USER MOD reduce.3.24.130724 H: found=0, std=0, add=154, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 154 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 -13:sc= 0.292 USER MOD Single : A 1 G O5' : rot 180:sc= -0.394 USER MOD Single : A 2 G O2' : rot -26:sc= 0.316 USER MOD Single : A 3 U O2' : rot -13:sc= 0.3 USER MOD Single : A 4 U O2' : rot -19:sc= 0.358 USER MOD Single : A 5 C O2' : rot -12:sc= 0.355 USER MOD Single : A 6 A O2' : rot 4:sc= -4.11! USER MOD Single : A 7 G O2' : rot -25:sc= 0.562 USER MOD Single : A 8 A O2' : rot 168:sc= -3.71! USER MOD Single : A 9 A O2' : rot 11:sc= 0.242 USER MOD Single : A 10 G O2' : rot -13:sc= 0.338 USER MOD Single : A 11 A O2' : rot -108:sc= 0.05 USER MOD Single : A 12 A O2' : rot -23:sc= 0.316 USER MOD Single : A 13 C O2' : rot -15:sc= 0.427 USER MOD Single : A 14 C O2' : rot -28:sc= 0.191 USER MOD Single : A 14 C O3' : rot 180:sc= 0.159 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -5.278 -9.284 -9.073 1.00 0.00 O ATOM 2 C5' G A 1 -6.676 -9.508 -9.274 1.00 0.00 C ATOM 3 C4' G A 1 -7.322 -10.153 -8.052 1.00 0.00 C ATOM 4 O4' G A 1 -6.484 -11.170 -7.495 1.00 0.00 O ATOM 5 C3' G A 1 -7.527 -9.138 -6.939 1.00 0.00 C ATOM 6 O3' G A 1 -8.840 -8.588 -7.061 1.00 0.00 O ATOM 7 C2' G A 1 -7.479 -9.991 -5.687 1.00 0.00 C ATOM 8 O2' G A 1 -8.759 -10.559 -5.387 1.00 0.00 O ATOM 9 C1' G A 1 -6.465 -11.067 -6.060 1.00 0.00 C ATOM 10 N9 G A 1 -5.121 -10.710 -5.569 1.00 0.00 N ATOM 11 C8 G A 1 -4.144 -9.985 -6.168 1.00 0.00 C ATOM 12 N7 G A 1 -3.050 -9.796 -5.510 1.00 0.00 N ATOM 13 C5 G A 1 -3.313 -10.476 -4.317 1.00 0.00 C ATOM 14 C6 G A 1 -2.498 -10.644 -3.166 1.00 0.00 C ATOM 15 O6 G A 1 -1.361 -10.219 -2.968 1.00 0.00 O ATOM 16 N1 G A 1 -3.141 -11.394 -2.190 1.00 0.00 N ATOM 17 C2 G A 1 -4.412 -11.921 -2.302 1.00 0.00 C ATOM 18 N2 G A 1 -4.857 -12.615 -1.255 1.00 0.00 N ATOM 19 N3 G A 1 -5.187 -11.767 -3.382 1.00 0.00 N ATOM 20 C4 G A 1 -4.581 -11.039 -4.347 1.00 0.00 C ATOM 0 H5' G A 1 -6.821 -10.149 -10.144 1.00 0.00 H new ATOM 0 H5'' G A 1 -7.170 -8.561 -9.490 1.00 0.00 H new ATOM 0 H4' G A 1 -8.270 -10.565 -8.399 1.00 0.00 H new ATOM 0 H3' G A 1 -6.802 -8.324 -6.947 1.00 0.00 H new ATOM 0 H2' G A 1 -7.208 -9.430 -4.792 1.00 0.00 H new ATOM 0 HO2' G A 1 -9.448 -10.113 -5.922 1.00 0.00 H new ATOM 0 HO5' G A 1 -4.894 -8.871 -9.875 1.00 0.00 H new ATOM 0 H1' G A 1 -6.719 -12.023 -5.602 1.00 0.00 H new ATOM 0 H8 G A 1 -4.277 -9.580 -7.160 1.00 0.00 H new ATOM 0 H1 G A 1 -2.634 -11.569 -1.322 1.00 0.00 H new ATOM 0 H21 G A 1 -5.789 -13.030 -1.277 1.00 0.00 H new ATOM 0 H22 G A 1 -4.266 -12.732 -0.432 1.00 0.00 H new ATOM 33 P G A 2 -9.148 -7.096 -6.539 1.00 0.00 P ATOM 34 OP1 G A 2 -10.502 -6.714 -6.998 1.00 0.00 O ATOM 35 OP2 G A 2 -7.988 -6.240 -6.873 1.00 0.00 O ATOM 36 O5' G A 2 -9.190 -7.284 -4.941 1.00 0.00 O ATOM 37 C5' G A 2 -10.368 -7.779 -4.301 1.00 0.00 C ATOM 38 C4' G A 2 -10.182 -7.896 -2.790 1.00 0.00 C ATOM 39 O4' G A 2 -9.088 -8.755 -2.459 1.00 0.00 O ATOM 40 C3' G A 2 -9.827 -6.557 -2.174 1.00 0.00 C ATOM 41 O3' G A 2 -11.035 -5.874 -1.828 1.00 0.00 O ATOM 42 C2' G A 2 -9.120 -6.963 -0.896 1.00 0.00 C ATOM 43 O2' G A 2 -10.052 -7.235 0.158 1.00 0.00 O ATOM 44 C1' G A 2 -8.378 -8.226 -1.324 1.00 0.00 C ATOM 45 N9 G A 2 -6.980 -7.911 -1.668 1.00 0.00 N ATOM 46 C8 G A 2 -6.439 -7.560 -2.860 1.00 0.00 C ATOM 47 N7 G A 2 -5.173 -7.303 -2.890 1.00 0.00 N ATOM 48 C5 G A 2 -4.811 -7.505 -1.555 1.00 0.00 C ATOM 49 C6 G A 2 -3.541 -7.381 -0.929 1.00 0.00 C ATOM 50 O6 G A 2 -2.467 -7.063 -1.435 1.00 0.00 O ATOM 51 N1 G A 2 -3.613 -7.674 0.428 1.00 0.00 N ATOM 52 C2 G A 2 -4.760 -8.040 1.104 1.00 0.00 C ATOM 53 N2 G A 2 -4.625 -8.282 2.407 1.00 0.00 N ATOM 54 N3 G A 2 -5.957 -8.159 0.521 1.00 0.00 N ATOM 55 C4 G A 2 -5.912 -7.878 -0.801 1.00 0.00 C ATOM 0 H5' G A 2 -10.623 -8.755 -4.713 1.00 0.00 H new ATOM 0 H5'' G A 2 -11.205 -7.114 -4.514 1.00 0.00 H new ATOM 0 H4' G A 2 -11.128 -8.283 -2.411 1.00 0.00 H new ATOM 0 H3' G A 2 -9.239 -5.910 -2.826 1.00 0.00 H new ATOM 0 H2' G A 2 -8.468 -6.187 -0.495 1.00 0.00 H new ATOM 0 HO2' G A 2 -10.876 -6.727 0.005 1.00 0.00 H new ATOM 0 H1' G A 2 -8.344 -8.959 -0.518 1.00 0.00 H new ATOM 0 H8 G A 2 -7.044 -7.497 -3.752 1.00 0.00 H new ATOM 0 H1 G A 2 -2.749 -7.614 0.967 1.00 0.00 H new ATOM 0 H21 G A 2 -5.436 -8.557 2.961 1.00 0.00 H new ATOM 0 H22 G A 2 -3.711 -8.193 2.850 1.00 0.00 H new ATOM 67 P U A 3 -11.081 -4.265 -1.816 1.00 0.00 P ATOM 68 OP1 U A 3 -12.480 -3.843 -1.583 1.00 0.00 O ATOM 69 OP2 U A 3 -10.351 -3.771 -3.004 1.00 0.00 O ATOM 70 O5' U A 3 -10.221 -3.898 -0.505 1.00 0.00 O ATOM 71 C5' U A 3 -10.865 -3.772 0.765 1.00 0.00 C ATOM 72 C4' U A 3 -9.860 -3.622 1.905 1.00 0.00 C ATOM 73 O4' U A 3 -8.760 -4.519 1.766 1.00 0.00 O ATOM 74 C3' U A 3 -9.227 -2.246 1.917 1.00 0.00 C ATOM 75 O3' U A 3 -10.068 -1.358 2.659 1.00 0.00 O ATOM 76 C2' U A 3 -7.955 -2.482 2.716 1.00 0.00 C ATOM 77 O2' U A 3 -8.188 -2.344 4.123 1.00 0.00 O ATOM 78 C1' U A 3 -7.587 -3.923 2.350 1.00 0.00 C ATOM 79 N1 U A 3 -6.451 -3.943 1.411 1.00 0.00 N ATOM 80 C2 U A 3 -5.184 -3.829 1.951 1.00 0.00 C ATOM 81 O2 U A 3 -4.997 -3.729 3.161 1.00 0.00 O ATOM 82 N3 U A 3 -4.136 -3.833 1.049 1.00 0.00 N ATOM 83 C4 U A 3 -4.244 -3.939 -0.327 1.00 0.00 C ATOM 84 O4 U A 3 -3.240 -3.930 -1.037 1.00 0.00 O ATOM 85 C5 U A 3 -5.605 -4.056 -0.804 1.00 0.00 C ATOM 86 C6 U A 3 -6.648 -4.055 0.061 1.00 0.00 C ATOM 0 H5' U A 3 -11.488 -4.649 0.944 1.00 0.00 H new ATOM 0 H5'' U A 3 -11.528 -2.907 0.751 1.00 0.00 H new ATOM 0 H4' U A 3 -10.435 -3.818 2.810 1.00 0.00 H new ATOM 0 H3' U A 3 -9.065 -1.822 0.926 1.00 0.00 H new ATOM 0 H2' U A 3 -7.166 -1.765 2.490 1.00 0.00 H new ATOM 0 HO2' U A 3 -9.064 -1.930 4.270 1.00 0.00 H new ATOM 0 H1' U A 3 -7.275 -4.485 3.230 1.00 0.00 H new ATOM 0 H3 U A 3 -3.195 -3.750 1.434 1.00 0.00 H new ATOM 0 H5 U A 3 -5.792 -4.145 -1.864 1.00 0.00 H new ATOM 0 H6 U A 3 -7.654 -4.144 -0.322 1.00 0.00 H new ATOM 97 P U A 4 -9.934 0.237 2.470 1.00 0.00 P ATOM 98 OP1 U A 4 -10.955 0.889 3.321 1.00 0.00 O ATOM 99 OP2 U A 4 -9.886 0.530 1.020 1.00 0.00 O ATOM 100 O5' U A 4 -8.482 0.548 3.097 1.00 0.00 O ATOM 101 C5' U A 4 -8.339 0.790 4.500 1.00 0.00 C ATOM 102 C4' U A 4 -6.871 0.846 4.922 1.00 0.00 C ATOM 103 O4' U A 4 -6.085 -0.133 4.244 1.00 0.00 O ATOM 104 C3' U A 4 -6.232 2.170 4.546 1.00 0.00 C ATOM 105 O3' U A 4 -6.468 3.114 5.595 1.00 0.00 O ATOM 106 C2' U A 4 -4.753 1.824 4.538 1.00 0.00 C ATOM 107 O2' U A 4 -4.176 1.951 5.842 1.00 0.00 O ATOM 108 C1' U A 4 -4.748 0.370 4.064 1.00 0.00 C ATOM 109 N1 U A 4 -4.331 0.291 2.652 1.00 0.00 N ATOM 110 C2 U A 4 -2.976 0.341 2.390 1.00 0.00 C ATOM 111 O2 U A 4 -2.140 0.425 3.288 1.00 0.00 O ATOM 112 N3 U A 4 -2.613 0.292 1.058 1.00 0.00 N ATOM 113 C4 U A 4 -3.476 0.199 -0.021 1.00 0.00 C ATOM 114 O4 U A 4 -3.043 0.164 -1.170 1.00 0.00 O ATOM 115 C5 U A 4 -4.874 0.150 0.348 1.00 0.00 C ATOM 116 C6 U A 4 -5.253 0.197 1.647 1.00 0.00 C ATOM 0 H5' U A 4 -8.847 0.003 5.058 1.00 0.00 H new ATOM 0 H5'' U A 4 -8.827 1.730 4.758 1.00 0.00 H new ATOM 0 H4' U A 4 -6.883 0.684 6.000 1.00 0.00 H new ATOM 0 H3' U A 4 -6.603 2.592 3.612 1.00 0.00 H new ATOM 0 H2' U A 4 -4.161 2.486 3.906 1.00 0.00 H new ATOM 0 HO2' U A 4 -4.753 2.512 6.402 1.00 0.00 H new ATOM 0 H1' U A 4 -4.039 -0.229 4.635 1.00 0.00 H new ATOM 0 H3 U A 4 -1.615 0.328 0.850 1.00 0.00 H new ATOM 0 H5 U A 4 -5.626 0.075 -0.424 1.00 0.00 H new ATOM 0 H6 U A 4 -6.304 0.160 1.894 1.00 0.00 H new ATOM 127 P C A 5 -6.468 4.695 5.281 1.00 0.00 P ATOM 128 OP1 C A 5 -6.988 5.403 6.472 1.00 0.00 O ATOM 129 OP2 C A 5 -7.106 4.905 3.962 1.00 0.00 O ATOM 130 O5' C A 5 -4.899 5.031 5.142 1.00 0.00 O ATOM 131 C5' C A 5 -4.141 5.423 6.289 1.00 0.00 C ATOM 132 C4' C A 5 -2.652 5.540 5.974 1.00 0.00 C ATOM 133 O4' C A 5 -2.196 4.463 5.160 1.00 0.00 O ATOM 134 C3' C A 5 -2.353 6.784 5.162 1.00 0.00 C ATOM 135 O3' C A 5 -2.145 7.879 6.057 1.00 0.00 O ATOM 136 C2' C A 5 -1.028 6.438 4.505 1.00 0.00 C ATOM 137 O2' C A 5 0.080 6.789 5.342 1.00 0.00 O ATOM 138 C1' C A 5 -1.124 4.922 4.319 1.00 0.00 C ATOM 139 N1 C A 5 -1.373 4.589 2.905 1.00 0.00 N ATOM 140 C2 C A 5 -0.275 4.547 2.060 1.00 0.00 C ATOM 141 O2 C A 5 0.849 4.770 2.501 1.00 0.00 O ATOM 142 N3 C A 5 -0.482 4.255 0.747 1.00 0.00 N ATOM 143 C4 C A 5 -1.714 4.014 0.283 1.00 0.00 C ATOM 144 N4 C A 5 -1.881 3.731 -1.009 1.00 0.00 N ATOM 145 C5 C A 5 -2.850 4.056 1.152 1.00 0.00 C ATOM 146 C6 C A 5 -2.635 4.346 2.448 1.00 0.00 C ATOM 0 H5' C A 5 -4.287 4.695 7.087 1.00 0.00 H new ATOM 0 H5'' C A 5 -4.510 6.380 6.659 1.00 0.00 H new ATOM 0 H4' C A 5 -2.158 5.552 6.945 1.00 0.00 H new ATOM 0 H3' C A 5 -3.142 7.056 4.461 1.00 0.00 H new ATOM 0 H2' C A 5 -0.860 6.977 3.573 1.00 0.00 H new ATOM 0 HO2' C A 5 -0.232 7.357 6.077 1.00 0.00 H new ATOM 0 H1' C A 5 -0.190 4.434 4.596 1.00 0.00 H new ATOM 0 H41 C A 5 -2.815 3.546 -1.374 1.00 0.00 H new ATOM 0 H42 C A 5 -1.074 3.700 -1.633 1.00 0.00 H new ATOM 0 H5 C A 5 -3.845 3.862 0.780 1.00 0.00 H new ATOM 0 H6 C A 5 -3.469 4.387 3.133 1.00 0.00 H new ATOM 158 P A A 6 -2.412 9.390 5.569 1.00 0.00 P ATOM 159 OP1 A A 6 -1.521 10.291 6.334 1.00 0.00 O ATOM 160 OP2 A A 6 -3.874 9.625 5.567 1.00 0.00 O ATOM 161 O5' A A 6 -1.906 9.360 4.040 1.00 0.00 O ATOM 162 C5' A A 6 -1.028 10.375 3.547 1.00 0.00 C ATOM 163 C4' A A 6 -0.200 9.873 2.363 1.00 0.00 C ATOM 164 O4' A A 6 -0.535 8.536 2.028 1.00 0.00 O ATOM 165 C3' A A 6 -0.478 10.677 1.103 1.00 0.00 C ATOM 166 O3' A A 6 0.481 11.734 1.026 1.00 0.00 O ATOM 167 C2' A A 6 -0.197 9.693 -0.032 1.00 0.00 C ATOM 168 O2' A A 6 1.091 9.925 -0.613 1.00 0.00 O ATOM 169 C1' A A 6 -0.263 8.317 0.640 1.00 0.00 C ATOM 170 N9 A A 6 -1.308 7.478 0.024 1.00 0.00 N ATOM 171 C8 A A 6 -2.479 7.033 0.542 1.00 0.00 C ATOM 172 N7 A A 6 -3.222 6.293 -0.211 1.00 0.00 N ATOM 173 C5 A A 6 -2.460 6.229 -1.382 1.00 0.00 C ATOM 174 C6 A A 6 -2.661 5.593 -2.612 1.00 0.00 C ATOM 175 N6 A A 6 -3.741 4.862 -2.886 1.00 0.00 N ATOM 176 N1 A A 6 -1.706 5.738 -3.548 1.00 0.00 N ATOM 177 C2 A A 6 -0.617 6.464 -3.294 1.00 0.00 C ATOM 178 N3 A A 6 -0.324 7.107 -2.168 1.00 0.00 N ATOM 179 C4 A A 6 -1.294 6.948 -1.246 1.00 0.00 C ATOM 0 H5' A A 6 -0.362 10.701 4.346 1.00 0.00 H new ATOM 0 H5'' A A 6 -1.610 11.245 3.243 1.00 0.00 H new ATOM 0 H4' A A 6 0.839 9.966 2.678 1.00 0.00 H new ATOM 0 H3' A A 6 -1.483 11.097 1.072 1.00 0.00 H new ATOM 0 H2' A A 6 -0.908 9.790 -0.852 1.00 0.00 H new ATOM 0 HO2' A A 6 1.551 10.634 -0.116 1.00 0.00 H new ATOM 0 H1' A A 6 0.680 7.786 0.515 1.00 0.00 H new ATOM 0 H8 A A 6 -2.779 7.288 1.548 1.00 0.00 H new ATOM 0 H61 A A 6 -3.839 4.419 -3.800 1.00 0.00 H new ATOM 0 H62 A A 6 -4.470 4.745 -2.182 1.00 0.00 H new ATOM 0 H2 A A 6 0.107 6.538 -4.092 1.00 0.00 H new ATOM 191 P G A 7 0.147 13.081 0.213 1.00 0.00 P ATOM 192 OP1 G A 7 1.360 13.929 0.202 1.00 0.00 O ATOM 193 OP2 G A 7 -1.130 13.624 0.727 1.00 0.00 O ATOM 194 O5' G A 7 -0.100 12.534 -1.281 1.00 0.00 O ATOM 195 C5' G A 7 0.995 12.353 -2.182 1.00 0.00 C ATOM 196 C4' G A 7 0.532 11.788 -3.518 1.00 0.00 C ATOM 197 O4' G A 7 -0.137 10.536 -3.345 1.00 0.00 O ATOM 198 C3' G A 7 -0.471 12.729 -4.194 1.00 0.00 C ATOM 199 O3' G A 7 -0.065 12.899 -5.552 1.00 0.00 O ATOM 200 C2' G A 7 -1.785 11.956 -4.189 1.00 0.00 C ATOM 201 O2' G A 7 -2.560 12.229 -5.361 1.00 0.00 O ATOM 202 C1' G A 7 -1.302 10.519 -4.162 1.00 0.00 C ATOM 203 N9 G A 7 -2.326 9.607 -3.617 1.00 0.00 N ATOM 204 C8 G A 7 -2.791 8.443 -4.127 1.00 0.00 C ATOM 205 N7 G A 7 -3.688 7.808 -3.452 1.00 0.00 N ATOM 206 C5 G A 7 -3.856 8.644 -2.344 1.00 0.00 C ATOM 207 C6 G A 7 -4.713 8.502 -1.220 1.00 0.00 C ATOM 208 O6 G A 7 -5.506 7.596 -0.976 1.00 0.00 O ATOM 209 N1 G A 7 -4.574 9.564 -0.335 1.00 0.00 N ATOM 210 C2 G A 7 -3.718 10.634 -0.505 1.00 0.00 C ATOM 211 N2 G A 7 -3.730 11.555 0.457 1.00 0.00 N ATOM 212 N3 G A 7 -2.907 10.775 -1.560 1.00 0.00 N ATOM 213 C4 G A 7 -3.025 9.752 -2.438 1.00 0.00 C ATOM 0 H5' G A 7 1.727 11.680 -1.736 1.00 0.00 H new ATOM 0 H5'' G A 7 1.496 13.307 -2.344 1.00 0.00 H new ATOM 0 H4' G A 7 1.427 11.668 -4.128 1.00 0.00 H new ATOM 0 H3' G A 7 -0.546 13.699 -3.703 1.00 0.00 H new ATOM 0 H2' G A 7 -2.444 12.214 -3.360 1.00 0.00 H new ATOM 0 HO2' G A 7 -2.320 13.111 -5.713 1.00 0.00 H new ATOM 0 H1' G A 7 -1.092 10.149 -5.165 1.00 0.00 H new ATOM 0 H8 G A 7 -2.424 8.059 -5.067 1.00 0.00 H new ATOM 0 H1 G A 7 -5.150 9.552 0.507 1.00 0.00 H new ATOM 0 H21 G A 7 -3.120 12.370 0.390 1.00 0.00 H new ATOM 0 H22 G A 7 -4.349 11.445 1.260 1.00 0.00 H new ATOM 225 P A A 8 -0.240 14.317 -6.290 1.00 0.00 P ATOM 226 OP1 A A 8 0.457 15.347 -5.489 1.00 0.00 O ATOM 227 OP2 A A 8 -1.670 14.488 -6.629 1.00 0.00 O ATOM 228 O5' A A 8 0.581 14.097 -7.656 1.00 0.00 O ATOM 229 C5' A A 8 0.056 13.261 -8.690 1.00 0.00 C ATOM 230 C4' A A 8 1.064 12.191 -9.117 1.00 0.00 C ATOM 231 O4' A A 8 2.403 12.557 -8.740 1.00 0.00 O ATOM 232 C3' A A 8 0.796 10.845 -8.436 1.00 0.00 C ATOM 233 O3' A A 8 1.183 9.812 -9.346 1.00 0.00 O ATOM 234 C2' A A 8 1.783 10.840 -7.290 1.00 0.00 C ATOM 235 O2' A A 8 2.090 9.513 -6.861 1.00 0.00 O ATOM 236 C1' A A 8 2.969 11.503 -7.953 1.00 0.00 C ATOM 237 N9 A A 8 3.937 12.014 -6.968 1.00 0.00 N ATOM 238 C8 A A 8 3.731 12.638 -5.782 1.00 0.00 C ATOM 239 N7 A A 8 4.774 12.981 -5.102 1.00 0.00 N ATOM 240 C5 A A 8 5.810 12.533 -5.929 1.00 0.00 C ATOM 241 C6 A A 8 7.205 12.574 -5.815 1.00 0.00 C ATOM 242 N6 A A 8 7.836 13.112 -4.772 1.00 0.00 N ATOM 243 N1 A A 8 7.924 12.038 -6.820 1.00 0.00 N ATOM 244 C2 A A 8 7.312 11.493 -7.873 1.00 0.00 C ATOM 245 N3 A A 8 6.003 11.402 -8.081 1.00 0.00 N ATOM 246 C4 A A 8 5.306 11.944 -7.065 1.00 0.00 C ATOM 0 H5' A A 8 -0.213 13.872 -9.551 1.00 0.00 H new ATOM 0 H5'' A A 8 -0.859 12.781 -8.341 1.00 0.00 H new ATOM 0 H4' A A 8 0.957 12.109 -10.199 1.00 0.00 H new ATOM 0 H3' A A 8 -0.240 10.701 -8.131 1.00 0.00 H new ATOM 0 H2' A A 8 1.432 11.333 -6.384 1.00 0.00 H new ATOM 0 HO2' A A 8 2.865 9.534 -6.262 1.00 0.00 H new ATOM 0 H1' A A 8 3.539 10.800 -8.561 1.00 0.00 H new ATOM 0 H8 A A 8 2.734 12.840 -5.420 1.00 0.00 H new ATOM 0 H61 A A 8 8.855 13.116 -4.739 1.00 0.00 H new ATOM 0 H62 A A 8 7.300 13.520 -4.007 1.00 0.00 H new ATOM 0 H2 A A 8 7.951 11.081 -8.640 1.00 0.00 H new ATOM 258 P A A 9 0.433 8.390 -9.353 1.00 0.00 P ATOM 259 OP1 A A 9 0.145 8.025 -10.758 1.00 0.00 O ATOM 260 OP2 A A 9 -0.664 8.436 -8.360 1.00 0.00 O ATOM 261 O5' A A 9 1.577 7.401 -8.799 1.00 0.00 O ATOM 262 C5' A A 9 2.531 6.823 -9.694 1.00 0.00 C ATOM 263 C4' A A 9 3.970 7.193 -9.315 1.00 0.00 C ATOM 264 O4' A A 9 3.966 8.262 -8.366 1.00 0.00 O ATOM 265 C3' A A 9 4.706 6.018 -8.667 1.00 0.00 C ATOM 266 O3' A A 9 5.756 5.613 -9.546 1.00 0.00 O ATOM 267 C2' A A 9 5.382 6.583 -7.423 1.00 0.00 C ATOM 268 O2' A A 9 6.792 6.727 -7.622 1.00 0.00 O ATOM 269 C1' A A 9 4.721 7.933 -7.195 1.00 0.00 C ATOM 270 N9 A A 9 3.864 7.883 -5.998 1.00 0.00 N ATOM 271 C8 A A 9 2.612 7.392 -5.842 1.00 0.00 C ATOM 272 N7 A A 9 2.090 7.453 -4.665 1.00 0.00 N ATOM 273 C5 A A 9 3.113 8.060 -3.935 1.00 0.00 C ATOM 274 C6 A A 9 3.227 8.428 -2.591 1.00 0.00 C ATOM 275 N6 A A 9 2.259 8.234 -1.698 1.00 0.00 N ATOM 276 N1 A A 9 4.376 9.004 -2.205 1.00 0.00 N ATOM 277 C2 A A 9 5.357 9.208 -3.085 1.00 0.00 C ATOM 278 N3 A A 9 5.356 8.899 -4.376 1.00 0.00 N ATOM 279 C4 A A 9 4.196 8.324 -4.739 1.00 0.00 C ATOM 0 H5' A A 9 2.326 7.160 -10.710 1.00 0.00 H new ATOM 0 H5'' A A 9 2.422 5.738 -9.689 1.00 0.00 H new ATOM 0 H4' A A 9 4.475 7.480 -10.237 1.00 0.00 H new ATOM 0 H3' A A 9 4.030 5.190 -8.451 1.00 0.00 H new ATOM 0 H2' A A 9 5.268 5.923 -6.563 1.00 0.00 H new ATOM 0 HO2' A A 9 7.003 6.604 -8.571 1.00 0.00 H new ATOM 0 H1' A A 9 5.472 8.704 -7.022 1.00 0.00 H new ATOM 0 H8 A A 9 2.071 6.965 -6.673 1.00 0.00 H new ATOM 0 H61 A A 9 2.394 8.522 -0.729 1.00 0.00 H new ATOM 0 H62 A A 9 1.382 7.798 -1.983 1.00 0.00 H new ATOM 0 H2 A A 9 6.252 9.677 -2.705 1.00 0.00 H new ATOM 291 P G A 10 6.380 4.133 -9.434 1.00 0.00 P ATOM 292 OP1 G A 10 7.731 4.153 -10.038 1.00 0.00 O ATOM 293 OP2 G A 10 5.369 3.165 -9.917 1.00 0.00 O ATOM 294 O5' G A 10 6.541 3.944 -7.841 1.00 0.00 O ATOM 295 C5' G A 10 7.838 3.972 -7.237 1.00 0.00 C ATOM 296 C4' G A 10 7.759 4.044 -5.714 1.00 0.00 C ATOM 297 O4' G A 10 6.726 4.929 -5.274 1.00 0.00 O ATOM 298 C3' G A 10 7.397 2.700 -5.114 1.00 0.00 C ATOM 299 O3' G A 10 8.597 1.955 -4.899 1.00 0.00 O ATOM 300 C2' G A 10 6.823 3.089 -3.765 1.00 0.00 C ATOM 301 O2' G A 10 7.854 3.247 -2.783 1.00 0.00 O ATOM 302 C1' G A 10 6.131 4.417 -4.066 1.00 0.00 C ATOM 303 N9 G A 10 4.677 4.224 -4.228 1.00 0.00 N ATOM 304 C8 G A 10 3.959 3.973 -5.349 1.00 0.00 C ATOM 305 N7 G A 10 2.683 3.827 -5.225 1.00 0.00 N ATOM 306 C5 G A 10 2.509 4.001 -3.848 1.00 0.00 C ATOM 307 C6 G A 10 1.321 3.960 -3.070 1.00 0.00 C ATOM 308 O6 G A 10 0.169 3.759 -3.446 1.00 0.00 O ATOM 309 N1 G A 10 1.585 4.185 -1.726 1.00 0.00 N ATOM 310 C2 G A 10 2.835 4.421 -1.189 1.00 0.00 C ATOM 311 N2 G A 10 2.881 4.615 0.129 1.00 0.00 N ATOM 312 N3 G A 10 3.959 4.462 -1.914 1.00 0.00 N ATOM 313 C4 G A 10 3.726 4.245 -3.229 1.00 0.00 C ATOM 0 H5' G A 10 8.394 4.831 -7.612 1.00 0.00 H new ATOM 0 H5'' G A 10 8.393 3.081 -7.529 1.00 0.00 H new ATOM 0 H4' G A 10 8.744 4.385 -5.396 1.00 0.00 H new ATOM 0 H3' G A 10 6.725 2.104 -5.732 1.00 0.00 H new ATOM 0 H2' G A 10 6.153 2.337 -3.348 1.00 0.00 H new ATOM 0 HO2' G A 10 8.694 2.879 -3.129 1.00 0.00 H new ATOM 0 H1' G A 10 6.261 5.122 -3.245 1.00 0.00 H new ATOM 0 H8 G A 10 4.438 3.898 -6.314 1.00 0.00 H new ATOM 0 H1 G A 10 0.793 4.175 -1.084 1.00 0.00 H new ATOM 0 H21 G A 10 3.774 4.794 0.587 1.00 0.00 H new ATOM 0 H22 G A 10 2.023 4.584 0.679 1.00 0.00 H new ATOM 325 P A A 11 8.566 0.345 -4.911 1.00 0.00 P ATOM 326 OP1 A A 11 9.963 -0.144 -4.870 1.00 0.00 O ATOM 327 OP2 A A 11 7.665 -0.092 -6.001 1.00 0.00 O ATOM 328 O5' A A 11 7.865 -0.006 -3.504 1.00 0.00 O ATOM 329 C5' A A 11 8.603 0.095 -2.283 1.00 0.00 C ATOM 330 C4' A A 11 7.683 0.230 -1.072 1.00 0.00 C ATOM 331 O4' A A 11 6.568 1.071 -1.345 1.00 0.00 O ATOM 332 C3' A A 11 7.070 -1.103 -0.693 1.00 0.00 C ATOM 333 O3' A A 11 7.948 -1.760 0.224 1.00 0.00 O ATOM 334 C2' A A 11 5.805 -0.705 0.057 1.00 0.00 C ATOM 335 O2' A A 11 6.033 -0.650 1.470 1.00 0.00 O ATOM 336 C1' A A 11 5.469 0.679 -0.507 1.00 0.00 C ATOM 337 N9 A A 11 4.205 0.637 -1.268 1.00 0.00 N ATOM 338 C8 A A 11 3.998 0.593 -2.607 1.00 0.00 C ATOM 339 N7 A A 11 2.775 0.537 -3.020 1.00 0.00 N ATOM 340 C5 A A 11 2.069 0.543 -1.813 1.00 0.00 C ATOM 341 C6 A A 11 0.703 0.499 -1.515 1.00 0.00 C ATOM 342 N6 A A 11 -0.246 0.438 -2.448 1.00 0.00 N ATOM 343 N1 A A 11 0.352 0.522 -0.216 1.00 0.00 N ATOM 344 C2 A A 11 1.286 0.582 0.735 1.00 0.00 C ATOM 345 N3 A A 11 2.605 0.628 0.565 1.00 0.00 N ATOM 346 C4 A A 11 2.932 0.604 -0.743 1.00 0.00 C ATOM 0 H5' A A 11 9.269 0.957 -2.331 1.00 0.00 H new ATOM 0 H5'' A A 11 9.232 -0.787 -2.165 1.00 0.00 H new ATOM 0 H4' A A 11 8.313 0.636 -0.281 1.00 0.00 H new ATOM 0 H3' A A 11 6.889 -1.759 -1.544 1.00 0.00 H new ATOM 0 H2' A A 11 4.994 -1.421 -0.076 1.00 0.00 H new ATOM 0 HO2' A A 11 5.590 -1.410 1.903 1.00 0.00 H new ATOM 0 H1' A A 11 5.328 1.403 0.296 1.00 0.00 H new ATOM 0 H8 A A 11 4.824 0.604 -3.302 1.00 0.00 H new ATOM 0 H61 A A 11 -1.228 0.408 -2.175 1.00 0.00 H new ATOM 0 H62 A A 11 0.010 0.421 -3.435 1.00 0.00 H new ATOM 0 H2 A A 11 0.932 0.595 1.755 1.00 0.00 H new ATOM 358 P A A 12 7.693 -3.295 0.634 1.00 0.00 P ATOM 359 OP1 A A 12 8.945 -3.832 1.211 1.00 0.00 O ATOM 360 OP2 A A 12 7.055 -3.981 -0.511 1.00 0.00 O ATOM 361 O5' A A 12 6.608 -3.169 1.815 1.00 0.00 O ATOM 362 C5' A A 12 7.029 -3.021 3.172 1.00 0.00 C ATOM 363 C4' A A 12 5.860 -3.159 4.145 1.00 0.00 C ATOM 364 O4' A A 12 4.787 -2.276 3.803 1.00 0.00 O ATOM 365 C3' A A 12 5.266 -4.555 4.097 1.00 0.00 C ATOM 366 O3' A A 12 5.916 -5.362 5.082 1.00 0.00 O ATOM 367 C2' A A 12 3.832 -4.325 4.534 1.00 0.00 C ATOM 368 O2' A A 12 3.715 -4.315 5.962 1.00 0.00 O ATOM 369 C1' A A 12 3.526 -2.955 3.938 1.00 0.00 C ATOM 370 N9 A A 12 2.853 -3.091 2.633 1.00 0.00 N ATOM 371 C8 A A 12 3.381 -3.108 1.384 1.00 0.00 C ATOM 372 N7 A A 12 2.564 -3.246 0.394 1.00 0.00 N ATOM 373 C5 A A 12 1.334 -3.333 1.054 1.00 0.00 C ATOM 374 C6 A A 12 0.022 -3.492 0.594 1.00 0.00 C ATOM 375 N6 A A 12 -0.290 -3.595 -0.697 1.00 0.00 N ATOM 376 N1 A A 12 -0.956 -3.538 1.517 1.00 0.00 N ATOM 377 C2 A A 12 -0.665 -3.436 2.815 1.00 0.00 C ATOM 378 N3 A A 12 0.540 -3.284 3.359 1.00 0.00 N ATOM 379 C4 A A 12 1.502 -3.240 2.416 1.00 0.00 C ATOM 0 H5' A A 12 7.498 -2.046 3.303 1.00 0.00 H new ATOM 0 H5'' A A 12 7.785 -3.772 3.402 1.00 0.00 H new ATOM 0 H4' A A 12 6.267 -2.929 5.129 1.00 0.00 H new ATOM 0 H3' A A 12 5.362 -5.043 3.127 1.00 0.00 H new ATOM 0 H2' A A 12 3.145 -5.105 4.205 1.00 0.00 H new ATOM 0 HO2' A A 12 4.467 -4.805 6.355 1.00 0.00 H new ATOM 0 H1' A A 12 2.849 -2.390 4.579 1.00 0.00 H new ATOM 0 H8 A A 12 4.445 -3.010 1.224 1.00 0.00 H new ATOM 0 H61 A A 12 -1.264 -3.710 -0.979 1.00 0.00 H new ATOM 0 H62 A A 12 0.445 -3.559 -1.404 1.00 0.00 H new ATOM 0 H2 A A 12 -1.499 -3.482 3.500 1.00 0.00 H new ATOM 391 P C A 13 5.976 -6.962 4.913 1.00 0.00 P ATOM 392 OP1 C A 13 6.707 -7.523 6.070 1.00 0.00 O ATOM 393 OP2 C A 13 6.427 -7.264 3.537 1.00 0.00 O ATOM 394 O5' C A 13 4.428 -7.387 5.042 1.00 0.00 O ATOM 395 C5' C A 13 3.861 -7.674 6.322 1.00 0.00 C ATOM 396 C4' C A 13 2.394 -8.082 6.213 1.00 0.00 C ATOM 397 O4' C A 13 1.643 -7.134 5.458 1.00 0.00 O ATOM 398 C3' C A 13 2.241 -9.391 5.465 1.00 0.00 C ATOM 399 O3' C A 13 2.304 -10.464 6.409 1.00 0.00 O ATOM 400 C2' C A 13 0.824 -9.313 4.918 1.00 0.00 C ATOM 401 O2' C A 13 -0.123 -9.871 5.836 1.00 0.00 O ATOM 402 C1' C A 13 0.601 -7.808 4.732 1.00 0.00 C ATOM 403 N1 C A 13 0.632 -7.449 3.303 1.00 0.00 N ATOM 404 C2 C A 13 -0.565 -7.499 2.609 1.00 0.00 C ATOM 405 O2 C A 13 -1.600 -7.822 3.190 1.00 0.00 O ATOM 406 N3 C A 13 -0.559 -7.183 1.285 1.00 0.00 N ATOM 407 C4 C A 13 0.575 -6.833 0.668 1.00 0.00 C ATOM 408 N4 C A 13 0.545 -6.530 -0.631 1.00 0.00 N ATOM 409 C5 C A 13 1.815 -6.779 1.379 1.00 0.00 C ATOM 410 C6 C A 13 1.798 -7.094 2.690 1.00 0.00 C ATOM 0 H5' C A 13 3.948 -6.797 6.963 1.00 0.00 H new ATOM 0 H5'' C A 13 4.427 -8.474 6.799 1.00 0.00 H new ATOM 0 H4' C A 13 2.035 -8.156 7.239 1.00 0.00 H new ATOM 0 H3' C A 13 3.000 -9.550 4.699 1.00 0.00 H new ATOM 0 H2' C A 13 0.693 -9.880 3.996 1.00 0.00 H new ATOM 0 HO2' C A 13 0.350 -10.399 6.513 1.00 0.00 H new ATOM 0 H1' C A 13 -0.378 -7.512 5.109 1.00 0.00 H new ATOM 0 H41 C A 13 1.403 -6.262 -1.112 1.00 0.00 H new ATOM 0 H42 C A 13 -0.336 -6.567 -1.143 1.00 0.00 H new ATOM 0 H5 C A 13 2.732 -6.496 0.884 1.00 0.00 H new ATOM 0 H6 C A 13 2.715 -7.065 3.260 1.00 0.00 H new ATOM 422 P C A 14 3.030 -11.848 6.022 1.00 0.00 P ATOM 423 OP1 C A 14 3.350 -12.569 7.274 1.00 0.00 O ATOM 424 OP2 C A 14 4.103 -11.551 5.047 1.00 0.00 O ATOM 425 O5' C A 14 1.866 -12.656 5.258 1.00 0.00 O ATOM 426 C5' C A 14 0.979 -13.510 5.987 1.00 0.00 C ATOM 427 C4' C A 14 -0.264 -13.859 5.172 1.00 0.00 C ATOM 428 O4' C A 14 -0.821 -12.701 4.549 1.00 0.00 O ATOM 429 C3' C A 14 0.072 -14.807 4.037 1.00 0.00 C ATOM 430 O3' C A 14 0.069 -16.173 4.472 1.00 0.00 O ATOM 431 C2' C A 14 -1.050 -14.535 3.050 1.00 0.00 C ATOM 432 O2' C A 14 -2.204 -15.333 3.338 1.00 0.00 O ATOM 433 C1' C A 14 -1.337 -13.048 3.255 1.00 0.00 C ATOM 434 N1 C A 14 -0.702 -12.237 2.198 1.00 0.00 N ATOM 435 C2 C A 14 -1.427 -12.023 1.037 1.00 0.00 C ATOM 436 O2 C A 14 -2.552 -12.502 0.917 1.00 0.00 O ATOM 437 N3 C A 14 -0.859 -11.279 0.049 1.00 0.00 N ATOM 438 C4 C A 14 0.370 -10.765 0.195 1.00 0.00 C ATOM 439 N4 C A 14 0.895 -10.040 -0.793 1.00 0.00 N ATOM 440 C5 C A 14 1.121 -10.982 1.392 1.00 0.00 C ATOM 441 C6 C A 14 0.549 -11.721 2.363 1.00 0.00 C ATOM 0 H5' C A 14 0.681 -13.019 6.914 1.00 0.00 H new ATOM 0 H5'' C A 14 1.501 -14.426 6.265 1.00 0.00 H new ATOM 0 H4' C A 14 -0.964 -14.308 5.877 1.00 0.00 H new ATOM 0 H3' C A 14 1.068 -14.653 3.621 1.00 0.00 H new ATOM 0 H2' C A 14 -0.784 -14.782 2.022 1.00 0.00 H new ATOM 0 HO2' C A 14 -1.925 -16.167 3.771 1.00 0.00 H new ATOM 0 HO3' C A 14 0.288 -16.757 3.716 1.00 0.00 H new ATOM 0 H1' C A 14 -2.407 -12.849 3.199 1.00 0.00 H new ATOM 0 H41 C A 14 1.830 -9.644 -0.694 1.00 0.00 H new ATOM 0 H42 C A 14 0.362 -9.882 -1.648 1.00 0.00 H new ATOM 0 H5 C A 14 2.111 -10.569 1.514 1.00 0.00 H new ATOM 0 H6 C A 14 1.087 -11.906 3.281 1.00 0.00 H new TER 454 C A 14