USER MOD reduce.3.24.130724 H: found=0, std=0, add=153, rem=0, adj=16 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 -19:sc= 0.375 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 G O2' : rot -7:sc= -1.4! USER MOD Single : A 3 C O2' : rot 1:sc= -0.808 USER MOD Single : A 4 C O2' : rot -18:sc= -1.53! USER MOD Single : A 5 U O2' : rot -16:sc= 0.388 USER MOD Single : A 6 G O2' : rot -129:sc= -6.38! USER MOD Single : A 7 A O2' : rot 144:sc= -6.15! USER MOD Single : A 8 U O2' : rot 141:sc= 0.738 USER MOD Single : A 9 A O2' : rot -79:sc= 0.628 USER MOD Single : A 10 G O2' : rot -73:sc= 0.789 USER MOD Single : A 11 G O2' : rot -13:sc= 0.379 USER MOD Single : A 12 G O2' : rot -11:sc= 0.135 USER MOD Single : A 13 U O2' : rot -2:sc= -1 USER MOD Single : A 14 C O2' : rot -15:sc= 0.202 USER MOD Single : A 14 C O3' : rot 180:sc= 0.196 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -4.534 -4.776 11.739 1.00 0.00 O ATOM 2 C5' G A 1 -4.469 -6.104 11.211 1.00 0.00 C ATOM 3 C4' G A 1 -3.041 -6.643 11.220 1.00 0.00 C ATOM 4 O4' G A 1 -2.934 -7.703 10.264 1.00 0.00 O ATOM 5 C3' G A 1 -1.981 -5.643 10.797 1.00 0.00 C ATOM 6 O3' G A 1 -1.467 -5.046 11.991 1.00 0.00 O ATOM 7 C2' G A 1 -0.881 -6.522 10.217 1.00 0.00 C ATOM 8 O2' G A 1 -0.050 -7.047 11.256 1.00 0.00 O ATOM 9 C1' G A 1 -1.686 -7.640 9.557 1.00 0.00 C ATOM 10 N9 G A 1 -1.964 -7.370 8.132 1.00 0.00 N ATOM 11 C8 G A 1 -2.750 -6.388 7.583 1.00 0.00 C ATOM 12 N7 G A 1 -2.797 -6.419 6.281 1.00 0.00 N ATOM 13 C5 G A 1 -1.986 -7.495 5.941 1.00 0.00 C ATOM 14 C6 G A 1 -1.654 -8.016 4.660 1.00 0.00 C ATOM 15 O6 G A 1 -2.021 -7.618 3.557 1.00 0.00 O ATOM 16 N1 G A 1 -0.809 -9.108 4.757 1.00 0.00 N ATOM 17 C2 G A 1 -0.335 -9.639 5.936 1.00 0.00 C ATOM 18 N2 G A 1 0.474 -10.695 5.843 1.00 0.00 N ATOM 19 N3 G A 1 -0.639 -9.158 7.144 1.00 0.00 N ATOM 20 C4 G A 1 -1.469 -8.087 7.067 1.00 0.00 C ATOM 0 H5' G A 1 -4.854 -6.110 10.191 1.00 0.00 H new ATOM 0 H5'' G A 1 -5.110 -6.761 11.798 1.00 0.00 H new ATOM 0 H4' G A 1 -2.865 -6.938 12.254 1.00 0.00 H new ATOM 0 H3' G A 1 -2.340 -4.876 10.111 1.00 0.00 H new ATOM 0 H2' G A 1 -0.209 -5.997 9.538 1.00 0.00 H new ATOM 0 HO2' G A 1 -0.159 -6.507 12.066 1.00 0.00 H new ATOM 0 HO5' G A 1 -5.462 -4.460 11.717 1.00 0.00 H new ATOM 0 H1' G A 1 -1.119 -8.570 9.600 1.00 0.00 H new ATOM 0 H8 G A 1 -3.281 -5.657 8.175 1.00 0.00 H new ATOM 0 H1 G A 1 -0.515 -9.554 3.888 1.00 0.00 H new ATOM 0 H21 G A 1 0.851 -11.124 6.688 1.00 0.00 H new ATOM 0 H22 G A 1 0.715 -11.073 4.927 1.00 0.00 H new ATOM 33 P G A 2 -0.763 -3.597 11.951 1.00 0.00 P ATOM 34 OP1 G A 2 -0.616 -3.116 13.342 1.00 0.00 O ATOM 35 OP2 G A 2 -1.473 -2.765 10.954 1.00 0.00 O ATOM 36 O5' G A 2 0.704 -3.938 11.379 1.00 0.00 O ATOM 37 C5' G A 2 1.273 -3.169 10.314 1.00 0.00 C ATOM 38 C4' G A 2 2.619 -3.733 9.875 1.00 0.00 C ATOM 39 O4' G A 2 2.449 -5.094 9.464 1.00 0.00 O ATOM 40 C3' G A 2 3.232 -3.053 8.663 1.00 0.00 C ATOM 41 O3' G A 2 4.099 -2.021 9.148 1.00 0.00 O ATOM 42 C2' G A 2 4.110 -4.143 8.072 1.00 0.00 C ATOM 43 O2' G A 2 5.349 -4.238 8.779 1.00 0.00 O ATOM 44 C1' G A 2 3.259 -5.387 8.312 1.00 0.00 C ATOM 45 N9 G A 2 2.372 -5.686 7.171 1.00 0.00 N ATOM 46 C8 G A 2 1.025 -5.451 7.046 1.00 0.00 C ATOM 47 N7 G A 2 0.531 -5.828 5.902 1.00 0.00 N ATOM 48 C5 G A 2 1.623 -6.349 5.219 1.00 0.00 C ATOM 49 C6 G A 2 1.696 -6.912 3.917 1.00 0.00 C ATOM 50 O6 G A 2 0.792 -7.064 3.102 1.00 0.00 O ATOM 51 N1 G A 2 2.985 -7.316 3.608 1.00 0.00 N ATOM 52 C2 G A 2 4.072 -7.196 4.443 1.00 0.00 C ATOM 53 N2 G A 2 5.241 -7.639 3.980 1.00 0.00 N ATOM 54 N3 G A 2 4.014 -6.669 5.668 1.00 0.00 N ATOM 55 C4 G A 2 2.759 -6.267 5.986 1.00 0.00 C ATOM 0 H5' G A 2 1.398 -2.135 10.637 1.00 0.00 H new ATOM 0 H5'' G A 2 0.588 -3.157 9.466 1.00 0.00 H new ATOM 0 H4' G A 2 3.268 -3.589 10.739 1.00 0.00 H new ATOM 0 H3' G A 2 2.504 -2.638 7.965 1.00 0.00 H new ATOM 0 H2' G A 2 4.380 -3.979 7.029 1.00 0.00 H new ATOM 0 HO2' G A 2 5.417 -3.500 9.421 1.00 0.00 H new ATOM 0 H1' G A 2 3.904 -6.255 8.450 1.00 0.00 H new ATOM 0 H8 G A 2 0.431 -4.996 7.824 1.00 0.00 H new ATOM 0 H1 G A 2 3.140 -7.735 2.691 1.00 0.00 H new ATOM 0 H21 G A 2 6.077 -7.573 4.560 1.00 0.00 H new ATOM 0 H22 G A 2 5.299 -8.044 3.046 1.00 0.00 H new ATOM 67 P C A 3 4.406 -0.721 8.249 1.00 0.00 P ATOM 68 OP1 C A 3 5.351 0.143 8.992 1.00 0.00 O ATOM 69 OP2 C A 3 3.117 -0.168 7.776 1.00 0.00 O ATOM 70 O5' C A 3 5.181 -1.343 6.980 1.00 0.00 O ATOM 71 C5' C A 3 6.491 -1.899 7.126 1.00 0.00 C ATOM 72 C4' C A 3 6.994 -2.503 5.819 1.00 0.00 C ATOM 73 O4' C A 3 6.245 -3.689 5.525 1.00 0.00 O ATOM 74 C3' C A 3 6.797 -1.628 4.594 1.00 0.00 C ATOM 75 O3' C A 3 7.991 -0.856 4.428 1.00 0.00 O ATOM 76 C2' C A 3 6.743 -2.639 3.459 1.00 0.00 C ATOM 77 O2' C A 3 8.061 -3.048 3.080 1.00 0.00 O ATOM 78 C1' C A 3 5.989 -3.796 4.111 1.00 0.00 C ATOM 79 N1 C A 3 4.529 -3.716 3.880 1.00 0.00 N ATOM 80 C2 C A 3 4.001 -4.459 2.831 1.00 0.00 C ATOM 81 O2 C A 3 4.736 -5.148 2.126 1.00 0.00 O ATOM 82 N3 C A 3 2.660 -4.404 2.603 1.00 0.00 N ATOM 83 C4 C A 3 1.865 -3.649 3.374 1.00 0.00 C ATOM 84 N4 C A 3 0.560 -3.647 3.108 1.00 0.00 N ATOM 85 C5 C A 3 2.401 -2.882 4.452 1.00 0.00 C ATOM 86 C6 C A 3 3.726 -2.942 4.669 1.00 0.00 C ATOM 0 H5' C A 3 6.477 -2.666 7.900 1.00 0.00 H new ATOM 0 H5'' C A 3 7.181 -1.123 7.458 1.00 0.00 H new ATOM 0 H4' C A 3 8.059 -2.660 5.987 1.00 0.00 H new ATOM 0 H3' C A 3 5.928 -0.971 4.646 1.00 0.00 H new ATOM 0 H2' C A 3 6.279 -2.259 2.549 1.00 0.00 H new ATOM 0 HO2' C A 3 8.720 -2.594 3.646 1.00 0.00 H new ATOM 0 H1' C A 3 6.325 -4.742 3.686 1.00 0.00 H new ATOM 0 H41 C A 3 -0.075 -3.084 3.674 1.00 0.00 H new ATOM 0 H42 C A 3 0.196 -4.208 2.338 1.00 0.00 H new ATOM 0 H5 C A 3 1.762 -2.273 5.074 1.00 0.00 H new ATOM 0 H6 C A 3 4.161 -2.372 5.476 1.00 0.00 H new ATOM 98 P C A 4 7.932 0.612 3.770 1.00 0.00 P ATOM 99 OP1 C A 4 9.255 1.252 3.946 1.00 0.00 O ATOM 100 OP2 C A 4 6.712 1.293 4.261 1.00 0.00 O ATOM 101 O5' C A 4 7.731 0.289 2.205 1.00 0.00 O ATOM 102 C5' C A 4 8.745 -0.405 1.470 1.00 0.00 C ATOM 103 C4' C A 4 8.324 -0.648 0.024 1.00 0.00 C ATOM 104 O4' C A 4 7.407 -1.750 -0.025 1.00 0.00 O ATOM 105 C3' C A 4 7.551 0.486 -0.622 1.00 0.00 C ATOM 106 O3' C A 4 8.504 1.355 -1.243 1.00 0.00 O ATOM 107 C2' C A 4 6.791 -0.227 -1.725 1.00 0.00 C ATOM 108 O2' C A 4 7.651 -0.520 -2.832 1.00 0.00 O ATOM 109 C1' C A 4 6.381 -1.508 -1.008 1.00 0.00 C ATOM 110 N1 C A 4 5.090 -1.346 -0.309 1.00 0.00 N ATOM 111 C2 C A 4 3.941 -1.781 -0.954 1.00 0.00 C ATOM 112 O2 C A 4 4.008 -2.295 -2.068 1.00 0.00 O ATOM 113 N3 C A 4 2.743 -1.619 -0.327 1.00 0.00 N ATOM 114 C4 C A 4 2.677 -1.049 0.885 1.00 0.00 C ATOM 115 N4 C A 4 1.476 -0.920 1.446 1.00 0.00 N ATOM 116 C5 C A 4 3.858 -0.597 1.550 1.00 0.00 C ATOM 117 C6 C A 4 5.032 -0.765 0.924 1.00 0.00 C ATOM 0 H5' C A 4 8.957 -1.359 1.953 1.00 0.00 H new ATOM 0 H5'' C A 4 9.669 0.173 1.488 1.00 0.00 H new ATOM 0 H4' C A 4 9.266 -0.798 -0.503 1.00 0.00 H new ATOM 0 H3' C A 4 6.922 1.055 0.063 1.00 0.00 H new ATOM 0 H2' C A 4 5.964 0.344 -2.147 1.00 0.00 H new ATOM 0 HO2' C A 4 8.455 0.038 -2.778 1.00 0.00 H new ATOM 0 H1' C A 4 6.270 -2.324 -1.722 1.00 0.00 H new ATOM 0 H41 C A 4 1.387 -0.491 2.367 1.00 0.00 H new ATOM 0 H42 C A 4 0.645 -1.250 0.954 1.00 0.00 H new ATOM 0 H5 C A 4 3.807 -0.135 2.525 1.00 0.00 H new ATOM 0 H6 C A 4 5.943 -0.436 1.402 1.00 0.00 H new ATOM 129 P U A 5 8.114 2.878 -1.596 1.00 0.00 P ATOM 130 OP1 U A 5 9.226 3.473 -2.372 1.00 0.00 O ATOM 131 OP2 U A 5 7.645 3.536 -0.358 1.00 0.00 O ATOM 132 O5' U A 5 6.851 2.698 -2.579 1.00 0.00 O ATOM 133 C5' U A 5 7.033 2.273 -3.935 1.00 0.00 C ATOM 134 C4' U A 5 5.757 2.419 -4.741 1.00 0.00 C ATOM 135 O4' U A 5 4.789 1.500 -4.243 1.00 0.00 O ATOM 136 C3' U A 5 5.093 3.779 -4.624 1.00 0.00 C ATOM 137 O3' U A 5 5.551 4.561 -5.732 1.00 0.00 O ATOM 138 C2' U A 5 3.621 3.474 -4.857 1.00 0.00 C ATOM 139 O2' U A 5 3.328 3.433 -6.256 1.00 0.00 O ATOM 140 C1' U A 5 3.480 2.082 -4.241 1.00 0.00 C ATOM 141 N1 U A 5 2.981 2.123 -2.847 1.00 0.00 N ATOM 142 C2 U A 5 1.609 2.168 -2.658 1.00 0.00 C ATOM 143 O2 U A 5 0.811 2.197 -3.591 1.00 0.00 O ATOM 144 N3 U A 5 1.183 2.180 -1.344 1.00 0.00 N ATOM 145 C4 U A 5 1.991 2.150 -0.225 1.00 0.00 C ATOM 146 O4 U A 5 1.487 2.150 0.897 1.00 0.00 O ATOM 147 C5 U A 5 3.407 2.107 -0.504 1.00 0.00 C ATOM 148 C6 U A 5 3.848 2.097 -1.785 1.00 0.00 C ATOM 0 H5' U A 5 7.357 1.232 -3.951 1.00 0.00 H new ATOM 0 H5'' U A 5 7.826 2.861 -4.398 1.00 0.00 H new ATOM 0 H4' U A 5 6.055 2.252 -5.776 1.00 0.00 H new ATOM 0 H3' U A 5 5.290 4.294 -3.684 1.00 0.00 H new ATOM 0 H2' U A 5 2.946 4.217 -4.432 1.00 0.00 H new ATOM 0 HO2' U A 5 4.056 3.858 -6.755 1.00 0.00 H new ATOM 0 H1' U A 5 2.757 1.508 -4.821 1.00 0.00 H new ATOM 0 H3 U A 5 0.176 2.214 -1.185 1.00 0.00 H new ATOM 0 H5 U A 5 4.116 2.083 0.310 1.00 0.00 H new ATOM 0 H6 U A 5 4.911 2.068 -1.975 1.00 0.00 H new ATOM 159 P G A 6 6.148 6.040 -5.503 1.00 0.00 P ATOM 160 OP1 G A 6 6.647 6.544 -6.802 1.00 0.00 O ATOM 161 OP2 G A 6 7.051 5.999 -4.330 1.00 0.00 O ATOM 162 O5' G A 6 4.837 6.883 -5.102 1.00 0.00 O ATOM 163 C5' G A 6 3.749 7.019 -6.022 1.00 0.00 C ATOM 164 C4' G A 6 2.414 7.121 -5.292 1.00 0.00 C ATOM 165 O4' G A 6 2.349 6.103 -4.302 1.00 0.00 O ATOM 166 C3' G A 6 2.210 8.401 -4.499 1.00 0.00 C ATOM 167 O3' G A 6 1.448 9.293 -5.320 1.00 0.00 O ATOM 168 C2' G A 6 1.321 7.985 -3.317 1.00 0.00 C ATOM 169 O2' G A 6 -0.021 8.402 -3.514 1.00 0.00 O ATOM 170 C1' G A 6 1.376 6.459 -3.325 1.00 0.00 C ATOM 171 N9 G A 6 1.785 5.928 -2.009 1.00 0.00 N ATOM 172 C8 G A 6 3.034 5.559 -1.583 1.00 0.00 C ATOM 173 N7 G A 6 3.071 5.174 -0.337 1.00 0.00 N ATOM 174 C5 G A 6 1.754 5.297 0.091 1.00 0.00 C ATOM 175 C6 G A 6 1.179 5.022 1.361 1.00 0.00 C ATOM 176 O6 G A 6 1.736 4.612 2.378 1.00 0.00 O ATOM 177 N1 G A 6 -0.183 5.279 1.373 1.00 0.00 N ATOM 178 C2 G A 6 -0.908 5.741 0.298 1.00 0.00 C ATOM 179 N2 G A 6 -2.215 5.933 0.484 1.00 0.00 N ATOM 180 N3 G A 6 -0.377 6.002 -0.898 1.00 0.00 N ATOM 181 C4 G A 6 0.955 5.756 -0.927 1.00 0.00 C ATOM 0 H5' G A 6 3.732 6.163 -6.697 1.00 0.00 H new ATOM 0 H5'' G A 6 3.899 7.907 -6.636 1.00 0.00 H new ATOM 0 H4' G A 6 1.669 7.057 -6.085 1.00 0.00 H new ATOM 0 H3' G A 6 3.144 8.870 -4.187 1.00 0.00 H new ATOM 0 H2' G A 6 1.660 8.430 -2.382 1.00 0.00 H new ATOM 0 HO2' G A 6 -0.333 8.885 -2.721 1.00 0.00 H new ATOM 0 H1' G A 6 0.393 6.044 -3.549 1.00 0.00 H new ATOM 0 H8 G A 6 3.906 5.584 -2.219 1.00 0.00 H new ATOM 0 H1 G A 6 -0.686 5.113 2.245 1.00 0.00 H new ATOM 0 H21 G A 6 -2.795 6.274 -0.283 1.00 0.00 H new ATOM 0 H22 G A 6 -2.635 5.738 1.393 1.00 0.00 H new ATOM 193 P A A 7 1.295 10.853 -4.927 1.00 0.00 P ATOM 194 OP1 A A 7 1.507 11.661 -6.149 1.00 0.00 O ATOM 195 OP2 A A 7 2.110 11.113 -3.719 1.00 0.00 O ATOM 196 O5' A A 7 -0.260 10.960 -4.517 1.00 0.00 O ATOM 197 C5' A A 7 -1.183 9.964 -4.960 1.00 0.00 C ATOM 198 C4' A A 7 -2.457 9.941 -4.146 1.00 0.00 C ATOM 199 O4' A A 7 -2.192 9.277 -2.896 1.00 0.00 O ATOM 200 C3' A A 7 -2.985 11.297 -3.733 1.00 0.00 C ATOM 201 O3' A A 7 -4.323 11.003 -3.321 1.00 0.00 O ATOM 202 C2' A A 7 -2.125 11.577 -2.508 1.00 0.00 C ATOM 203 O2' A A 7 -2.671 12.604 -1.701 1.00 0.00 O ATOM 204 C1' A A 7 -2.181 10.223 -1.818 1.00 0.00 C ATOM 205 N9 A A 7 -1.005 9.954 -0.963 1.00 0.00 N ATOM 206 C8 A A 7 0.318 10.204 -1.218 1.00 0.00 C ATOM 207 N7 A A 7 1.118 9.825 -0.261 1.00 0.00 N ATOM 208 C5 A A 7 0.262 9.289 0.693 1.00 0.00 C ATOM 209 C6 A A 7 0.486 8.711 1.953 1.00 0.00 C ATOM 210 N6 A A 7 1.696 8.566 2.493 1.00 0.00 N ATOM 211 N1 A A 7 -0.583 8.282 2.643 1.00 0.00 N ATOM 212 C2 A A 7 -1.791 8.418 2.111 1.00 0.00 C ATOM 213 N3 A A 7 -2.132 8.941 0.943 1.00 0.00 N ATOM 214 C4 A A 7 -1.036 9.363 0.278 1.00 0.00 C ATOM 0 H5' A A 7 -0.707 8.985 -4.908 1.00 0.00 H new ATOM 0 H5'' A A 7 -1.429 10.143 -6.007 1.00 0.00 H new ATOM 0 H4' A A 7 -3.186 9.456 -4.795 1.00 0.00 H new ATOM 0 H3' A A 7 -2.966 12.110 -4.459 1.00 0.00 H new ATOM 0 H2' A A 7 -1.119 11.932 -2.731 1.00 0.00 H new ATOM 0 HO2' A A 7 -2.514 12.396 -0.756 1.00 0.00 H new ATOM 0 H1' A A 7 -3.048 10.172 -1.159 1.00 0.00 H new ATOM 0 H8 A A 7 0.666 10.672 -2.127 1.00 0.00 H new ATOM 0 H61 A A 7 1.796 8.138 3.413 1.00 0.00 H new ATOM 0 H62 A A 7 2.522 8.883 1.986 1.00 0.00 H new ATOM 0 H2 A A 7 -2.609 8.052 2.714 1.00 0.00 H new ATOM 226 P U A 8 -5.431 12.083 -2.878 1.00 0.00 P ATOM 227 OP1 U A 8 -6.397 12.238 -3.988 1.00 0.00 O ATOM 228 OP2 U A 8 -4.779 13.274 -2.298 1.00 0.00 O ATOM 229 O5' U A 8 -6.146 11.253 -1.699 1.00 0.00 O ATOM 230 C5' U A 8 -6.106 9.814 -1.743 1.00 0.00 C ATOM 231 C4' U A 8 -5.623 9.196 -0.430 1.00 0.00 C ATOM 232 O4' U A 8 -4.526 9.955 0.092 1.00 0.00 O ATOM 233 C3' U A 8 -6.662 9.189 0.683 1.00 0.00 C ATOM 234 O3' U A 8 -6.337 8.105 1.566 1.00 0.00 O ATOM 235 C2' U A 8 -6.355 10.479 1.414 1.00 0.00 C ATOM 236 O2' U A 8 -6.859 10.458 2.751 1.00 0.00 O ATOM 237 C1' U A 8 -4.845 10.452 1.395 1.00 0.00 C ATOM 238 N1 U A 8 -4.259 11.792 1.547 1.00 0.00 N ATOM 239 C2 U A 8 -4.181 12.326 2.824 1.00 0.00 C ATOM 240 O2 U A 8 -4.560 11.717 3.822 1.00 0.00 O ATOM 241 N3 U A 8 -3.645 13.595 2.914 1.00 0.00 N ATOM 242 C4 U A 8 -3.190 14.363 1.859 1.00 0.00 C ATOM 243 O4 U A 8 -2.734 15.486 2.067 1.00 0.00 O ATOM 244 C5 U A 8 -3.303 13.736 0.564 1.00 0.00 C ATOM 245 C6 U A 8 -3.826 12.487 0.454 1.00 0.00 C ATOM 0 H5' U A 8 -5.448 9.498 -2.552 1.00 0.00 H new ATOM 0 H5'' U A 8 -7.101 9.434 -1.974 1.00 0.00 H new ATOM 0 H4' U A 8 -5.366 8.169 -0.692 1.00 0.00 H new ATOM 0 H3' U A 8 -7.693 9.095 0.343 1.00 0.00 H new ATOM 0 H2' U A 8 -6.802 11.369 0.971 1.00 0.00 H new ATOM 0 HO2' U A 8 -6.216 10.893 3.350 1.00 0.00 H new ATOM 0 H1' U A 8 -4.454 9.851 2.216 1.00 0.00 H new ATOM 0 H3 U A 8 -3.579 14.004 3.846 1.00 0.00 H new ATOM 0 H5 U A 8 -2.971 14.261 -0.320 1.00 0.00 H new ATOM 0 H6 U A 8 -3.901 12.032 -0.523 1.00 0.00 H new ATOM 256 P A A 9 -7.495 7.287 2.339 1.00 0.00 P ATOM 257 OP1 A A 9 -7.932 8.092 3.501 1.00 0.00 O ATOM 258 OP2 A A 9 -7.022 5.899 2.539 1.00 0.00 O ATOM 259 O5' A A 9 -8.692 7.267 1.260 1.00 0.00 O ATOM 260 C5' A A 9 -9.111 6.044 0.645 1.00 0.00 C ATOM 261 C4' A A 9 -9.607 6.283 -0.782 1.00 0.00 C ATOM 262 O4' A A 9 -8.950 7.451 -1.308 1.00 0.00 O ATOM 263 C3' A A 9 -9.276 5.172 -1.780 1.00 0.00 C ATOM 264 O3' A A 9 -10.454 4.372 -1.953 1.00 0.00 O ATOM 265 C2' A A 9 -9.051 5.939 -3.075 1.00 0.00 C ATOM 266 O2' A A 9 -10.295 6.330 -3.665 1.00 0.00 O ATOM 267 C1' A A 9 -8.304 7.148 -2.551 1.00 0.00 C ATOM 268 N9 A A 9 -6.879 6.854 -2.301 1.00 0.00 N ATOM 269 C8 A A 9 -6.284 6.408 -1.151 1.00 0.00 C ATOM 270 N7 A A 9 -4.997 6.223 -1.265 1.00 0.00 N ATOM 271 C5 A A 9 -4.726 6.578 -2.580 1.00 0.00 C ATOM 272 C6 A A 9 -3.543 6.609 -3.333 1.00 0.00 C ATOM 273 N6 A A 9 -2.350 6.268 -2.849 1.00 0.00 N ATOM 274 N1 A A 9 -3.625 7.012 -4.609 1.00 0.00 N ATOM 275 C2 A A 9 -4.808 7.362 -5.100 1.00 0.00 C ATOM 276 N3 A A 9 -5.987 7.376 -4.500 1.00 0.00 N ATOM 277 C4 A A 9 -5.867 6.966 -3.221 1.00 0.00 C ATOM 0 H5' A A 9 -9.905 5.590 1.237 1.00 0.00 H new ATOM 0 H5'' A A 9 -8.281 5.338 0.631 1.00 0.00 H new ATOM 0 H4' A A 9 -10.690 6.360 -0.690 1.00 0.00 H new ATOM 0 H3' A A 9 -8.440 4.540 -1.480 1.00 0.00 H new ATOM 0 H2' A A 9 -8.532 5.377 -3.852 1.00 0.00 H new ATOM 0 HO2' A A 9 -10.694 5.563 -4.127 1.00 0.00 H new ATOM 0 H1' A A 9 -8.326 7.967 -3.270 1.00 0.00 H new ATOM 0 H8 A A 9 -6.828 6.226 -0.236 1.00 0.00 H new ATOM 0 H61 A A 9 -1.525 6.312 -3.448 1.00 0.00 H new ATOM 0 H62 A A 9 -2.261 5.963 -1.880 1.00 0.00 H new ATOM 0 H2 A A 9 -4.808 7.679 -6.132 1.00 0.00 H new ATOM 289 P G A 10 -10.440 3.089 -2.936 1.00 0.00 P ATOM 290 OP1 G A 10 -11.824 2.583 -3.057 1.00 0.00 O ATOM 291 OP2 G A 10 -9.356 2.180 -2.501 1.00 0.00 O ATOM 292 O5' G A 10 -10.015 3.745 -4.347 1.00 0.00 O ATOM 293 C5' G A 10 -10.280 3.083 -5.589 1.00 0.00 C ATOM 294 C4' G A 10 -9.028 2.446 -6.188 1.00 0.00 C ATOM 295 O4' G A 10 -7.924 3.350 -6.064 1.00 0.00 O ATOM 296 C3' G A 10 -8.536 1.186 -5.500 1.00 0.00 C ATOM 297 O3' G A 10 -9.185 0.075 -6.128 1.00 0.00 O ATOM 298 C2' G A 10 -7.071 1.147 -5.905 1.00 0.00 C ATOM 299 O2' G A 10 -6.921 0.635 -7.233 1.00 0.00 O ATOM 300 C1' G A 10 -6.696 2.627 -5.857 1.00 0.00 C ATOM 301 N9 G A 10 -6.135 3.005 -4.547 1.00 0.00 N ATOM 302 C8 G A 10 -6.803 3.340 -3.401 1.00 0.00 C ATOM 303 N7 G A 10 -6.021 3.584 -2.388 1.00 0.00 N ATOM 304 C5 G A 10 -4.741 3.400 -2.901 1.00 0.00 C ATOM 305 C6 G A 10 -3.477 3.524 -2.264 1.00 0.00 C ATOM 306 O6 G A 10 -3.237 3.825 -1.098 1.00 0.00 O ATOM 307 N1 G A 10 -2.435 3.252 -3.137 1.00 0.00 N ATOM 308 C2 G A 10 -2.586 2.904 -4.461 1.00 0.00 C ATOM 309 N2 G A 10 -1.472 2.679 -5.158 1.00 0.00 N ATOM 310 N3 G A 10 -3.768 2.782 -5.067 1.00 0.00 N ATOM 311 C4 G A 10 -4.799 3.044 -4.227 1.00 0.00 C ATOM 0 H5' G A 10 -10.695 3.799 -6.298 1.00 0.00 H new ATOM 0 H5'' G A 10 -11.037 2.314 -5.433 1.00 0.00 H new ATOM 0 H4' G A 10 -9.329 2.207 -7.208 1.00 0.00 H new ATOM 0 H3' G A 10 -8.709 1.159 -4.424 1.00 0.00 H new ATOM 0 H2' G A 10 -6.455 0.508 -5.272 1.00 0.00 H new ATOM 0 HO2' G A 10 -7.090 -0.330 -7.232 1.00 0.00 H new ATOM 0 H1' G A 10 -5.939 2.849 -6.609 1.00 0.00 H new ATOM 0 H8 G A 10 -7.880 3.397 -3.342 1.00 0.00 H new ATOM 0 H1 G A 10 -1.485 3.314 -2.771 1.00 0.00 H new ATOM 0 H21 G A 10 -1.530 2.418 -6.142 1.00 0.00 H new ATOM 0 H22 G A 10 -0.562 2.768 -4.707 1.00 0.00 H new ATOM 323 P G A 11 -8.989 -1.420 -5.558 1.00 0.00 P ATOM 324 OP1 G A 11 -10.014 -2.288 -6.178 1.00 0.00 O ATOM 325 OP2 G A 11 -8.880 -1.346 -4.084 1.00 0.00 O ATOM 326 O5' G A 11 -7.550 -1.838 -6.155 1.00 0.00 O ATOM 327 C5' G A 11 -6.428 -2.055 -5.291 1.00 0.00 C ATOM 328 C4' G A 11 -5.112 -1.718 -5.989 1.00 0.00 C ATOM 329 O4' G A 11 -4.637 -0.451 -5.517 1.00 0.00 O ATOM 330 C3' G A 11 -3.973 -2.678 -5.696 1.00 0.00 C ATOM 331 O3' G A 11 -3.972 -3.655 -6.745 1.00 0.00 O ATOM 332 C2' G A 11 -2.734 -1.815 -5.879 1.00 0.00 C ATOM 333 O2' G A 11 -2.386 -1.711 -7.262 1.00 0.00 O ATOM 334 C1' G A 11 -3.209 -0.463 -5.344 1.00 0.00 C ATOM 335 N9 G A 11 -2.907 -0.279 -3.908 1.00 0.00 N ATOM 336 C8 G A 11 -3.755 0.103 -2.899 1.00 0.00 C ATOM 337 N7 G A 11 -3.178 0.194 -1.736 1.00 0.00 N ATOM 338 C5 G A 11 -1.855 -0.152 -1.986 1.00 0.00 C ATOM 339 C6 G A 11 -0.751 -0.231 -1.094 1.00 0.00 C ATOM 340 O6 G A 11 -0.731 -0.002 0.112 1.00 0.00 O ATOM 341 N1 G A 11 0.407 -0.617 -1.748 1.00 0.00 N ATOM 342 C2 G A 11 0.499 -0.896 -3.092 1.00 0.00 C ATOM 343 N2 G A 11 1.695 -1.264 -3.551 1.00 0.00 N ATOM 344 N3 G A 11 -0.531 -0.824 -3.940 1.00 0.00 N ATOM 345 C4 G A 11 -1.675 -0.446 -3.316 1.00 0.00 C ATOM 0 H5' G A 11 -6.413 -3.095 -4.966 1.00 0.00 H new ATOM 0 H5'' G A 11 -6.533 -1.443 -4.395 1.00 0.00 H new ATOM 0 H4' G A 11 -5.351 -1.752 -7.052 1.00 0.00 H new ATOM 0 H3' G A 11 -4.034 -3.161 -4.721 1.00 0.00 H new ATOM 0 H2' G A 11 -1.848 -2.206 -5.379 1.00 0.00 H new ATOM 0 HO2' G A 11 -2.881 -2.383 -7.775 1.00 0.00 H new ATOM 0 H1' G A 11 -2.699 0.338 -5.879 1.00 0.00 H new ATOM 0 H8 G A 11 -4.804 0.309 -3.055 1.00 0.00 H new ATOM 0 H1 G A 11 1.257 -0.701 -1.190 1.00 0.00 H new ATOM 0 H21 G A 11 1.817 -1.482 -4.540 1.00 0.00 H new ATOM 0 H22 G A 11 2.488 -1.328 -2.913 1.00 0.00 H new ATOM 357 P G A 12 -4.077 -5.227 -6.409 1.00 0.00 P ATOM 358 OP1 G A 12 -4.401 -5.946 -7.660 1.00 0.00 O ATOM 359 OP2 G A 12 -4.943 -5.391 -5.218 1.00 0.00 O ATOM 360 O5' G A 12 -2.567 -5.594 -5.984 1.00 0.00 O ATOM 361 C5' G A 12 -1.721 -6.349 -6.861 1.00 0.00 C ATOM 362 C4' G A 12 -0.251 -6.016 -6.649 1.00 0.00 C ATOM 363 O4' G A 12 -0.148 -4.702 -6.096 1.00 0.00 O ATOM 364 C3' G A 12 0.458 -6.911 -5.646 1.00 0.00 C ATOM 365 O3' G A 12 1.111 -7.941 -6.394 1.00 0.00 O ATOM 366 C2' G A 12 1.540 -6.010 -5.075 1.00 0.00 C ATOM 367 O2' G A 12 2.684 -5.980 -5.935 1.00 0.00 O ATOM 368 C1' G A 12 0.845 -4.651 -5.064 1.00 0.00 C ATOM 369 N9 G A 12 0.173 -4.370 -3.778 1.00 0.00 N ATOM 370 C8 G A 12 -1.145 -4.063 -3.551 1.00 0.00 C ATOM 371 N7 G A 12 -1.426 -3.851 -2.297 1.00 0.00 N ATOM 372 C5 G A 12 -0.213 -4.031 -1.645 1.00 0.00 C ATOM 373 C6 G A 12 0.100 -3.931 -0.263 1.00 0.00 C ATOM 374 O6 G A 12 -0.650 -3.656 0.668 1.00 0.00 O ATOM 375 N1 G A 12 1.439 -4.188 -0.024 1.00 0.00 N ATOM 376 C2 G A 12 2.368 -4.503 -0.989 1.00 0.00 C ATOM 377 N2 G A 12 3.617 -4.724 -0.578 1.00 0.00 N ATOM 378 N3 G A 12 2.086 -4.601 -2.291 1.00 0.00 N ATOM 379 C4 G A 12 0.778 -4.351 -2.543 1.00 0.00 C ATOM 0 H5' G A 12 -1.995 -6.145 -7.896 1.00 0.00 H new ATOM 0 H5'' G A 12 -1.881 -7.414 -6.693 1.00 0.00 H new ATOM 0 H4' G A 12 0.210 -6.137 -7.629 1.00 0.00 H new ATOM 0 H3' G A 12 -0.199 -7.343 -4.891 1.00 0.00 H new ATOM 0 H2' G A 12 1.910 -6.330 -4.101 1.00 0.00 H new ATOM 0 HO2' G A 12 2.600 -6.681 -6.615 1.00 0.00 H new ATOM 0 H1' G A 12 1.585 -3.865 -5.217 1.00 0.00 H new ATOM 0 H8 G A 12 -1.881 -4.003 -4.339 1.00 0.00 H new ATOM 0 H1 G A 12 1.762 -4.140 0.942 1.00 0.00 H new ATOM 0 H21 G A 12 4.342 -4.961 -1.255 1.00 0.00 H new ATOM 0 H22 G A 12 3.847 -4.656 0.413 1.00 0.00 H new ATOM 391 P U A 13 1.072 -9.472 -5.893 1.00 0.00 P ATOM 392 OP1 U A 13 1.434 -10.342 -7.034 1.00 0.00 O ATOM 393 OP2 U A 13 -0.201 -9.695 -5.172 1.00 0.00 O ATOM 394 O5' U A 13 2.273 -9.522 -4.821 1.00 0.00 O ATOM 395 C5' U A 13 3.605 -9.163 -5.198 1.00 0.00 C ATOM 396 C4' U A 13 4.489 -8.934 -3.978 1.00 0.00 C ATOM 397 O4' U A 13 4.067 -7.740 -3.310 1.00 0.00 O ATOM 398 C3' U A 13 4.397 -10.013 -2.914 1.00 0.00 C ATOM 399 O3' U A 13 5.454 -10.946 -3.166 1.00 0.00 O ATOM 400 C2' U A 13 4.745 -9.270 -1.633 1.00 0.00 C ATOM 401 O2' U A 13 6.162 -9.147 -1.484 1.00 0.00 O ATOM 402 C1' U A 13 4.112 -7.902 -1.881 1.00 0.00 C ATOM 403 N1 U A 13 2.735 -7.811 -1.344 1.00 0.00 N ATOM 404 C2 U A 13 2.589 -7.508 -0.001 1.00 0.00 C ATOM 405 O2 U A 13 3.550 -7.335 0.748 1.00 0.00 O ATOM 406 N3 U A 13 1.293 -7.413 0.459 1.00 0.00 N ATOM 407 C4 U A 13 0.146 -7.592 -0.288 1.00 0.00 C ATOM 408 O4 U A 13 -0.958 -7.476 0.240 1.00 0.00 O ATOM 409 C5 U A 13 0.377 -7.909 -1.678 1.00 0.00 C ATOM 410 C6 U A 13 1.643 -8.007 -2.153 1.00 0.00 C ATOM 0 H5' U A 13 3.581 -8.259 -5.806 1.00 0.00 H new ATOM 0 H5'' U A 13 4.034 -9.951 -5.817 1.00 0.00 H new ATOM 0 H4' U A 13 5.503 -8.905 -4.376 1.00 0.00 H new ATOM 0 H3' U A 13 3.436 -10.526 -2.882 1.00 0.00 H new ATOM 0 H2' U A 13 4.395 -9.766 -0.728 1.00 0.00 H new ATOM 0 HO2' U A 13 6.610 -9.594 -2.232 1.00 0.00 H new ATOM 0 H1' U A 13 4.697 -7.130 -1.380 1.00 0.00 H new ATOM 0 H3 U A 13 1.170 -7.189 1.446 1.00 0.00 H new ATOM 0 H5 U A 13 -0.461 -8.068 -2.341 1.00 0.00 H new ATOM 0 H6 U A 13 1.797 -8.245 -3.195 1.00 0.00 H new ATOM 421 P C A 14 5.311 -12.487 -2.725 1.00 0.00 P ATOM 422 OP1 C A 14 6.523 -13.211 -3.171 1.00 0.00 O ATOM 423 OP2 C A 14 3.973 -12.967 -3.137 1.00 0.00 O ATOM 424 O5' C A 14 5.340 -12.397 -1.116 1.00 0.00 O ATOM 425 C5' C A 14 6.541 -12.036 -0.426 1.00 0.00 C ATOM 426 C4' C A 14 6.313 -11.928 1.079 1.00 0.00 C ATOM 427 O4' C A 14 5.498 -10.789 1.350 1.00 0.00 O ATOM 428 C3' C A 14 5.543 -13.086 1.691 1.00 0.00 C ATOM 429 O3' C A 14 6.427 -14.164 2.015 1.00 0.00 O ATOM 430 C2' C A 14 4.983 -12.452 2.959 1.00 0.00 C ATOM 431 O2' C A 14 5.960 -12.467 4.002 1.00 0.00 O ATOM 432 C1' C A 14 4.696 -11.014 2.518 1.00 0.00 C ATOM 433 N1 C A 14 3.272 -10.807 2.173 1.00 0.00 N ATOM 434 C2 C A 14 2.436 -10.302 3.159 1.00 0.00 C ATOM 435 O2 C A 14 2.879 -10.043 4.277 1.00 0.00 O ATOM 436 N3 C A 14 1.122 -10.105 2.864 1.00 0.00 N ATOM 437 C4 C A 14 0.644 -10.393 1.647 1.00 0.00 C ATOM 438 N4 C A 14 -0.652 -10.179 1.423 1.00 0.00 N ATOM 439 C5 C A 14 1.497 -10.915 0.626 1.00 0.00 C ATOM 440 C6 C A 14 2.795 -11.105 0.927 1.00 0.00 C ATOM 0 H5' C A 14 6.909 -11.084 -0.808 1.00 0.00 H new ATOM 0 H5'' C A 14 7.313 -12.779 -0.625 1.00 0.00 H new ATOM 0 H4' C A 14 7.316 -11.891 1.504 1.00 0.00 H new ATOM 0 H3' C A 14 4.784 -13.512 1.034 1.00 0.00 H new ATOM 0 H2' C A 14 4.109 -12.971 3.354 1.00 0.00 H new ATOM 0 HO2' C A 14 6.686 -13.079 3.761 1.00 0.00 H new ATOM 0 HO3' C A 14 5.914 -14.900 2.410 1.00 0.00 H new ATOM 0 H1' C A 14 4.927 -10.326 3.331 1.00 0.00 H new ATOM 0 H41 C A 14 -1.052 -10.386 0.508 1.00 0.00 H new ATOM 0 H42 C A 14 -1.244 -9.808 2.166 1.00 0.00 H new ATOM 0 H5 C A 14 1.112 -11.149 -0.356 1.00 0.00 H new ATOM 0 H6 C A 14 3.466 -11.497 0.177 1.00 0.00 H new TER 453 C A 14