USER MOD reduce.3.24.130724 H: found=0, std=0, add=133, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 133 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 -25:sc= 0.189 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 G O2' : rot -142:sc= 1.06 USER MOD Single : A 3 G O2' : rot -14:sc= -1.35! USER MOD Single : A 4 C O2' : rot -17:sc= 0.192 USER MOD Single : A 5 G O2' : rot -93:sc= 2.37 USER MOD Single : A 6 A O2' : rot -96:sc= 0.914 USER MOD Single : A 7 G O2' : rot -90:sc= 1.55 USER MOD Single : A 8 A O2' : rot -15:sc= 0.226 USER MOD Single : A 9 G O2' : rot -5:sc= -0.827 USER MOD Single : A 10 C O2' : rot -5:sc= -0.853 USER MOD Single : A 11 C O2' : rot -151:sc= 0.189 USER MOD Single : A 12 U O2' : rot -27:sc= 0.122 USER MOD Single : A 12 U O3' : rot 180:sc= 0.125 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -10.973 1.125 -9.399 1.00 0.00 O ATOM 2 C5' G A 1 -11.238 -0.247 -9.092 1.00 0.00 C ATOM 3 C4' G A 1 -12.056 -0.388 -7.809 1.00 0.00 C ATOM 4 O4' G A 1 -12.259 -1.768 -7.466 1.00 0.00 O ATOM 5 C3' G A 1 -11.324 0.224 -6.622 1.00 0.00 C ATOM 6 O3' G A 1 -11.734 1.590 -6.481 1.00 0.00 O ATOM 7 C2' G A 1 -11.879 -0.579 -5.465 1.00 0.00 C ATOM 8 O2' G A 1 -13.176 -0.116 -5.069 1.00 0.00 O ATOM 9 C1' G A 1 -11.941 -1.969 -6.077 1.00 0.00 C ATOM 10 N9 G A 1 -10.652 -2.669 -5.923 1.00 0.00 N ATOM 11 C8 G A 1 -9.693 -2.921 -6.844 1.00 0.00 C ATOM 12 N7 G A 1 -8.636 -3.549 -6.452 1.00 0.00 N ATOM 13 C5 G A 1 -8.910 -3.747 -5.096 1.00 0.00 C ATOM 14 C6 G A 1 -8.133 -4.384 -4.092 1.00 0.00 C ATOM 15 O6 G A 1 -7.027 -4.905 -4.200 1.00 0.00 O ATOM 16 N1 G A 1 -8.776 -4.365 -2.864 1.00 0.00 N ATOM 17 C2 G A 1 -10.011 -3.805 -2.622 1.00 0.00 C ATOM 18 N2 G A 1 -10.460 -3.884 -1.375 1.00 0.00 N ATOM 19 N3 G A 1 -10.749 -3.205 -3.556 1.00 0.00 N ATOM 20 C4 G A 1 -10.145 -3.210 -4.765 1.00 0.00 C ATOM 0 H5' G A 1 -10.296 -0.785 -8.985 1.00 0.00 H new ATOM 0 H5'' G A 1 -11.776 -0.708 -9.920 1.00 0.00 H new ATOM 0 H4' G A 1 -13.002 0.117 -8.002 1.00 0.00 H new ATOM 0 H3' G A 1 -10.237 0.204 -6.702 1.00 0.00 H new ATOM 0 H2' G A 1 -11.286 -0.517 -4.553 1.00 0.00 H new ATOM 0 HO2' G A 1 -13.277 0.826 -5.319 1.00 0.00 H new ATOM 0 HO5' G A 1 -10.447 1.180 -10.224 1.00 0.00 H new ATOM 0 H1' G A 1 -12.687 -2.592 -5.584 1.00 0.00 H new ATOM 0 H8 G A 1 -9.808 -2.608 -7.871 1.00 0.00 H new ATOM 0 H1 G A 1 -8.296 -4.801 -2.076 1.00 0.00 H new ATOM 0 H21 G A 1 -11.368 -3.487 -1.134 1.00 0.00 H new ATOM 0 H22 G A 1 -9.897 -4.341 -0.658 1.00 0.00 H new ATOM 33 P G A 2 -10.684 2.717 -6.010 1.00 0.00 P ATOM 34 OP1 G A 2 -11.358 4.032 -6.071 1.00 0.00 O ATOM 35 OP2 G A 2 -9.417 2.503 -6.746 1.00 0.00 O ATOM 36 O5' G A 2 -10.439 2.345 -4.460 1.00 0.00 O ATOM 37 C5' G A 2 -11.471 2.550 -3.489 1.00 0.00 C ATOM 38 C4' G A 2 -11.225 1.737 -2.219 1.00 0.00 C ATOM 39 O4' G A 2 -11.076 0.342 -2.511 1.00 0.00 O ATOM 40 C3' G A 2 -9.925 2.138 -1.541 1.00 0.00 C ATOM 41 O3' G A 2 -10.181 3.234 -0.651 1.00 0.00 O ATOM 42 C2' G A 2 -9.615 0.899 -0.726 1.00 0.00 C ATOM 43 O2' G A 2 -10.371 0.855 0.491 1.00 0.00 O ATOM 44 C1' G A 2 -10.031 -0.209 -1.687 1.00 0.00 C ATOM 45 N9 G A 2 -8.881 -0.652 -2.498 1.00 0.00 N ATOM 46 C8 G A 2 -8.565 -0.374 -3.788 1.00 0.00 C ATOM 47 N7 G A 2 -7.474 -0.880 -4.259 1.00 0.00 N ATOM 48 C5 G A 2 -6.989 -1.589 -3.154 1.00 0.00 C ATOM 49 C6 G A 2 -5.812 -2.373 -3.014 1.00 0.00 C ATOM 50 O6 G A 2 -4.944 -2.605 -3.851 1.00 0.00 O ATOM 51 N1 G A 2 -5.706 -2.909 -1.740 1.00 0.00 N ATOM 52 C2 G A 2 -6.613 -2.719 -0.721 1.00 0.00 C ATOM 53 N2 G A 2 -6.336 -3.309 0.434 1.00 0.00 N ATOM 54 N3 G A 2 -7.720 -1.987 -0.840 1.00 0.00 N ATOM 55 C4 G A 2 -7.848 -1.453 -2.074 1.00 0.00 C ATOM 0 H5' G A 2 -12.434 2.272 -3.918 1.00 0.00 H new ATOM 0 H5'' G A 2 -11.528 3.609 -3.237 1.00 0.00 H new ATOM 0 H4' G A 2 -12.088 1.929 -1.582 1.00 0.00 H new ATOM 0 H3' G A 2 -9.131 2.442 -2.223 1.00 0.00 H new ATOM 0 H2' G A 2 -8.578 0.837 -0.397 1.00 0.00 H new ATOM 0 HO2' G A 2 -9.810 0.499 1.212 1.00 0.00 H new ATOM 0 H1' G A 2 -10.387 -1.090 -1.152 1.00 0.00 H new ATOM 0 H8 G A 2 -9.203 0.248 -4.399 1.00 0.00 H new ATOM 0 H1 G A 2 -4.892 -3.490 -1.541 1.00 0.00 H new ATOM 0 H21 G A 2 -6.971 -3.204 1.225 1.00 0.00 H new ATOM 0 H22 G A 2 -5.488 -3.867 0.531 1.00 0.00 H new ATOM 67 P G A 3 -8.967 4.118 -0.059 1.00 0.00 P ATOM 68 OP1 G A 3 -9.540 5.334 0.563 1.00 0.00 O ATOM 69 OP2 G A 3 -7.932 4.246 -1.110 1.00 0.00 O ATOM 70 O5' G A 3 -8.377 3.182 1.114 1.00 0.00 O ATOM 71 C5' G A 3 -9.138 2.933 2.302 1.00 0.00 C ATOM 72 C4' G A 3 -8.610 1.725 3.074 1.00 0.00 C ATOM 73 O4' G A 3 -8.476 0.576 2.220 1.00 0.00 O ATOM 74 C3' G A 3 -7.209 1.971 3.622 1.00 0.00 C ATOM 75 O3' G A 3 -7.303 2.564 4.923 1.00 0.00 O ATOM 76 C2' G A 3 -6.700 0.555 3.772 1.00 0.00 C ATOM 77 O2' G A 3 -7.260 -0.089 4.924 1.00 0.00 O ATOM 78 C1' G A 3 -7.210 -0.062 2.481 1.00 0.00 C ATOM 79 N9 G A 3 -6.249 0.172 1.388 1.00 0.00 N ATOM 80 C8 G A 3 -6.275 1.088 0.388 1.00 0.00 C ATOM 81 N7 G A 3 -5.284 1.099 -0.438 1.00 0.00 N ATOM 82 C5 G A 3 -4.486 0.066 0.061 1.00 0.00 C ATOM 83 C6 G A 3 -3.242 -0.430 -0.403 1.00 0.00 C ATOM 84 O6 G A 3 -2.581 -0.056 -1.368 1.00 0.00 O ATOM 85 N1 G A 3 -2.782 -1.470 0.388 1.00 0.00 N ATOM 86 C2 G A 3 -3.430 -1.979 1.489 1.00 0.00 C ATOM 87 N2 G A 3 -2.821 -2.977 2.119 1.00 0.00 N ATOM 88 N3 G A 3 -4.601 -1.524 1.934 1.00 0.00 N ATOM 89 C4 G A 3 -5.072 -0.505 1.180 1.00 0.00 C ATOM 0 H5' G A 3 -10.182 2.766 2.036 1.00 0.00 H new ATOM 0 H5'' G A 3 -9.109 3.814 2.943 1.00 0.00 H new ATOM 0 H4' G A 3 -9.331 1.559 3.874 1.00 0.00 H new ATOM 0 H3' G A 3 -6.591 2.623 3.005 1.00 0.00 H new ATOM 0 H2' G A 3 -5.623 0.473 3.919 1.00 0.00 H new ATOM 0 HO2' G A 3 -7.681 0.582 5.501 1.00 0.00 H new ATOM 0 H1' G A 3 -7.327 -1.143 2.559 1.00 0.00 H new ATOM 0 H8 G A 3 -7.096 1.783 0.287 1.00 0.00 H new ATOM 0 H1 G A 3 -1.890 -1.893 0.133 1.00 0.00 H new ATOM 0 H21 G A 3 -3.251 -3.398 2.943 1.00 0.00 H new ATOM 0 H22 G A 3 -1.924 -3.323 1.779 1.00 0.00 H new ATOM 101 P C A 4 -6.035 3.331 5.564 1.00 0.00 P ATOM 102 OP1 C A 4 -6.331 3.603 6.989 1.00 0.00 O ATOM 103 OP2 C A 4 -5.663 4.443 4.663 1.00 0.00 O ATOM 104 O5' C A 4 -4.871 2.214 5.494 1.00 0.00 O ATOM 105 C5' C A 4 -4.855 1.115 6.412 1.00 0.00 C ATOM 106 C4' C A 4 -3.683 0.166 6.155 1.00 0.00 C ATOM 107 O4' C A 4 -3.691 -0.350 4.818 1.00 0.00 O ATOM 108 C3' C A 4 -2.347 0.874 6.280 1.00 0.00 C ATOM 109 O3' C A 4 -1.954 0.901 7.659 1.00 0.00 O ATOM 110 C2' C A 4 -1.444 -0.082 5.530 1.00 0.00 C ATOM 111 O2' C A 4 -1.117 -1.231 6.323 1.00 0.00 O ATOM 112 C1' C A 4 -2.330 -0.456 4.345 1.00 0.00 C ATOM 113 N1 C A 4 -2.086 0.445 3.195 1.00 0.00 N ATOM 114 C2 C A 4 -1.001 0.162 2.373 1.00 0.00 C ATOM 115 O2 C A 4 -0.277 -0.804 2.608 1.00 0.00 O ATOM 116 N3 C A 4 -0.763 0.980 1.313 1.00 0.00 N ATOM 117 C4 C A 4 -1.554 2.032 1.067 1.00 0.00 C ATOM 118 N4 C A 4 -1.292 2.809 0.019 1.00 0.00 N ATOM 119 C5 C A 4 -2.671 2.329 1.909 1.00 0.00 C ATOM 120 C6 C A 4 -2.900 1.514 2.955 1.00 0.00 C ATOM 0 H5' C A 4 -5.792 0.563 6.332 1.00 0.00 H new ATOM 0 H5'' C A 4 -4.795 1.496 7.432 1.00 0.00 H new ATOM 0 H4' C A 4 -3.801 -0.624 6.897 1.00 0.00 H new ATOM 0 H3' C A 4 -2.337 1.901 5.915 1.00 0.00 H new ATOM 0 H2' C A 4 -0.478 0.340 5.253 1.00 0.00 H new ATOM 0 HO2' C A 4 -1.308 -1.043 7.266 1.00 0.00 H new ATOM 0 H1' C A 4 -2.116 -1.464 3.989 1.00 0.00 H new ATOM 0 H41 C A 4 -1.886 3.614 -0.180 1.00 0.00 H new ATOM 0 H42 C A 4 -0.497 2.600 -0.585 1.00 0.00 H new ATOM 0 H5 C A 4 -3.309 3.178 1.712 1.00 0.00 H new ATOM 0 H6 C A 4 -3.736 1.708 3.611 1.00 0.00 H new ATOM 132 P G A 5 -0.983 2.064 8.209 1.00 0.00 P ATOM 133 OP1 G A 5 -0.771 1.847 9.658 1.00 0.00 O ATOM 134 OP2 G A 5 -1.497 3.366 7.726 1.00 0.00 O ATOM 135 O5' G A 5 0.401 1.755 7.442 1.00 0.00 O ATOM 136 C5' G A 5 1.254 0.689 7.874 1.00 0.00 C ATOM 137 C4' G A 5 2.415 0.464 6.907 1.00 0.00 C ATOM 138 O4' G A 5 1.952 0.163 5.584 1.00 0.00 O ATOM 139 C3' G A 5 3.260 1.718 6.750 1.00 0.00 C ATOM 140 O3' G A 5 4.266 1.742 7.769 1.00 0.00 O ATOM 141 C2' G A 5 3.922 1.464 5.413 1.00 0.00 C ATOM 142 O2' G A 5 5.012 0.536 5.524 1.00 0.00 O ATOM 143 C1' G A 5 2.758 0.875 4.625 1.00 0.00 C ATOM 144 N9 G A 5 1.986 1.942 3.960 1.00 0.00 N ATOM 145 C8 G A 5 0.812 2.518 4.319 1.00 0.00 C ATOM 146 N7 G A 5 0.355 3.462 3.566 1.00 0.00 N ATOM 147 C5 G A 5 1.340 3.538 2.576 1.00 0.00 C ATOM 148 C6 G A 5 1.432 4.391 1.442 1.00 0.00 C ATOM 149 O6 G A 5 0.648 5.261 1.075 1.00 0.00 O ATOM 150 N1 G A 5 2.583 4.140 0.711 1.00 0.00 N ATOM 151 C2 G A 5 3.529 3.190 1.022 1.00 0.00 C ATOM 152 N2 G A 5 4.560 3.098 0.197 1.00 0.00 N ATOM 153 N3 G A 5 3.453 2.383 2.080 1.00 0.00 N ATOM 154 C4 G A 5 2.340 2.609 2.811 1.00 0.00 C ATOM 0 H5' G A 5 0.672 -0.228 7.963 1.00 0.00 H new ATOM 0 H5'' G A 5 1.646 0.916 8.866 1.00 0.00 H new ATOM 0 H4' G A 5 2.986 -0.361 7.333 1.00 0.00 H new ATOM 0 H3' G A 5 2.701 2.652 6.816 1.00 0.00 H new ATOM 0 H2' G A 5 4.373 2.347 4.960 1.00 0.00 H new ATOM 0 HO2' G A 5 5.849 1.029 5.656 1.00 0.00 H new ATOM 0 H1' G A 5 3.103 0.209 3.834 1.00 0.00 H new ATOM 0 H8 G A 5 0.279 2.199 5.202 1.00 0.00 H new ATOM 0 H1 G A 5 2.741 4.704 -0.124 1.00 0.00 H new ATOM 0 H21 G A 5 5.295 2.413 0.373 1.00 0.00 H new ATOM 0 H22 G A 5 4.620 3.712 -0.615 1.00 0.00 H new ATOM 166 P A A 6 4.529 3.082 8.625 1.00 0.00 P ATOM 167 OP1 A A 6 5.824 2.934 9.325 1.00 0.00 O ATOM 168 OP2 A A 6 3.303 3.384 9.401 1.00 0.00 O ATOM 169 O5' A A 6 4.701 4.208 7.481 1.00 0.00 O ATOM 170 C5' A A 6 3.756 5.280 7.349 1.00 0.00 C ATOM 171 C4' A A 6 4.419 6.558 6.835 1.00 0.00 C ATOM 172 O4' A A 6 5.519 6.933 7.675 1.00 0.00 O ATOM 173 C3' A A 6 4.998 6.354 5.439 1.00 0.00 C ATOM 174 O3' A A 6 4.045 6.844 4.474 1.00 0.00 O ATOM 175 C2' A A 6 6.216 7.264 5.437 1.00 0.00 C ATOM 176 O2' A A 6 5.885 8.604 5.054 1.00 0.00 O ATOM 177 C1' A A 6 6.684 7.199 6.878 1.00 0.00 C ATOM 178 N9 A A 6 7.706 6.151 7.053 1.00 0.00 N ATOM 179 C8 A A 6 7.656 5.009 7.772 1.00 0.00 C ATOM 180 N7 A A 6 8.712 4.265 7.790 1.00 0.00 N ATOM 181 C5 A A 6 9.583 4.997 6.977 1.00 0.00 C ATOM 182 C6 A A 6 10.900 4.780 6.561 1.00 0.00 C ATOM 183 N6 A A 6 11.619 3.726 6.939 1.00 0.00 N ATOM 184 N1 A A 6 11.457 5.700 5.756 1.00 0.00 N ATOM 185 C2 A A 6 10.761 6.776 5.381 1.00 0.00 C ATOM 186 N3 A A 6 9.513 7.083 5.717 1.00 0.00 N ATOM 187 C4 A A 6 8.977 6.144 6.523 1.00 0.00 C ATOM 0 H5' A A 6 3.290 5.475 8.315 1.00 0.00 H new ATOM 0 H5'' A A 6 2.961 4.982 6.665 1.00 0.00 H new ATOM 0 H4' A A 6 3.646 7.326 6.828 1.00 0.00 H new ATOM 0 H3' A A 6 5.230 5.316 5.202 1.00 0.00 H new ATOM 0 H2' A A 6 6.976 6.955 4.719 1.00 0.00 H new ATOM 0 HO2' A A 6 6.064 8.725 4.098 1.00 0.00 H new ATOM 0 H1' A A 6 7.152 8.135 7.182 1.00 0.00 H new ATOM 0 H8 A A 6 6.765 4.728 8.313 1.00 0.00 H new ATOM 0 H61 A A 6 12.577 3.616 6.606 1.00 0.00 H new ATOM 0 H62 A A 6 11.212 3.028 7.562 1.00 0.00 H new ATOM 0 H2 A A 6 11.269 7.474 4.732 1.00 0.00 H new ATOM 199 P G A 7 4.383 6.876 2.892 1.00 0.00 P ATOM 200 OP1 G A 7 3.271 7.563 2.195 1.00 0.00 O ATOM 201 OP2 G A 7 4.781 5.514 2.473 1.00 0.00 O ATOM 202 O5' G A 7 5.680 7.834 2.833 1.00 0.00 O ATOM 203 C5' G A 7 6.424 8.040 1.621 1.00 0.00 C ATOM 204 C4' G A 7 7.448 6.928 1.373 1.00 0.00 C ATOM 205 O4' G A 7 7.857 6.308 2.589 1.00 0.00 O ATOM 206 C3' G A 7 6.864 5.802 0.535 1.00 0.00 C ATOM 207 O3' G A 7 7.091 6.126 -0.848 1.00 0.00 O ATOM 208 C2' G A 7 7.736 4.606 0.915 1.00 0.00 C ATOM 209 O2' G A 7 8.824 4.453 -0.002 1.00 0.00 O ATOM 210 C1' G A 7 8.250 4.955 2.321 1.00 0.00 C ATOM 211 N9 G A 7 7.722 4.037 3.356 1.00 0.00 N ATOM 212 C8 G A 7 6.455 3.870 3.814 1.00 0.00 C ATOM 213 N7 G A 7 6.270 3.024 4.769 1.00 0.00 N ATOM 214 C5 G A 7 7.566 2.555 4.991 1.00 0.00 C ATOM 215 C6 G A 7 8.037 1.595 5.925 1.00 0.00 C ATOM 216 O6 G A 7 7.395 0.956 6.752 1.00 0.00 O ATOM 217 N1 G A 7 9.408 1.414 5.817 1.00 0.00 N ATOM 218 C2 G A 7 10.228 2.070 4.926 1.00 0.00 C ATOM 219 N2 G A 7 11.517 1.753 4.970 1.00 0.00 N ATOM 220 N3 G A 7 9.796 2.975 4.046 1.00 0.00 N ATOM 221 C4 G A 7 8.462 3.169 4.129 1.00 0.00 C ATOM 0 H5' G A 7 6.938 9.000 1.671 1.00 0.00 H new ATOM 0 H5'' G A 7 5.735 8.091 0.778 1.00 0.00 H new ATOM 0 H4' G A 7 8.281 7.417 0.868 1.00 0.00 H new ATOM 0 H3' G A 7 5.799 5.627 0.690 1.00 0.00 H new ATOM 0 H2' G A 7 7.189 3.664 0.889 1.00 0.00 H new ATOM 0 HO2' G A 7 8.549 3.873 -0.742 1.00 0.00 H new ATOM 0 H1' G A 7 9.334 4.847 2.353 1.00 0.00 H new ATOM 0 H8 G A 7 5.631 4.427 3.393 1.00 0.00 H new ATOM 0 H1 G A 7 9.844 0.741 6.448 1.00 0.00 H new ATOM 0 H21 G A 7 12.175 2.205 4.335 1.00 0.00 H new ATOM 0 H22 G A 7 11.849 1.058 5.639 1.00 0.00 H new ATOM 233 P A A 8 6.280 5.386 -2.031 1.00 0.00 P ATOM 234 OP1 A A 8 6.162 6.328 -3.166 1.00 0.00 O ATOM 235 OP2 A A 8 5.060 4.776 -1.455 1.00 0.00 O ATOM 236 O5' A A 8 7.283 4.200 -2.461 1.00 0.00 O ATOM 237 C5' A A 8 8.387 4.458 -3.340 1.00 0.00 C ATOM 238 C4' A A 8 9.467 3.381 -3.229 1.00 0.00 C ATOM 239 O4' A A 8 9.986 3.299 -1.892 1.00 0.00 O ATOM 240 C3' A A 8 8.905 1.998 -3.546 1.00 0.00 C ATOM 241 O3' A A 8 9.158 1.705 -4.924 1.00 0.00 O ATOM 242 C2' A A 8 9.768 1.096 -2.687 1.00 0.00 C ATOM 243 O2' A A 8 11.037 0.839 -3.302 1.00 0.00 O ATOM 244 C1' A A 8 9.915 1.942 -1.432 1.00 0.00 C ATOM 245 N9 A A 8 8.772 1.751 -0.512 1.00 0.00 N ATOM 246 C8 A A 8 7.457 2.033 -0.686 1.00 0.00 C ATOM 247 N7 A A 8 6.651 1.738 0.275 1.00 0.00 N ATOM 248 C5 A A 8 7.524 1.195 1.219 1.00 0.00 C ATOM 249 C6 A A 8 7.327 0.673 2.501 1.00 0.00 C ATOM 250 N6 A A 8 6.131 0.608 3.084 1.00 0.00 N ATOM 251 N1 A A 8 8.411 0.230 3.159 1.00 0.00 N ATOM 252 C2 A A 8 9.617 0.296 2.591 1.00 0.00 C ATOM 253 N3 A A 8 9.916 0.764 1.386 1.00 0.00 N ATOM 254 C4 A A 8 8.817 1.202 0.748 1.00 0.00 C ATOM 0 H5' A A 8 8.819 5.431 -3.105 1.00 0.00 H new ATOM 0 H5'' A A 8 8.029 4.508 -4.368 1.00 0.00 H new ATOM 0 H4' A A 8 10.245 3.664 -3.938 1.00 0.00 H new ATOM 0 H3' A A 8 7.835 1.896 -3.365 1.00 0.00 H new ATOM 0 H2' A A 8 9.348 0.105 -2.513 1.00 0.00 H new ATOM 0 HO2' A A 8 11.001 1.098 -4.247 1.00 0.00 H new ATOM 0 H1' A A 8 10.802 1.660 -0.865 1.00 0.00 H new ATOM 0 H8 A A 8 7.098 2.488 -1.597 1.00 0.00 H new ATOM 0 H61 A A 8 6.041 0.218 4.022 1.00 0.00 H new ATOM 0 H62 A A 8 5.305 0.949 2.592 1.00 0.00 H new ATOM 0 H2 A A 8 10.444 -0.074 3.179 1.00 0.00 H new ATOM 266 P G A 9 7.984 1.145 -5.876 1.00 0.00 P ATOM 267 OP1 G A 9 8.260 1.596 -7.258 1.00 0.00 O ATOM 268 OP2 G A 9 6.680 1.461 -5.246 1.00 0.00 O ATOM 269 O5' G A 9 8.209 -0.452 -5.816 1.00 0.00 O ATOM 270 C5' G A 9 7.177 -1.330 -5.344 1.00 0.00 C ATOM 271 C4' G A 9 7.269 -1.574 -3.837 1.00 0.00 C ATOM 272 O4' G A 9 7.087 -0.366 -3.087 1.00 0.00 O ATOM 273 C3' G A 9 6.161 -2.508 -3.376 1.00 0.00 C ATOM 274 O3' G A 9 6.637 -3.858 -3.450 1.00 0.00 O ATOM 275 C2' G A 9 6.005 -2.124 -1.919 1.00 0.00 C ATOM 276 O2' G A 9 7.001 -2.750 -1.102 1.00 0.00 O ATOM 277 C1' G A 9 6.201 -0.613 -1.978 1.00 0.00 C ATOM 278 N9 G A 9 4.919 0.096 -2.160 1.00 0.00 N ATOM 279 C8 G A 9 4.511 0.892 -3.179 1.00 0.00 C ATOM 280 N7 G A 9 3.339 1.425 -3.090 1.00 0.00 N ATOM 281 C5 G A 9 2.893 0.931 -1.860 1.00 0.00 C ATOM 282 C6 G A 9 1.664 1.149 -1.182 1.00 0.00 C ATOM 283 O6 G A 9 0.710 1.837 -1.534 1.00 0.00 O ATOM 284 N1 G A 9 1.618 0.467 0.025 1.00 0.00 N ATOM 285 C2 G A 9 2.626 -0.328 0.524 1.00 0.00 C ATOM 286 N2 G A 9 2.391 -0.907 1.697 1.00 0.00 N ATOM 287 N3 G A 9 3.786 -0.540 -0.103 1.00 0.00 N ATOM 288 C4 G A 9 3.854 0.115 -1.284 1.00 0.00 C ATOM 0 H5' G A 9 7.245 -2.283 -5.869 1.00 0.00 H new ATOM 0 H5'' G A 9 6.203 -0.903 -5.582 1.00 0.00 H new ATOM 0 H4' G A 9 8.260 -1.994 -3.665 1.00 0.00 H new ATOM 0 H3' G A 9 5.242 -2.437 -3.958 1.00 0.00 H new ATOM 0 H2' G A 9 5.056 -2.431 -1.479 1.00 0.00 H new ATOM 0 HO2' G A 9 7.537 -3.361 -1.650 1.00 0.00 H new ATOM 0 H1' G A 9 6.619 -0.242 -1.043 1.00 0.00 H new ATOM 0 H8 G A 9 5.144 1.074 -4.035 1.00 0.00 H new ATOM 0 H1 G A 9 0.772 0.562 0.587 1.00 0.00 H new ATOM 0 H21 G A 9 3.098 -1.508 2.120 1.00 0.00 H new ATOM 0 H22 G A 9 1.503 -0.750 2.174 1.00 0.00 H new ATOM 300 P C A 10 5.614 -5.080 -3.697 1.00 0.00 P ATOM 301 OP1 C A 10 6.396 -6.336 -3.750 1.00 0.00 O ATOM 302 OP2 C A 10 4.721 -4.720 -4.820 1.00 0.00 O ATOM 303 O5' C A 10 4.740 -5.087 -2.342 1.00 0.00 O ATOM 304 C5' C A 10 5.336 -5.445 -1.089 1.00 0.00 C ATOM 305 C4' C A 10 4.359 -5.272 0.074 1.00 0.00 C ATOM 306 O4' C A 10 3.815 -3.950 0.123 1.00 0.00 O ATOM 307 C3' C A 10 3.148 -6.173 -0.074 1.00 0.00 C ATOM 308 O3' C A 10 3.463 -7.473 0.442 1.00 0.00 O ATOM 309 C2' C A 10 2.166 -5.499 0.863 1.00 0.00 C ATOM 310 O2' C A 10 2.425 -5.848 2.227 1.00 0.00 O ATOM 311 C1' C A 10 2.455 -4.018 0.603 1.00 0.00 C ATOM 312 N1 C A 10 1.499 -3.454 -0.381 1.00 0.00 N ATOM 313 C2 C A 10 0.194 -3.244 0.043 1.00 0.00 C ATOM 314 O2 C A 10 -0.139 -3.517 1.194 1.00 0.00 O ATOM 315 N3 C A 10 -0.697 -2.729 -0.844 1.00 0.00 N ATOM 316 C4 C A 10 -0.332 -2.432 -2.094 1.00 0.00 C ATOM 317 N4 C A 10 -1.236 -1.928 -2.931 1.00 0.00 N ATOM 318 C5 C A 10 1.007 -2.644 -2.540 1.00 0.00 C ATOM 319 C6 C A 10 1.888 -3.154 -1.657 1.00 0.00 C ATOM 0 H5' C A 10 6.219 -4.829 -0.917 1.00 0.00 H new ATOM 0 H5'' C A 10 5.673 -6.481 -1.130 1.00 0.00 H new ATOM 0 H4' C A 10 4.942 -5.506 0.965 1.00 0.00 H new ATOM 0 H3' C A 10 2.796 -6.299 -1.098 1.00 0.00 H new ATOM 0 H2' C A 10 1.127 -5.783 0.695 1.00 0.00 H new ATOM 0 HO2' C A 10 3.137 -6.520 2.263 1.00 0.00 H new ATOM 0 H1' C A 10 2.336 -3.425 1.510 1.00 0.00 H new ATOM 0 H41 C A 10 -0.971 -1.697 -3.888 1.00 0.00 H new ATOM 0 H42 C A 10 -2.193 -1.773 -2.615 1.00 0.00 H new ATOM 0 H5 C A 10 1.304 -2.404 -3.550 1.00 0.00 H new ATOM 0 H6 C A 10 2.910 -3.327 -1.960 1.00 0.00 H new ATOM 331 P C A 11 2.651 -8.774 -0.056 1.00 0.00 P ATOM 332 OP1 C A 11 3.188 -9.956 0.655 1.00 0.00 O ATOM 333 OP2 C A 11 2.613 -8.758 -1.537 1.00 0.00 O ATOM 334 O5' C A 11 1.159 -8.491 0.487 1.00 0.00 O ATOM 335 C5' C A 11 0.878 -8.496 1.892 1.00 0.00 C ATOM 336 C4' C A 11 -0.490 -7.892 2.199 1.00 0.00 C ATOM 337 O4' C A 11 -0.625 -6.586 1.641 1.00 0.00 O ATOM 338 C3' C A 11 -1.610 -8.692 1.564 1.00 0.00 C ATOM 339 O3' C A 11 -1.966 -9.767 2.445 1.00 0.00 O ATOM 340 C2' C A 11 -2.746 -7.680 1.534 1.00 0.00 C ATOM 341 O2' C A 11 -3.500 -7.694 2.752 1.00 0.00 O ATOM 342 C1' C A 11 -2.013 -6.345 1.348 1.00 0.00 C ATOM 343 N1 C A 11 -2.196 -5.828 -0.026 1.00 0.00 N ATOM 344 C2 C A 11 -3.366 -5.132 -0.295 1.00 0.00 C ATOM 345 O2 C A 11 -4.204 -4.971 0.588 1.00 0.00 O ATOM 346 N3 C A 11 -3.559 -4.647 -1.551 1.00 0.00 N ATOM 347 C4 C A 11 -2.642 -4.836 -2.507 1.00 0.00 C ATOM 348 N4 C A 11 -2.864 -4.349 -3.724 1.00 0.00 N ATOM 349 C5 C A 11 -1.434 -5.553 -2.239 1.00 0.00 C ATOM 350 C6 C A 11 -1.250 -6.029 -0.992 1.00 0.00 C ATOM 0 H5' C A 11 1.650 -7.935 2.419 1.00 0.00 H new ATOM 0 H5'' C A 11 0.916 -9.519 2.267 1.00 0.00 H new ATOM 0 H4' C A 11 -0.557 -7.883 3.287 1.00 0.00 H new ATOM 0 H3' C A 11 -1.364 -9.118 0.591 1.00 0.00 H new ATOM 0 H2' C A 11 -3.476 -7.884 0.751 1.00 0.00 H new ATOM 0 HO2' C A 11 -4.423 -7.419 2.569 1.00 0.00 H new ATOM 0 H1' C A 11 -2.415 -5.583 2.016 1.00 0.00 H new ATOM 0 H41 C A 11 -2.173 -4.486 -4.462 1.00 0.00 H new ATOM 0 H42 C A 11 -3.725 -3.838 -3.920 1.00 0.00 H new ATOM 0 H5 C A 11 -0.694 -5.708 -3.010 1.00 0.00 H new ATOM 0 H6 C A 11 -0.348 -6.573 -0.754 1.00 0.00 H new ATOM 362 P U A 12 -2.835 -11.016 1.913 1.00 0.00 P ATOM 363 OP1 U A 12 -2.901 -12.029 2.991 1.00 0.00 O ATOM 364 OP2 U A 12 -2.328 -11.397 0.575 1.00 0.00 O ATOM 365 O5' U A 12 -4.304 -10.378 1.729 1.00 0.00 O ATOM 366 C5' U A 12 -5.113 -10.059 2.866 1.00 0.00 C ATOM 367 C4' U A 12 -6.282 -9.151 2.487 1.00 0.00 C ATOM 368 O4' U A 12 -5.827 -7.934 1.884 1.00 0.00 O ATOM 369 C3' U A 12 -7.172 -9.805 1.443 1.00 0.00 C ATOM 370 O3' U A 12 -8.107 -10.718 2.032 1.00 0.00 O ATOM 371 C2' U A 12 -7.861 -8.592 0.852 1.00 0.00 C ATOM 372 O2' U A 12 -8.939 -8.144 1.683 1.00 0.00 O ATOM 373 C1' U A 12 -6.723 -7.573 0.816 1.00 0.00 C ATOM 374 N1 U A 12 -6.030 -7.586 -0.491 1.00 0.00 N ATOM 375 C2 U A 12 -6.345 -6.584 -1.391 1.00 0.00 C ATOM 376 O2 U A 12 -7.172 -5.708 -1.139 1.00 0.00 O ATOM 377 N3 U A 12 -5.678 -6.620 -2.598 1.00 0.00 N ATOM 378 C4 U A 12 -4.736 -7.553 -2.983 1.00 0.00 C ATOM 379 O4 U A 12 -4.203 -7.481 -4.086 1.00 0.00 O ATOM 380 C5 U A 12 -4.466 -8.563 -1.987 1.00 0.00 C ATOM 381 C6 U A 12 -5.107 -8.552 -0.795 1.00 0.00 C ATOM 0 H5' U A 12 -4.501 -9.568 3.623 1.00 0.00 H new ATOM 0 H5'' U A 12 -5.495 -10.978 3.311 1.00 0.00 H new ATOM 0 H4' U A 12 -6.819 -8.962 3.416 1.00 0.00 H new ATOM 0 H3' U A 12 -6.636 -10.415 0.716 1.00 0.00 H new ATOM 0 H2' U A 12 -8.320 -8.776 -0.119 1.00 0.00 H new ATOM 0 HO2' U A 12 -9.295 -8.901 2.194 1.00 0.00 H new ATOM 0 HO3' U A 12 -8.662 -11.117 1.329 1.00 0.00 H new ATOM 0 H1' U A 12 -7.102 -6.559 0.945 1.00 0.00 H new ATOM 0 H3 U A 12 -5.902 -5.887 -3.271 1.00 0.00 H new ATOM 0 H5 U A 12 -3.743 -9.338 -2.196 1.00 0.00 H new ATOM 0 H6 U A 12 -4.886 -9.320 -0.069 1.00 0.00 H new TER 393 U A 12