USER MOD reduce.3.24.130724 H: found=0, std=0, add=155, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 155 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 13 G O2' : rot -5:sc= -4.32! USER MOD Single : A 13 G O5' : rot 32:sc= -0.818! USER MOD Single : A 14 G O2' : rot -15:sc= -0.136 USER MOD Single : A 15 C O2' : rot -6:sc= -0.926 USER MOD Single : A 16 A O2' : rot -1:sc= -5.45! USER MOD Single : A 17 C O2' : rot -1:sc= -3.27! USER MOD Single : A 18 U O2' : rot 176:sc= -6.43! USER MOD Single : A 19 G O2' : rot -17:sc= 0.188 USER MOD Single : A 19 G O3' : rot 180:sc= 0.18 USER MOD Single : B 59 C O2' : rot -13:sc= -2.09! USER MOD Single : B 59 C O5' : rot 43:sc= -3.24! USER MOD Single : B 60 A O2' : rot -18:sc= 0.211 USER MOD Single : B 61 G O2' : rot -148:sc= -2.83! USER MOD Single : B 62 U O2' : rot -15:sc= -2.02! USER MOD Single : B 63 G O2' : rot -6:sc= -0.157 USER MOD Single : B 64 U O2' : rot -7:sc= 0.11 USER MOD Single : B 65 C O2' : rot -18:sc= 0.156 USER MOD Single : B 65 C O3' : rot 180:sc= 0.179 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 13 4.758 -7.163 -5.540 1.00 0.00 O ATOM 2 C5' G A 13 5.066 -8.028 -6.638 1.00 0.00 C ATOM 3 C4' G A 13 3.851 -8.848 -7.062 1.00 0.00 C ATOM 4 O4' G A 13 3.581 -9.901 -6.123 1.00 0.00 O ATOM 5 C3' G A 13 2.593 -7.984 -7.098 1.00 0.00 C ATOM 6 O3' G A 13 2.328 -7.611 -8.451 1.00 0.00 O ATOM 7 C2' G A 13 1.508 -8.940 -6.647 1.00 0.00 C ATOM 8 O2' G A 13 1.035 -9.752 -7.727 1.00 0.00 O ATOM 9 C1' G A 13 2.250 -9.762 -5.611 1.00 0.00 C ATOM 10 N9 G A 13 2.250 -9.075 -4.308 1.00 0.00 N ATOM 11 C8 G A 13 2.983 -8.013 -3.891 1.00 0.00 C ATOM 12 N7 G A 13 2.777 -7.575 -2.694 1.00 0.00 N ATOM 13 C5 G A 13 1.782 -8.446 -2.242 1.00 0.00 C ATOM 14 C6 G A 13 1.116 -8.493 -0.988 1.00 0.00 C ATOM 15 O6 G A 13 1.273 -7.762 -0.011 1.00 0.00 O ATOM 16 N1 G A 13 0.184 -9.521 -0.947 1.00 0.00 N ATOM 17 C2 G A 13 -0.081 -10.400 -1.978 1.00 0.00 C ATOM 18 N2 G A 13 -1.014 -11.321 -1.744 1.00 0.00 N ATOM 19 N3 G A 13 0.541 -10.363 -3.160 1.00 0.00 N ATOM 20 C4 G A 13 1.454 -9.368 -3.224 1.00 0.00 C ATOM 0 H5' G A 13 5.879 -8.698 -6.358 1.00 0.00 H new ATOM 0 H5'' G A 13 5.419 -7.435 -7.482 1.00 0.00 H new ATOM 0 H4' G A 13 4.085 -9.250 -8.048 1.00 0.00 H new ATOM 0 H3' G A 13 2.668 -7.080 -6.493 1.00 0.00 H new ATOM 0 H2' G A 13 0.611 -8.450 -6.269 1.00 0.00 H new ATOM 0 HO2' G A 13 1.459 -9.465 -8.562 1.00 0.00 H new ATOM 0 HO5' G A 13 4.083 -7.586 -4.970 1.00 0.00 H new ATOM 0 H1' G A 13 1.782 -10.732 -5.445 1.00 0.00 H new ATOM 0 H8 G A 13 3.714 -7.550 -4.538 1.00 0.00 H new ATOM 0 H1 G A 13 -0.348 -9.636 -0.085 1.00 0.00 H new ATOM 0 H21 G A 13 -1.254 -11.999 -2.467 1.00 0.00 H new ATOM 0 H22 G A 13 -1.488 -11.348 -0.841 1.00 0.00 H new ATOM 33 P G A 14 1.383 -6.347 -8.767 1.00 0.00 P ATOM 34 OP1 G A 14 1.237 -6.234 -10.236 1.00 0.00 O ATOM 35 OP2 G A 14 1.876 -5.192 -7.984 1.00 0.00 O ATOM 36 O5' G A 14 -0.034 -6.806 -8.154 1.00 0.00 O ATOM 37 C5' G A 14 -0.762 -7.881 -8.748 1.00 0.00 C ATOM 38 C4' G A 14 -2.184 -7.978 -8.199 1.00 0.00 C ATOM 39 O4' G A 14 -2.240 -8.658 -6.934 1.00 0.00 O ATOM 40 C3' G A 14 -2.766 -6.610 -7.912 1.00 0.00 C ATOM 41 O3' G A 14 -3.319 -6.054 -9.107 1.00 0.00 O ATOM 42 C2' G A 14 -3.895 -6.974 -6.974 1.00 0.00 C ATOM 43 O2' G A 14 -4.997 -7.556 -7.680 1.00 0.00 O ATOM 44 C1' G A 14 -3.201 -7.994 -6.086 1.00 0.00 C ATOM 45 N9 G A 14 -2.546 -7.343 -4.941 1.00 0.00 N ATOM 46 C8 G A 14 -1.312 -6.791 -4.832 1.00 0.00 C ATOM 47 N7 G A 14 -0.969 -6.325 -3.679 1.00 0.00 N ATOM 48 C5 G A 14 -2.110 -6.592 -2.915 1.00 0.00 C ATOM 49 C6 G A 14 -2.372 -6.322 -1.549 1.00 0.00 C ATOM 50 O6 G A 14 -1.633 -5.789 -0.726 1.00 0.00 O ATOM 51 N1 G A 14 -3.643 -6.752 -1.179 1.00 0.00 N ATOM 52 C2 G A 14 -4.549 -7.364 -2.016 1.00 0.00 C ATOM 53 N2 G A 14 -5.721 -7.694 -1.475 1.00 0.00 N ATOM 54 N3 G A 14 -4.308 -7.623 -3.302 1.00 0.00 N ATOM 55 C4 G A 14 -3.078 -7.213 -3.683 1.00 0.00 C ATOM 0 H5' G A 14 -0.238 -8.819 -8.566 1.00 0.00 H new ATOM 0 H5'' G A 14 -0.799 -7.741 -9.828 1.00 0.00 H new ATOM 0 H4' G A 14 -2.736 -8.515 -8.971 1.00 0.00 H new ATOM 0 H3' G A 14 -2.049 -5.887 -7.524 1.00 0.00 H new ATOM 0 H2' G A 14 -4.332 -6.130 -6.440 1.00 0.00 H new ATOM 0 HO2' G A 14 -4.896 -7.388 -8.640 1.00 0.00 H new ATOM 0 H1' G A 14 -3.911 -8.703 -5.659 1.00 0.00 H new ATOM 0 H8 G A 14 -0.642 -6.743 -5.678 1.00 0.00 H new ATOM 0 H1 G A 14 -3.926 -6.602 -0.211 1.00 0.00 H new ATOM 0 H21 G A 14 -6.435 -8.150 -2.043 1.00 0.00 H new ATOM 0 H22 G A 14 -5.905 -7.490 -0.493 1.00 0.00 H new ATOM 67 P C A 15 -3.409 -4.454 -9.263 1.00 0.00 P ATOM 68 OP1 C A 15 -4.133 -4.146 -10.515 1.00 0.00 O ATOM 69 OP2 C A 15 -2.063 -3.885 -9.024 1.00 0.00 O ATOM 70 O5' C A 15 -4.353 -4.064 -8.020 1.00 0.00 O ATOM 71 C5' C A 15 -5.733 -4.419 -8.037 1.00 0.00 C ATOM 72 C4' C A 15 -6.368 -4.316 -6.654 1.00 0.00 C ATOM 73 O4' C A 15 -5.690 -5.131 -5.694 1.00 0.00 O ATOM 74 C3' C A 15 -6.265 -2.927 -6.061 1.00 0.00 C ATOM 75 O3' C A 15 -7.289 -2.091 -6.604 1.00 0.00 O ATOM 76 C2' C A 15 -6.601 -3.226 -4.616 1.00 0.00 C ATOM 77 O2' C A 15 -8.008 -3.418 -4.431 1.00 0.00 O ATOM 78 C1' C A 15 -5.824 -4.521 -4.394 1.00 0.00 C ATOM 79 N1 C A 15 -4.514 -4.231 -3.775 1.00 0.00 N ATOM 80 C2 C A 15 -4.507 -3.975 -2.415 1.00 0.00 C ATOM 81 O2 C A 15 -5.562 -3.966 -1.785 1.00 0.00 O ATOM 82 N3 C A 15 -3.315 -3.723 -1.810 1.00 0.00 N ATOM 83 C4 C A 15 -2.176 -3.722 -2.512 1.00 0.00 C ATOM 84 N4 C A 15 -1.027 -3.472 -1.886 1.00 0.00 N ATOM 85 C5 C A 15 -2.177 -3.981 -3.918 1.00 0.00 C ATOM 86 C6 C A 15 -3.361 -4.226 -4.506 1.00 0.00 C ATOM 0 H5' C A 15 -5.840 -5.438 -8.410 1.00 0.00 H new ATOM 0 H5'' C A 15 -6.266 -3.768 -8.730 1.00 0.00 H new ATOM 0 H4' C A 15 -7.402 -4.618 -6.823 1.00 0.00 H new ATOM 0 H3' C A 15 -5.313 -2.426 -6.234 1.00 0.00 H new ATOM 0 H2' C A 15 -6.344 -2.425 -3.922 1.00 0.00 H new ATOM 0 HO2' C A 15 -8.477 -3.227 -5.270 1.00 0.00 H new ATOM 0 H1' C A 15 -6.336 -5.198 -3.710 1.00 0.00 H new ATOM 0 H41 C A 15 -0.151 -3.468 -2.409 1.00 0.00 H new ATOM 0 H42 C A 15 -1.023 -3.284 -0.883 1.00 0.00 H new ATOM 0 H5 C A 15 -1.259 -3.980 -4.488 1.00 0.00 H new ATOM 0 H6 C A 15 -3.400 -4.421 -5.568 1.00 0.00 H new ATOM 98 P A A 16 -7.149 -0.488 -6.506 1.00 0.00 P ATOM 99 OP1 A A 16 -8.367 0.119 -7.089 1.00 0.00 O ATOM 100 OP2 A A 16 -5.816 -0.108 -7.025 1.00 0.00 O ATOM 101 O5' A A 16 -7.164 -0.223 -4.915 1.00 0.00 O ATOM 102 C5' A A 16 -8.377 -0.364 -4.172 1.00 0.00 C ATOM 103 C4' A A 16 -8.163 -0.170 -2.670 1.00 0.00 C ATOM 104 O4' A A 16 -7.227 -1.109 -2.130 1.00 0.00 O ATOM 105 C3' A A 16 -7.557 1.182 -2.349 1.00 0.00 C ATOM 106 O3' A A 16 -8.596 2.159 -2.259 1.00 0.00 O ATOM 107 C2' A A 16 -7.004 0.943 -0.960 1.00 0.00 C ATOM 108 O2' A A 16 -8.030 1.024 0.036 1.00 0.00 O ATOM 109 C1' A A 16 -6.462 -0.468 -1.085 1.00 0.00 C ATOM 110 N9 A A 16 -5.023 -0.448 -1.403 1.00 0.00 N ATOM 111 C8 A A 16 -4.388 -0.707 -2.563 1.00 0.00 C ATOM 112 N7 A A 16 -3.099 -0.714 -2.555 1.00 0.00 N ATOM 113 C5 A A 16 -2.833 -0.411 -1.220 1.00 0.00 C ATOM 114 C6 A A 16 -1.646 -0.255 -0.507 1.00 0.00 C ATOM 115 N6 A A 16 -0.442 -0.437 -1.058 1.00 0.00 N ATOM 116 N1 A A 16 -1.751 0.055 0.800 1.00 0.00 N ATOM 117 C2 A A 16 -2.959 0.195 1.360 1.00 0.00 C ATOM 118 N3 A A 16 -4.136 0.062 0.776 1.00 0.00 N ATOM 119 C4 A A 16 -4.003 -0.242 -0.519 1.00 0.00 C ATOM 0 H5' A A 16 -8.798 -1.353 -4.352 1.00 0.00 H new ATOM 0 H5'' A A 16 -9.106 0.363 -4.530 1.00 0.00 H new ATOM 0 H4' A A 16 -9.158 -0.289 -2.242 1.00 0.00 H new ATOM 0 H3' A A 16 -6.830 1.531 -3.082 1.00 0.00 H new ATOM 0 H2' A A 16 -6.261 1.677 -0.648 1.00 0.00 H new ATOM 0 HO2' A A 16 -8.884 1.243 -0.391 1.00 0.00 H new ATOM 0 H1' A A 16 -6.560 -1.016 -0.148 1.00 0.00 H new ATOM 0 H8 A A 16 -4.941 -0.902 -3.470 1.00 0.00 H new ATOM 0 H61 A A 16 0.400 -0.311 -0.496 1.00 0.00 H new ATOM 0 H62 A A 16 -0.365 -0.701 -2.040 1.00 0.00 H new ATOM 0 H2 A A 16 -2.972 0.446 2.410 1.00 0.00 H new ATOM 131 P C A 17 -8.227 3.723 -2.331 1.00 0.00 P ATOM 132 OP1 C A 17 -9.474 4.502 -2.152 1.00 0.00 O ATOM 133 OP2 C A 17 -7.380 3.947 -3.523 1.00 0.00 O ATOM 134 O5' C A 17 -7.315 3.920 -1.017 1.00 0.00 O ATOM 135 C5' C A 17 -7.856 3.651 0.278 1.00 0.00 C ATOM 136 C4' C A 17 -6.804 3.767 1.379 1.00 0.00 C ATOM 137 O4' C A 17 -5.772 2.791 1.262 1.00 0.00 O ATOM 138 C3' C A 17 -6.082 5.093 1.327 1.00 0.00 C ATOM 139 O3' C A 17 -6.862 6.061 2.033 1.00 0.00 O ATOM 140 C2' C A 17 -4.830 4.799 2.130 1.00 0.00 C ATOM 141 O2' C A 17 -5.065 4.939 3.536 1.00 0.00 O ATOM 142 C1' C A 17 -4.538 3.350 1.754 1.00 0.00 C ATOM 143 N1 C A 17 -3.495 3.270 0.727 1.00 0.00 N ATOM 144 C2 C A 17 -2.180 3.261 1.145 1.00 0.00 C ATOM 145 O2 C A 17 -1.920 3.344 2.343 1.00 0.00 O ATOM 146 N3 C A 17 -1.205 3.160 0.199 1.00 0.00 N ATOM 147 C4 C A 17 -1.523 3.074 -1.102 1.00 0.00 C ATOM 148 N4 C A 17 -0.554 2.957 -2.011 1.00 0.00 N ATOM 149 C5 C A 17 -2.887 3.091 -1.522 1.00 0.00 C ATOM 150 C6 C A 17 -3.826 3.189 -0.586 1.00 0.00 C ATOM 0 H5' C A 17 -8.283 2.648 0.290 1.00 0.00 H new ATOM 0 H5'' C A 17 -8.670 4.347 0.481 1.00 0.00 H new ATOM 0 H4' C A 17 -7.370 3.638 2.302 1.00 0.00 H new ATOM 0 H3' C A 17 -5.894 5.468 0.321 1.00 0.00 H new ATOM 0 H2' C A 17 -4.005 5.479 1.918 1.00 0.00 H new ATOM 0 HO2' C A 17 -5.993 5.216 3.687 1.00 0.00 H new ATOM 0 H1' C A 17 -4.172 2.798 2.620 1.00 0.00 H new ATOM 0 H41 C A 17 -0.789 2.891 -3.001 1.00 0.00 H new ATOM 0 H42 C A 17 0.422 2.933 -1.716 1.00 0.00 H new ATOM 0 H5 C A 17 -3.148 3.026 -2.568 1.00 0.00 H new ATOM 0 H6 C A 17 -4.867 3.204 -0.875 1.00 0.00 H new ATOM 162 P U A 18 -6.796 7.616 1.629 1.00 0.00 P ATOM 163 OP1 U A 18 -7.652 8.376 2.567 1.00 0.00 O ATOM 164 OP2 U A 18 -7.017 7.728 0.171 1.00 0.00 O ATOM 165 O5' U A 18 -5.261 7.985 1.936 1.00 0.00 O ATOM 166 C5' U A 18 -4.720 7.827 3.251 1.00 0.00 C ATOM 167 C4' U A 18 -3.234 8.156 3.279 1.00 0.00 C ATOM 168 O4' U A 18 -2.461 7.113 2.691 1.00 0.00 O ATOM 169 C3' U A 18 -2.951 9.400 2.455 1.00 0.00 C ATOM 170 O3' U A 18 -2.748 10.498 3.346 1.00 0.00 O ATOM 171 C2' U A 18 -1.643 9.132 1.736 1.00 0.00 C ATOM 172 O2' U A 18 -0.598 9.981 2.215 1.00 0.00 O ATOM 173 C1' U A 18 -1.331 7.670 2.008 1.00 0.00 C ATOM 174 N1 U A 18 -1.077 6.978 0.738 1.00 0.00 N ATOM 175 C2 U A 18 0.239 6.833 0.349 1.00 0.00 C ATOM 176 O2 U A 18 1.172 7.249 1.032 1.00 0.00 O ATOM 177 N3 U A 18 0.447 6.198 -0.859 1.00 0.00 N ATOM 178 C4 U A 18 -0.535 5.698 -1.698 1.00 0.00 C ATOM 179 O4 U A 18 -0.230 5.150 -2.756 1.00 0.00 O ATOM 180 C5 U A 18 -1.886 5.894 -1.208 1.00 0.00 C ATOM 181 C6 U A 18 -2.109 6.521 -0.027 1.00 0.00 C ATOM 0 H5' U A 18 -4.875 6.803 3.590 1.00 0.00 H new ATOM 0 H5'' U A 18 -5.252 8.476 3.946 1.00 0.00 H new ATOM 0 H4' U A 18 -2.968 8.295 4.327 1.00 0.00 H new ATOM 0 H3' U A 18 -3.765 9.626 1.766 1.00 0.00 H new ATOM 0 H2' U A 18 -1.723 9.339 0.669 1.00 0.00 H new ATOM 0 HO2' U A 18 0.246 9.737 1.782 1.00 0.00 H new ATOM 0 H1' U A 18 -0.439 7.559 2.624 1.00 0.00 H new ATOM 0 H3 U A 18 1.415 6.087 -1.162 1.00 0.00 H new ATOM 0 H5 U A 18 -2.723 5.537 -1.790 1.00 0.00 H new ATOM 0 H6 U A 18 -3.124 6.661 0.315 1.00 0.00 H new ATOM 192 P G A 19 -2.642 12.002 2.779 1.00 0.00 P ATOM 193 OP1 G A 19 -2.933 12.940 3.886 1.00 0.00 O ATOM 194 OP2 G A 19 -3.413 12.081 1.518 1.00 0.00 O ATOM 195 O5' G A 19 -1.071 12.105 2.423 1.00 0.00 O ATOM 196 C5' G A 19 -0.109 12.153 3.482 1.00 0.00 C ATOM 197 C4' G A 19 1.322 11.919 2.993 1.00 0.00 C ATOM 198 O4' G A 19 1.499 10.614 2.455 1.00 0.00 O ATOM 199 C3' G A 19 1.704 12.840 1.856 1.00 0.00 C ATOM 200 O3' G A 19 2.021 14.157 2.320 1.00 0.00 O ATOM 201 C2' G A 19 2.930 12.123 1.305 1.00 0.00 C ATOM 202 O2' G A 19 4.118 12.493 2.016 1.00 0.00 O ATOM 203 C1' G A 19 2.588 10.648 1.518 1.00 0.00 C ATOM 204 N9 G A 19 2.220 10.019 0.238 1.00 0.00 N ATOM 205 C8 G A 19 0.998 9.738 -0.259 1.00 0.00 C ATOM 206 N7 G A 19 0.934 9.152 -1.406 1.00 0.00 N ATOM 207 C5 G A 19 2.285 9.023 -1.732 1.00 0.00 C ATOM 208 C6 G A 19 2.892 8.456 -2.882 1.00 0.00 C ATOM 209 O6 G A 19 2.347 7.939 -3.855 1.00 0.00 O ATOM 210 N1 G A 19 4.276 8.531 -2.815 1.00 0.00 N ATOM 211 C2 G A 19 4.995 9.084 -1.775 1.00 0.00 C ATOM 212 N2 G A 19 6.321 9.081 -1.907 1.00 0.00 N ATOM 213 N3 G A 19 4.431 9.618 -0.687 1.00 0.00 N ATOM 214 C4 G A 19 3.082 9.555 -0.729 1.00 0.00 C ATOM 0 H5' G A 19 -0.360 11.401 4.230 1.00 0.00 H new ATOM 0 H5'' G A 19 -0.166 13.124 3.975 1.00 0.00 H new ATOM 0 H4' G A 19 1.933 12.089 3.880 1.00 0.00 H new ATOM 0 H3' G A 19 0.912 13.004 1.125 1.00 0.00 H new ATOM 0 H2' G A 19 3.138 12.369 0.264 1.00 0.00 H new ATOM 0 HO2' G A 19 3.953 13.315 2.524 1.00 0.00 H new ATOM 0 HO3' G A 19 2.264 14.723 1.558 1.00 0.00 H new ATOM 0 H1' G A 19 3.440 10.089 1.905 1.00 0.00 H new ATOM 0 H8 G A 19 0.102 9.995 0.286 1.00 0.00 H new ATOM 0 H1 G A 19 4.805 8.146 -3.598 1.00 0.00 H new ATOM 0 H21 G A 19 6.908 9.476 -1.172 1.00 0.00 H new ATOM 0 H22 G A 19 6.749 8.684 -2.743 1.00 0.00 H new TER 227 G A 19 ATOM 228 O5' C B 59 8.540 4.789 -7.952 1.00 0.00 O ATOM 229 C5' C B 59 9.959 4.666 -8.011 1.00 0.00 C ATOM 230 C4' C B 59 10.664 5.558 -6.982 1.00 0.00 C ATOM 231 O4' C B 59 10.268 6.937 -7.121 1.00 0.00 O ATOM 232 C3' C B 59 10.287 5.173 -5.554 1.00 0.00 C ATOM 233 O3' C B 59 11.305 4.320 -5.025 1.00 0.00 O ATOM 234 C2' C B 59 10.353 6.502 -4.827 1.00 0.00 C ATOM 235 O2' C B 59 11.702 6.871 -4.517 1.00 0.00 O ATOM 236 C1' C B 59 9.749 7.415 -5.867 1.00 0.00 C ATOM 237 N1 C B 59 8.279 7.322 -5.839 1.00 0.00 N ATOM 238 C2 C B 59 7.602 7.921 -4.789 1.00 0.00 C ATOM 239 O2 C B 59 8.222 8.535 -3.923 1.00 0.00 O ATOM 240 N3 C B 59 6.244 7.796 -4.748 1.00 0.00 N ATOM 241 C4 C B 59 5.589 7.110 -5.697 1.00 0.00 C ATOM 242 N4 C B 59 4.261 7.008 -5.637 1.00 0.00 N ATOM 243 C5 C B 59 6.299 6.495 -6.776 1.00 0.00 C ATOM 244 C6 C B 59 7.625 6.632 -6.802 1.00 0.00 C ATOM 0 H5' C B 59 10.303 4.928 -9.012 1.00 0.00 H new ATOM 0 H5'' C B 59 10.239 3.627 -7.840 1.00 0.00 H new ATOM 0 H4' C B 59 11.730 5.425 -7.165 1.00 0.00 H new ATOM 0 H3' C B 59 9.327 4.664 -5.472 1.00 0.00 H new ATOM 0 H2' C B 59 9.848 6.516 -3.861 1.00 0.00 H new ATOM 0 HO2' C B 59 12.292 6.101 -4.655 1.00 0.00 H new ATOM 0 HO5' C B 59 8.297 5.733 -7.854 1.00 0.00 H new ATOM 0 H1' C B 59 9.997 8.462 -5.695 1.00 0.00 H new ATOM 0 H41 C B 59 3.756 6.488 -6.355 1.00 0.00 H new ATOM 0 H42 C B 59 3.750 7.450 -4.873 1.00 0.00 H new ATOM 0 H5 C B 59 5.779 5.939 -7.542 1.00 0.00 H new ATOM 0 H6 C B 59 8.188 6.184 -7.607 1.00 0.00 H new ATOM 257 P A B 60 10.939 3.224 -3.903 1.00 0.00 P ATOM 258 OP1 A B 60 12.190 2.548 -3.491 1.00 0.00 O ATOM 259 OP2 A B 60 9.793 2.426 -4.391 1.00 0.00 O ATOM 260 O5' A B 60 10.432 4.137 -2.678 1.00 0.00 O ATOM 261 C5' A B 60 11.304 5.098 -2.078 1.00 0.00 C ATOM 262 C4' A B 60 10.610 5.874 -0.963 1.00 0.00 C ATOM 263 O4' A B 60 9.670 6.832 -1.475 1.00 0.00 O ATOM 264 C3' A B 60 9.783 4.954 -0.085 1.00 0.00 C ATOM 265 O3' A B 60 10.624 4.408 0.937 1.00 0.00 O ATOM 266 C2' A B 60 8.811 5.935 0.537 1.00 0.00 C ATOM 267 O2' A B 60 9.424 6.684 1.594 1.00 0.00 O ATOM 268 C1' A B 60 8.483 6.822 -0.657 1.00 0.00 C ATOM 269 N9 A B 60 7.320 6.299 -1.406 1.00 0.00 N ATOM 270 C8 A B 60 7.270 5.555 -2.542 1.00 0.00 C ATOM 271 N7 A B 60 6.103 5.225 -2.987 1.00 0.00 N ATOM 272 C5 A B 60 5.262 5.817 -2.040 1.00 0.00 C ATOM 273 C6 A B 60 3.869 5.862 -1.904 1.00 0.00 C ATOM 274 N6 A B 60 3.034 5.269 -2.762 1.00 0.00 N ATOM 275 N1 A B 60 3.372 6.539 -0.851 1.00 0.00 N ATOM 276 C2 A B 60 4.195 7.137 0.017 1.00 0.00 C ATOM 277 N3 A B 60 5.522 7.154 -0.017 1.00 0.00 N ATOM 278 C4 A B 60 5.995 6.472 -1.077 1.00 0.00 C ATOM 0 H5' A B 60 11.657 5.793 -2.839 1.00 0.00 H new ATOM 0 H5'' A B 60 12.182 4.592 -1.677 1.00 0.00 H new ATOM 0 H4' A B 60 11.416 6.359 -0.413 1.00 0.00 H new ATOM 0 H3' A B 60 9.314 4.120 -0.607 1.00 0.00 H new ATOM 0 H2' A B 60 7.942 5.470 1.002 1.00 0.00 H new ATOM 0 HO2' A B 60 10.237 6.225 1.891 1.00 0.00 H new ATOM 0 H1' A B 60 8.209 7.829 -0.343 1.00 0.00 H new ATOM 0 H8 A B 60 8.171 5.251 -3.053 1.00 0.00 H new ATOM 0 H61 A B 60 2.026 5.331 -2.618 1.00 0.00 H new ATOM 0 H62 A B 60 3.404 4.754 -3.561 1.00 0.00 H new ATOM 0 H2 A B 60 3.729 7.664 0.836 1.00 0.00 H new ATOM 290 P G B 61 10.485 2.857 1.357 1.00 0.00 P ATOM 291 OP1 G B 61 11.641 2.503 2.211 1.00 0.00 O ATOM 292 OP2 G B 61 10.203 2.072 0.134 1.00 0.00 O ATOM 293 O5' G B 61 9.163 2.854 2.273 1.00 0.00 O ATOM 294 C5' G B 61 9.204 3.381 3.599 1.00 0.00 C ATOM 295 C4' G B 61 7.805 3.569 4.175 1.00 0.00 C ATOM 296 O4' G B 61 7.035 4.461 3.366 1.00 0.00 O ATOM 297 C3' G B 61 7.018 2.267 4.189 1.00 0.00 C ATOM 298 O3' G B 61 7.188 1.629 5.457 1.00 0.00 O ATOM 299 C2' G B 61 5.576 2.722 4.092 1.00 0.00 C ATOM 300 O2' G B 61 4.995 2.910 5.386 1.00 0.00 O ATOM 301 C1' G B 61 5.666 4.029 3.322 1.00 0.00 C ATOM 302 N9 G B 61 5.200 3.817 1.942 1.00 0.00 N ATOM 303 C8 G B 61 5.899 3.604 0.799 1.00 0.00 C ATOM 304 N7 G B 61 5.224 3.414 -0.285 1.00 0.00 N ATOM 305 C5 G B 61 3.910 3.504 0.181 1.00 0.00 C ATOM 306 C6 G B 61 2.681 3.382 -0.519 1.00 0.00 C ATOM 307 O6 G B 61 2.503 3.166 -1.716 1.00 0.00 O ATOM 308 N1 G B 61 1.594 3.538 0.332 1.00 0.00 N ATOM 309 C2 G B 61 1.674 3.781 1.686 1.00 0.00 C ATOM 310 N2 G B 61 0.518 3.888 2.334 1.00 0.00 N ATOM 311 N3 G B 61 2.821 3.900 2.349 1.00 0.00 N ATOM 312 C4 G B 61 3.892 3.752 1.543 1.00 0.00 C ATOM 0 H5' G B 61 9.727 4.337 3.594 1.00 0.00 H new ATOM 0 H5'' G B 61 9.774 2.709 4.240 1.00 0.00 H new ATOM 0 H4' G B 61 7.954 3.952 5.184 1.00 0.00 H new ATOM 0 H3' G B 61 7.324 1.579 3.401 1.00 0.00 H new ATOM 0 H2' G B 61 4.935 1.989 3.602 1.00 0.00 H new ATOM 0 HO2' G B 61 4.038 2.703 5.348 1.00 0.00 H new ATOM 0 H1' G B 61 5.033 4.800 3.761 1.00 0.00 H new ATOM 0 H8 G B 61 6.979 3.594 0.796 1.00 0.00 H new ATOM 0 H1 G B 61 0.663 3.467 -0.078 1.00 0.00 H new ATOM 0 H21 G B 61 0.511 4.068 3.338 1.00 0.00 H new ATOM 0 H22 G B 61 -0.362 3.790 1.827 1.00 0.00 H new ATOM 324 P U B 62 6.669 0.118 5.675 1.00 0.00 P ATOM 325 OP1 U B 62 7.354 -0.445 6.861 1.00 0.00 O ATOM 326 OP2 U B 62 6.731 -0.590 4.377 1.00 0.00 O ATOM 327 O5' U B 62 5.118 0.360 6.049 1.00 0.00 O ATOM 328 C5' U B 62 4.791 1.087 7.236 1.00 0.00 C ATOM 329 C4' U B 62 3.330 1.542 7.275 1.00 0.00 C ATOM 330 O4' U B 62 2.988 2.329 6.128 1.00 0.00 O ATOM 331 C3' U B 62 2.339 0.392 7.238 1.00 0.00 C ATOM 332 O3' U B 62 2.147 -0.123 8.556 1.00 0.00 O ATOM 333 C2' U B 62 1.084 1.129 6.826 1.00 0.00 C ATOM 334 O2' U B 62 0.542 1.899 7.906 1.00 0.00 O ATOM 335 C1' U B 62 1.639 2.016 5.728 1.00 0.00 C ATOM 336 N1 U B 62 1.621 1.301 4.447 1.00 0.00 N ATOM 337 C2 U B 62 0.418 1.208 3.770 1.00 0.00 C ATOM 338 O2 U B 62 -0.627 1.658 4.230 1.00 0.00 O ATOM 339 N3 U B 62 0.460 0.558 2.549 1.00 0.00 N ATOM 340 C4 U B 62 1.587 0.008 1.960 1.00 0.00 C ATOM 341 O4 U B 62 1.518 -0.529 0.857 1.00 0.00 O ATOM 342 C5 U B 62 2.791 0.152 2.750 1.00 0.00 C ATOM 343 C6 U B 62 2.767 0.775 3.945 1.00 0.00 C ATOM 0 H5' U B 62 5.440 1.960 7.311 1.00 0.00 H new ATOM 0 H5'' U B 62 4.995 0.462 8.106 1.00 0.00 H new ATOM 0 H4' U B 62 3.261 2.097 8.210 1.00 0.00 H new ATOM 0 H3' U B 62 2.633 -0.442 6.601 1.00 0.00 H new ATOM 0 H2' U B 62 0.258 0.487 6.521 1.00 0.00 H new ATOM 0 HO2' U B 62 0.950 1.612 8.749 1.00 0.00 H new ATOM 0 H1' U B 62 1.048 2.922 5.592 1.00 0.00 H new ATOM 0 H3 U B 62 -0.418 0.476 2.036 1.00 0.00 H new ATOM 0 H5 U B 62 3.723 -0.246 2.376 1.00 0.00 H new ATOM 0 H6 U B 62 3.680 0.857 4.516 1.00 0.00 H new ATOM 354 P G B 63 1.609 -1.627 8.755 1.00 0.00 P ATOM 355 OP1 G B 63 1.415 -1.862 10.202 1.00 0.00 O ATOM 356 OP2 G B 63 2.474 -2.535 7.969 1.00 0.00 O ATOM 357 O5' G B 63 0.159 -1.579 8.050 1.00 0.00 O ATOM 358 C5' G B 63 -0.870 -0.729 8.566 1.00 0.00 C ATOM 359 C4' G B 63 -2.186 -0.891 7.804 1.00 0.00 C ATOM 360 O4' G B 63 -2.166 -0.227 6.536 1.00 0.00 O ATOM 361 C3' G B 63 -2.469 -2.343 7.468 1.00 0.00 C ATOM 362 O3' G B 63 -3.126 -2.944 8.586 1.00 0.00 O ATOM 363 C2' G B 63 -3.462 -2.198 6.331 1.00 0.00 C ATOM 364 O2' G B 63 -4.779 -1.904 6.812 1.00 0.00 O ATOM 365 C1' G B 63 -2.873 -1.032 5.567 1.00 0.00 C ATOM 366 N9 G B 63 -1.965 -1.512 4.511 1.00 0.00 N ATOM 367 C8 G B 63 -0.615 -1.603 4.509 1.00 0.00 C ATOM 368 N7 G B 63 -0.042 -2.008 3.429 1.00 0.00 N ATOM 369 C5 G B 63 -1.137 -2.228 2.594 1.00 0.00 C ATOM 370 C6 G B 63 -1.175 -2.686 1.255 1.00 0.00 C ATOM 371 O6 G B 63 -0.232 -2.988 0.527 1.00 0.00 O ATOM 372 N1 G B 63 -2.477 -2.773 0.785 1.00 0.00 N ATOM 373 C2 G B 63 -3.609 -2.462 1.508 1.00 0.00 C ATOM 374 N2 G B 63 -4.775 -2.633 0.885 1.00 0.00 N ATOM 375 N3 G B 63 -3.583 -2.024 2.771 1.00 0.00 N ATOM 376 C4 G B 63 -2.322 -1.930 3.250 1.00 0.00 C ATOM 0 H5' G B 63 -0.544 0.310 8.509 1.00 0.00 H new ATOM 0 H5'' G B 63 -1.032 -0.955 9.620 1.00 0.00 H new ATOM 0 H4' G B 63 -2.938 -0.468 8.470 1.00 0.00 H new ATOM 0 H3' G B 63 -1.590 -2.942 7.228 1.00 0.00 H new ATOM 0 H2' G B 63 -3.590 -3.102 5.735 1.00 0.00 H new ATOM 0 HO2' G B 63 -4.788 -1.952 7.791 1.00 0.00 H new ATOM 0 H1' G B 63 -3.648 -0.449 5.071 1.00 0.00 H new ATOM 0 H8 G B 63 -0.037 -1.345 5.384 1.00 0.00 H new ATOM 0 H1 G B 63 -2.608 -3.093 -0.174 1.00 0.00 H new ATOM 0 H21 G B 63 -5.648 -2.420 1.368 1.00 0.00 H new ATOM 0 H22 G B 63 -4.795 -2.977 -0.075 1.00 0.00 H new ATOM 388 P U B 64 -2.778 -4.455 9.011 1.00 0.00 P ATOM 389 OP1 U B 64 -3.333 -4.696 10.362 1.00 0.00 O ATOM 390 OP2 U B 64 -1.341 -4.693 8.747 1.00 0.00 O ATOM 391 O5' U B 64 -3.635 -5.307 7.954 1.00 0.00 O ATOM 392 C5' U B 64 -5.043 -5.100 7.836 1.00 0.00 C ATOM 393 C4' U B 64 -5.614 -5.825 6.624 1.00 0.00 C ATOM 394 O4' U B 64 -5.420 -5.086 5.414 1.00 0.00 O ATOM 395 C3' U B 64 -4.902 -7.141 6.395 1.00 0.00 C ATOM 396 O3' U B 64 -5.543 -8.152 7.176 1.00 0.00 O ATOM 397 C2' U B 64 -5.187 -7.397 4.931 1.00 0.00 C ATOM 398 O2' U B 64 -6.483 -7.978 4.742 1.00 0.00 O ATOM 399 C1' U B 64 -5.115 -5.998 4.343 1.00 0.00 C ATOM 400 N1 U B 64 -3.787 -5.719 3.761 1.00 0.00 N ATOM 401 C2 U B 64 -3.642 -5.926 2.402 1.00 0.00 C ATOM 402 O2 U B 64 -4.561 -6.353 1.706 1.00 0.00 O ATOM 403 N3 U B 64 -2.401 -5.631 1.869 1.00 0.00 N ATOM 404 C4 U B 64 -1.306 -5.155 2.572 1.00 0.00 C ATOM 405 O4 U B 64 -0.244 -4.925 1.997 1.00 0.00 O ATOM 406 C5 U B 64 -1.548 -4.971 3.988 1.00 0.00 C ATOM 407 C6 U B 64 -2.755 -5.251 4.528 1.00 0.00 C ATOM 0 H5' U B 64 -5.249 -4.033 7.754 1.00 0.00 H new ATOM 0 H5'' U B 64 -5.541 -5.452 8.740 1.00 0.00 H new ATOM 0 H4' U B 64 -6.674 -5.958 6.841 1.00 0.00 H new ATOM 0 H3' U B 64 -3.843 -7.134 6.653 1.00 0.00 H new ATOM 0 H2' U B 64 -4.497 -8.103 4.468 1.00 0.00 H new ATOM 0 HO2' U B 64 -6.875 -8.195 5.614 1.00 0.00 H new ATOM 0 H1' U B 64 -5.826 -5.889 3.524 1.00 0.00 H new ATOM 0 H3 U B 64 -2.280 -5.777 0.867 1.00 0.00 H new ATOM 0 H5 U B 64 -0.753 -4.605 4.621 1.00 0.00 H new ATOM 0 H6 U B 64 -2.908 -5.102 5.587 1.00 0.00 H new ATOM 418 P C B 65 -4.665 -9.283 7.914 1.00 0.00 P ATOM 419 OP1 C B 65 -5.527 -9.968 8.903 1.00 0.00 O ATOM 420 OP2 C B 65 -3.389 -8.669 8.347 1.00 0.00 O ATOM 421 O5' C B 65 -4.350 -10.314 6.720 1.00 0.00 O ATOM 422 C5' C B 65 -5.419 -10.964 6.034 1.00 0.00 C ATOM 423 C4' C B 65 -4.926 -11.733 4.813 1.00 0.00 C ATOM 424 O4' C B 65 -4.731 -10.871 3.695 1.00 0.00 O ATOM 425 C3' C B 65 -3.580 -12.384 5.069 1.00 0.00 C ATOM 426 O3' C B 65 -3.723 -13.655 5.716 1.00 0.00 O ATOM 427 C2' C B 65 -3.036 -12.533 3.659 1.00 0.00 C ATOM 428 O2' C B 65 -3.521 -13.725 3.033 1.00 0.00 O ATOM 429 C1' C B 65 -3.566 -11.280 2.967 1.00 0.00 C ATOM 430 N1 C B 65 -2.560 -10.213 2.970 1.00 0.00 N ATOM 431 C2 C B 65 -1.756 -10.081 1.855 1.00 0.00 C ATOM 432 O2 C B 65 -1.876 -10.862 0.913 1.00 0.00 O ATOM 433 N3 C B 65 -0.845 -9.070 1.835 1.00 0.00 N ATOM 434 C4 C B 65 -0.736 -8.224 2.869 1.00 0.00 C ATOM 435 N4 C B 65 0.186 -7.260 2.832 1.00 0.00 N ATOM 436 C5 C B 65 -1.577 -8.362 4.020 1.00 0.00 C ATOM 437 C6 C B 65 -2.460 -9.370 4.027 1.00 0.00 C ATOM 0 H5' C B 65 -6.155 -10.223 5.723 1.00 0.00 H new ATOM 0 H5'' C B 65 -5.924 -11.649 6.715 1.00 0.00 H new ATOM 0 H4' C B 65 -5.695 -12.479 4.610 1.00 0.00 H new ATOM 0 H3' C B 65 -2.933 -11.812 5.734 1.00 0.00 H new ATOM 0 H2' C B 65 -1.950 -12.622 3.620 1.00 0.00 H new ATOM 0 HO2' C B 65 -3.858 -14.340 3.717 1.00 0.00 H new ATOM 0 HO3' C B 65 -2.838 -14.048 5.865 1.00 0.00 H new ATOM 0 H1' C B 65 -3.805 -11.488 1.924 1.00 0.00 H new ATOM 0 H41 C B 65 0.277 -6.611 3.614 1.00 0.00 H new ATOM 0 H42 C B 65 0.800 -7.172 2.022 1.00 0.00 H new ATOM 0 H5 C B 65 -1.502 -7.678 4.853 1.00 0.00 H new ATOM 0 H6 C B 65 -3.100 -9.513 4.885 1.00 0.00 H new TER 450 C B 65