ATOM 152 C4 G A 5 -1.852 6.570 11.846 1.00 0.00 C ATOM 0 H5' G A 5 2.691 10.797 13.265 1.00 0.00 H new ATOM 0 H5'' G A 5 2.308 10.727 14.974 1.00 0.00 H new ATOM 0 H4' G A 5 0.330 11.109 13.612 1.00 0.00 H new ATOM 0 H3' G A 5 0.492 8.444 15.138 1.00 0.00 H new ATOM 0 H2' G A 5 -1.811 8.060 14.375 1.00 0.00 H new ATOM 0 HO2' G A 5 -1.902 10.692 14.651 1.00 0.00 H new ATOM 0 H1' G A 5 -1.467 9.254 11.823 1.00 0.00 H new ATOM 0 H8 G A 5 1.280 6.770 12.560 1.00 0.00 H new ATOM 0 H1 G A 5 -4.297 4.072 10.862 1.00 0.00 H new ATOM 0 H21 G A 5 -5.598 7.275 11.229 1.00 0.00 H new ATOM 0 H22 G A 5 -5.895 5.579 10.832 1.00 0.00 H new ATOM 164 P U A 6 -0.851 9.372 17.262 1.00 0.00 P ATOM 165 OP1 U A 6 -0.978 10.425 18.294 1.00 0.00 O ATOM 166 OP2 U A 6 0.014 8.199 17.518 1.00 0.00 O ATOM 167 O5' U A 6 -2.335 8.828 16.920 1.00 0.00 O ATOM 168 C5' U A 6 -3.458 9.688 16.943 1.00 0.00 C ATOM 169 C4' U A 6 -4.742 8.879 16.687 1.00 0.00 C ATOM 170 O4' U A 6 -4.752 8.291 15.379 1.00 0.00 O ATOM 171 C3' U A 6 -4.901 7.711 17.647 1.00 0.00 C ATOM 172 O3' U A 6 -5.391 8.086 18.918 1.00 0.00 O ATOM 173 C2' U A 6 -5.913 6.889 16.895 1.00 0.00 C ATOM 174 O2' U A 6 -7.190 7.488 16.993 1.00 0.00 O ATOM 175 C1' U A 6 -5.429 7.019 15.465 1.00 0.00 C ATOM 176 N1 U A 6 -4.492 5.918 15.125 1.00 0.00 N ATOM 177 C2 U A 6 -5.025 4.766 14.565 1.00 0.00 C ATOM 178 O2 U A 6 -6.233 4.615 14.397 1.00 0.00 O ATOM 179 N3 U A 6 -4.117 3.787 14.200 1.00 0.00 N ATOM 180 C4 U A 6 -2.741 3.857 14.343 1.00 0.00 C ATOM 181 O4 U A 6 -2.029 2.917 14.003 1.00 0.00 O ATOM 182 C5 U A 6 -2.272 5.100 14.915 1.00 0.00 C ATOM 183 C6 U A 6 -3.142 6.064 15.287 1.00 0.00 C ATOM 0 H5' U A 6 -3.349 10.463 16.185 1.00 0.00 H new ATOM 0 H5'' U A 6 -3.521 10.192 17.907 1.00 0.00 H new ATOM 0 H4' U A 6 -5.545 9.605 16.814 1.00 0.00 H new ATOM 0 H3' U A 6 -3.962 7.211 17.885 1.00 0.00 H new ATOM 0 H2' U A 6 -5.999 5.865 17.259 1.00 0.00 H new ATOM 0 HO2' U A 6 -7.190 8.142 17.723 1.00 0.00 H new ATOM 0 H1' U A 6 -6.263 6.961 14.765 1.00 0.00 H new ATOM 0 H3 U A 6 -4.496 2.935 13.787 1.00 0.00 H new ATOM 0 H5 U A 6 -1.212 5.259 15.046 1.00 0.00 H new ATOM 0 H6 U A 6 -2.761 6.975 15.724 1.00 0.00 H new ATOM 194 P C A 7 -5.330 7.049 20.160 1.00 0.00 P ATOM 195 OP1 C A 7 -6.026 7.668 21.310 1.00 0.00 O ATOM 196 OP2 C A 7 -3.927 6.603 20.307 1.00 0.00 O ATOM 197 O5' C A 7 -6.205 5.778 19.667 1.00 0.00 O ATOM 198 C5' C A 7 -7.618 5.819 19.667 1.00 0.00 C ATOM 199 C4' C A 7 -8.185 4.466 19.211 1.00 0.00 C ATOM 200 O4' C A 7 -7.769 4.121 17.884 1.00 0.00 O ATOM 201 C3' C A 7 -7.705 3.320 20.075 1.00 0.00 C ATOM 202 O3' C A 7 -8.374 3.265 21.320 1.00 0.00 O ATOM 203 C2' C A 7 -8.060 2.149 19.187 1.00 0.00 C ATOM 204 O2' C A 7 -9.448 1.898 19.259 1.00 0.00 O ATOM 205 C1' C A 7 -7.731 2.680 17.791 1.00 0.00 C ATOM 206 N1 C A 7 -6.385 2.205 17.367 1.00 0.00 N ATOM 207 C2 C A 7 -6.272 0.871 16.983 1.00 0.00 C ATOM 208 O2 C A 7 -7.259 0.138 16.985 1.00 0.00 O ATOM 209 N3 C A 7 -5.046 0.407 16.609 1.00 0.00 N ATOM 210 C4 C A 7 -3.975 1.212 16.614 1.00 0.00 C ATOM 211 N4 C A 7 -2.793 0.718 16.236 1.00 0.00 N ATOM 212 C5 C A 7 -4.076 2.585 17.002 1.00 0.00 C ATOM 213 C6 C A 7 -5.297 3.036 17.362 1.00 0.00 C ATOM 0 H5' C A 7 -7.967 6.610 19.004 1.00 0.00 H new ATOM 0 H5'' C A 7 -7.983 6.057 20.666 1.00 0.00 H new ATOM 0 H4' C A 7 -9.265 4.596 19.276 1.00 0.00 H new ATOM 0 H3' C A 7 -6.654 3.378 20.360 1.00 0.00 H new ATOM 0 H2' C A 7 -7.541 1.229 19.455 1.00 0.00 H new ATOM 0 HO2' C A 7 -9.835 2.412 19.998 1.00 0.00 H new ATOM 0 H1' C A 7 -8.443 2.324 17.047 1.00 0.00 H new ATOM 0 H41 C A 7 -1.967 1.317 16.234 1.00 0.00 H new ATOM 0 H42 C A 7 -2.716 -0.258 15.950 1.00 0.00 H new ATOM 0 H5 C A 7 -3.212 3.234 17.007 1.00 0.00 H new ATOM 0 H6 C A 7 -5.417 4.070 17.651 1.00 0.00 H new ATOM 225 P C A 8 -7.812 2.341 22.519 1.00 0.00 P ATOM 226 OP1 C A 8 -8.726 2.480 23.675 1.00 0.00 O ATOM 227 OP2 C A 8 -6.372 2.638 22.684 1.00 0.00 O ATOM 228 O5' C A 8 -7.947 0.839 21.954 1.00 0.00 O ATOM 229 C5' C A 8 -9.194 0.175 21.931 1.00 0.00 C ATOM 230 C4' C A 8 -8.997 -1.250 21.407 1.00 0.00 C ATOM 231 O4' C A 8 -8.499 -1.255 20.077 1.00 0.00 O ATOM 232 C3' C A 8 -7.954 -2.005 22.198 1.00 0.00 C ATOM 233 O3' C A 8 -8.436 -2.458 23.445 1.00 0.00 O ATOM 234 C2' C A 8 -7.651 -3.140 21.271 1.00 0.00 C ATOM 235 O2' C A 8 -8.658 -4.124 21.373 1.00 0.00 O ATOM 236 C1' C A 8 -7.731 -2.458 19.910 1.00 0.00 C ATOM 237 N1 C A 8 -6.356 -2.141 19.462 1.00 0.00 N ATOM 238 C2 C A 8 -5.639 -3.148 18.822 1.00 0.00 C ATOM 239 O2 C A 8 -6.172 -4.227 18.571 1.00 0.00 O ATOM 240 N3 C A 8 -4.340 -2.905 18.491 1.00 0.00 N ATOM 241 C4 C A 8 -3.765 -1.732 18.786 1.00 0.00 C ATOM 242 N4 C A 8 -2.489 -1.533 18.441 1.00 0.00 N ATOM 243 C5 C A 8 -4.486 -0.698 19.466 1.00 0.00 C ATOM 244 C6 C A 8 -5.772 -0.949 19.777 1.00 0.00 C ATOM 0 H5' C A 8 -9.895 0.715 21.295 1.00 0.00 H new ATOM 0 H5'' C A 8 -9.625 0.151 22.932 1.00 0.00 H new ATOM 0 H4' C A 8 -9.982 -1.712 21.483 1.00 0.00 H new ATOM 0 H3' C A 8 -7.089 -1.400 22.469 1.00 0.00 H new ATOM 0 H2' C A 8 -6.702 -3.639 21.468 1.00 0.00 H new ATOM 0 HO2' C A 8 -9.127 -4.025 22.228 1.00 0.00 H new ATOM 0 HO3' C A 8 -7.724 -2.941 23.915 1.00 0.00 H new ATOM 0 H1' C A 8 -8.203 -3.096 19.163 1.00 0.00 H new ATOM 0 H41 C A 8 -2.035 -0.646 18.658 1.00 0.00 H new ATOM 0 H42 C A 8 -1.970 -2.268 17.961 1.00 0.00 H new ATOM 0 H5 C A 8 -4.019 0.242 19.718 1.00 0.00 H new ATOM 0 H6 C A 8 -6.352 -0.193 20.285 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 2.536 -9.388 13.636 1.00 0.00 O ATOM 259 C5' G B 9 1.933 -10.662 13.545 1.00 0.00 C ATOM 260 C4' G B 9 0.485 -10.601 14.043 1.00 0.00 C ATOM 261 O4' G B 9 0.421 -10.224 15.416 1.00 0.00 O ATOM 262 C3' G B 9 -0.349 -9.569 13.312 1.00 0.00 C ATOM 263 O3' G B 9 -0.733 -9.995 12.018 1.00 0.00 O ATOM 264 C2' G B 9 -1.517 -9.473 14.262 1.00 0.00 C ATOM 265 O2' G B 9 -2.330 -10.621 14.141 1.00 0.00 O ATOM 266 C1' G B 9 -0.810 -9.510 15.617 1.00 0.00 C ATOM 267 N9 G B 9 -0.519 -8.128 16.054 1.00 0.00 N ATOM 268 C8 G B 9 0.676 -7.452 16.046 1.00 0.00 C ATOM 269 N7 G B 9 0.595 -6.227 16.483 1.00 0.00 N ATOM 270 C5 G B 9 -0.750 -6.074 16.806 1.00 0.00 C ATOM 271 C6 G B 9 -1.443 -4.943 17.329 1.00 0.00 C ATOM 272 O6 G B 9 -0.991 -3.836 17.612 1.00 0.00 O ATOM 273 N1 G B 9 -2.795 -5.211 17.514 1.00 0.00 N ATOM 274 C2 G B 9 -3.409 -6.412 17.230 1.00 0.00 C ATOM 275 N2 G B 9 -4.723 -6.487 17.466 1.00 0.00 N ATOM 276 N3 G B 9 -2.763 -7.475 16.736 1.00 0.00 N ATOM 277 C4 G B 9 -1.439 -7.235 16.550 1.00 0.00 C ATOM 0 H5' G B 9 2.498 -11.383 14.136 1.00 0.00 H new ATOM 0 H5'' G B 9 1.955 -11.010 12.512 1.00 0.00 H new ATOM 0 H4' G B 9 0.098 -11.605 13.870 1.00 0.00 H new ATOM 0 H3' G B 9 0.159 -8.626 13.109 1.00 0.00 H new ATOM 0 H2' G B 9 -2.154 -8.604 14.097 1.00 0.00 H new ATOM 0 HO2' G B 9 -3.086 -10.553 14.761 1.00 0.00 H new ATOM 0 HO5' G B 9 3.461 -9.440 13.317 1.00 0.00 H new ATOM 0 H1' G B 9 -1.425 -9.991 16.377 1.00 0.00 H new ATOM 0 H8 G B 9 1.601 -7.896 15.708 1.00 0.00 H new ATOM 0 H1 G B 9 -3.377 -4.462 17.888 1.00 0.00 H new ATOM 0 H21 G B 9 -5.227 -7.353 17.274 1.00 0.00 H new ATOM 0 H22 G B 9 -5.221 -5.679 17.838 1.00 0.00 H new ATOM 290 P G B 10 -1.342 -8.947 10.947 1.00 0.00 P ATOM 291 OP1 G B 10 -1.614 -9.679 9.691 1.00 0.00 O ATOM 292 OP2 G B 10 -0.462 -7.758 10.927 1.00 0.00 O ATOM 293 O5' G B 10 -2.756 -8.510 11.587 1.00 0.00 O ATOM 294 C5' G B 10 -3.854 -9.396 11.590 1.00 0.00 C ATOM 295 C4' G B 10 -5.050 -8.733 12.279 1.00 0.00 C ATOM 296 O4' G B 10 -4.730 -8.358 13.622 1.00 0.00 O ATOM 297 C3' G B 10 -5.487 -7.448 11.602 1.00 0.00 C ATOM 298 O3' G B 10 -6.250 -7.674 10.431 1.00 0.00 O ATOM 299 C2' G B 10 -6.313 -6.845 12.714 1.00 0.00 C ATOM 300 O2' G B 10 -7.540 -7.535 12.846 1.00 0.00 O ATOM 301 C1' G B 10 -5.443 -7.146 13.927 1.00 0.00 C ATOM 302 N9 G B 10 -4.489 -6.029 14.123 1.00 0.00 N ATOM 303 C8 G B 10 -3.156 -5.963 13.804 1.00 0.00 C ATOM 304 N7 G B 10 -2.597 -4.821 14.090 1.00 0.00 N ATOM 305 C5 G B 10 -3.632 -4.068 14.632 1.00 0.00 C ATOM 306 C6 G B 10 -3.629 -2.729 15.120 1.00 0.00 C ATOM 307 O6 G B 10 -2.687 -1.944 15.181 1.00 0.00 O ATOM 308 N1 G B 10 -4.889 -2.342 15.562 1.00 0.00 N ATOM 309 C2 G B 10 -6.012 -3.141 15.548 1.00 0.00 C ATOM 310 N2 G B 10 -7.142 -2.599 16.013 1.00 0.00 N ATOM 311 N3 G B 10 -6.018 -4.401 15.096 1.00 0.00 N ATOM 312 C4 G B 10 -4.797 -4.797 14.652 1.00 0.00 C ATOM 0 H5' G B 10 -3.589 -10.318 12.108 1.00 0.00 H new ATOM 0 H5'' G B 10 -4.116 -9.669 10.568 1.00 0.00 H new ATOM 0 H4' G B 10 -5.842 -9.480 12.232 1.00 0.00 H new ATOM 0 H3' G B 10 -4.670 -6.825 11.238 1.00 0.00 H new ATOM 0 H2' G B 10 -6.556 -5.793 12.565 1.00 0.00 H new ATOM 0 HO2' G B 10 -8.064 -7.135 13.571 1.00 0.00 H new ATOM 0 H1' G B 10 -6.033 -7.259 14.837 1.00 0.00 H new ATOM 0 H8 G B 10 -2.618 -6.785 13.356 1.00 0.00 H new ATOM 0 H1 G B 10 -4.990 -1.394 15.924 1.00 0.00 H new ATOM 0 H21 G B 10 -8.003 -3.146 16.025 1.00 0.00 H new ATOM 0 H22 G B 10 -7.144 -1.638 16.355 1.00 0.00 H new ATOM 324 P A B 11 -6.489 -6.487 9.350 1.00 0.00 P ATOM 325 OP1 A B 11 -7.347 -7.021 8.269 1.00 0.00 O ATOM 326 OP2 A B 11 -5.171 -5.904 9.018 1.00 0.00 O ATOM 327 O5' A B 11 -7.335 -5.375 10.158 1.00 0.00 O ATOM 328 C5' A B 11 -8.683 -5.603 10.507 1.00 0.00 C ATOM 329 C4' A B 11 -9.225 -4.410 11.300 1.00 0.00 C ATOM 330 O4' A B 11 -8.428 -4.154 12.459 1.00 0.00 O ATOM 331 C3' A B 11 -9.221 -3.107 10.527 1.00 0.00 C ATOM 332 O3' A B 11 -10.309 -3.008 9.631 1.00 0.00 O ATOM 333 C2' A B 11 -9.333 -2.108 11.643 1.00 0.00 C ATOM 334 O2' A B 11 -10.662 -2.071 12.121 1.00 0.00 O ATOM 335 C1' A B 11 -8.436 -2.736 12.705 1.00 0.00 C ATOM 336 N9 A B 11 -7.062 -2.192 12.585 1.00 0.00 N ATOM 337 C8 A B 11 -5.916 -2.813 12.155 1.00 0.00 C ATOM 338 N7 A B 11 -4.850 -2.065 12.222 1.00 0.00 N ATOM 339 C5 A B 11 -5.323 -0.856 12.716 1.00 0.00 C ATOM 340 C6 A B 11 -4.690 0.365 13.010 1.00 0.00 C ATOM 341 N6 A B 11 -3.376 0.566 12.855 1.00 0.00 N ATOM 342 N1 A B 11 -5.459 1.375 13.457 1.00 0.00 N ATOM 343 C2 A B 11 -6.765 1.173 13.610 1.00 0.00 C ATOM 344 N3 A B 11 -7.473 0.074 13.383 1.00 0.00 N ATOM 345 C4 A B 11 -6.673 -0.918 12.927 1.00 0.00 C ATOM 0 H5' A B 11 -8.765 -6.513 11.101 1.00 0.00 H new ATOM 0 H5'' A B 11 -9.280 -5.754 9.608 1.00 0.00 H new ATOM 0 H4' A B 11 -10.247 -4.701 11.543 1.00 0.00 H new ATOM 0 H3' A B 11 -8.347 -2.978 9.888 1.00 0.00 H new ATOM 0 H2' A B 11 -9.064 -1.090 11.361 1.00 0.00 H new ATOM 0 HO2' A B 11 -11.273 -2.364 11.413 1.00 0.00 H new ATOM 0 H1' A B 11 -8.800 -2.517 13.709 1.00 0.00 H new ATOM 0 H8 A B 11 -5.899 -3.831 11.793 1.00 0.00 H new ATOM 0 H61 A B 11 -2.968 1.473 13.084 1.00 0.00 H new ATOM 0 H62 A B 11 -2.782 -0.187 12.508 1.00 0.00 H new ATOM 0 H2 A B 11 -7.328 2.022 13.969 1.00 0.00 H new ATOM 357 P U B 12 -10.067 -2.666 8.083 1.00 0.00 P ATOM 358 OP1 U B 12 -11.352 -2.806 7.362 1.00 0.00 O ATOM 359 OP2 U B 12 -8.871 -3.401 7.618 1.00 0.00 O ATOM 360 O5' U B 12 -9.707 -1.102 8.183 1.00 0.00 O ATOM 361 C5' U B 12 -10.699 -0.164 8.551 1.00 0.00 C ATOM 362 C4' U B 12 -10.056 1.190 8.852 1.00 0.00 C ATOM 363 O4' U B 12 -9.172 1.099 9.967 1.00 0.00 O ATOM 364 C3' U B 12 -9.210 1.709 7.709 1.00 0.00 C ATOM 365 O3' U B 12 -9.999 2.280 6.680 1.00 0.00 O ATOM 366 C2' U B 12 -8.379 2.741 8.436 1.00 0.00 C ATOM 367 O2' U B 12 -9.149 3.903 8.659 1.00 0.00 O ATOM 368 C1' U B 12 -8.125 2.062 9.784 1.00 0.00 C ATOM 369 N1 U B 12 -6.801 1.391 9.779 1.00 0.00 N ATOM 370 C2 U B 12 -5.692 2.186 10.018 1.00 0.00 C ATOM 371 O2 U B 12 -5.792 3.392 10.231 1.00 0.00 O ATOM 372 N3 U B 12 -4.461 1.548 10.006 1.00 0.00 N ATOM 373 C4 U B 12 -4.249 0.199 9.770 1.00 0.00 C ATOM 374 O4 U B 12 -3.112 -0.264 9.770 1.00 0.00 O ATOM 375 C5 U B 12 -5.463 -0.560 9.546 1.00 0.00 C ATOM 376 C6 U B 12 -6.676 0.042 9.559 1.00 0.00 C ATOM 0 H5' U B 12 -11.241 -0.521 9.427 1.00 0.00 H new ATOM 0 H5'' U B 12 -11.427 -0.059 7.747 1.00 0.00 H new ATOM 0 H4' U B 12 -10.894 1.861 9.040 1.00 0.00 H new ATOM 0 H3' U B 12 -8.630 0.948 7.187 1.00 0.00 H new ATOM 0 H2' U B 12 -7.479 3.035 7.896 1.00 0.00 H new ATOM 0 HO2' U B 12 -10.042 3.782 8.275 1.00 0.00 H new ATOM 0 H1' U B 12 -8.121 2.791 10.595 1.00 0.00 H new ATOM 0 H3 U B 12 -3.638 2.123 10.187 1.00 0.00 H new ATOM 0 H5 U B 12 -5.399 -1.623 9.366 1.00 0.00 H new ATOM 0 H6 U B 12 -7.563 -0.551 9.393 1.00 0.00 H new ATOM 387 P G B 13 -9.336 2.721 5.277 1.00 0.00 P ATOM 388 OP1 G B 13 -10.420 3.168 4.375 1.00 0.00 O ATOM 389 OP2 G B 13 -8.421 1.640 4.846 1.00 0.00 O ATOM 390 O5' G B 13 -8.445 4.005 5.663 1.00 0.00 O ATOM 391 C5' G B 13 -9.046 5.263 5.903 1.00 0.00 C ATOM 392 C4' G B 13 -7.958 6.283 6.246 1.00 0.00 C ATOM 393 O4' G B 13 -7.231 5.890 7.404 1.00 0.00 O ATOM 394 C3' G B 13 -6.914 6.382 5.153 1.00 0.00 C ATOM 395 O3' G B 13 -7.354 7.166 4.053 1.00 0.00 O ATOM 396 C2' G B 13 -5.791 7.046 5.909 1.00 0.00 C ATOM 397 O2' G B 13 -6.005 8.440 5.949 1.00 0.00 O ATOM 398 C1' G B 13 -5.933 6.489 7.320 1.00 0.00 C ATOM 399 N9 G B 13 -4.877 5.489 7.558 1.00 0.00 N ATOM 400 C8 G B 13 -4.939 4.130 7.438 1.00 0.00 C ATOM 401 N7 G B 13 -3.814 3.521 7.698 1.00 0.00 N ATOM 402 C5 G B 13 -2.937 4.558 8.005 1.00 0.00 C ATOM 403 C6 G B 13 -1.555 4.523 8.363 1.00 0.00 C ATOM 404 O6 G B 13 -0.819 3.549 8.506 1.00 0.00 O ATOM 405 N1 G B 13 -1.052 5.798 8.559 1.00 0.00 N ATOM 406 C2 G B 13 -1.770 6.965 8.447 1.00 0.00 C ATOM 407 N2 G B 13 -1.106 8.101 8.686 1.00 0.00 N ATOM 408 N3 G B 13 -3.064 7.006 8.121 1.00 0.00 N ATOM 409 C4 G B 13 -3.582 5.769 7.912 1.00 0.00 C ATOM 0 H5' G B 13 -9.761 5.187 6.722 1.00 0.00 H new ATOM 0 H5'' G B 13 -9.602 5.588 5.023 1.00 0.00 H new ATOM 0 H4' G B 13 -8.484 7.227 6.388 1.00 0.00 H new ATOM 0 H3' G B 13 -6.653 5.429 4.692 1.00 0.00 H new ATOM 0 H2' G B 13 -4.814 6.866 5.461 1.00 0.00 H new ATOM 0 HO2' G B 13 -6.671 8.688 5.275 1.00 0.00 H new ATOM 0 H1' G B 13 -5.830 7.270 8.074 1.00 0.00 H new ATOM 0 H8 G B 13 -5.839 3.606 7.153 1.00 0.00 H new ATOM 0 H1 G B 13 -0.066 5.878 8.807 1.00 0.00 H new ATOM 0 H21 G B 13 -1.588 8.997 8.618 1.00 0.00 H new ATOM 0 H22 G B 13 -0.118 8.071 8.937 1.00 0.00 H new ATOM 421 P U B 14 -6.585 7.109 2.627 1.00 0.00 P ATOM 422 OP1 U B 14 -7.333 7.955 1.671 1.00 0.00 O ATOM 423 OP2 U B 14 -6.336 5.687 2.307 1.00 0.00 O ATOM 424 O5' U B 14 -5.155 7.813 2.902 1.00 0.00 O ATOM 425 C5' U B 14 -4.994 9.218 2.814 1.00 0.00 C ATOM 426 C4' U B 14 -3.517 9.584 3.028 1.00 0.00 C ATOM 427 O4' U B 14 -3.052 9.181 4.323 1.00 0.00 O ATOM 428 C3' U B 14 -2.594 8.887 2.045 1.00 0.00 C ATOM 429 O3' U B 14 -2.573 9.487 0.765 1.00 0.00 O ATOM 430 C2' U B 14 -1.281 9.074 2.756 1.00 0.00 C ATOM 431 O2' U B 14 -0.863 10.417 2.639 1.00 0.00 O ATOM 432 C1' U B 14 -1.662 8.813 4.200 1.00 0.00 C ATOM 433 N1 U B 14 -1.476 7.380 4.542 1.00 0.00 N ATOM 434 C2 U B 14 -0.248 6.997 5.063 1.00 0.00 C ATOM 435 O2 U B 14 0.682 7.788 5.202 1.00 0.00 O ATOM 436 N3 U B 14 -0.124 5.666 5.420 1.00 0.00 N ATOM 437 C4 U B 14 -1.104 4.695 5.300 1.00 0.00 C ATOM 438 O4 U B 14 -0.875 3.533 5.625 1.00 0.00 O ATOM 439 C5 U B 14 -2.357 5.185 4.771 1.00 0.00 C ATOM 440 C6 U B 14 -2.498 6.480 4.409 1.00 0.00 C ATOM 0 H5' U B 14 -5.613 9.712 3.562 1.00 0.00 H new ATOM 0 H5'' U B 14 -5.329 9.572 1.839 1.00 0.00 H new ATOM 0 H4' U B 14 -3.485 10.666 2.899 1.00 0.00 H new ATOM 0 H3' U B 14 -2.879 7.858 1.826 1.00 0.00 H new ATOM 0 H2' U B 14 -0.481 8.441 2.372 1.00 0.00 H new ATOM 0 HO2' U B 14 -1.376 10.859 1.931 1.00 0.00 H new ATOM 0 H1' U B 14 -1.035 9.388 4.881 1.00 0.00 H new ATOM 0 H3 U B 14 0.773 5.373 5.808 1.00 0.00 H new ATOM 0 H5 U B 14 -3.191 4.508 4.664 1.00 0.00 H new ATOM 0 H6 U B 14 -3.442 6.813 4.004 1.00 0.00 H new ATOM 451 P C B 15 -1.880 8.728 -0.486 1.00 0.00 P ATOM 452 OP1 C B 15 -1.905 9.643 -1.648 1.00 0.00 O ATOM 453 OP2 C B 15 -2.495 7.387 -0.597 1.00 0.00 O ATOM 454 O5' C B 15 -0.338 8.531 -0.033 1.00 0.00 O ATOM 455 C5' C B 15 0.580 9.606 -0.073 1.00 0.00 C ATOM 456 C4' C B 15 1.972 9.124 0.358 1.00 0.00 C ATOM 457 O4' C B 15 1.977 8.602 1.693 1.00 0.00 O ATOM 458 C3' C B 15 2.477 7.985 -0.500 1.00 0.00 C ATOM 459 O3' C B 15 2.928 8.422 -1.769 1.00 0.00 O ATOM 460 C2' C B 15 3.608 7.485 0.367 1.00 0.00 C ATOM 461 O2' C B 15 4.710 8.360 0.260 1.00 0.00 O ATOM 462 C1' C B 15 3.024 7.610 1.775 1.00 0.00 C ATOM 463 N1 C B 15 2.485 6.295 2.221 1.00 0.00 N ATOM 464 C2 C B 15 3.408 5.326 2.607 1.00 0.00 C ATOM 465 O2 C B 15 4.612 5.573 2.585 1.00 0.00 O ATOM 466 N3 C B 15 2.941 4.109 3.003 1.00 0.00 N ATOM 467 C4 C B 15 1.627 3.848 3.017 1.00 0.00 C ATOM 468 N4 C B 15 1.211 2.643 3.417 1.00 0.00 N ATOM 469 C5 C B 15 0.666 4.834 2.626 1.00 0.00 C ATOM 470 C6 C B 15 1.141 6.038 2.244 1.00 0.00 C ATOM 0 H5' C B 15 0.244 10.407 0.585 1.00 0.00 H new ATOM 0 H5'' C B 15 0.625 10.019 -1.081 1.00 0.00 H new ATOM 0 H4' C B 15 2.600 10.010 0.266 1.00 0.00 H new ATOM 0 H3' C B 15 1.725 7.237 -0.751 1.00 0.00 H new ATOM 0 H2' C B 15 3.947 6.483 0.104 1.00 0.00 H new ATOM 0 HO2' C B 15 5.442 8.034 0.824 1.00 0.00 H new ATOM 0 H1' C B 15 3.780 7.908 2.502 1.00 0.00 H new ATOM 0 H41 C B 15 0.214 2.427 3.434 1.00 0.00 H new ATOM 0 H42 C B 15 1.890 1.939 3.705 1.00 0.00 H new ATOM 0 H5 C B 15 -0.393 4.624 2.636 1.00 0.00 H new ATOM 0 H6 C B 15 0.448 6.813 1.951 1.00 0.00 H new ATOM 482 P C B 16 3.218 7.363 -2.952 1.00 0.00 P ATOM 483 OP1 C B 16 3.688 8.113 -4.138 1.00 0.00 O ATOM 484 OP2 C B 16 2.041 6.475 -3.065 1.00 0.00 O ATOM 485 O5' C B 16 4.450 6.485 -2.398 1.00 0.00 O ATOM 486 C5' C B 16 5.770 6.985 -2.414 1.00 0.00 C ATOM 487 C4' C B 16 6.722 5.905 -1.891 1.00 0.00 C ATOM 488 O4' C B 16 6.430 5.557 -0.545 1.00 0.00 O ATOM 489 C3' C B 16 6.578 4.607 -2.650 1.00 0.00 C ATOM 490 O3' C B 16 7.186 4.643 -3.923 1.00 0.00 O ATOM 491 C2' C B 16 7.260 3.653 -1.719 1.00 0.00 C ATOM 492 O2' C B 16 8.663 3.771 -1.844 1.00 0.00 O ATOM 493 C1' C B 16 6.821 4.185 -0.360 1.00 0.00 C ATOM 494 N1 C B 16 5.677 3.374 0.113 1.00 0.00 N ATOM 495 C2 C B 16 5.964 2.179 0.767 1.00 0.00 C ATOM 496 O2 C B 16 7.128 1.867 1.008 1.00 0.00 O ATOM 497 N3 C B 16 4.925 1.373 1.123 1.00 0.00 N ATOM 498 C4 C B 16 3.662 1.716 0.838 1.00 0.00 C ATOM 499 N4 C B 16 2.671 0.899 1.208 1.00 0.00 N ATOM 500 C5 C B 16 3.358 2.930 0.141 1.00 0.00 C ATOM 501 C6 C B 16 4.394 3.721 -0.194 1.00 0.00 C ATOM 0 H5' C B 16 5.841 7.880 -1.796 1.00 0.00 H new ATOM 0 H5'' C B 16 6.050 7.275 -3.427 1.00 0.00 H new ATOM 0 H4' C B 16 7.717 6.336 -2.003 1.00 0.00 H new ATOM 0 H3' C B 16 5.546 4.347 -2.884 1.00 0.00 H new ATOM 0 H2' C B 16 7.016 2.606 -1.897 1.00 0.00 H new ATOM 0 HO2' C B 16 8.887 4.065 -2.752 1.00 0.00 H new ATOM 0 HO3' C B 16 7.064 3.779 -4.368 1.00 0.00 H new ATOM 0 H1' C B 16 7.620 4.125 0.379 1.00 0.00 H new ATOM 0 H41 C B 16 1.703 1.144 0.999 1.00 0.00 H new ATOM 0 H42 C B 16 2.883 0.030 1.699 1.00 0.00 H new ATOM 0 H5 C B 16 2.341 3.199 -0.105 1.00 0.00 H new ATOM 0 H6 C B 16 4.206 4.648 -0.716 1.00 0.00 H new TER 514 C B 16