USER MOD reduce.3.24.130724 H: found=0, std=0, add=184, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 184 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 DA O5' : rot 180:sc= -0.0206 USER MOD Single : A 2 DT C7 :methyl -30:sc= -1.01 (180deg=-2.94!) USER MOD Single : A 5 DT C7 :methyl 150:sc= -1.27 (180deg=-1.27) USER MOD Single : A 8 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 9 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 11 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 16 DT C7 :methyl -30:sc= -0.393 (180deg=-0.514) USER MOD Single : A 16 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 3.969 1.972 -0.393 1.00 0.00 O ATOM 2 C5' DA A 1 5.044 2.279 -1.290 1.00 0.00 C ATOM 3 C4' DA A 1 5.648 3.651 -1.028 1.00 0.00 C ATOM 4 O4' DA A 1 4.831 4.694 -1.619 1.00 0.00 O ATOM 5 C3' DA A 1 5.735 3.930 0.467 1.00 0.00 C ATOM 6 O3' DA A 1 7.011 4.478 0.823 1.00 0.00 O ATOM 7 C2' DA A 1 4.646 4.918 0.727 1.00 0.00 C ATOM 8 C1' DA A 1 4.388 5.605 -0.589 1.00 0.00 C ATOM 9 N9 DA A 1 2.960 5.940 -0.745 1.00 0.00 N ATOM 10 C8 DA A 1 1.887 5.123 -0.884 1.00 0.00 C ATOM 11 N7 DA A 1 0.730 5.679 -1.026 1.00 0.00 N ATOM 12 C5 DA A 1 1.063 7.037 -0.974 1.00 0.00 C ATOM 13 C6 DA A 1 0.298 8.207 -1.063 1.00 0.00 C ATOM 14 N6 DA A 1 -1.022 8.204 -1.236 1.00 0.00 N ATOM 15 N1 DA A 1 0.950 9.380 -0.971 1.00 0.00 N ATOM 16 C2 DA A 1 2.273 9.407 -0.803 1.00 0.00 C ATOM 17 N3 DA A 1 3.091 8.365 -0.708 1.00 0.00 N ATOM 18 C4 DA A 1 2.417 7.202 -0.802 1.00 0.00 C ATOM 0 H5' DA A 1 4.680 2.236 -2.316 1.00 0.00 H new ATOM 0 H5'' DA A 1 5.820 1.520 -1.195 1.00 0.00 H new ATOM 0 H4' DA A 1 6.644 3.650 -1.471 1.00 0.00 H new ATOM 0 H3' DA A 1 5.625 3.020 1.058 1.00 0.00 H new ATOM 0 H2' DA A 1 3.747 4.421 1.091 1.00 0.00 H new ATOM 0 H2'' DA A 1 4.945 5.636 1.491 1.00 0.00 H new ATOM 0 HO5' DA A 1 3.613 1.083 -0.601 1.00 0.00 H new ATOM 0 H1' DA A 1 4.927 6.550 -0.649 1.00 0.00 H new ATOM 0 H8 DA A 1 1.996 4.049 -0.876 1.00 0.00 H new ATOM 0 H61 DA A 1 -1.531 9.086 -1.294 1.00 0.00 H new ATOM 0 H62 DA A 1 -1.525 7.320 -1.310 1.00 0.00 H new ATOM 0 H2 DA A 1 2.729 10.384 -0.737 1.00 0.00 H new ATOM 31 P DT A 2 7.364 4.806 2.358 1.00 0.00 P ATOM 32 OP1 DT A 2 8.839 4.776 2.530 1.00 0.00 O ATOM 33 OP2 DT A 2 6.515 3.962 3.238 1.00 0.00 O ATOM 34 O5' DT A 2 6.861 6.330 2.454 1.00 0.00 O ATOM 35 C5' DT A 2 7.276 7.297 1.480 1.00 0.00 C ATOM 36 C4' DT A 2 6.873 8.719 1.849 1.00 0.00 C ATOM 37 O4' DT A 2 5.486 8.978 1.507 1.00 0.00 O ATOM 38 C3' DT A 2 7.025 8.967 3.345 1.00 0.00 C ATOM 39 O3' DT A 2 7.719 10.196 3.596 1.00 0.00 O ATOM 40 C2' DT A 2 5.626 9.038 3.865 1.00 0.00 C ATOM 41 C1' DT A 2 4.768 9.415 2.684 1.00 0.00 C ATOM 42 N1 DT A 2 3.423 8.799 2.747 1.00 0.00 N ATOM 43 C2 DT A 2 2.337 9.639 2.626 1.00 0.00 C ATOM 44 O2 DT A 2 2.458 10.860 2.552 1.00 0.00 O ATOM 45 N3 DT A 2 1.099 9.029 2.606 1.00 0.00 N ATOM 46 C4 DT A 2 0.851 7.673 2.697 1.00 0.00 C ATOM 47 O4 DT A 2 -0.302 7.243 2.661 1.00 0.00 O ATOM 48 C5 DT A 2 2.045 6.871 2.827 1.00 0.00 C ATOM 49 C7 DT A 2 1.928 5.354 2.910 1.00 0.00 C ATOM 50 C6 DT A 2 3.266 7.442 2.852 1.00 0.00 C ATOM 0 H5' DT A 2 6.842 7.041 0.513 1.00 0.00 H new ATOM 0 H5'' DT A 2 8.359 7.249 1.366 1.00 0.00 H new ATOM 0 H4' DT A 2 7.533 9.380 1.287 1.00 0.00 H new ATOM 0 H3' DT A 2 7.608 8.183 3.829 1.00 0.00 H new ATOM 0 H2' DT A 2 5.316 8.081 4.284 1.00 0.00 H new ATOM 0 H2'' DT A 2 5.542 9.777 4.661 1.00 0.00 H new ATOM 0 H1' DT A 2 4.593 10.491 2.671 1.00 0.00 H new ATOM 0 H3 DT A 2 0.287 9.640 2.515 1.00 0.00 H new ATOM 0 H71 DT A 2 0.980 5.087 3.377 1.00 0.00 H new ATOM 0 H72 DT A 2 1.970 4.930 1.907 1.00 0.00 H new ATOM 0 H73 DT A 2 2.750 4.958 3.506 1.00 0.00 H new ATOM 0 H6 DT A 2 4.140 6.816 2.957 1.00 0.00 H new ATOM 63 P DC A 3 7.980 10.697 5.100 1.00 0.00 P ATOM 64 OP1 DC A 3 9.280 11.413 5.150 1.00 0.00 O ATOM 65 OP2 DC A 3 7.737 9.569 6.034 1.00 0.00 O ATOM 66 O5' DC A 3 6.789 11.768 5.253 1.00 0.00 O ATOM 67 C5' DC A 3 6.720 12.904 4.380 1.00 0.00 C ATOM 68 C4' DC A 3 5.593 13.866 4.739 1.00 0.00 C ATOM 69 O4' DC A 3 4.292 13.290 4.450 1.00 0.00 O ATOM 70 C3' DC A 3 5.616 14.221 6.221 1.00 0.00 C ATOM 71 O3' DC A 3 5.555 15.639 6.408 1.00 0.00 O ATOM 72 C2' DC A 3 4.407 13.552 6.796 1.00 0.00 C ATOM 73 C1' DC A 3 3.465 13.339 5.637 1.00 0.00 C ATOM 74 N1 DC A 3 2.672 12.098 5.790 1.00 0.00 N ATOM 75 C2 DC A 3 1.294 12.207 5.721 1.00 0.00 C ATOM 76 O2 DC A 3 0.763 13.308 5.588 1.00 0.00 O ATOM 77 N3 DC A 3 0.558 11.072 5.813 1.00 0.00 N ATOM 78 C4 DC A 3 1.140 9.878 5.968 1.00 0.00 C ATOM 79 N4 DC A 3 0.379 8.788 6.044 1.00 0.00 N ATOM 80 C5 DC A 3 2.559 9.760 6.045 1.00 0.00 C ATOM 81 C6 DC A 3 3.282 10.889 5.955 1.00 0.00 C ATOM 0 H5' DC A 3 6.583 12.559 3.355 1.00 0.00 H new ATOM 0 H5'' DC A 3 7.670 13.438 4.412 1.00 0.00 H new ATOM 0 H4' DC A 3 5.752 14.759 4.135 1.00 0.00 H new ATOM 0 H3' DC A 3 6.535 13.891 6.707 1.00 0.00 H new ATOM 0 H2' DC A 3 4.671 12.604 7.265 1.00 0.00 H new ATOM 0 H2'' DC A 3 3.946 14.171 7.566 1.00 0.00 H new ATOM 0 H1' DC A 3 2.735 14.147 5.580 1.00 0.00 H new ATOM 0 H41 DC A 3 0.811 7.872 6.162 1.00 0.00 H new ATOM 0 H42 DC A 3 -0.636 8.869 5.984 1.00 0.00 H new ATOM 0 H5 DC A 3 3.035 8.799 6.171 1.00 0.00 H new ATOM 0 H6 DC A 3 4.359 10.839 6.014 1.00 0.00 H new ATOM 93 P DC A 4 5.538 16.275 7.882 1.00 0.00 P ATOM 94 OP1 DC A 4 6.177 17.615 7.835 1.00 0.00 O ATOM 95 OP2 DC A 4 6.033 15.266 8.851 1.00 0.00 O ATOM 96 O5' DC A 4 3.955 16.462 8.083 1.00 0.00 O ATOM 97 C5' DC A 4 3.157 17.011 7.025 1.00 0.00 C ATOM 98 C4' DC A 4 1.722 17.289 7.449 1.00 0.00 C ATOM 99 O4' DC A 4 0.888 16.113 7.280 1.00 0.00 O ATOM 100 C3' DC A 4 1.648 17.697 8.914 1.00 0.00 C ATOM 101 O3' DC A 4 0.881 18.892 9.085 1.00 0.00 O ATOM 102 C2' DC A 4 0.992 16.545 9.602 1.00 0.00 C ATOM 103 C1' DC A 4 0.232 15.803 8.531 1.00 0.00 C ATOM 104 N1 DC A 4 0.215 14.343 8.782 1.00 0.00 N ATOM 105 C2 DC A 4 -1.018 13.712 8.800 1.00 0.00 C ATOM 106 O2 DC A 4 -2.050 14.359 8.636 1.00 0.00 O ATOM 107 N3 DC A 4 -1.049 12.370 9.003 1.00 0.00 N ATOM 108 C4 DC A 4 0.078 11.668 9.183 1.00 0.00 C ATOM 109 N4 DC A 4 0.010 10.348 9.372 1.00 0.00 N ATOM 110 C5 DC A 4 1.351 12.313 9.169 1.00 0.00 C ATOM 111 C6 DC A 4 1.375 13.644 8.967 1.00 0.00 C ATOM 0 H5' DC A 4 3.154 16.319 6.182 1.00 0.00 H new ATOM 0 H5'' DC A 4 3.613 17.937 6.676 1.00 0.00 H new ATOM 0 H4' DC A 4 1.364 18.100 6.814 1.00 0.00 H new ATOM 0 H3' DC A 4 2.636 17.914 9.321 1.00 0.00 H new ATOM 0 H2' DC A 4 1.732 15.899 10.074 1.00 0.00 H new ATOM 0 H2'' DC A 4 0.321 16.890 10.389 1.00 0.00 H new ATOM 0 H1' DC A 4 -0.813 16.112 8.515 1.00 0.00 H new ATOM 0 H41 DC A 4 0.864 9.808 9.510 1.00 0.00 H new ATOM 0 H42 DC A 4 -0.896 9.880 9.379 1.00 0.00 H new ATOM 0 H5 DC A 4 2.263 11.753 9.315 1.00 0.00 H new ATOM 0 H6 DC A 4 2.321 14.165 8.951 1.00 0.00 H new ATOM 123 P DT A 5 0.647 19.496 10.554 1.00 0.00 P ATOM 124 OP1 DT A 5 0.561 20.975 10.457 1.00 0.00 O ATOM 125 OP2 DT A 5 1.626 18.884 11.487 1.00 0.00 O ATOM 126 O5' DT A 5 -0.815 18.907 10.868 1.00 0.00 O ATOM 127 C5' DT A 5 -1.928 19.273 10.041 1.00 0.00 C ATOM 128 C4' DT A 5 -3.200 18.507 10.381 1.00 0.00 C ATOM 129 O4' DT A 5 -2.989 17.071 10.326 1.00 0.00 O ATOM 130 C3' DT A 5 -3.691 18.844 11.781 1.00 0.00 C ATOM 131 O3' DT A 5 -5.077 19.199 11.761 1.00 0.00 O ATOM 132 C2' DT A 5 -3.465 17.594 12.579 1.00 0.00 C ATOM 133 C1' DT A 5 -3.410 16.473 11.574 1.00 0.00 C ATOM 134 N1 DT A 5 -2.482 15.396 11.992 1.00 0.00 N ATOM 135 C2 DT A 5 -3.000 14.117 12.096 1.00 0.00 C ATOM 136 O2 DT A 5 -4.196 13.881 11.943 1.00 0.00 O ATOM 137 N3 DT A 5 -2.094 13.117 12.403 1.00 0.00 N ATOM 138 C4 DT A 5 -0.742 13.280 12.614 1.00 0.00 C ATOM 139 O4 DT A 5 -0.032 12.308 12.873 1.00 0.00 O ATOM 140 C5 DT A 5 -0.289 14.648 12.492 1.00 0.00 C ATOM 141 C7 DT A 5 1.191 14.967 12.669 1.00 0.00 C ATOM 142 C6 DT A 5 -1.153 15.644 12.196 1.00 0.00 C ATOM 0 H5' DT A 5 -1.672 19.095 8.997 1.00 0.00 H new ATOM 0 H5'' DT A 5 -2.115 20.342 10.146 1.00 0.00 H new ATOM 0 H4' DT A 5 -3.941 18.805 9.639 1.00 0.00 H new ATOM 0 H3' DT A 5 -3.166 19.699 12.207 1.00 0.00 H new ATOM 0 H2' DT A 5 -2.537 17.655 13.148 1.00 0.00 H new ATOM 0 H2'' DT A 5 -4.270 17.437 13.297 1.00 0.00 H new ATOM 0 H1' DT A 5 -4.385 15.996 11.478 1.00 0.00 H new ATOM 0 H3 DT A 5 -2.462 12.169 12.480 1.00 0.00 H new ATOM 0 H71 DT A 5 1.451 15.835 12.063 1.00 0.00 H new ATOM 0 H72 DT A 5 1.394 15.183 13.718 1.00 0.00 H new ATOM 0 H73 DT A 5 1.788 14.112 12.353 1.00 0.00 H new ATOM 0 H6 DT A 5 -0.786 16.657 12.119 1.00 0.00 H new ATOM 155 P DA A 6 -5.692 20.169 12.882 1.00 0.00 P ATOM 156 OP1 DA A 6 -6.683 21.072 12.244 1.00 0.00 O ATOM 157 OP2 DA A 6 -4.583 20.752 13.678 1.00 0.00 O ATOM 158 O5' DA A 6 -6.471 19.094 13.785 1.00 0.00 O ATOM 159 C5' DA A 6 -7.541 18.319 13.232 1.00 0.00 C ATOM 160 C4' DA A 6 -7.985 17.203 14.162 1.00 0.00 C ATOM 161 O4' DA A 6 -7.060 16.084 14.109 1.00 0.00 O ATOM 162 C3' DA A 6 -8.041 17.687 15.608 1.00 0.00 C ATOM 163 O3' DA A 6 -9.285 17.318 16.221 1.00 0.00 O ATOM 164 C2' DA A 6 -6.890 17.001 16.274 1.00 0.00 C ATOM 165 C1' DA A 6 -6.626 15.770 15.448 1.00 0.00 C ATOM 166 N9 DA A 6 -5.206 15.361 15.499 1.00 0.00 N ATOM 167 C8 DA A 6 -4.070 16.107 15.522 1.00 0.00 C ATOM 168 N7 DA A 6 -2.949 15.480 15.662 1.00 0.00 N ATOM 169 C5 DA A 6 -3.380 14.152 15.741 1.00 0.00 C ATOM 170 C6 DA A 6 -2.701 12.939 15.900 1.00 0.00 C ATOM 171 N6 DA A 6 -1.379 12.855 16.045 1.00 0.00 N ATOM 172 N1 DA A 6 -3.441 11.818 15.931 1.00 0.00 N ATOM 173 C2 DA A 6 -4.769 11.882 15.816 1.00 0.00 C ATOM 174 N3 DA A 6 -5.509 12.969 15.668 1.00 0.00 N ATOM 175 C4 DA A 6 -4.749 14.077 15.638 1.00 0.00 C ATOM 0 H5' DA A 6 -7.223 17.892 12.281 1.00 0.00 H new ATOM 0 H5'' DA A 6 -8.388 18.972 13.021 1.00 0.00 H new ATOM 0 H4' DA A 6 -8.975 16.890 13.830 1.00 0.00 H new ATOM 0 H3' DA A 6 -7.977 18.772 15.687 1.00 0.00 H new ATOM 0 H2' DA A 6 -6.013 17.647 16.307 1.00 0.00 H new ATOM 0 H2'' DA A 6 -7.132 16.739 17.304 1.00 0.00 H new ATOM 0 H1' DA A 6 -7.173 14.912 15.839 1.00 0.00 H new ATOM 0 H8 DA A 6 -4.103 17.182 15.427 1.00 0.00 H new ATOM 0 H61 DA A 6 -0.935 11.944 16.158 1.00 0.00 H new ATOM 0 H62 DA A 6 -0.811 13.702 16.043 1.00 0.00 H new ATOM 0 H2 DA A 6 -5.299 10.942 15.847 1.00 0.00 H new ATOM 187 P DG A 7 -9.843 18.105 17.507 1.00 0.00 P ATOM 188 OP1 DG A 7 -11.229 18.561 17.226 1.00 0.00 O ATOM 189 OP2 DG A 7 -8.828 19.100 17.939 1.00 0.00 O ATOM 190 O5' DG A 7 -9.897 16.910 18.585 1.00 0.00 O ATOM 191 C5' DG A 7 -10.177 15.560 18.181 1.00 0.00 C ATOM 192 C4' DG A 7 -9.561 14.522 19.125 1.00 0.00 C ATOM 193 O4' DG A 7 -8.133 14.405 18.887 1.00 0.00 O ATOM 194 C3' DG A 7 -9.744 14.878 20.608 1.00 0.00 C ATOM 195 O3' DG A 7 -10.214 13.747 21.352 1.00 0.00 O ATOM 196 C2' DG A 7 -8.383 15.282 21.074 1.00 0.00 C ATOM 197 C1' DG A 7 -7.410 14.638 20.119 1.00 0.00 C ATOM 198 N9 DG A 7 -6.233 15.500 19.896 1.00 0.00 N ATOM 199 C8 DG A 7 -6.168 16.829 19.630 1.00 0.00 C ATOM 200 N7 DG A 7 -4.998 17.354 19.481 1.00 0.00 N ATOM 201 C5 DG A 7 -4.162 16.248 19.668 1.00 0.00 C ATOM 202 C6 DG A 7 -2.744 16.163 19.632 1.00 0.00 C ATOM 203 O6 DG A 7 -1.932 17.060 19.420 1.00 0.00 O ATOM 204 N1 DG A 7 -2.305 14.867 19.874 1.00 0.00 N ATOM 205 C2 DG A 7 -3.123 13.783 20.119 1.00 0.00 C ATOM 206 N2 DG A 7 -2.510 12.617 20.326 1.00 0.00 N ATOM 207 N3 DG A 7 -4.458 13.854 20.155 1.00 0.00 N ATOM 208 C4 DG A 7 -4.911 15.108 19.923 1.00 0.00 C ATOM 0 H5' DG A 7 -9.795 15.400 17.173 1.00 0.00 H new ATOM 0 H5'' DG A 7 -11.256 15.413 18.140 1.00 0.00 H new ATOM 0 H4' DG A 7 -10.082 13.588 18.916 1.00 0.00 H new ATOM 0 H3' DG A 7 -10.482 15.667 20.749 1.00 0.00 H new ATOM 0 H2' DG A 7 -8.275 16.367 21.069 1.00 0.00 H new ATOM 0 H2'' DG A 7 -8.205 14.948 22.096 1.00 0.00 H new ATOM 0 H1' DG A 7 -7.027 13.702 20.525 1.00 0.00 H new ATOM 0 H8 DG A 7 -7.064 17.427 19.546 1.00 0.00 H new ATOM 0 H1 DG A 7 -1.298 14.704 19.870 1.00 0.00 H new ATOM 0 H21 DG A 7 -3.059 11.778 20.512 1.00 0.00 H new ATOM 0 H22 DG A 7 -1.492 12.564 20.298 1.00 0.00 H new ATOM 220 P DT A 8 -10.470 13.861 22.933 1.00 0.00 P ATOM 221 OP1 DT A 8 -11.662 13.049 23.287 1.00 0.00 O ATOM 222 OP2 DT A 8 -10.423 15.292 23.326 1.00 0.00 O ATOM 223 O5' DT A 8 -9.152 13.125 23.489 1.00 0.00 O ATOM 224 C5' DT A 8 -9.105 11.695 23.588 1.00 0.00 C ATOM 225 C4' DT A 8 -7.687 11.168 23.791 1.00 0.00 C ATOM 226 O4' DT A 8 -6.715 12.044 23.168 1.00 0.00 O ATOM 227 C3' DT A 8 -7.326 11.065 25.272 1.00 0.00 C ATOM 228 O3' DT A 8 -6.760 9.782 25.572 1.00 0.00 O ATOM 229 C2' DT A 8 -6.324 12.155 25.493 1.00 0.00 C ATOM 230 C1' DT A 8 -5.719 12.435 24.137 1.00 0.00 C ATOM 231 N1 DT A 8 -5.347 13.860 23.988 1.00 0.00 N ATOM 232 C2 DT A 8 -4.038 14.136 23.637 1.00 0.00 C ATOM 233 O2 DT A 8 -3.212 13.247 23.443 1.00 0.00 O ATOM 234 N3 DT A 8 -3.711 15.473 23.513 1.00 0.00 N ATOM 235 C4 DT A 8 -4.564 16.543 23.707 1.00 0.00 C ATOM 236 O4 DT A 8 -4.163 17.697 23.570 1.00 0.00 O ATOM 237 C5 DT A 8 -5.910 16.163 24.071 1.00 0.00 C ATOM 238 C7 DT A 8 -6.952 17.250 24.322 1.00 0.00 C ATOM 239 C6 DT A 8 -6.259 14.865 24.197 1.00 0.00 C ATOM 0 H5' DT A 8 -9.525 11.258 22.682 1.00 0.00 H new ATOM 0 H5'' DT A 8 -9.732 11.371 24.419 1.00 0.00 H new ATOM 0 H4' DT A 8 -7.662 10.178 23.335 1.00 0.00 H new ATOM 0 H3' DT A 8 -8.198 11.169 25.917 1.00 0.00 H new ATOM 0 H2' DT A 8 -6.799 13.047 25.901 1.00 0.00 H new ATOM 0 H2'' DT A 8 -5.560 11.846 26.206 1.00 0.00 H new ATOM 0 H1' DT A 8 -4.793 11.876 23.999 1.00 0.00 H new ATOM 0 H3 DT A 8 -2.749 15.691 23.254 1.00 0.00 H new ATOM 0 H71 DT A 8 -7.941 16.874 24.060 1.00 0.00 H new ATOM 0 H72 DT A 8 -6.938 17.531 25.375 1.00 0.00 H new ATOM 0 H73 DT A 8 -6.722 18.122 23.710 1.00 0.00 H new ATOM 0 H6 DT A 8 -7.274 14.613 24.467 1.00 0.00 H new ATOM 252 P DT A 9 -6.511 9.330 27.094 1.00 0.00 P ATOM 253 OP1 DT A 9 -6.391 7.851 27.145 1.00 0.00 O ATOM 254 OP2 DT A 9 -7.505 10.007 27.965 1.00 0.00 O ATOM 255 O5' DT A 9 -5.064 9.980 27.352 1.00 0.00 O ATOM 256 C5' DT A 9 -3.880 9.385 26.799 1.00 0.00 C ATOM 257 C4' DT A 9 -3.160 10.317 25.831 1.00 0.00 C ATOM 258 O4' DT A 9 -3.322 11.705 26.223 1.00 0.00 O ATOM 259 C3' DT A 9 -1.667 10.028 25.792 1.00 0.00 C ATOM 260 O3' DT A 9 -1.201 9.937 24.447 1.00 0.00 O ATOM 261 C2' DT A 9 -1.031 11.183 26.492 1.00 0.00 C ATOM 262 C1' DT A 9 -2.022 12.314 26.402 1.00 0.00 C ATOM 263 N1 DT A 9 -1.980 13.144 27.620 1.00 0.00 N ATOM 264 C2 DT A 9 -1.594 14.462 27.479 1.00 0.00 C ATOM 265 O2 DT A 9 -1.304 14.946 26.388 1.00 0.00 O ATOM 266 N3 DT A 9 -1.550 15.208 28.642 1.00 0.00 N ATOM 267 C4 DT A 9 -1.856 14.754 29.913 1.00 0.00 C ATOM 268 O4 DT A 9 -1.781 15.506 30.882 1.00 0.00 O ATOM 269 C5 DT A 9 -2.250 13.364 29.961 1.00 0.00 C ATOM 270 C7 DT A 9 -2.613 12.733 31.301 1.00 0.00 C ATOM 271 C6 DT A 9 -2.301 12.617 28.841 1.00 0.00 C ATOM 0 H5' DT A 9 -4.147 8.464 26.281 1.00 0.00 H new ATOM 0 H5'' DT A 9 -3.202 9.111 27.608 1.00 0.00 H new ATOM 0 H4' DT A 9 -3.603 10.144 24.850 1.00 0.00 H new ATOM 0 H3' DT A 9 -1.425 9.077 26.266 1.00 0.00 H new ATOM 0 H2' DT A 9 -0.811 10.938 27.531 1.00 0.00 H new ATOM 0 H2'' DT A 9 -0.086 11.453 26.021 1.00 0.00 H new ATOM 0 H1' DT A 9 -1.790 12.979 25.570 1.00 0.00 H new ATOM 0 H3 DT A 9 -1.266 16.184 28.555 1.00 0.00 H new ATOM 0 H71 DT A 9 -3.349 11.944 31.144 1.00 0.00 H new ATOM 0 H72 DT A 9 -1.719 12.309 31.758 1.00 0.00 H new ATOM 0 H73 DT A 9 -3.031 13.494 31.960 1.00 0.00 H new ATOM 0 H6 DT A 9 -2.601 11.582 28.908 1.00 0.00 H new ATOM 284 P DA A 10 -0.315 8.688 23.992 1.00 0.00 P ATOM 285 OP1 DA A 10 0.551 8.277 25.125 1.00 0.00 O ATOM 286 OP2 DA A 10 0.304 8.985 22.676 1.00 0.00 O ATOM 287 O5' DA A 10 -1.467 7.588 23.799 1.00 0.00 O ATOM 288 C5' DA A 10 -1.147 6.209 23.981 1.00 0.00 C ATOM 289 C4' DA A 10 -1.836 5.303 22.968 1.00 0.00 C ATOM 290 O4' DA A 10 -3.058 5.912 22.482 1.00 0.00 O ATOM 291 C3' DA A 10 -0.922 5.089 21.772 1.00 0.00 C ATOM 292 O3' DA A 10 -1.116 3.794 21.200 1.00 0.00 O ATOM 293 C2' DA A 10 -1.353 6.163 20.832 1.00 0.00 C ATOM 294 C1' DA A 10 -2.814 6.401 21.156 1.00 0.00 C ATOM 295 N9 DA A 10 -3.245 7.804 21.056 1.00 0.00 N ATOM 296 C8 DA A 10 -2.525 8.939 21.164 1.00 0.00 C ATOM 297 N7 DA A 10 -3.166 10.059 21.189 1.00 0.00 N ATOM 298 C5 DA A 10 -4.488 9.625 21.105 1.00 0.00 C ATOM 299 C6 DA A 10 -5.708 10.306 21.082 1.00 0.00 C ATOM 300 N6 DA A 10 -5.798 11.634 21.109 1.00 0.00 N ATOM 301 N1 DA A 10 -6.829 9.568 20.995 1.00 0.00 N ATOM 302 C2 DA A 10 -6.756 8.238 20.930 1.00 0.00 C ATOM 303 N3 DA A 10 -5.655 7.493 20.942 1.00 0.00 N ATOM 304 C4 DA A 10 -4.547 8.257 21.031 1.00 0.00 C ATOM 0 H5' DA A 10 -1.433 5.904 24.988 1.00 0.00 H new ATOM 0 H5'' DA A 10 -0.068 6.078 23.903 1.00 0.00 H new ATOM 0 H4' DA A 10 -2.063 4.358 23.462 1.00 0.00 H new ATOM 0 H3' DA A 10 0.137 5.136 22.024 1.00 0.00 H new ATOM 0 H2' DA A 10 -0.765 7.070 20.972 1.00 0.00 H new ATOM 0 H2'' DA A 10 -1.223 5.855 19.794 1.00 0.00 H new ATOM 0 H1' DA A 10 -3.399 5.869 20.406 1.00 0.00 H new ATOM 0 H8 DA A 10 -1.447 8.912 21.228 1.00 0.00 H new ATOM 0 H61 DA A 10 -6.713 12.084 21.090 1.00 0.00 H new ATOM 0 H62 DA A 10 -4.952 12.202 21.148 1.00 0.00 H new ATOM 0 H2 DA A 10 -7.694 7.708 20.860 1.00 0.00 H new ATOM 316 P DT A 11 -0.300 3.354 19.891 1.00 0.00 P ATOM 317 OP1 DT A 11 0.097 1.930 20.024 1.00 0.00 O ATOM 318 OP2 DT A 11 0.734 4.378 19.599 1.00 0.00 O ATOM 319 O5' DT A 11 -1.473 3.469 18.803 1.00 0.00 O ATOM 320 C5' DT A 11 -2.662 2.689 18.966 1.00 0.00 C ATOM 321 C4' DT A 11 -3.851 3.245 18.197 1.00 0.00 C ATOM 322 O4' DT A 11 -3.901 4.696 18.258 1.00 0.00 O ATOM 323 C3' DT A 11 -3.793 2.852 16.729 1.00 0.00 C ATOM 324 O3' DT A 11 -5.015 2.233 16.322 1.00 0.00 O ATOM 325 C2' DT A 11 -3.564 4.136 15.992 1.00 0.00 C ATOM 326 C1' DT A 11 -4.030 5.228 16.919 1.00 0.00 C ATOM 327 N1 DT A 11 -3.239 6.466 16.744 1.00 0.00 N ATOM 328 C2 DT A 11 -3.928 7.616 16.410 1.00 0.00 C ATOM 329 O2 DT A 11 -5.147 7.627 16.255 1.00 0.00 O ATOM 330 N3 DT A 11 -3.167 8.760 16.267 1.00 0.00 N ATOM 331 C4 DT A 11 -1.796 8.854 16.430 1.00 0.00 C ATOM 332 O4 DT A 11 -1.220 9.932 16.292 1.00 0.00 O ATOM 333 C5 DT A 11 -1.161 7.602 16.776 1.00 0.00 C ATOM 334 C7 DT A 11 0.348 7.560 16.990 1.00 0.00 C ATOM 335 C6 DT A 11 -1.881 6.470 16.918 1.00 0.00 C ATOM 0 H5' DT A 11 -2.914 2.638 20.025 1.00 0.00 H new ATOM 0 H5'' DT A 11 -2.468 1.669 18.635 1.00 0.00 H new ATOM 0 H4' DT A 11 -4.738 2.822 18.669 1.00 0.00 H new ATOM 0 H3' DT A 11 -3.005 2.126 16.528 1.00 0.00 H new ATOM 0 H2' DT A 11 -2.511 4.260 15.740 1.00 0.00 H new ATOM 0 H2'' DT A 11 -4.121 4.154 15.055 1.00 0.00 H new ATOM 0 H1' DT A 11 -5.061 5.511 16.707 1.00 0.00 H new ATOM 0 H3 DT A 11 -3.662 9.616 16.018 1.00 0.00 H new ATOM 0 H71 DT A 11 0.591 6.782 17.714 1.00 0.00 H new ATOM 0 H72 DT A 11 0.844 7.343 16.044 1.00 0.00 H new ATOM 0 H73 DT A 11 0.689 8.525 17.366 1.00 0.00 H new ATOM 0 H6 DT A 11 -1.377 5.550 17.174 1.00 0.00 H new ATOM 348 P DA A 12 -5.221 1.752 14.807 1.00 0.00 P ATOM 349 OP1 DA A 12 -6.125 0.574 14.792 1.00 0.00 O ATOM 350 OP2 DA A 12 -3.895 1.663 14.146 1.00 0.00 O ATOM 351 O5' DA A 12 -6.010 3.023 14.225 1.00 0.00 O ATOM 352 C5' DA A 12 -7.077 3.615 14.980 1.00 0.00 C ATOM 353 C4' DA A 12 -7.824 4.680 14.194 1.00 0.00 C ATOM 354 O4' DA A 12 -7.144 5.958 14.280 1.00 0.00 O ATOM 355 C3' DA A 12 -7.909 4.308 12.721 1.00 0.00 C ATOM 356 O3' DA A 12 -9.231 4.514 12.212 1.00 0.00 O ATOM 357 C2' DA A 12 -6.935 5.215 12.045 1.00 0.00 C ATOM 358 C1' DA A 12 -6.790 6.408 12.952 1.00 0.00 C ATOM 359 N9 DA A 12 -5.417 6.949 12.917 1.00 0.00 N ATOM 360 C8 DA A 12 -4.226 6.316 13.057 1.00 0.00 C ATOM 361 N7 DA A 12 -3.157 7.043 13.020 1.00 0.00 N ATOM 362 C5 DA A 12 -3.693 8.321 12.830 1.00 0.00 C ATOM 363 C6 DA A 12 -3.111 9.589 12.699 1.00 0.00 C ATOM 364 N6 DA A 12 -1.795 9.805 12.753 1.00 0.00 N ATOM 365 N1 DA A 12 -3.941 10.629 12.522 1.00 0.00 N ATOM 366 C2 DA A 12 -5.257 10.448 12.476 1.00 0.00 C ATOM 367 N3 DA A 12 -5.913 9.300 12.587 1.00 0.00 N ATOM 368 C4 DA A 12 -5.067 8.268 12.764 1.00 0.00 C ATOM 0 H5' DA A 12 -6.672 4.057 15.890 1.00 0.00 H new ATOM 0 H5'' DA A 12 -7.776 2.837 15.287 1.00 0.00 H new ATOM 0 H4' DA A 12 -8.822 4.751 14.626 1.00 0.00 H new ATOM 0 H3' DA A 12 -7.682 3.255 12.552 1.00 0.00 H new ATOM 0 H2' DA A 12 -5.976 4.718 11.896 1.00 0.00 H new ATOM 0 H2'' DA A 12 -7.296 5.513 11.061 1.00 0.00 H new ATOM 0 H1' DA A 12 -7.440 7.221 12.630 1.00 0.00 H new ATOM 0 H8 DA A 12 -4.172 5.246 13.194 1.00 0.00 H new ATOM 0 H61 DA A 12 -1.429 10.752 12.651 1.00 0.00 H new ATOM 0 H62 DA A 12 -1.155 9.023 12.896 1.00 0.00 H new ATOM 0 H2 DA A 12 -5.859 11.333 12.332 1.00 0.00 H new ATOM 380 P DG A 13 -9.569 4.219 10.669 1.00 0.00 P ATOM 381 OP1 DG A 13 -10.964 3.722 10.568 1.00 0.00 O ATOM 382 OP2 DG A 13 -8.467 3.416 10.078 1.00 0.00 O ATOM 383 O5' DG A 13 -9.502 5.712 10.074 1.00 0.00 O ATOM 384 C5' DG A 13 -10.262 6.771 10.674 1.00 0.00 C ATOM 385 C4' DG A 13 -10.106 8.098 9.939 1.00 0.00 C ATOM 386 O4' DG A 13 -8.786 8.662 10.158 1.00 0.00 O ATOM 387 C3' DG A 13 -10.275 7.918 8.438 1.00 0.00 C ATOM 388 O3' DG A 13 -11.101 8.949 7.886 1.00 0.00 O ATOM 389 C2' DG A 13 -8.891 8.009 7.886 1.00 0.00 C ATOM 390 C1' DG A 13 -8.107 8.815 8.888 1.00 0.00 C ATOM 391 N9 DG A 13 -6.709 8.354 8.973 1.00 0.00 N ATOM 392 C8 DG A 13 -6.219 7.099 9.112 1.00 0.00 C ATOM 393 N7 DG A 13 -4.941 6.963 9.220 1.00 0.00 N ATOM 394 C5 DG A 13 -4.509 8.289 9.140 1.00 0.00 C ATOM 395 C6 DG A 13 -3.197 8.821 9.193 1.00 0.00 C ATOM 396 O6 DG A 13 -2.131 8.221 9.329 1.00 0.00 O ATOM 397 N1 DG A 13 -3.206 10.202 9.073 1.00 0.00 N ATOM 398 C2 DG A 13 -4.330 10.984 8.915 1.00 0.00 C ATOM 399 N2 DG A 13 -4.124 12.296 8.784 1.00 0.00 N ATOM 400 N3 DG A 13 -5.570 10.492 8.868 1.00 0.00 N ATOM 401 C4 DG A 13 -5.588 9.146 8.985 1.00 0.00 C ATOM 0 H5' DG A 13 -9.948 6.896 11.710 1.00 0.00 H new ATOM 0 H5'' DG A 13 -11.315 6.492 10.691 1.00 0.00 H new ATOM 0 H4' DG A 13 -10.876 8.762 10.331 1.00 0.00 H new ATOM 0 H3' DG A 13 -10.760 6.973 8.195 1.00 0.00 H new ATOM 0 H2' DG A 13 -8.456 7.018 7.753 1.00 0.00 H new ATOM 0 H2'' DG A 13 -8.890 8.491 6.908 1.00 0.00 H new ATOM 0 H1' DG A 13 -8.062 9.863 8.592 1.00 0.00 H new ATOM 0 H8 DG A 13 -6.876 6.242 9.132 1.00 0.00 H new ATOM 0 H1 DG A 13 -2.305 10.680 9.104 1.00 0.00 H new ATOM 0 H21 DG A 13 -4.916 12.927 8.664 1.00 0.00 H new ATOM 0 H22 DG A 13 -3.174 12.668 8.804 1.00 0.00 H new ATOM 413 P DG A 14 -11.390 9.003 6.307 1.00 0.00 P ATOM 414 OP1 DG A 14 -12.822 9.326 6.088 1.00 0.00 O ATOM 415 OP2 DG A 14 -10.812 7.792 5.669 1.00 0.00 O ATOM 416 O5' DG A 14 -10.498 10.281 5.903 1.00 0.00 O ATOM 417 C5' DG A 14 -10.655 11.527 6.598 1.00 0.00 C ATOM 418 C4' DG A 14 -9.695 12.606 6.108 1.00 0.00 C ATOM 419 O4' DG A 14 -8.331 12.331 6.524 1.00 0.00 O ATOM 420 C3' DG A 14 -9.699 12.699 4.588 1.00 0.00 C ATOM 421 O3' DG A 14 -9.858 14.054 4.155 1.00 0.00 O ATOM 422 C2' DG A 14 -8.370 12.156 4.168 1.00 0.00 C ATOM 423 C1' DG A 14 -7.466 12.306 5.364 1.00 0.00 C ATOM 424 N9 DG A 14 -6.496 11.197 5.439 1.00 0.00 N ATOM 425 C8 DG A 14 -6.712 9.862 5.468 1.00 0.00 C ATOM 426 N7 DG A 14 -5.685 9.089 5.544 1.00 0.00 N ATOM 427 C5 DG A 14 -4.640 10.014 5.568 1.00 0.00 C ATOM 428 C6 DG A 14 -3.243 9.800 5.643 1.00 0.00 C ATOM 429 O6 DG A 14 -2.637 8.733 5.710 1.00 0.00 O ATOM 430 N1 DG A 14 -2.546 11.000 5.639 1.00 0.00 N ATOM 431 C2 DG A 14 -3.115 12.253 5.569 1.00 0.00 C ATOM 432 N2 DG A 14 -2.272 13.284 5.569 1.00 0.00 N ATOM 433 N3 DG A 14 -4.431 12.464 5.499 1.00 0.00 N ATOM 434 C4 DG A 14 -5.130 11.309 5.503 1.00 0.00 C ATOM 0 H5' DG A 14 -10.497 11.365 7.664 1.00 0.00 H new ATOM 0 H5'' DG A 14 -11.680 11.878 6.477 1.00 0.00 H new ATOM 0 H4' DG A 14 -10.039 13.543 6.546 1.00 0.00 H new ATOM 0 H3' DG A 14 -10.527 12.144 4.147 1.00 0.00 H new ATOM 0 H2' DG A 14 -8.452 11.111 3.869 1.00 0.00 H new ATOM 0 H2'' DG A 14 -7.978 12.703 3.311 1.00 0.00 H new ATOM 0 H1' DG A 14 -6.874 13.219 5.300 1.00 0.00 H new ATOM 0 H8 DG A 14 -7.713 9.458 5.429 1.00 0.00 H new ATOM 0 H1 DG A 14 -1.529 10.950 5.692 1.00 0.00 H new ATOM 0 H21 DG A 14 -2.632 14.237 5.519 1.00 0.00 H new ATOM 0 H22 DG A 14 -1.266 13.121 5.619 1.00 0.00 H new ATOM 446 P DA A 15 -9.872 14.418 2.591 1.00 0.00 P ATOM 447 OP1 DA A 15 -10.717 15.621 2.385 1.00 0.00 O ATOM 448 OP2 DA A 15 -10.159 13.187 1.811 1.00 0.00 O ATOM 449 O5' DA A 15 -8.329 14.822 2.384 1.00 0.00 O ATOM 450 C5' DA A 15 -7.757 15.905 3.132 1.00 0.00 C ATOM 451 C4' DA A 15 -6.352 16.267 2.666 1.00 0.00 C ATOM 452 O4' DA A 15 -5.384 15.271 3.088 1.00 0.00 O ATOM 453 C3' DA A 15 -6.283 16.352 1.147 1.00 0.00 C ATOM 454 O3' DA A 15 -5.624 17.548 0.722 1.00 0.00 O ATOM 455 C2' DA A 15 -5.504 15.149 0.731 1.00 0.00 C ATOM 456 C1' DA A 15 -4.683 14.758 1.931 1.00 0.00 C ATOM 457 N9 DA A 15 -4.519 13.297 2.002 1.00 0.00 N ATOM 458 C8 DA A 15 -5.449 12.315 1.922 1.00 0.00 C ATOM 459 N7 DA A 15 -5.037 11.096 2.004 1.00 0.00 N ATOM 460 C5 DA A 15 -3.661 11.277 2.155 1.00 0.00 C ATOM 461 C6 DA A 15 -2.600 10.384 2.299 1.00 0.00 C ATOM 462 N6 DA A 15 -2.755 9.059 2.312 1.00 0.00 N ATOM 463 N1 DA A 15 -1.372 10.906 2.425 1.00 0.00 N ATOM 464 C2 DA A 15 -1.189 12.224 2.412 1.00 0.00 C ATOM 465 N3 DA A 15 -2.117 13.160 2.280 1.00 0.00 N ATOM 466 C4 DA A 15 -3.341 12.615 2.156 1.00 0.00 C ATOM 0 H5' DA A 15 -7.727 15.635 4.188 1.00 0.00 H new ATOM 0 H5'' DA A 15 -8.401 16.780 3.045 1.00 0.00 H new ATOM 0 H4' DA A 15 -6.118 17.234 3.112 1.00 0.00 H new ATOM 0 H3' DA A 15 -7.277 16.379 0.700 1.00 0.00 H new ATOM 0 H2' DA A 15 -6.167 14.338 0.430 1.00 0.00 H new ATOM 0 H2'' DA A 15 -4.866 15.373 -0.124 1.00 0.00 H new ATOM 0 H1' DA A 15 -3.676 15.173 1.875 1.00 0.00 H new ATOM 0 H8 DA A 15 -6.497 12.545 1.794 1.00 0.00 H new ATOM 0 H61 DA A 15 -1.943 8.452 2.420 1.00 0.00 H new ATOM 0 H62 DA A 15 -3.686 8.653 2.214 1.00 0.00 H new ATOM 0 H2 DA A 15 -0.171 12.569 2.521 1.00 0.00 H new ATOM 478 P DT A 16 -5.398 17.836 -0.841 1.00 0.00 P ATOM 479 OP1 DT A 16 -5.436 19.302 -1.072 1.00 0.00 O ATOM 480 OP2 DT A 16 -6.293 16.951 -1.628 1.00 0.00 O ATOM 481 O5' DT A 16 -3.882 17.322 -1.001 1.00 0.00 O ATOM 482 C5' DT A 16 -2.838 17.907 -0.211 1.00 0.00 C ATOM 483 C4' DT A 16 -1.452 17.388 -0.574 1.00 0.00 C ATOM 484 O4' DT A 16 -1.281 16.003 -0.170 1.00 0.00 O ATOM 485 C3' DT A 16 -1.207 17.463 -2.076 1.00 0.00 C ATOM 486 O3' DT A 16 0.021 18.138 -2.365 1.00 0.00 O ATOM 487 C2' DT A 16 -1.160 16.036 -2.531 1.00 0.00 C ATOM 488 C1' DT A 16 -0.834 15.221 -1.300 1.00 0.00 C ATOM 489 N1 DT A 16 -1.493 13.897 -1.332 1.00 0.00 N ATOM 490 C2 DT A 16 -0.686 12.781 -1.194 1.00 0.00 C ATOM 491 O2 DT A 16 0.530 12.869 -1.037 1.00 0.00 O ATOM 492 N3 DT A 16 -1.328 11.558 -1.246 1.00 0.00 N ATOM 493 C4 DT A 16 -2.685 11.356 -1.424 1.00 0.00 C ATOM 494 O4 DT A 16 -3.150 10.219 -1.466 1.00 0.00 O ATOM 495 C5 DT A 16 -3.447 12.577 -1.557 1.00 0.00 C ATOM 496 C7 DT A 16 -4.957 12.501 -1.760 1.00 0.00 C ATOM 497 C6 DT A 16 -2.847 13.782 -1.508 1.00 0.00 C ATOM 0 H5' DT A 16 -3.031 17.705 0.843 1.00 0.00 H new ATOM 0 H5'' DT A 16 -2.859 18.990 -0.337 1.00 0.00 H new ATOM 0 H4' DT A 16 -0.741 18.023 -0.045 1.00 0.00 H new ATOM 0 H3' DT A 16 -1.985 18.029 -2.589 1.00 0.00 H new ATOM 0 H2' DT A 16 -2.114 15.731 -2.960 1.00 0.00 H new ATOM 0 H2'' DT A 16 -0.404 15.897 -3.304 1.00 0.00 H new ATOM 0 HO3' DT A 16 0.156 18.171 -3.335 1.00 0.00 H new ATOM 0 H1' DT A 16 0.235 15.017 -1.241 1.00 0.00 H new ATOM 0 H3 DT A 16 -0.747 10.726 -1.143 1.00 0.00 H new ATOM 0 H71 DT A 16 -5.207 11.582 -2.290 1.00 0.00 H new ATOM 0 H72 DT A 16 -5.455 12.508 -0.791 1.00 0.00 H new ATOM 0 H73 DT A 16 -5.289 13.359 -2.345 1.00 0.00 H new ATOM 0 H6 DT A 16 -3.445 14.675 -1.609 1.00 0.00 H new TER 511 DT A 16