USER MOD reduce.3.24.130724 H: found=0, std=0, add=152, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 153 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= -0.0492 USER MOD Single : A 2 G O2' : rot -19:sc= 0.145 USER MOD Single : A 3 C O2' : rot -68:sc= 0.814 USER MOD Single : A 4 A O2' : rot -24:sc= 0.222 USER MOD Single : A 5 C O2' : rot -19:sc= 0.107 USER MOD Single : A 6 U O2' : rot -163:sc= 1.2 USER MOD Single : A 7 U O2' : rot -98:sc= 1.17 USER MOD Single : A 8 C O2' : rot 18:sc= 0.135 USER MOD Single : A 9 G O2' : rot -24:sc= 0.149 USER MOD Single : A 10 G O2' : rot 180:sc= -0.0584 USER MOD Single : A 11 U O2' : rot -16:sc= 0.209 USER MOD Single : A 12 G O2' : rot -25:sc= 0.146 USER MOD Single : A 13 C O2' : rot -15:sc= 0.148 USER MOD Single : A 14 C O2' : rot -10:sc= 0.305 USER MOD Single : A 14 C O3' : rot 180:sc= 0.273 USER MOD ----------------------------------------------------------------- ATOM 1 OP3 G A 1 -7.902 -4.048 10.062 1.00 10.00 O ATOM 2 P G A 1 -9.048 -5.063 10.492 1.00 10.00 P ATOM 3 OP1 G A 1 -9.878 -4.394 11.525 1.00 10.00 O ATOM 4 OP2 G A 1 -8.436 -6.381 10.784 1.00 10.00 O ATOM 5 O5' G A 1 -9.926 -5.187 9.172 1.00 10.00 O ATOM 6 C5' G A 1 -10.314 -6.455 8.654 1.00 10.00 C ATOM 7 C4' G A 1 -11.112 -6.284 7.380 1.00 10.00 C ATOM 8 O4' G A 1 -11.812 -5.000 7.397 1.00 10.00 O ATOM 9 C3' G A 1 -10.298 -6.252 6.089 1.00 10.00 C ATOM 10 O3' G A 1 -9.990 -7.564 5.610 1.00 10.00 O ATOM 11 C2' G A 1 -11.257 -5.523 5.159 1.00 10.00 C ATOM 12 O2' G A 1 -12.347 -6.339 4.773 1.00 10.00 O ATOM 13 C1' G A 1 -11.752 -4.432 6.100 1.00 10.00 C ATOM 14 N9 G A 1 -10.901 -3.245 6.103 1.00 10.00 N ATOM 15 C8 G A 1 -10.096 -2.752 7.103 1.00 10.00 C ATOM 16 N7 G A 1 -9.550 -1.602 6.806 1.00 10.00 N ATOM 17 C5 G A 1 -10.021 -1.316 5.533 1.00 10.00 C ATOM 18 C6 G A 1 -9.781 -0.197 4.682 1.00 10.00 C ATOM 19 O6 G A 1 -9.099 0.817 4.905 1.00 10.00 O ATOM 20 N1 G A 1 -10.459 -0.315 3.470 1.00 10.00 N ATOM 21 C2 G A 1 -11.266 -1.377 3.130 1.00 10.00 C ATOM 22 N2 G A 1 -11.826 -1.343 1.909 1.00 10.00 N ATOM 23 N3 G A 1 -11.498 -2.416 3.911 1.00 10.00 N ATOM 24 C4 G A 1 -10.849 -2.321 5.088 1.00 10.00 C ATOM 0 H5' G A 1 -10.909 -6.990 9.394 1.00 10.00 H new ATOM 0 H5'' G A 1 -9.429 -7.061 8.458 1.00 10.00 H new ATOM 0 H4' G A 1 -11.761 -7.160 7.371 1.00 10.00 H new ATOM 0 H3' G A 1 -9.321 -5.779 6.192 1.00 10.00 H new ATOM 0 H2' G A 1 -10.803 -5.191 4.225 1.00 10.00 H new ATOM 0 HO2' G A 1 -12.939 -5.834 4.178 1.00 10.00 H new ATOM 0 H1' G A 1 -12.729 -4.088 5.762 1.00 10.00 H new ATOM 0 H8 G A 1 -9.931 -3.264 8.040 1.00 10.00 H new ATOM 0 H1 G A 1 -10.350 0.436 2.789 1.00 10.00 H new ATOM 0 H21 G A 1 -12.433 -2.104 1.605 1.00 10.00 H new ATOM 0 H22 G A 1 -11.644 -0.556 1.286 1.00 10.00 H new ATOM 37 P G A 2 -8.545 -7.923 4.984 1.00 10.00 P ATOM 38 OP1 G A 2 -8.286 -9.360 5.243 1.00 10.00 O ATOM 39 OP2 G A 2 -7.570 -6.919 5.467 1.00 10.00 O ATOM 40 O5' G A 2 -8.709 -7.736 3.409 1.00 10.00 O ATOM 41 C5' G A 2 -9.942 -8.071 2.785 1.00 10.00 C ATOM 42 C4' G A 2 -10.068 -7.504 1.387 1.00 10.00 C ATOM 43 O4' G A 2 -10.651 -6.184 1.502 1.00 10.00 O ATOM 44 C3' G A 2 -8.799 -7.306 0.568 1.00 10.00 C ATOM 45 O3' G A 2 -8.512 -8.473 -0.193 1.00 10.00 O ATOM 46 C2' G A 2 -9.173 -6.137 -0.339 1.00 10.00 C ATOM 47 O2' G A 2 -9.959 -6.559 -1.435 1.00 10.00 O ATOM 48 C1' G A 2 -10.028 -5.293 0.604 1.00 10.00 C ATOM 49 N9 G A 2 -9.269 -4.337 1.400 1.00 10.00 N ATOM 50 C8 G A 2 -8.832 -4.516 2.689 1.00 10.00 C ATOM 51 N7 G A 2 -8.202 -3.479 3.167 1.00 10.00 N ATOM 52 C5 G A 2 -8.221 -2.559 2.125 1.00 10.00 C ATOM 53 C6 G A 2 -7.685 -1.245 2.045 1.00 10.00 C ATOM 54 O6 G A 2 -7.065 -0.608 2.909 1.00 10.00 O ATOM 55 N1 G A 2 -7.927 -0.659 0.803 1.00 10.00 N ATOM 56 C2 G A 2 -8.597 -1.274 -0.232 1.00 10.00 C ATOM 57 N2 G A 2 -8.741 -0.560 -1.362 1.00 10.00 N ATOM 58 N3 G A 2 -9.097 -2.497 -0.169 1.00 10.00 N ATOM 59 C4 G A 2 -8.873 -3.077 1.028 1.00 10.00 C ATOM 0 H5' G A 2 -10.765 -7.702 3.397 1.00 10.00 H new ATOM 0 H5'' G A 2 -10.039 -9.156 2.742 1.00 10.00 H new ATOM 0 H4' G A 2 -10.650 -8.260 0.860 1.00 10.00 H new ATOM 0 H3' G A 2 -7.909 -7.119 1.169 1.00 10.00 H new ATOM 0 H2' G A 2 -8.310 -5.630 -0.771 1.00 10.00 H new ATOM 0 HO2' G A 2 -9.854 -7.525 -1.560 1.00 10.00 H new ATOM 0 H1' G A 2 -10.722 -4.719 -0.010 1.00 10.00 H new ATOM 0 H8 G A 2 -8.994 -5.424 3.251 1.00 10.00 H new ATOM 0 H1 G A 2 -7.585 0.290 0.650 1.00 10.00 H new ATOM 0 H21 G A 2 -9.228 -0.964 -2.162 1.00 10.00 H new ATOM 0 H22 G A 2 -8.363 0.386 -1.419 1.00 10.00 H new ATOM 71 P C A 3 -7.026 -8.730 -0.743 1.00 10.00 P ATOM 72 OP1 C A 3 -7.069 -9.968 -1.565 1.00 10.00 O ATOM 73 OP2 C A 3 -6.091 -8.654 0.401 1.00 10.00 O ATOM 74 O5' C A 3 -6.741 -7.504 -1.716 1.00 10.00 O ATOM 75 C5' C A 3 -6.835 -7.673 -3.127 1.00 10.00 C ATOM 76 C4' C A 3 -6.379 -6.428 -3.850 1.00 10.00 C ATOM 77 O4' C A 3 -6.836 -5.254 -3.140 1.00 10.00 O ATOM 78 C3' C A 3 -4.876 -6.231 -3.947 1.00 10.00 C ATOM 79 O3' C A 3 -4.345 -6.980 -5.034 1.00 10.00 O ATOM 80 C2' C A 3 -4.755 -4.726 -4.180 1.00 10.00 C ATOM 81 O2' C A 3 -4.890 -4.403 -5.550 1.00 10.00 O ATOM 82 C1' C A 3 -5.958 -4.176 -3.406 1.00 10.00 C ATOM 83 N1 C A 3 -5.595 -3.543 -2.126 1.00 10.00 N ATOM 84 C2 C A 3 -5.208 -2.199 -2.125 1.00 10.00 C ATOM 85 O2 C A 3 -5.139 -1.586 -3.202 1.00 10.00 O ATOM 86 N3 C A 3 -4.920 -1.592 -0.952 1.00 10.00 N ATOM 87 C4 C A 3 -5.010 -2.273 0.192 1.00 10.00 C ATOM 88 N4 C A 3 -4.739 -1.620 1.322 1.00 10.00 N ATOM 89 C5 C A 3 -5.390 -3.645 0.225 1.00 10.00 C ATOM 90 C6 C A 3 -5.668 -4.235 -0.946 1.00 10.00 C ATOM 0 H5' C A 3 -7.865 -7.902 -3.402 1.00 10.00 H new ATOM 0 H5'' C A 3 -6.226 -8.522 -3.437 1.00 10.00 H new ATOM 0 H4' C A 3 -6.790 -6.557 -4.851 1.00 10.00 H new ATOM 0 H3' C A 3 -4.324 -6.569 -3.070 1.00 10.00 H new ATOM 0 H2' C A 3 -3.790 -4.326 -3.867 1.00 10.00 H new ATOM 0 HO2' C A 3 -4.115 -4.743 -6.044 1.00 10.00 H new ATOM 0 H1' C A 3 -6.418 -3.404 -4.023 1.00 10.00 H new ATOM 0 H41 C A 3 -4.796 -2.105 2.218 1.00 10.00 H new ATOM 0 H42 C A 3 -4.474 -0.635 1.291 1.00 10.00 H new ATOM 0 H5 C A 3 -5.452 -4.188 1.156 1.00 10.00 H new ATOM 0 H6 C A 3 -5.955 -5.276 -0.959 1.00 10.00 H new ATOM 102 P A A 4 -2.762 -7.032 -5.289 1.00 10.00 P ATOM 103 OP1 A A 4 -2.496 -8.110 -6.269 1.00 10.00 O ATOM 104 OP2 A A 4 -2.093 -7.070 -3.965 1.00 10.00 O ATOM 105 O5' A A 4 -2.439 -5.632 -5.971 1.00 10.00 O ATOM 106 C5' A A 4 -2.022 -5.536 -7.328 1.00 10.00 C ATOM 107 C4' A A 4 -1.421 -4.173 -7.587 1.00 10.00 C ATOM 108 O4' A A 4 -1.990 -3.214 -6.651 1.00 10.00 O ATOM 109 C3' A A 4 0.084 -4.065 -7.387 1.00 10.00 C ATOM 110 O3' A A 4 0.779 -4.369 -8.596 1.00 10.00 O ATOM 111 C2' A A 4 0.269 -2.609 -6.998 1.00 10.00 C ATOM 112 O2' A A 4 0.319 -1.798 -8.152 1.00 10.00 O ATOM 113 C1' A A 4 -0.992 -2.315 -6.195 1.00 10.00 C ATOM 114 N9 A A 4 -0.842 -2.479 -4.745 1.00 10.00 N ATOM 115 C8 A A 4 -1.050 -3.609 -3.993 1.00 10.00 C ATOM 116 N7 A A 4 -0.846 -3.441 -2.708 1.00 10.00 N ATOM 117 C5 A A 4 -0.475 -2.110 -2.605 1.00 10.00 C ATOM 118 C6 A A 4 -0.125 -1.318 -1.502 1.00 10.00 C ATOM 119 N6 A A 4 -0.106 -1.778 -0.250 1.00 10.00 N ATOM 120 N1 A A 4 0.196 -0.029 -1.733 1.00 10.00 N ATOM 121 C2 A A 4 0.164 0.424 -2.996 1.00 10.00 C ATOM 122 N3 A A 4 -0.147 -0.229 -4.121 1.00 10.00 N ATOM 123 C4 A A 4 -0.462 -1.505 -3.851 1.00 10.00 C ATOM 0 H5' A A 4 -2.871 -5.700 -7.991 1.00 10.00 H new ATOM 0 H5'' A A 4 -1.290 -6.313 -7.549 1.00 10.00 H new ATOM 0 H4' A A 4 -1.644 -3.982 -8.637 1.00 10.00 H new ATOM 0 H3' A A 4 0.475 -4.760 -6.644 1.00 10.00 H new ATOM 0 H2' A A 4 1.190 -2.416 -6.447 1.00 10.00 H new ATOM 0 HO2' A A 4 0.601 -2.338 -8.920 1.00 10.00 H new ATOM 0 H1' A A 4 -1.245 -1.266 -6.351 1.00 10.00 H new ATOM 0 H8 A A 4 -1.355 -4.552 -4.421 1.00 10.00 H new ATOM 0 H61 A A 4 0.156 -1.159 0.517 1.00 10.00 H new ATOM 0 H62 A A 4 -0.354 -2.749 -0.060 1.00 10.00 H new ATOM 0 H2 A A 4 0.427 1.464 -3.122 1.00 10.00 H new ATOM 135 P C A 5 2.309 -4.853 -8.552 1.00 10.00 P ATOM 136 OP1 C A 5 2.788 -4.959 -9.951 1.00 10.00 O ATOM 137 OP2 C A 5 2.410 -6.025 -7.651 1.00 10.00 O ATOM 138 O5' C A 5 3.071 -3.643 -7.861 1.00 10.00 O ATOM 139 C5' C A 5 3.815 -2.709 -8.626 1.00 10.00 C ATOM 140 C4' C A 5 3.995 -1.437 -7.832 1.00 10.00 C ATOM 141 O4' C A 5 2.924 -1.345 -6.858 1.00 10.00 O ATOM 142 C3' C A 5 5.252 -1.350 -6.984 1.00 10.00 C ATOM 143 O3' C A 5 6.360 -0.900 -7.756 1.00 10.00 O ATOM 144 C2' C A 5 4.849 -0.329 -5.927 1.00 10.00 C ATOM 145 O2' C A 5 4.897 0.988 -6.436 1.00 10.00 O ATOM 146 C1' C A 5 3.396 -0.739 -5.672 1.00 10.00 C ATOM 147 N1 C A 5 3.249 -1.657 -4.526 1.00 10.00 N ATOM 148 C2 C A 5 3.418 -1.136 -3.238 1.00 10.00 C ATOM 149 O2 C A 5 3.751 0.049 -3.112 1.00 10.00 O ATOM 150 N3 C A 5 3.216 -1.931 -2.161 1.00 10.00 N ATOM 151 C4 C A 5 2.855 -3.204 -2.328 1.00 10.00 C ATOM 152 N4 C A 5 2.659 -3.940 -1.228 1.00 10.00 N ATOM 153 C5 C A 5 2.683 -3.770 -3.626 1.00 10.00 C ATOM 154 C6 C A 5 2.897 -2.972 -4.683 1.00 10.00 C ATOM 0 H5' C A 5 3.299 -2.496 -9.562 1.00 10.00 H new ATOM 0 H5'' C A 5 4.787 -3.128 -8.886 1.00 10.00 H new ATOM 0 H4' C A 5 4.027 -0.657 -8.593 1.00 10.00 H new ATOM 0 H3' C A 5 5.574 -2.304 -6.566 1.00 10.00 H new ATOM 0 H2' C A 5 5.493 -0.323 -5.048 1.00 10.00 H new ATOM 0 HO2' C A 5 5.455 1.007 -7.241 1.00 10.00 H new ATOM 0 H1' C A 5 2.814 0.145 -5.413 1.00 10.00 H new ATOM 0 H41 C A 5 2.382 -4.918 -1.311 1.00 10.00 H new ATOM 0 H42 C A 5 2.787 -3.523 -0.306 1.00 10.00 H new ATOM 0 H5 C A 5 2.391 -4.802 -3.753 1.00 10.00 H new ATOM 0 H6 C A 5 2.790 -3.375 -5.679 1.00 10.00 H new ATOM 166 P U A 6 7.775 -1.645 -7.640 1.00 10.00 P ATOM 167 OP1 U A 6 8.709 -1.027 -8.616 1.00 10.00 O ATOM 168 OP2 U A 6 7.519 -3.103 -7.699 1.00 10.00 O ATOM 169 O5' U A 6 8.279 -1.285 -6.176 1.00 10.00 O ATOM 170 C5' U A 6 8.891 -0.026 -5.916 1.00 10.00 C ATOM 171 C4' U A 6 9.132 0.142 -4.436 1.00 10.00 C ATOM 172 O4' U A 6 7.907 -0.110 -3.703 1.00 10.00 O ATOM 173 C3' U A 6 10.120 -0.833 -3.814 1.00 10.00 C ATOM 174 O3' U A 6 11.466 -0.439 -4.065 1.00 10.00 O ATOM 175 C2' U A 6 9.756 -0.726 -2.338 1.00 10.00 C ATOM 176 O2' U A 6 10.287 0.451 -1.758 1.00 10.00 O ATOM 177 C1' U A 6 8.232 -0.616 -2.417 1.00 10.00 C ATOM 178 N1 U A 6 7.540 -1.900 -2.224 1.00 10.00 N ATOM 179 C2 U A 6 7.352 -2.337 -0.925 1.00 10.00 C ATOM 180 O2 U A 6 7.751 -1.720 0.048 1.00 10.00 O ATOM 181 N3 U A 6 6.703 -3.542 -0.803 1.00 10.00 N ATOM 182 C4 U A 6 6.231 -4.339 -1.821 1.00 10.00 C ATOM 183 O4 U A 6 5.664 -5.399 -1.549 1.00 10.00 O ATOM 184 C5 U A 6 6.468 -3.823 -3.133 1.00 10.00 C ATOM 185 C6 U A 6 7.093 -2.652 -3.292 1.00 10.00 C ATOM 0 H5' U A 6 8.253 0.779 -6.281 1.00 10.00 H new ATOM 0 H5'' U A 6 9.835 0.046 -6.456 1.00 10.00 H new ATOM 0 H4' U A 6 9.521 1.157 -4.363 1.00 10.00 H new ATOM 0 H3' U A 6 10.062 -1.848 -4.208 1.00 10.00 H new ATOM 0 H2' U A 6 10.134 -1.551 -1.734 1.00 10.00 H new ATOM 0 HO2' U A 6 10.276 0.368 -0.782 1.00 10.00 H new ATOM 0 H1' U A 6 7.901 0.039 -1.611 1.00 10.00 H new ATOM 0 H3 U A 6 6.555 -3.883 0.147 1.00 10.00 H new ATOM 0 H5 U A 6 6.141 -4.381 -3.998 1.00 10.00 H new ATOM 0 H6 U A 6 7.254 -2.280 -4.293 1.00 10.00 H new ATOM 196 P U A 7 12.674 -1.478 -3.856 1.00 10.00 P ATOM 197 OP1 U A 7 13.715 -1.194 -4.873 1.00 10.00 O ATOM 198 OP2 U A 7 12.099 -2.843 -3.780 1.00 10.00 O ATOM 199 O5' U A 7 13.269 -1.105 -2.426 1.00 10.00 O ATOM 200 C5' U A 7 14.569 -1.546 -2.039 1.00 10.00 C ATOM 201 C4' U A 7 15.129 -0.634 -0.971 1.00 10.00 C ATOM 202 O4' U A 7 15.174 0.724 -1.502 1.00 10.00 O ATOM 203 C3' U A 7 14.309 -0.561 0.317 1.00 10.00 C ATOM 204 O3' U A 7 15.127 -0.682 1.476 1.00 10.00 O ATOM 205 C2' U A 7 13.633 0.806 0.268 1.00 10.00 C ATOM 206 O2' U A 7 13.531 1.381 1.552 1.00 10.00 O ATOM 207 C1' U A 7 14.629 1.616 -0.557 1.00 10.00 C ATOM 208 N1 U A 7 14.017 2.752 -1.263 1.00 10.00 N ATOM 209 C2 U A 7 14.387 4.034 -0.892 1.00 10.00 C ATOM 210 O2 U A 7 15.223 4.265 -0.032 1.00 10.00 O ATOM 211 N3 U A 7 13.754 5.041 -1.574 1.00 10.00 N ATOM 212 C4 U A 7 12.809 4.909 -2.569 1.00 10.00 C ATOM 213 O4 U A 7 12.311 5.920 -3.068 1.00 10.00 O ATOM 214 C5 U A 7 12.482 3.556 -2.898 1.00 10.00 C ATOM 215 C6 U A 7 13.077 2.546 -2.250 1.00 10.00 C ATOM 0 H5' U A 7 15.231 -1.555 -2.905 1.00 10.00 H new ATOM 0 H5'' U A 7 14.519 -2.569 -1.665 1.00 10.00 H new ATOM 0 H4' U A 7 16.103 -1.052 -0.718 1.00 10.00 H new ATOM 0 H3' U A 7 13.592 -1.380 0.382 1.00 10.00 H new ATOM 0 H2' U A 7 12.619 0.764 -0.130 1.00 10.00 H new ATOM 0 HO2' U A 7 12.636 1.215 1.915 1.00 10.00 H new ATOM 0 H1' U A 7 15.376 2.045 0.111 1.00 10.00 H new ATOM 0 H3 U A 7 14.011 5.994 -1.316 1.00 10.00 H new ATOM 0 H5 U A 7 11.755 3.349 -3.669 1.00 10.00 H new ATOM 0 H6 U A 7 12.810 1.532 -2.511 1.00 10.00 H new ATOM 226 P C A 8 15.133 -2.059 2.307 1.00 10.00 P ATOM 227 OP1 C A 8 15.955 -1.857 3.521 1.00 10.00 O ATOM 228 OP2 C A 8 15.501 -3.135 1.357 1.00 10.00 O ATOM 229 O5' C A 8 13.620 -2.280 2.755 1.00 10.00 O ATOM 230 C5' C A 8 13.187 -2.050 4.098 1.00 10.00 C ATOM 231 C4' C A 8 11.947 -2.862 4.402 1.00 10.00 C ATOM 232 O4' C A 8 11.102 -2.879 3.214 1.00 10.00 O ATOM 233 C3' C A 8 12.178 -4.333 4.744 1.00 10.00 C ATOM 234 O3' C A 8 11.197 -4.822 5.658 1.00 10.00 O ATOM 235 C2' C A 8 12.022 -5.007 3.386 1.00 10.00 C ATOM 236 O2' C A 8 11.682 -6.378 3.496 1.00 10.00 O ATOM 237 C1' C A 8 10.824 -4.220 2.870 1.00 10.00 C ATOM 238 N1 C A 8 10.640 -4.307 1.416 1.00 10.00 N ATOM 239 C2 C A 8 9.627 -5.105 0.881 1.00 10.00 C ATOM 240 O2 C A 8 8.869 -5.723 1.643 1.00 10.00 O ATOM 241 N3 C A 8 9.499 -5.191 -0.464 1.00 10.00 N ATOM 242 C4 C A 8 10.337 -4.519 -1.256 1.00 10.00 C ATOM 243 N4 C A 8 10.173 -4.601 -2.571 1.00 10.00 N ATOM 244 C5 C A 8 11.374 -3.707 -0.737 1.00 10.00 C ATOM 245 C6 C A 8 11.487 -3.626 0.588 1.00 10.00 C ATOM 0 H5' C A 8 12.979 -0.990 4.243 1.00 10.00 H new ATOM 0 H5'' C A 8 13.983 -2.316 4.794 1.00 10.00 H new ATOM 0 H4' C A 8 11.515 -2.378 5.278 1.00 10.00 H new ATOM 0 H3' C A 8 13.138 -4.515 5.228 1.00 10.00 H new ATOM 0 H2' C A 8 12.923 -4.998 2.772 1.00 10.00 H new ATOM 0 HO2' C A 8 11.337 -6.558 4.395 1.00 10.00 H new ATOM 0 H1' C A 8 9.908 -4.619 3.306 1.00 10.00 H new ATOM 0 H41 C A 8 10.801 -4.096 -3.196 1.00 10.00 H new ATOM 0 H42 C A 8 9.419 -5.169 -2.956 1.00 10.00 H new ATOM 0 H5 C A 8 12.048 -3.173 -1.391 1.00 10.00 H new ATOM 0 H6 C A 8 12.264 -3.010 1.016 1.00 10.00 H new ATOM 257 P G A 9 11.480 -4.880 7.237 1.00 10.00 P ATOM 258 OP1 G A 9 12.890 -5.274 7.462 1.00 10.00 O ATOM 259 OP2 G A 9 10.398 -5.687 7.851 1.00 10.00 O ATOM 260 O5' G A 9 11.294 -3.377 7.721 1.00 10.00 O ATOM 261 C5' G A 9 9.988 -2.831 7.909 1.00 10.00 C ATOM 262 C4' G A 9 10.076 -1.334 8.093 1.00 10.00 C ATOM 263 O4' G A 9 11.057 -0.806 7.170 1.00 10.00 O ATOM 264 C3' G A 9 8.813 -0.548 7.770 1.00 10.00 C ATOM 265 O3' G A 9 7.903 -0.544 8.861 1.00 10.00 O ATOM 266 C2' G A 9 9.361 0.848 7.495 1.00 10.00 C ATOM 267 O2' G A 9 9.538 1.588 8.687 1.00 10.00 O ATOM 268 C1' G A 9 10.729 0.537 6.891 1.00 10.00 C ATOM 269 N9 G A 9 10.800 0.739 5.446 1.00 10.00 N ATOM 270 C8 G A 9 11.655 1.604 4.825 1.00 10.00 C ATOM 271 N7 G A 9 11.558 1.589 3.526 1.00 10.00 N ATOM 272 C5 G A 9 10.567 0.649 3.272 1.00 10.00 C ATOM 273 C6 G A 9 10.024 0.201 2.039 1.00 10.00 C ATOM 274 O6 G A 9 10.319 0.564 0.893 1.00 10.00 O ATOM 275 N1 G A 9 9.040 -0.765 2.221 1.00 10.00 N ATOM 276 C2 G A 9 8.626 -1.232 3.446 1.00 10.00 C ATOM 277 N2 G A 9 7.656 -2.157 3.434 1.00 10.00 N ATOM 278 N3 G A 9 9.119 -0.822 4.606 1.00 10.00 N ATOM 279 C4 G A 9 10.083 0.113 4.449 1.00 10.00 C ATOM 0 H5' G A 9 9.517 -3.286 8.780 1.00 10.00 H new ATOM 0 H5'' G A 9 9.360 -3.064 7.049 1.00 10.00 H new ATOM 0 H4' G A 9 10.305 -1.215 9.152 1.00 10.00 H new ATOM 0 H3' G A 9 8.243 -0.965 6.940 1.00 10.00 H new ATOM 0 H2' G A 9 8.699 1.444 6.867 1.00 10.00 H new ATOM 0 HO2' G A 9 8.939 1.240 9.380 1.00 10.00 H new ATOM 0 H1' G A 9 11.432 1.236 7.344 1.00 10.00 H new ATOM 0 H8 G A 9 12.345 2.240 5.360 1.00 10.00 H new ATOM 0 H1 G A 9 8.595 -1.153 1.389 1.00 10.00 H new ATOM 0 H21 G A 9 7.307 -2.542 4.312 1.00 10.00 H new ATOM 0 H22 G A 9 7.267 -2.476 2.547 1.00 10.00 H new ATOM 291 P G A 10 6.327 -0.478 8.570 1.00 10.00 P ATOM 292 OP1 G A 10 5.656 0.089 9.763 1.00 10.00 O ATOM 293 OP2 G A 10 5.922 -1.818 8.077 1.00 10.00 O ATOM 294 O5' G A 10 6.183 0.556 7.367 1.00 10.00 O ATOM 295 C5' G A 10 6.083 1.953 7.610 1.00 10.00 C ATOM 296 C4' G A 10 6.237 2.755 6.336 1.00 10.00 C ATOM 297 O4' G A 10 6.849 1.913 5.319 1.00 10.00 O ATOM 298 C3' G A 10 4.957 3.243 5.670 1.00 10.00 C ATOM 299 O3' G A 10 4.544 4.490 6.227 1.00 10.00 O ATOM 300 C2' G A 10 5.407 3.409 4.226 1.00 10.00 C ATOM 301 O2' G A 10 6.246 4.537 4.085 1.00 10.00 O ATOM 302 C1' G A 10 6.222 2.129 4.066 1.00 10.00 C ATOM 303 N9 G A 10 5.401 0.966 3.747 1.00 10.00 N ATOM 304 C8 G A 10 4.871 0.069 4.633 1.00 10.00 C ATOM 305 N7 G A 10 4.204 -0.895 4.058 1.00 10.00 N ATOM 306 C5 G A 10 4.288 -0.605 2.701 1.00 10.00 C ATOM 307 C6 G A 10 3.755 -1.290 1.566 1.00 10.00 C ATOM 308 O6 G A 10 3.084 -2.333 1.535 1.00 10.00 O ATOM 309 N1 G A 10 4.078 -0.645 0.373 1.00 10.00 N ATOM 310 C2 G A 10 4.818 0.513 0.290 1.00 10.00 C ATOM 311 N2 G A 10 5.027 1.009 -0.935 1.00 10.00 N ATOM 312 N3 G A 10 5.315 1.157 1.334 1.00 10.00 N ATOM 313 C4 G A 10 5.017 0.547 2.498 1.00 10.00 C ATOM 0 H5' G A 10 6.849 2.254 8.324 1.00 10.00 H new ATOM 0 H5'' G A 10 5.118 2.175 8.065 1.00 10.00 H new ATOM 0 H4' G A 10 6.811 3.623 6.660 1.00 10.00 H new ATOM 0 H3' G A 10 4.104 2.575 5.792 1.00 10.00 H new ATOM 0 H2' G A 10 4.602 3.554 3.506 1.00 10.00 H new ATOM 0 HO2' G A 10 6.524 4.623 3.149 1.00 10.00 H new ATOM 0 H1' G A 10 6.924 2.248 3.240 1.00 10.00 H new ATOM 0 H8 G A 10 4.992 0.150 5.703 1.00 10.00 H new ATOM 0 H1 G A 10 3.743 -1.059 -0.497 1.00 10.00 H new ATOM 0 H21 G A 10 5.569 1.865 -1.053 1.00 10.00 H new ATOM 0 H22 G A 10 4.644 0.531 -1.751 1.00 10.00 H new ATOM 325 P U A 11 3.003 4.938 6.163 1.00 10.00 P ATOM 326 OP1 U A 11 2.848 6.182 6.951 1.00 10.00 O ATOM 327 OP2 U A 11 2.186 3.754 6.514 1.00 10.00 O ATOM 328 O5' U A 11 2.741 5.288 4.633 1.00 10.00 O ATOM 329 C5' U A 11 3.412 6.365 3.986 1.00 10.00 C ATOM 330 C4' U A 11 3.142 6.325 2.497 1.00 10.00 C ATOM 331 O4' U A 11 3.440 5.002 1.983 1.00 10.00 O ATOM 332 C3' U A 11 1.697 6.582 2.090 1.00 10.00 C ATOM 333 O3' U A 11 1.470 7.974 1.913 1.00 10.00 O ATOM 334 C2' U A 11 1.558 5.834 0.770 1.00 10.00 C ATOM 335 O2' U A 11 1.983 6.633 -0.314 1.00 10.00 O ATOM 336 C1' U A 11 2.535 4.672 0.946 1.00 10.00 C ATOM 337 N1 U A 11 1.881 3.398 1.274 1.00 10.00 N ATOM 338 C2 U A 11 1.394 2.642 0.223 1.00 10.00 C ATOM 339 O2 U A 11 1.413 3.026 -0.934 1.00 10.00 O ATOM 340 N3 U A 11 0.869 1.426 0.579 1.00 10.00 N ATOM 341 C4 U A 11 0.786 0.898 1.849 1.00 10.00 C ATOM 342 O4 U A 11 0.289 -0.218 2.013 1.00 10.00 O ATOM 343 C5 U A 11 1.306 1.741 2.875 1.00 10.00 C ATOM 344 C6 U A 11 1.816 2.931 2.567 1.00 10.00 C ATOM 0 H5' U A 11 4.484 6.300 4.171 1.00 10.00 H new ATOM 0 H5'' U A 11 3.074 7.315 4.400 1.00 10.00 H new ATOM 0 H4' U A 11 3.769 7.121 2.095 1.00 10.00 H new ATOM 0 H3' U A 11 0.976 6.252 2.838 1.00 10.00 H new ATOM 0 H2' U A 11 0.531 5.539 0.557 1.00 10.00 H new ATOM 0 HO2' U A 11 2.027 7.571 -0.032 1.00 10.00 H new ATOM 0 H1' U A 11 3.040 4.529 -0.009 1.00 10.00 H new ATOM 0 H3 U A 11 0.500 0.850 -0.178 1.00 10.00 H new ATOM 0 H5 U A 11 1.286 1.413 3.904 1.00 10.00 H new ATOM 0 H6 U A 11 2.194 3.555 3.363 1.00 10.00 H new ATOM 355 P G A 12 0.007 8.592 2.129 1.00 10.00 P ATOM 356 OP1 G A 12 0.113 10.060 1.939 1.00 10.00 O ATOM 357 OP2 G A 12 -0.524 8.056 3.405 1.00 10.00 O ATOM 358 O5' G A 12 -0.856 7.994 0.932 1.00 10.00 O ATOM 359 C5' G A 12 -1.233 8.826 -0.160 1.00 10.00 C ATOM 360 C4' G A 12 -1.797 8.008 -1.296 1.00 10.00 C ATOM 361 O4' G A 12 -1.242 6.665 -1.257 1.00 10.00 O ATOM 362 C3' G A 12 -3.302 7.790 -1.266 1.00 10.00 C ATOM 363 O3' G A 12 -3.991 8.890 -1.848 1.00 10.00 O ATOM 364 C2' G A 12 -3.463 6.529 -2.107 1.00 10.00 C ATOM 365 O2' G A 12 -3.420 6.833 -3.486 1.00 10.00 O ATOM 366 C1' G A 12 -2.214 5.739 -1.709 1.00 10.00 C ATOM 367 N9 G A 12 -2.468 4.771 -0.648 1.00 10.00 N ATOM 368 C8 G A 12 -2.334 4.962 0.708 1.00 10.00 C ATOM 369 N7 G A 12 -2.678 3.917 1.410 1.00 10.00 N ATOM 370 C5 G A 12 -3.066 2.980 0.459 1.00 10.00 C ATOM 371 C6 G A 12 -3.542 1.650 0.614 1.00 10.00 C ATOM 372 O6 G A 12 -3.726 1.013 1.662 1.00 10.00 O ATOM 373 N1 G A 12 -3.819 1.050 -0.613 1.00 10.00 N ATOM 374 C2 G A 12 -3.651 1.663 -1.834 1.00 10.00 C ATOM 375 N2 G A 12 -3.947 0.929 -2.914 1.00 10.00 N ATOM 376 N3 G A 12 -3.214 2.899 -1.991 1.00 10.00 N ATOM 377 C4 G A 12 -2.939 3.493 -0.812 1.00 10.00 C ATOM 0 H5' G A 12 -0.367 9.389 -0.508 1.00 10.00 H new ATOM 0 H5'' G A 12 -1.974 9.553 0.172 1.00 10.00 H new ATOM 0 H4' G A 12 -1.538 8.589 -2.181 1.00 10.00 H new ATOM 0 H3' G A 12 -3.712 7.698 -0.260 1.00 10.00 H new ATOM 0 H2' G A 12 -4.406 6.008 -1.944 1.00 10.00 H new ATOM 0 HO2' G A 12 -3.693 7.764 -3.624 1.00 10.00 H new ATOM 0 H1' G A 12 -1.877 5.178 -2.581 1.00 10.00 H new ATOM 0 H8 G A 12 -1.980 5.883 1.147 1.00 10.00 H new ATOM 0 H1 G A 12 -4.170 0.092 -0.606 1.00 10.00 H new ATOM 0 H21 G A 12 -3.843 1.329 -3.847 1.00 10.00 H new ATOM 0 H22 G A 12 -4.277 -0.030 -2.804 1.00 10.00 H new ATOM 389 P C A 13 -5.395 9.372 -1.237 1.00 10.00 P ATOM 390 OP1 C A 13 -5.794 10.624 -1.924 1.00 10.00 O ATOM 391 OP2 C A 13 -5.269 9.368 0.238 1.00 10.00 O ATOM 392 O5' C A 13 -6.418 8.228 -1.652 1.00 10.00 O ATOM 393 C5' C A 13 -7.060 8.254 -2.925 1.00 10.00 C ATOM 394 C4' C A 13 -7.581 6.882 -3.281 1.00 10.00 C ATOM 395 O4' C A 13 -6.715 5.873 -2.711 1.00 10.00 O ATOM 396 C3' C A 13 -8.945 6.526 -2.714 1.00 10.00 C ATOM 397 O3' C A 13 -9.992 7.097 -3.492 1.00 10.00 O ATOM 398 C2' C A 13 -8.934 5.002 -2.794 1.00 10.00 C ATOM 399 O2' C A 13 -9.319 4.551 -4.078 1.00 10.00 O ATOM 400 C1' C A 13 -7.456 4.677 -2.550 1.00 10.00 C ATOM 401 N1 C A 13 -7.190 4.124 -1.209 1.00 10.00 N ATOM 402 C2 C A 13 -7.474 2.776 -0.970 1.00 10.00 C ATOM 403 O2 C A 13 -7.932 2.086 -1.893 1.00 10.00 O ATOM 404 N3 C A 13 -7.227 2.251 0.254 1.00 10.00 N ATOM 405 C4 C A 13 -6.715 3.017 1.219 1.00 10.00 C ATOM 406 N4 C A 13 -6.501 2.464 2.416 1.00 10.00 N ATOM 407 C5 C A 13 -6.412 4.390 1.004 1.00 10.00 C ATOM 408 C6 C A 13 -6.668 4.899 -0.209 1.00 10.00 C ATOM 0 H5' C A 13 -6.357 8.592 -3.687 1.00 10.00 H new ATOM 0 H5'' C A 13 -7.882 8.969 -2.910 1.00 10.00 H new ATOM 0 H4' C A 13 -7.631 6.907 -4.370 1.00 10.00 H new ATOM 0 H3' C A 13 -9.121 6.903 -1.706 1.00 10.00 H new ATOM 0 H2' C A 13 -9.623 4.531 -2.093 1.00 10.00 H new ATOM 0 HO2' C A 13 -9.741 5.286 -4.570 1.00 10.00 H new ATOM 0 H1' C A 13 -7.163 3.910 -3.266 1.00 10.00 H new ATOM 0 H41 C A 13 -6.111 3.024 3.174 1.00 10.00 H new ATOM 0 H42 C A 13 -6.728 1.482 2.572 1.00 10.00 H new ATOM 0 H5 C A 13 -5.991 5.000 1.790 1.00 10.00 H new ATOM 0 H6 C A 13 -6.458 5.941 -0.401 1.00 10.00 H new ATOM 420 P C A 14 -11.328 7.637 -2.781 1.00 10.00 P ATOM 421 OP1 C A 14 -12.105 8.401 -3.787 1.00 10.00 O ATOM 422 OP2 C A 14 -10.937 8.304 -1.517 1.00 10.00 O ATOM 423 O5' C A 14 -12.139 6.314 -2.426 1.00 10.00 O ATOM 424 C5' C A 14 -12.964 5.691 -3.405 1.00 10.00 C ATOM 425 C4' C A 14 -13.144 4.225 -3.091 1.00 10.00 C ATOM 426 O4' C A 14 -11.957 3.732 -2.421 1.00 10.00 O ATOM 427 C3' C A 14 -14.275 3.906 -2.126 1.00 10.00 C ATOM 428 O3' C A 14 -15.513 3.729 -2.820 1.00 10.00 O ATOM 429 C2' C A 14 -13.835 2.600 -1.473 1.00 10.00 C ATOM 430 O2' C A 14 -14.332 1.502 -2.206 1.00 10.00 O ATOM 431 C1' C A 14 -12.306 2.654 -1.573 1.00 10.00 C ATOM 432 N1 C A 14 -11.642 2.849 -0.276 1.00 10.00 N ATOM 433 C2 C A 14 -11.261 1.723 0.459 1.00 10.00 C ATOM 434 O2 C A 14 -11.539 0.598 0.018 1.00 10.00 O ATOM 435 N3 C A 14 -10.628 1.885 1.644 1.00 10.00 N ATOM 436 C4 C A 14 -10.371 3.110 2.105 1.00 10.00 C ATOM 437 N4 C A 14 -9.749 3.217 3.286 1.00 10.00 N ATOM 438 C5 C A 14 -10.751 4.278 1.379 1.00 10.00 C ATOM 439 C6 C A 14 -11.378 4.102 0.206 1.00 10.00 C ATOM 0 H5' C A 14 -12.516 5.805 -4.392 1.00 10.00 H new ATOM 0 H5'' C A 14 -13.936 6.184 -3.437 1.00 10.00 H new ATOM 0 H4' C A 14 -13.355 3.767 -4.057 1.00 10.00 H new ATOM 0 H3' C A 14 -14.448 4.707 -1.407 1.00 10.00 H new ATOM 0 H2' C A 14 -14.195 2.486 -0.450 1.00 10.00 H new ATOM 0 HO2' C A 14 -14.982 1.818 -2.868 1.00 10.00 H new ATOM 0 HO3' C A 14 -16.223 3.523 -2.176 1.00 10.00 H new ATOM 0 H1' C A 14 -11.971 1.693 -1.963 1.00 10.00 H new ATOM 0 H41 C A 14 -9.537 4.138 3.669 1.00 10.00 H new ATOM 0 H42 C A 14 -9.488 2.377 3.803 1.00 10.00 H new ATOM 0 H5 C A 14 -10.542 5.267 1.759 1.00 10.00 H new ATOM 0 H6 C A 14 -11.680 4.965 -0.368 1.00 10.00 H new TER 452 C A 14