USER MOD reduce.3.24.130724 H: found=0, std=0, add=163, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 163 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 G O2' : rot -17:sc= 0.0988 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 A O2' : rot -16:sc= -0.413 USER MOD Single : A 3 G O2' : rot -17:sc= 0.0715 USER MOD Single : A 4 A O2' : rot 180:sc= -2.12! USER MOD Single : A 5 G O2' : rot -72:sc= 1.09 USER MOD Single : A 6 U O2' : rot -155:sc= -2.39! USER MOD Single : A 7 U O2' : rot 43:sc= -0.359 USER MOD Single : A 8 G O2' : rot 12:sc= 0.216 USER MOD Single : A 9 G O2' : rot 21:sc= 0.203 USER MOD Single : A 10 G O2' : rot 139:sc= -3.12! USER MOD Single : A 11 C O2' : rot -129:sc= 1.18 USER MOD Single : A 12 U O2' : rot -172:sc= -3.48! USER MOD Single : A 13 C O2' : rot 180:sc= -1.16 USER MOD Single : A 14 U O2' : rot 180:sc= 0 USER MOD Single : A 15 C O2' : rot -21:sc= 0.125 USER MOD Single : A 15 C O3' : rot 180:sc= 0.137 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -4.723 -9.114 -8.494 1.00 0.00 O ATOM 2 C5' G A 1 -4.230 -8.569 -7.267 1.00 0.00 C ATOM 3 C4' G A 1 -5.014 -9.103 -6.092 1.00 0.00 C ATOM 4 O4' G A 1 -4.154 -9.990 -5.329 1.00 0.00 O ATOM 5 C3' G A 1 -5.491 -8.052 -5.097 1.00 0.00 C ATOM 6 O3' G A 1 -6.781 -7.563 -5.450 1.00 0.00 O ATOM 7 C2' G A 1 -5.500 -8.807 -3.773 1.00 0.00 C ATOM 8 O2' G A 1 -6.667 -9.595 -3.643 1.00 0.00 O ATOM 9 C1' G A 1 -4.303 -9.740 -3.944 1.00 0.00 C ATOM 10 N9 G A 1 -3.040 -9.205 -3.444 1.00 0.00 N ATOM 11 C8 G A 1 -2.518 -7.950 -3.644 1.00 0.00 C ATOM 12 N7 G A 1 -1.336 -7.795 -3.113 1.00 0.00 N ATOM 13 C5 G A 1 -1.075 -9.012 -2.499 1.00 0.00 C ATOM 14 C6 G A 1 0.052 -9.445 -1.750 1.00 0.00 C ATOM 15 O6 G A 1 1.086 -8.824 -1.482 1.00 0.00 O ATOM 16 N1 G A 1 -0.105 -10.751 -1.301 1.00 0.00 N ATOM 17 C2 G A 1 -1.199 -11.539 -1.543 1.00 0.00 C ATOM 18 N2 G A 1 -1.163 -12.767 -1.026 1.00 0.00 N ATOM 19 N3 G A 1 -2.251 -11.154 -2.241 1.00 0.00 N ATOM 20 C4 G A 1 -2.123 -9.887 -2.684 1.00 0.00 C ATOM 0 H5' G A 1 -4.299 -7.482 -7.293 1.00 0.00 H new ATOM 0 H5'' G A 1 -3.175 -8.819 -7.150 1.00 0.00 H new ATOM 0 H4' G A 1 -5.891 -9.578 -6.532 1.00 0.00 H new ATOM 0 H3' G A 1 -4.859 -7.164 -5.063 1.00 0.00 H new ATOM 0 H2' G A 1 -5.465 -8.149 -2.904 1.00 0.00 H new ATOM 0 HO2' G A 1 -7.340 -9.292 -4.288 1.00 0.00 H new ATOM 0 HO5' G A 1 -4.204 -8.755 -9.243 1.00 0.00 H new ATOM 0 H1' G A 1 -4.512 -10.635 -3.358 1.00 0.00 H new ATOM 0 H8 G A 1 -3.034 -7.171 -4.186 1.00 0.00 H new ATOM 0 H1 G A 1 0.652 -11.153 -0.749 1.00 0.00 H new ATOM 0 H21 G A 1 -1.947 -13.404 -1.170 1.00 0.00 H new ATOM 0 H22 G A 1 -0.352 -13.070 -0.487 1.00 0.00 H new ATOM 33 P A A 2 -7.243 -6.102 -4.964 1.00 0.00 P ATOM 34 OP1 A A 2 -8.644 -5.912 -5.419 1.00 0.00 O ATOM 35 OP2 A A 2 -6.201 -5.123 -5.367 1.00 0.00 O ATOM 36 O5' A A 2 -7.251 -6.212 -3.374 1.00 0.00 O ATOM 37 C5' A A 2 -6.093 -5.892 -2.612 1.00 0.00 C ATOM 38 C4' A A 2 -6.117 -6.631 -1.296 1.00 0.00 C ATOM 39 O4' A A 2 -5.078 -7.652 -1.295 1.00 0.00 O ATOM 40 C3' A A 2 -5.809 -5.765 -0.087 1.00 0.00 C ATOM 41 O3' A A 2 -6.990 -5.139 0.407 1.00 0.00 O ATOM 42 C2' A A 2 -5.218 -6.767 0.896 1.00 0.00 C ATOM 43 O2' A A 2 -6.229 -7.555 1.498 1.00 0.00 O ATOM 44 C1' A A 2 -4.405 -7.647 -0.047 1.00 0.00 C ATOM 45 N9 A A 2 -3.046 -7.156 -0.260 1.00 0.00 N ATOM 46 C8 A A 2 -2.642 -6.217 -1.173 1.00 0.00 C ATOM 47 N7 A A 2 -1.358 -5.961 -1.134 1.00 0.00 N ATOM 48 C5 A A 2 -0.883 -6.794 -0.131 1.00 0.00 C ATOM 49 C6 A A 2 0.403 -7.002 0.392 1.00 0.00 C ATOM 50 N6 A A 2 1.486 -6.354 -0.036 1.00 0.00 N ATOM 51 N1 A A 2 0.537 -7.908 1.385 1.00 0.00 N ATOM 52 C2 A A 2 -0.555 -8.552 1.817 1.00 0.00 C ATOM 53 N3 A A 2 -1.816 -8.441 1.405 1.00 0.00 N ATOM 54 C4 A A 2 -1.912 -7.535 0.416 1.00 0.00 C ATOM 0 H5' A A 2 -6.051 -4.817 -2.434 1.00 0.00 H new ATOM 0 H5'' A A 2 -5.196 -6.158 -3.171 1.00 0.00 H new ATOM 0 H4' A A 2 -7.131 -7.022 -1.214 1.00 0.00 H new ATOM 0 H3' A A 2 -5.132 -4.936 -0.293 1.00 0.00 H new ATOM 0 H2' A A 2 -4.664 -6.304 1.713 1.00 0.00 H new ATOM 0 HO2' A A 2 -7.101 -7.130 1.360 1.00 0.00 H new ATOM 0 H1' A A 2 -4.321 -8.639 0.397 1.00 0.00 H new ATOM 0 H8 A A 2 -3.320 -5.733 -1.861 1.00 0.00 H new ATOM 0 H61 A A 2 2.395 -6.548 0.383 1.00 0.00 H new ATOM 0 H62 A A 2 1.405 -5.664 -0.783 1.00 0.00 H new ATOM 0 H2 A A 2 -0.389 -9.263 2.613 1.00 0.00 H new ATOM 66 P G A 3 -6.956 -3.595 0.856 1.00 0.00 P ATOM 67 OP1 G A 3 -8.212 -2.970 0.367 1.00 0.00 O ATOM 68 OP2 G A 3 -5.649 -3.004 0.472 1.00 0.00 O ATOM 69 O5' G A 3 -7.030 -3.657 2.447 1.00 0.00 O ATOM 70 C5' G A 3 -6.782 -4.874 3.151 1.00 0.00 C ATOM 71 C4' G A 3 -5.998 -4.599 4.413 1.00 0.00 C ATOM 72 O4' G A 3 -4.771 -5.385 4.388 1.00 0.00 O ATOM 73 C3' G A 3 -5.539 -3.158 4.586 1.00 0.00 C ATOM 74 O3' G A 3 -6.531 -2.370 5.242 1.00 0.00 O ATOM 75 C2' G A 3 -4.269 -3.315 5.411 1.00 0.00 C ATOM 76 O2' G A 3 -4.570 -3.565 6.769 1.00 0.00 O ATOM 77 C1' G A 3 -3.678 -4.578 4.792 1.00 0.00 C ATOM 78 N9 G A 3 -2.837 -4.328 3.625 1.00 0.00 N ATOM 79 C8 G A 3 -3.257 -3.932 2.383 1.00 0.00 C ATOM 80 N7 G A 3 -2.283 -3.799 1.526 1.00 0.00 N ATOM 81 C5 G A 3 -1.144 -4.123 2.250 1.00 0.00 C ATOM 82 C6 G A 3 0.218 -4.154 1.855 1.00 0.00 C ATOM 83 O6 G A 3 0.707 -3.895 0.750 1.00 0.00 O ATOM 84 N1 G A 3 1.047 -4.534 2.905 1.00 0.00 N ATOM 85 C2 G A 3 0.621 -4.841 4.172 1.00 0.00 C ATOM 86 N2 G A 3 1.574 -5.185 5.047 1.00 0.00 N ATOM 87 N3 G A 3 -0.645 -4.815 4.556 1.00 0.00 N ATOM 88 C4 G A 3 -1.468 -4.449 3.550 1.00 0.00 C ATOM 0 H5' G A 3 -6.229 -5.564 2.514 1.00 0.00 H new ATOM 0 H5'' G A 3 -7.727 -5.357 3.400 1.00 0.00 H new ATOM 0 H4' G A 3 -6.683 -4.846 5.224 1.00 0.00 H new ATOM 0 H3' G A 3 -5.367 -2.632 3.647 1.00 0.00 H new ATOM 0 H2' G A 3 -3.625 -2.435 5.398 1.00 0.00 H new ATOM 0 HO2' G A 3 -5.500 -3.314 6.949 1.00 0.00 H new ATOM 0 H1' G A 3 -3.038 -5.050 5.537 1.00 0.00 H new ATOM 0 H8 G A 3 -4.293 -3.748 2.138 1.00 0.00 H new ATOM 0 H1 G A 3 2.048 -4.589 2.719 1.00 0.00 H new ATOM 0 H21 G A 3 1.323 -5.425 6.006 1.00 0.00 H new ATOM 0 H22 G A 3 2.551 -5.207 4.755 1.00 0.00 H new ATOM 100 P A A 4 -6.796 -0.857 4.762 1.00 0.00 P ATOM 101 OP1 A A 4 -7.947 -0.323 5.537 1.00 0.00 O ATOM 102 OP2 A A 4 -6.850 -0.856 3.277 1.00 0.00 O ATOM 103 O5' A A 4 -5.483 -0.082 5.221 1.00 0.00 O ATOM 104 C5' A A 4 -4.286 -0.151 4.451 1.00 0.00 C ATOM 105 C4' A A 4 -3.096 -0.318 5.365 1.00 0.00 C ATOM 106 O4' A A 4 -2.290 -1.421 4.874 1.00 0.00 O ATOM 107 C3' A A 4 -2.152 0.875 5.444 1.00 0.00 C ATOM 108 O3' A A 4 -2.552 1.756 6.492 1.00 0.00 O ATOM 109 C2' A A 4 -0.794 0.228 5.706 1.00 0.00 C ATOM 110 O2' A A 4 -0.621 -0.075 7.078 1.00 0.00 O ATOM 111 C1' A A 4 -0.919 -1.087 4.936 1.00 0.00 C ATOM 112 N9 A A 4 -0.408 -1.050 3.566 1.00 0.00 N ATOM 113 C8 A A 4 -1.157 -1.013 2.419 1.00 0.00 C ATOM 114 N7 A A 4 -0.445 -1.024 1.320 1.00 0.00 N ATOM 115 C5 A A 4 0.865 -1.064 1.773 1.00 0.00 C ATOM 116 C6 A A 4 2.094 -1.097 1.098 1.00 0.00 C ATOM 117 N6 A A 4 2.201 -1.102 -0.232 1.00 0.00 N ATOM 118 N1 A A 4 3.220 -1.127 1.842 1.00 0.00 N ATOM 119 C2 A A 4 3.104 -1.122 3.177 1.00 0.00 C ATOM 120 N3 A A 4 2.004 -1.097 3.928 1.00 0.00 N ATOM 121 C4 A A 4 0.905 -1.069 3.155 1.00 0.00 C ATOM 0 H5' A A 4 -4.174 0.755 3.855 1.00 0.00 H new ATOM 0 H5'' A A 4 -4.340 -0.987 3.753 1.00 0.00 H new ATOM 0 H4' A A 4 -3.526 -0.467 6.356 1.00 0.00 H new ATOM 0 H3' A A 4 -2.141 1.494 4.547 1.00 0.00 H new ATOM 0 H2' A A 4 0.040 0.867 5.417 1.00 0.00 H new ATOM 0 HO2' A A 4 0.257 -0.489 7.213 1.00 0.00 H new ATOM 0 H1' A A 4 -0.312 -1.817 5.472 1.00 0.00 H new ATOM 0 H8 A A 4 -2.236 -0.978 2.421 1.00 0.00 H new ATOM 0 H61 A A 4 3.122 -1.127 -0.669 1.00 0.00 H new ATOM 0 H62 A A 4 1.362 -1.081 -0.811 1.00 0.00 H new ATOM 0 H2 A A 4 4.036 -1.141 3.722 1.00 0.00 H new ATOM 133 P G A 5 -2.234 3.330 6.386 1.00 0.00 P ATOM 134 OP1 G A 5 -2.949 4.024 7.489 1.00 0.00 O ATOM 135 OP2 G A 5 -2.471 3.748 4.981 1.00 0.00 O ATOM 136 O5' G A 5 -0.671 3.424 6.671 1.00 0.00 O ATOM 137 C5' G A 5 -0.105 2.873 7.858 1.00 0.00 C ATOM 138 C4' G A 5 1.374 3.164 7.908 1.00 0.00 C ATOM 139 O4' G A 5 2.071 2.148 7.135 1.00 0.00 O ATOM 140 C3' G A 5 1.782 4.498 7.296 1.00 0.00 C ATOM 141 O3' G A 5 1.802 5.518 8.293 1.00 0.00 O ATOM 142 C2' G A 5 3.162 4.206 6.713 1.00 0.00 C ATOM 143 O2' G A 5 4.166 4.237 7.711 1.00 0.00 O ATOM 144 C1' G A 5 2.993 2.761 6.254 1.00 0.00 C ATOM 145 N9 G A 5 2.492 2.602 4.892 1.00 0.00 N ATOM 146 C8 G A 5 1.180 2.577 4.483 1.00 0.00 C ATOM 147 N7 G A 5 1.043 2.340 3.211 1.00 0.00 N ATOM 148 C5 G A 5 2.343 2.233 2.740 1.00 0.00 C ATOM 149 C6 G A 5 2.823 1.986 1.436 1.00 0.00 C ATOM 150 O6 G A 5 2.181 1.767 0.412 1.00 0.00 O ATOM 151 N1 G A 5 4.208 1.992 1.391 1.00 0.00 N ATOM 152 C2 G A 5 5.032 2.176 2.473 1.00 0.00 C ATOM 153 N2 G A 5 6.346 2.133 2.230 1.00 0.00 N ATOM 154 N3 G A 5 4.597 2.390 3.703 1.00 0.00 N ATOM 155 C4 G A 5 3.250 2.410 3.762 1.00 0.00 C ATOM 0 H5' G A 5 -0.273 1.796 7.885 1.00 0.00 H new ATOM 0 H5'' G A 5 -0.597 3.295 8.735 1.00 0.00 H new ATOM 0 H4' G A 5 1.630 3.181 8.967 1.00 0.00 H new ATOM 0 H3' G A 5 1.095 4.870 6.536 1.00 0.00 H new ATOM 0 H2' G A 5 3.460 4.922 5.947 1.00 0.00 H new ATOM 0 HO2' G A 5 4.323 5.164 7.988 1.00 0.00 H new ATOM 0 H1' G A 5 3.984 2.307 6.265 1.00 0.00 H new ATOM 0 H8 G A 5 0.346 2.738 5.151 1.00 0.00 H new ATOM 0 H1 G A 5 4.650 1.848 0.483 1.00 0.00 H new ATOM 0 H21 G A 5 7.010 2.263 2.993 1.00 0.00 H new ATOM 0 H22 G A 5 6.684 1.970 1.281 1.00 0.00 H new ATOM 167 P U A 6 2.400 6.970 7.947 1.00 0.00 P ATOM 168 OP1 U A 6 3.875 6.917 8.115 1.00 0.00 O ATOM 169 OP2 U A 6 1.612 7.968 8.713 1.00 0.00 O ATOM 170 O5' U A 6 2.076 7.166 6.401 1.00 0.00 O ATOM 171 C5' U A 6 0.732 7.318 5.951 1.00 0.00 C ATOM 172 C4' U A 6 0.715 7.765 4.512 1.00 0.00 C ATOM 173 O4' U A 6 1.295 6.738 3.676 1.00 0.00 O ATOM 174 C3' U A 6 -0.669 7.973 3.921 1.00 0.00 C ATOM 175 O3' U A 6 -1.159 9.278 4.213 1.00 0.00 O ATOM 176 C2' U A 6 -0.462 7.764 2.421 1.00 0.00 C ATOM 177 O2' U A 6 -0.155 8.985 1.780 1.00 0.00 O ATOM 178 C1' U A 6 0.772 6.860 2.370 1.00 0.00 C ATOM 179 N1 U A 6 0.446 5.525 1.857 1.00 0.00 N ATOM 180 C2 U A 6 1.186 5.035 0.796 1.00 0.00 C ATOM 181 O2 U A 6 2.123 5.638 0.301 1.00 0.00 O ATOM 182 N3 U A 6 0.787 3.809 0.334 1.00 0.00 N ATOM 183 C4 U A 6 -0.252 3.038 0.816 1.00 0.00 C ATOM 184 O4 U A 6 -0.510 1.963 0.275 1.00 0.00 O ATOM 185 C5 U A 6 -0.945 3.606 1.930 1.00 0.00 C ATOM 186 C6 U A 6 -0.584 4.797 2.404 1.00 0.00 C ATOM 0 H5' U A 6 0.212 8.047 6.573 1.00 0.00 H new ATOM 0 H5'' U A 6 0.197 6.374 6.053 1.00 0.00 H new ATOM 0 H4' U A 6 1.257 8.711 4.525 1.00 0.00 H new ATOM 0 H3' U A 6 -1.414 7.291 4.332 1.00 0.00 H new ATOM 0 H2' U A 6 -1.345 7.356 1.929 1.00 0.00 H new ATOM 0 HO2' U A 6 -0.413 8.933 0.836 1.00 0.00 H new ATOM 0 H1' U A 6 1.501 7.310 1.696 1.00 0.00 H new ATOM 0 H3 U A 6 1.314 3.424 -0.450 1.00 0.00 H new ATOM 0 H5 U A 6 -1.762 3.069 2.388 1.00 0.00 H new ATOM 0 H6 U A 6 -1.119 5.206 3.248 1.00 0.00 H new ATOM 197 P U A 7 -2.716 9.495 4.563 1.00 0.00 P ATOM 198 OP1 U A 7 -2.789 10.010 5.955 1.00 0.00 O ATOM 199 OP2 U A 7 -3.470 8.270 4.193 1.00 0.00 O ATOM 200 O5' U A 7 -3.152 10.666 3.575 1.00 0.00 O ATOM 201 C5' U A 7 -2.851 10.591 2.183 1.00 0.00 C ATOM 202 C4' U A 7 -2.511 11.961 1.640 1.00 0.00 C ATOM 203 O4' U A 7 -1.980 12.794 2.715 1.00 0.00 O ATOM 204 C3' U A 7 -1.412 11.951 0.586 1.00 0.00 C ATOM 205 O3' U A 7 -1.534 13.033 -0.333 1.00 0.00 O ATOM 206 C2' U A 7 -0.153 12.065 1.431 1.00 0.00 C ATOM 207 O2' U A 7 0.923 12.617 0.696 1.00 0.00 O ATOM 208 C1' U A 7 -0.615 13.083 2.465 1.00 0.00 C ATOM 209 N1 U A 7 0.112 13.039 3.742 1.00 0.00 N ATOM 210 C2 U A 7 0.886 14.135 4.080 1.00 0.00 C ATOM 211 O2 U A 7 0.988 15.120 3.370 1.00 0.00 O ATOM 212 N3 U A 7 1.538 14.035 5.283 1.00 0.00 N ATOM 213 C4 U A 7 1.495 12.978 6.164 1.00 0.00 C ATOM 214 O4 U A 7 2.139 13.038 7.211 1.00 0.00 O ATOM 215 C5 U A 7 0.675 11.886 5.743 1.00 0.00 C ATOM 216 C6 U A 7 0.026 11.947 4.576 1.00 0.00 C ATOM 0 H5' U A 7 -3.704 10.180 1.642 1.00 0.00 H new ATOM 0 H5'' U A 7 -2.014 9.912 2.022 1.00 0.00 H new ATOM 0 H4' U A 7 -3.440 12.330 1.205 1.00 0.00 H new ATOM 0 H3' U A 7 -1.434 11.065 -0.049 1.00 0.00 H new ATOM 0 H2' U A 7 0.207 11.111 1.815 1.00 0.00 H new ATOM 0 HO2' U A 7 0.602 13.376 0.165 1.00 0.00 H new ATOM 0 H1' U A 7 -0.433 14.079 2.061 1.00 0.00 H new ATOM 0 H3 U A 7 2.117 14.830 5.554 1.00 0.00 H new ATOM 0 H5 U A 7 0.580 11.011 6.368 1.00 0.00 H new ATOM 0 H6 U A 7 -0.588 11.110 4.277 1.00 0.00 H new ATOM 227 P G A 8 -1.189 12.806 -1.888 1.00 0.00 P ATOM 228 OP1 G A 8 0.112 13.460 -2.181 1.00 0.00 O ATOM 229 OP2 G A 8 -2.394 13.192 -2.665 1.00 0.00 O ATOM 230 O5' G A 8 -1.002 11.230 -2.026 1.00 0.00 O ATOM 231 C5' G A 8 0.167 10.571 -1.531 1.00 0.00 C ATOM 232 C4' G A 8 0.054 9.081 -1.758 1.00 0.00 C ATOM 233 O4' G A 8 -0.991 8.569 -0.888 1.00 0.00 O ATOM 234 C3' G A 8 -0.354 8.656 -3.164 1.00 0.00 C ATOM 235 O3' G A 8 0.155 7.366 -3.498 1.00 0.00 O ATOM 236 C2' G A 8 -1.877 8.664 -3.094 1.00 0.00 C ATOM 237 O2' G A 8 -2.430 7.706 -3.976 1.00 0.00 O ATOM 238 C1' G A 8 -2.120 8.200 -1.656 1.00 0.00 C ATOM 239 N9 G A 8 -3.307 8.787 -1.043 1.00 0.00 N ATOM 240 C8 G A 8 -3.700 10.102 -1.088 1.00 0.00 C ATOM 241 N7 G A 8 -4.815 10.330 -0.448 1.00 0.00 N ATOM 242 C5 G A 8 -5.182 9.087 0.051 1.00 0.00 C ATOM 243 C6 G A 8 -6.306 8.705 0.830 1.00 0.00 C ATOM 244 O6 G A 8 -7.231 9.411 1.249 1.00 0.00 O ATOM 245 N1 G A 8 -6.290 7.345 1.117 1.00 0.00 N ATOM 246 C2 G A 8 -5.321 6.465 0.709 1.00 0.00 C ATOM 247 N2 G A 8 -5.487 5.191 1.086 1.00 0.00 N ATOM 248 N3 G A 8 -4.267 6.805 -0.014 1.00 0.00 N ATOM 249 C4 G A 8 -4.262 8.123 -0.306 1.00 0.00 C ATOM 0 H5' G A 8 0.288 10.777 -0.468 1.00 0.00 H new ATOM 0 H5'' G A 8 1.053 10.958 -2.034 1.00 0.00 H new ATOM 0 H4' G A 8 1.054 8.692 -1.568 1.00 0.00 H new ATOM 0 H3' G A 8 0.042 9.312 -3.940 1.00 0.00 H new ATOM 0 H2' G A 8 -2.316 9.626 -3.358 1.00 0.00 H new ATOM 0 HO2' G A 8 -1.720 7.116 -4.305 1.00 0.00 H new ATOM 0 H1' G A 8 -2.280 7.122 -1.682 1.00 0.00 H new ATOM 0 H8 G A 8 -3.142 10.871 -1.602 1.00 0.00 H new ATOM 0 H1 G A 8 -7.059 6.973 1.674 1.00 0.00 H new ATOM 0 H21 G A 8 -4.802 4.486 0.815 1.00 0.00 H new ATOM 0 H22 G A 8 -6.299 4.926 1.644 1.00 0.00 H new ATOM 261 P G A 9 1.538 7.232 -4.314 1.00 0.00 P ATOM 262 OP1 G A 9 2.551 6.691 -3.372 1.00 0.00 O ATOM 263 OP2 G A 9 1.809 8.507 -5.027 1.00 0.00 O ATOM 264 O5' G A 9 1.233 6.109 -5.403 1.00 0.00 O ATOM 265 C5' G A 9 2.175 5.807 -6.432 1.00 0.00 C ATOM 266 C4' G A 9 1.453 5.445 -7.708 1.00 0.00 C ATOM 267 O4' G A 9 1.080 6.674 -8.394 1.00 0.00 O ATOM 268 C3' G A 9 2.280 4.659 -8.719 1.00 0.00 C ATOM 269 O3' G A 9 1.462 3.808 -9.521 1.00 0.00 O ATOM 270 C2' G A 9 2.936 5.759 -9.544 1.00 0.00 C ATOM 271 O2' G A 9 3.206 5.314 -10.860 1.00 0.00 O ATOM 272 C1' G A 9 1.815 6.795 -9.598 1.00 0.00 C ATOM 273 N9 G A 9 2.280 8.173 -9.713 1.00 0.00 N ATOM 274 C8 G A 9 3.007 8.884 -8.789 1.00 0.00 C ATOM 275 N7 G A 9 3.273 10.104 -9.169 1.00 0.00 N ATOM 276 C5 G A 9 2.686 10.206 -10.423 1.00 0.00 C ATOM 277 C6 G A 9 2.638 11.296 -11.332 1.00 0.00 C ATOM 278 O6 G A 9 3.121 12.428 -11.205 1.00 0.00 O ATOM 279 N1 G A 9 1.941 10.968 -12.489 1.00 0.00 N ATOM 280 C2 G A 9 1.363 9.750 -12.741 1.00 0.00 C ATOM 281 N2 G A 9 0.735 9.627 -13.916 1.00 0.00 N ATOM 282 N3 G A 9 1.397 8.726 -11.905 1.00 0.00 N ATOM 283 C4 G A 9 2.070 9.022 -10.774 1.00 0.00 C ATOM 0 H5' G A 9 2.814 4.981 -6.120 1.00 0.00 H new ATOM 0 H5'' G A 9 2.825 6.665 -6.604 1.00 0.00 H new ATOM 0 H4' G A 9 0.616 4.823 -7.391 1.00 0.00 H new ATOM 0 H3' G A 9 3.000 3.985 -8.256 1.00 0.00 H new ATOM 0 H2' G A 9 3.883 6.107 -9.132 1.00 0.00 H new ATOM 0 HO2' G A 9 2.639 4.542 -11.067 1.00 0.00 H new ATOM 0 H1' G A 9 1.224 6.595 -10.492 1.00 0.00 H new ATOM 0 H8 G A 9 3.327 8.474 -7.842 1.00 0.00 H new ATOM 0 H1 G A 9 1.853 11.688 -13.206 1.00 0.00 H new ATOM 0 H21 G A 9 0.285 8.746 -14.164 1.00 0.00 H new ATOM 0 H22 G A 9 0.707 10.414 -14.564 1.00 0.00 H new ATOM 295 P G A 10 1.517 2.213 -9.313 1.00 0.00 P ATOM 296 OP1 G A 10 1.339 1.589 -10.650 1.00 0.00 O ATOM 297 OP2 G A 10 0.591 1.855 -8.209 1.00 0.00 O ATOM 298 O5' G A 10 3.010 1.935 -8.830 1.00 0.00 O ATOM 299 C5' G A 10 4.115 2.099 -9.717 1.00 0.00 C ATOM 300 C4' G A 10 5.314 2.638 -8.968 1.00 0.00 C ATOM 301 O4' G A 10 4.844 3.424 -7.838 1.00 0.00 O ATOM 302 C3' G A 10 6.240 1.587 -8.370 1.00 0.00 C ATOM 303 O3' G A 10 7.588 2.047 -8.342 1.00 0.00 O ATOM 304 C2' G A 10 5.658 1.364 -6.978 1.00 0.00 C ATOM 305 O2' G A 10 6.655 1.002 -6.044 1.00 0.00 O ATOM 306 C1' G A 10 5.150 2.761 -6.625 1.00 0.00 C ATOM 307 N9 G A 10 3.943 2.725 -5.806 1.00 0.00 N ATOM 308 C8 G A 10 2.761 2.104 -6.118 1.00 0.00 C ATOM 309 N7 G A 10 1.862 2.204 -5.180 1.00 0.00 N ATOM 310 C5 G A 10 2.489 2.941 -4.184 1.00 0.00 C ATOM 311 C6 G A 10 2.011 3.370 -2.925 1.00 0.00 C ATOM 312 O6 G A 10 0.898 3.184 -2.423 1.00 0.00 O ATOM 313 N1 G A 10 2.976 4.088 -2.229 1.00 0.00 N ATOM 314 C2 G A 10 4.235 4.370 -2.693 1.00 0.00 C ATOM 315 N2 G A 10 5.016 5.079 -1.874 1.00 0.00 N ATOM 316 N3 G A 10 4.692 3.986 -3.872 1.00 0.00 N ATOM 317 C4 G A 10 3.774 3.276 -4.559 1.00 0.00 C ATOM 0 H5' G A 10 3.845 2.781 -10.523 1.00 0.00 H new ATOM 0 H5'' G A 10 4.365 1.143 -10.178 1.00 0.00 H new ATOM 0 H4' G A 10 5.876 3.198 -9.715 1.00 0.00 H new ATOM 0 H3' G A 10 6.286 0.663 -8.946 1.00 0.00 H new ATOM 0 H2' G A 10 4.912 0.569 -6.957 1.00 0.00 H new ATOM 0 HO2' G A 10 6.490 1.462 -5.194 1.00 0.00 H new ATOM 0 H1' G A 10 5.923 3.273 -6.052 1.00 0.00 H new ATOM 0 H8 G A 10 2.592 1.583 -7.049 1.00 0.00 H new ATOM 0 H1 G A 10 2.729 4.432 -1.301 1.00 0.00 H new ATOM 0 H21 G A 10 5.965 5.323 -2.158 1.00 0.00 H new ATOM 0 H22 G A 10 4.664 5.377 -0.964 1.00 0.00 H new ATOM 329 P C A 11 8.791 0.990 -8.196 1.00 0.00 P ATOM 330 OP1 C A 11 9.964 1.551 -8.915 1.00 0.00 O ATOM 331 OP2 C A 11 8.292 -0.363 -8.551 1.00 0.00 O ATOM 332 O5' C A 11 9.109 1.006 -6.635 1.00 0.00 O ATOM 333 C5' C A 11 9.781 2.111 -6.036 1.00 0.00 C ATOM 334 C4' C A 11 9.930 1.892 -4.548 1.00 0.00 C ATOM 335 O4' C A 11 8.861 2.567 -3.838 1.00 0.00 O ATOM 336 C3' C A 11 9.788 0.465 -4.048 1.00 0.00 C ATOM 337 O3' C A 11 10.942 -0.327 -4.308 1.00 0.00 O ATOM 338 C2' C A 11 9.551 0.683 -2.559 1.00 0.00 C ATOM 339 O2' C A 11 10.760 0.972 -1.882 1.00 0.00 O ATOM 340 C1' C A 11 8.688 1.947 -2.575 1.00 0.00 C ATOM 341 N1 C A 11 7.257 1.671 -2.365 1.00 0.00 N ATOM 342 C2 C A 11 6.770 1.622 -1.056 1.00 0.00 C ATOM 343 O2 C A 11 7.553 1.822 -0.117 1.00 0.00 O ATOM 344 N3 C A 11 5.463 1.355 -0.848 1.00 0.00 N ATOM 345 C4 C A 11 4.654 1.139 -1.886 1.00 0.00 C ATOM 346 N4 C A 11 3.378 0.858 -1.639 1.00 0.00 N ATOM 347 C5 C A 11 5.117 1.196 -3.227 1.00 0.00 C ATOM 348 C6 C A 11 6.415 1.460 -3.421 1.00 0.00 C ATOM 0 H5' C A 11 9.222 3.029 -6.221 1.00 0.00 H new ATOM 0 H5'' C A 11 10.763 2.238 -6.492 1.00 0.00 H new ATOM 0 H4' C A 11 10.943 2.251 -4.367 1.00 0.00 H new ATOM 0 H3' C A 11 8.993 -0.094 -4.542 1.00 0.00 H new ATOM 0 H2' C A 11 9.115 -0.183 -2.061 1.00 0.00 H new ATOM 0 HO2' C A 11 10.849 0.381 -1.105 1.00 0.00 H new ATOM 0 H1' C A 11 9.007 2.588 -1.753 1.00 0.00 H new ATOM 0 H41 C A 11 2.734 0.688 -2.412 1.00 0.00 H new ATOM 0 H42 C A 11 3.043 0.813 -0.677 1.00 0.00 H new ATOM 0 H5 C A 11 4.448 1.033 -4.059 1.00 0.00 H new ATOM 0 H6 C A 11 6.803 1.507 -4.428 1.00 0.00 H new ATOM 360 P U A 12 10.835 -1.931 -4.256 1.00 0.00 P ATOM 361 OP1 U A 12 12.116 -2.480 -4.770 1.00 0.00 O ATOM 362 OP2 U A 12 9.555 -2.335 -4.893 1.00 0.00 O ATOM 363 O5' U A 12 10.737 -2.262 -2.699 1.00 0.00 O ATOM 364 C5' U A 12 11.869 -2.108 -1.844 1.00 0.00 C ATOM 365 C4' U A 12 11.429 -2.047 -0.399 1.00 0.00 C ATOM 366 O4' U A 12 10.321 -1.119 -0.270 1.00 0.00 O ATOM 367 C3' U A 12 10.887 -3.346 0.178 1.00 0.00 C ATOM 368 O3' U A 12 11.944 -4.195 0.616 1.00 0.00 O ATOM 369 C2' U A 12 10.013 -2.859 1.329 1.00 0.00 C ATOM 370 O2' U A 12 10.798 -2.547 2.464 1.00 0.00 O ATOM 371 C1' U A 12 9.450 -1.555 0.758 1.00 0.00 C ATOM 372 N1 U A 12 8.097 -1.680 0.196 1.00 0.00 N ATOM 373 C2 U A 12 7.022 -1.472 1.043 1.00 0.00 C ATOM 374 O2 U A 12 7.151 -1.209 2.225 1.00 0.00 O ATOM 375 N3 U A 12 5.788 -1.583 0.453 1.00 0.00 N ATOM 376 C4 U A 12 5.525 -1.870 -0.867 1.00 0.00 C ATOM 377 O4 U A 12 4.357 -1.905 -1.258 1.00 0.00 O ATOM 378 C5 U A 12 6.686 -2.079 -1.674 1.00 0.00 C ATOM 379 C6 U A 12 7.903 -1.986 -1.132 1.00 0.00 C ATOM 0 H5' U A 12 12.410 -1.199 -2.105 1.00 0.00 H new ATOM 0 H5'' U A 12 12.558 -2.941 -1.987 1.00 0.00 H new ATOM 0 H4' U A 12 12.337 -1.768 0.135 1.00 0.00 H new ATOM 0 H3' U A 12 10.335 -3.953 -0.540 1.00 0.00 H new ATOM 0 H2' U A 12 9.272 -3.593 1.646 1.00 0.00 H new ATOM 0 HO2' U A 12 10.211 -2.359 3.226 1.00 0.00 H new ATOM 0 H1' U A 12 9.380 -0.848 1.584 1.00 0.00 H new ATOM 0 H3 U A 12 4.979 -1.437 1.057 1.00 0.00 H new ATOM 0 H5 U A 12 6.579 -2.312 -2.723 1.00 0.00 H new ATOM 0 H6 U A 12 8.766 -2.157 -1.758 1.00 0.00 H new ATOM 390 P C A 13 11.640 -5.734 0.968 1.00 0.00 P ATOM 391 OP1 C A 13 12.861 -6.295 1.601 1.00 0.00 O ATOM 392 OP2 C A 13 11.071 -6.393 -0.236 1.00 0.00 O ATOM 393 O5' C A 13 10.495 -5.657 2.074 1.00 0.00 O ATOM 394 C5' C A 13 10.790 -5.250 3.408 1.00 0.00 C ATOM 395 C4' C A 13 9.658 -5.629 4.334 1.00 0.00 C ATOM 396 O4' C A 13 8.557 -4.700 4.172 1.00 0.00 O ATOM 397 C3' C A 13 9.009 -6.977 4.070 1.00 0.00 C ATOM 398 O3' C A 13 9.781 -8.048 4.601 1.00 0.00 O ATOM 399 C2' C A 13 7.657 -6.827 4.763 1.00 0.00 C ATOM 400 O2' C A 13 7.776 -7.035 6.157 1.00 0.00 O ATOM 401 C1' C A 13 7.344 -5.349 4.516 1.00 0.00 C ATOM 402 N1 C A 13 6.370 -5.122 3.434 1.00 0.00 N ATOM 403 C2 C A 13 5.013 -5.007 3.758 1.00 0.00 C ATOM 404 O2 C A 13 4.667 -5.116 4.944 1.00 0.00 O ATOM 405 N3 C A 13 4.115 -4.780 2.773 1.00 0.00 N ATOM 406 C4 C A 13 4.526 -4.674 1.508 1.00 0.00 C ATOM 407 N4 C A 13 3.605 -4.434 0.572 1.00 0.00 N ATOM 408 C5 C A 13 5.900 -4.803 1.148 1.00 0.00 C ATOM 409 C6 C A 13 6.779 -5.022 2.134 1.00 0.00 C ATOM 0 H5' C A 13 10.950 -4.172 3.440 1.00 0.00 H new ATOM 0 H5'' C A 13 11.715 -5.719 3.742 1.00 0.00 H new ATOM 0 H4' C A 13 10.135 -5.634 5.314 1.00 0.00 H new ATOM 0 H3' C A 13 8.920 -7.223 3.012 1.00 0.00 H new ATOM 0 H2' C A 13 6.908 -7.532 4.401 1.00 0.00 H new ATOM 0 HO2' C A 13 6.898 -6.932 6.579 1.00 0.00 H new ATOM 0 H1' C A 13 6.898 -4.953 5.428 1.00 0.00 H new ATOM 0 H41 C A 13 3.882 -4.347 -0.406 1.00 0.00 H new ATOM 0 H42 C A 13 2.624 -4.338 0.835 1.00 0.00 H new ATOM 0 H5 C A 13 6.219 -4.727 0.119 1.00 0.00 H new ATOM 0 H6 C A 13 7.828 -5.121 1.898 1.00 0.00 H new ATOM 421 P U A 14 9.613 -9.529 3.993 1.00 0.00 P ATOM 422 OP1 U A 14 10.589 -10.423 4.666 1.00 0.00 O ATOM 423 OP2 U A 14 9.627 -9.408 2.513 1.00 0.00 O ATOM 424 O5' U A 14 8.144 -9.958 4.437 1.00 0.00 O ATOM 425 C5' U A 14 7.827 -10.178 5.810 1.00 0.00 C ATOM 426 C4' U A 14 6.465 -10.821 5.935 1.00 0.00 C ATOM 427 O4' U A 14 5.443 -9.807 5.741 1.00 0.00 O ATOM 428 C3' U A 14 6.149 -11.884 4.893 1.00 0.00 C ATOM 429 O3' U A 14 6.651 -13.157 5.287 1.00 0.00 O ATOM 430 C2' U A 14 4.627 -11.848 4.830 1.00 0.00 C ATOM 431 O2' U A 14 4.053 -12.558 5.912 1.00 0.00 O ATOM 432 C1' U A 14 4.350 -10.358 5.027 1.00 0.00 C ATOM 433 N1 U A 14 4.193 -9.607 3.772 1.00 0.00 N ATOM 434 C2 U A 14 2.927 -9.538 3.216 1.00 0.00 C ATOM 435 O2 U A 14 1.954 -10.083 3.710 1.00 0.00 O ATOM 436 N3 U A 14 2.843 -8.807 2.059 1.00 0.00 N ATOM 437 C4 U A 14 3.872 -8.153 1.415 1.00 0.00 C ATOM 438 O4 U A 14 3.639 -7.527 0.381 1.00 0.00 O ATOM 439 C5 U A 14 5.145 -8.280 2.046 1.00 0.00 C ATOM 440 C6 U A 14 5.266 -8.986 3.172 1.00 0.00 C ATOM 0 H5' U A 14 7.841 -9.231 6.350 1.00 0.00 H new ATOM 0 H5'' U A 14 8.582 -10.817 6.267 1.00 0.00 H new ATOM 0 H4' U A 14 6.476 -11.286 6.921 1.00 0.00 H new ATOM 0 H3' U A 14 6.612 -11.703 3.923 1.00 0.00 H new ATOM 0 H2' U A 14 4.224 -12.287 3.917 1.00 0.00 H new ATOM 0 HO2' U A 14 3.076 -12.518 5.848 1.00 0.00 H new ATOM 0 H1' U A 14 3.404 -10.273 5.562 1.00 0.00 H new ATOM 0 H3 U A 14 1.921 -8.740 1.629 1.00 0.00 H new ATOM 0 H5 U A 14 6.012 -7.804 1.612 1.00 0.00 H new ATOM 0 H6 U A 14 6.240 -9.074 3.629 1.00 0.00 H new ATOM 451 P C A 15 7.089 -14.227 4.170 1.00 0.00 P ATOM 452 OP1 C A 15 7.859 -15.294 4.858 1.00 0.00 O ATOM 453 OP2 C A 15 7.702 -13.499 3.029 1.00 0.00 O ATOM 454 O5' C A 15 5.709 -14.853 3.675 1.00 0.00 O ATOM 455 C5' C A 15 4.898 -15.628 4.556 1.00 0.00 C ATOM 456 C4' C A 15 3.619 -16.032 3.861 1.00 0.00 C ATOM 457 O4' C A 15 2.769 -14.861 3.735 1.00 0.00 O ATOM 458 C3' C A 15 3.784 -16.547 2.438 1.00 0.00 C ATOM 459 O3' C A 15 4.064 -17.947 2.398 1.00 0.00 O ATOM 460 C2' C A 15 2.439 -16.214 1.802 1.00 0.00 C ATOM 461 O2' C A 15 1.461 -17.179 2.143 1.00 0.00 O ATOM 462 C1' C A 15 2.089 -14.897 2.495 1.00 0.00 C ATOM 463 N1 C A 15 2.465 -13.698 1.726 1.00 0.00 N ATOM 464 C2 C A 15 1.487 -13.063 0.960 1.00 0.00 C ATOM 465 O2 C A 15 0.342 -13.533 0.947 1.00 0.00 O ATOM 466 N3 C A 15 1.813 -11.956 0.254 1.00 0.00 N ATOM 467 C4 C A 15 3.058 -11.482 0.298 1.00 0.00 C ATOM 468 N4 C A 15 3.334 -10.386 -0.412 1.00 0.00 N ATOM 469 C5 C A 15 4.078 -12.110 1.073 1.00 0.00 C ATOM 470 C6 C A 15 3.740 -13.208 1.761 1.00 0.00 C ATOM 0 H5' C A 15 4.668 -15.052 5.453 1.00 0.00 H new ATOM 0 H5'' C A 15 5.442 -16.516 4.878 1.00 0.00 H new ATOM 0 H4' C A 15 3.214 -16.836 4.475 1.00 0.00 H new ATOM 0 H3' C A 15 4.629 -16.097 1.917 1.00 0.00 H new ATOM 0 H2' C A 15 2.476 -16.176 0.713 1.00 0.00 H new ATOM 0 HO2' C A 15 1.903 -18.011 2.412 1.00 0.00 H new ATOM 0 HO3' C A 15 4.160 -18.235 1.466 1.00 0.00 H new ATOM 0 H1' C A 15 1.005 -14.872 2.606 1.00 0.00 H new ATOM 0 H41 C A 15 4.276 -9.996 -0.402 1.00 0.00 H new ATOM 0 H42 C A 15 2.603 -9.939 -0.965 1.00 0.00 H new ATOM 0 H5 C A 15 5.083 -11.715 1.104 1.00 0.00 H new ATOM 0 H6 C A 15 4.488 -13.715 2.353 1.00 0.00 H new TER 483 C A 15