USER MOD reduce.3.24.130724 H: found=0, std=0, add=184, rem=0, adj=3 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 USER MOD Single : A 2 DT C7 :methyl 150:sc= -0.46 (180deg=-0.46) USER MOD Single : A 5 DT C7 :methyl -30:sc= -0.822 (180deg=-1.28) 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 150:sc= -0.543 (180deg=-0.543) USER MOD Single : A 16 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 1.561 2.726 -1.697 1.00 0.00 O ATOM 2 C5' DA A 1 2.829 2.825 -2.359 1.00 0.00 C ATOM 3 C4' DA A 1 3.462 4.200 -2.194 1.00 0.00 C ATOM 4 O4' DA A 1 2.560 5.243 -2.648 1.00 0.00 O ATOM 5 C3' DA A 1 3.781 4.477 -0.731 1.00 0.00 C ATOM 6 O3' DA A 1 5.094 5.029 -0.584 1.00 0.00 O ATOM 7 C2' DA A 1 2.737 5.457 -0.301 1.00 0.00 C ATOM 8 C1' DA A 1 2.283 6.151 -1.558 1.00 0.00 C ATOM 9 N9 DA A 1 0.848 6.491 -1.492 1.00 0.00 N ATOM 10 C8 DA A 1 -0.237 5.678 -1.480 1.00 0.00 C ATOM 11 N7 DA A 1 -1.401 6.239 -1.436 1.00 0.00 N ATOM 12 C5 DA A 1 -1.059 7.595 -1.415 1.00 0.00 C ATOM 13 C6 DA A 1 -1.826 8.765 -1.368 1.00 0.00 C ATOM 14 N6 DA A 1 -3.158 8.764 -1.339 1.00 0.00 N ATOM 15 N1 DA A 1 -1.166 9.938 -1.359 1.00 0.00 N ATOM 16 C2 DA A 1 0.168 9.961 -1.393 1.00 0.00 C ATOM 17 N3 DA A 1 0.989 8.917 -1.439 1.00 0.00 N ATOM 18 C4 DA A 1 0.306 7.756 -1.447 1.00 0.00 C ATOM 0 H5' DA A 1 2.700 2.612 -3.420 1.00 0.00 H new ATOM 0 H5'' DA A 1 3.504 2.067 -1.962 1.00 0.00 H new ATOM 0 H4' DA A 1 4.375 4.203 -2.789 1.00 0.00 H new ATOM 0 H3' DA A 1 3.771 3.569 -0.128 1.00 0.00 H new ATOM 0 H2' DA A 1 1.905 4.952 0.189 1.00 0.00 H new ATOM 0 H2'' DA A 1 3.143 6.171 0.415 1.00 0.00 H new ATOM 0 HO5' DA A 1 1.191 1.828 -1.831 1.00 0.00 H new ATOM 0 H1' DA A 1 2.810 7.095 -1.696 1.00 0.00 H new ATOM 0 H8 DA A 1 -0.133 4.603 -1.506 1.00 0.00 H new ATOM 0 H61 DA A 1 -3.668 9.647 -1.305 1.00 0.00 H new ATOM 0 H62 DA A 1 -3.668 7.881 -1.351 1.00 0.00 H new ATOM 0 H2 DA A 1 0.632 10.936 -1.382 1.00 0.00 H new ATOM 31 P DT A 2 5.695 5.323 0.876 1.00 0.00 P ATOM 32 OP1 DT A 2 7.178 5.343 0.790 1.00 0.00 O ATOM 33 OP2 DT A 2 5.038 4.421 1.855 1.00 0.00 O ATOM 34 O5' DT A 2 5.165 6.822 1.109 1.00 0.00 O ATOM 35 C5' DT A 2 5.389 7.839 0.122 1.00 0.00 C ATOM 36 C4' DT A 2 5.073 9.238 0.633 1.00 0.00 C ATOM 37 O4' DT A 2 3.685 9.593 0.383 1.00 0.00 O ATOM 38 C3' DT A 2 5.302 9.343 2.138 1.00 0.00 C ATOM 39 O3' DT A 2 6.091 10.492 2.461 1.00 0.00 O ATOM 40 C2' DT A 2 3.936 9.473 2.722 1.00 0.00 C ATOM 41 C1' DT A 2 3.081 10.040 1.619 1.00 0.00 C ATOM 42 N1 DT A 2 1.668 9.614 1.741 1.00 0.00 N ATOM 43 C2 DT A 2 0.717 10.612 1.818 1.00 0.00 C ATOM 44 O2 DT A 2 1.014 11.805 1.782 1.00 0.00 O ATOM 45 N3 DT A 2 -0.591 10.197 1.938 1.00 0.00 N ATOM 46 C4 DT A 2 -1.031 8.888 1.985 1.00 0.00 C ATOM 47 O4 DT A 2 -2.228 8.632 2.091 1.00 0.00 O ATOM 48 C5 DT A 2 0.029 7.911 1.899 1.00 0.00 C ATOM 49 C7 DT A 2 -0.319 6.426 1.938 1.00 0.00 C ATOM 50 C6 DT A 2 1.319 8.291 1.783 1.00 0.00 C ATOM 0 H5' DT A 2 4.775 7.630 -0.754 1.00 0.00 H new ATOM 0 H5'' DT A 2 6.429 7.802 -0.202 1.00 0.00 H new ATOM 0 H4' DT A 2 5.740 9.915 0.098 1.00 0.00 H new ATOM 0 H3' DT A 2 5.843 8.480 2.526 1.00 0.00 H new ATOM 0 H2' DT A 2 3.558 8.507 3.055 1.00 0.00 H new ATOM 0 H2'' DT A 2 3.942 10.130 3.592 1.00 0.00 H new ATOM 0 H1' DT A 2 3.046 11.129 1.664 1.00 0.00 H new ATOM 0 H3 DT A 2 -1.303 10.925 1.998 1.00 0.00 H new ATOM 0 H71 DT A 2 0.417 5.865 1.362 1.00 0.00 H new ATOM 0 H72 DT A 2 -0.313 6.078 2.971 1.00 0.00 H new ATOM 0 H73 DT A 2 -1.309 6.273 1.509 1.00 0.00 H new ATOM 0 H6 DT A 2 2.090 7.537 1.722 1.00 0.00 H new ATOM 63 P DC A 3 6.426 10.842 3.994 1.00 0.00 P ATOM 64 OP1 DC A 3 7.828 11.324 4.085 1.00 0.00 O ATOM 65 OP2 DC A 3 5.992 9.707 4.848 1.00 0.00 O ATOM 66 O5' DC A 3 5.426 12.082 4.228 1.00 0.00 O ATOM 67 C5' DC A 3 5.304 13.122 3.243 1.00 0.00 C ATOM 68 C4' DC A 3 4.390 14.259 3.688 1.00 0.00 C ATOM 69 O4' DC A 3 2.993 13.902 3.514 1.00 0.00 O ATOM 70 C3' DC A 3 4.599 14.590 5.162 1.00 0.00 C ATOM 71 O3' DC A 3 4.736 16.000 5.373 1.00 0.00 O ATOM 72 C2' DC A 3 3.375 14.071 5.843 1.00 0.00 C ATOM 73 C1' DC A 3 2.303 13.989 4.783 1.00 0.00 C ATOM 74 N1 DC A 3 1.440 12.808 4.992 1.00 0.00 N ATOM 75 C2 DC A 3 0.078 13.013 5.132 1.00 0.00 C ATOM 76 O2 DC A 3 -0.387 14.151 5.105 1.00 0.00 O ATOM 77 N3 DC A 3 -0.716 11.925 5.304 1.00 0.00 N ATOM 78 C4 DC A 3 -0.200 10.689 5.341 1.00 0.00 C ATOM 79 N4 DC A 3 -1.010 9.644 5.512 1.00 0.00 N ATOM 80 C5 DC A 3 1.203 10.477 5.199 1.00 0.00 C ATOM 81 C6 DC A 3 1.980 11.559 5.031 1.00 0.00 C ATOM 0 H5' DC A 3 4.919 12.695 2.317 1.00 0.00 H new ATOM 0 H5'' DC A 3 6.293 13.523 3.022 1.00 0.00 H new ATOM 0 H4' DC A 3 4.641 15.121 3.070 1.00 0.00 H new ATOM 0 H3' DC A 3 5.515 14.143 5.549 1.00 0.00 H new ATOM 0 H2' DC A 3 3.561 13.092 6.284 1.00 0.00 H new ATOM 0 H2'' DC A 3 3.071 14.733 6.653 1.00 0.00 H new ATOM 0 H1' DC A 3 1.650 14.861 4.819 1.00 0.00 H new ATOM 0 H41 DC A 3 -0.625 8.700 5.541 1.00 0.00 H new ATOM 0 H42 DC A 3 -2.015 9.789 5.614 1.00 0.00 H new ATOM 0 H5 DC A 3 1.625 9.483 5.226 1.00 0.00 H new ATOM 0 H6 DC A 3 3.048 11.437 4.925 1.00 0.00 H new ATOM 93 P DC A 4 4.963 16.578 6.857 1.00 0.00 P ATOM 94 OP1 DC A 4 5.677 17.877 6.767 1.00 0.00 O ATOM 95 OP2 DC A 4 5.524 15.500 7.711 1.00 0.00 O ATOM 96 O5' DC A 4 3.441 16.850 7.297 1.00 0.00 O ATOM 97 C5' DC A 4 2.526 17.486 6.394 1.00 0.00 C ATOM 98 C4' DC A 4 1.151 17.710 7.010 1.00 0.00 C ATOM 99 O4' DC A 4 0.322 16.520 6.904 1.00 0.00 O ATOM 100 C3' DC A 4 1.256 18.059 8.491 1.00 0.00 C ATOM 101 O3' DC A 4 0.510 19.240 8.801 1.00 0.00 O ATOM 102 C2' DC A 4 0.691 16.877 9.207 1.00 0.00 C ATOM 103 C1' DC A 4 -0.194 16.177 8.212 1.00 0.00 C ATOM 104 N1 DC A 4 -0.216 14.710 8.433 1.00 0.00 N ATOM 105 C2 DC A 4 -1.455 14.110 8.592 1.00 0.00 C ATOM 106 O2 DC A 4 -2.481 14.788 8.572 1.00 0.00 O ATOM 107 N3 DC A 4 -1.499 12.766 8.772 1.00 0.00 N ATOM 108 C4 DC A 4 -0.381 12.030 8.798 1.00 0.00 C ATOM 109 N4 DC A 4 -0.464 10.706 8.966 1.00 0.00 N ATOM 110 C5 DC A 4 0.900 12.641 8.639 1.00 0.00 C ATOM 111 C6 DC A 4 0.937 13.975 8.462 1.00 0.00 C ATOM 0 H5' DC A 4 2.423 16.874 5.498 1.00 0.00 H new ATOM 0 H5'' DC A 4 2.939 18.444 6.080 1.00 0.00 H new ATOM 0 H4' DC A 4 0.701 18.535 6.457 1.00 0.00 H new ATOM 0 H3' DC A 4 2.285 18.266 8.783 1.00 0.00 H new ATOM 0 H2' DC A 4 1.484 16.216 9.557 1.00 0.00 H new ATOM 0 H2'' DC A 4 0.124 17.186 10.085 1.00 0.00 H new ATOM 0 H1' DC A 4 -1.231 16.496 8.316 1.00 0.00 H new ATOM 0 H41 DC A 4 0.385 10.140 8.987 1.00 0.00 H new ATOM 0 H42 DC A 4 -1.376 10.262 9.074 1.00 0.00 H new ATOM 0 H5 DC A 4 1.806 12.054 8.660 1.00 0.00 H new ATOM 0 H6 DC A 4 1.889 14.471 8.341 1.00 0.00 H new ATOM 123 P DT A 5 0.431 19.778 10.314 1.00 0.00 P ATOM 124 OP1 DT A 5 0.446 21.263 10.302 1.00 0.00 O ATOM 125 OP2 DT A 5 1.428 19.047 11.138 1.00 0.00 O ATOM 126 O5' DT A 5 -1.042 19.271 10.710 1.00 0.00 O ATOM 127 C5' DT A 5 -2.131 19.447 9.794 1.00 0.00 C ATOM 128 C4' DT A 5 -3.416 18.774 10.258 1.00 0.00 C ATOM 129 O4' DT A 5 -3.311 17.326 10.198 1.00 0.00 O ATOM 130 C3' DT A 5 -3.752 19.151 11.695 1.00 0.00 C ATOM 131 O3' DT A 5 -5.104 19.609 11.807 1.00 0.00 O ATOM 132 C2' DT A 5 -3.541 17.892 12.480 1.00 0.00 C ATOM 133 C1' DT A 5 -3.636 16.759 11.488 1.00 0.00 C ATOM 134 N1 DT A 5 -2.710 15.654 11.828 1.00 0.00 N ATOM 135 C2 DT A 5 -3.251 14.387 11.984 1.00 0.00 C ATOM 136 O2 DT A 5 -4.461 14.181 11.927 1.00 0.00 O ATOM 137 N3 DT A 5 -2.346 13.364 12.222 1.00 0.00 N ATOM 138 C4 DT A 5 -0.975 13.497 12.319 1.00 0.00 C ATOM 139 O4 DT A 5 -0.268 12.511 12.524 1.00 0.00 O ATOM 140 C5 DT A 5 -0.501 14.853 12.150 1.00 0.00 C ATOM 141 C7 DT A 5 0.997 15.140 12.208 1.00 0.00 C ATOM 142 C6 DT A 5 -1.363 15.868 11.921 1.00 0.00 C ATOM 0 H5' DT A 5 -1.848 19.045 8.821 1.00 0.00 H new ATOM 0 H5'' DT A 5 -2.315 20.513 9.658 1.00 0.00 H new ATOM 0 H4' DT A 5 -4.200 19.120 9.584 1.00 0.00 H new ATOM 0 H3' DT A 5 -3.131 19.969 12.059 1.00 0.00 H new ATOM 0 H2' DT A 5 -2.569 17.898 12.972 1.00 0.00 H new ATOM 0 H2'' DT A 5 -4.294 17.790 13.262 1.00 0.00 H new ATOM 0 H1' DT A 5 -4.636 16.324 11.494 1.00 0.00 H new ATOM 0 H3 DT A 5 -2.729 12.425 12.336 1.00 0.00 H new ATOM 0 H71 DT A 5 1.480 14.419 12.868 1.00 0.00 H new ATOM 0 H72 DT A 5 1.422 15.058 11.208 1.00 0.00 H new ATOM 0 H73 DT A 5 1.160 16.148 12.590 1.00 0.00 H new ATOM 0 H6 DT A 5 -0.979 16.871 11.809 1.00 0.00 H new ATOM 155 P DA A 6 -5.606 20.358 13.136 1.00 0.00 P ATOM 156 OP1 DA A 6 -6.622 21.375 12.763 1.00 0.00 O ATOM 157 OP2 DA A 6 -4.423 20.772 13.933 1.00 0.00 O ATOM 158 O5' DA A 6 -6.338 19.142 13.884 1.00 0.00 O ATOM 159 C5' DA A 6 -7.516 18.548 13.324 1.00 0.00 C ATOM 160 C4' DA A 6 -7.991 17.346 14.123 1.00 0.00 C ATOM 161 O4' DA A 6 -7.074 16.228 13.973 1.00 0.00 O ATOM 162 C3' DA A 6 -8.071 17.679 15.611 1.00 0.00 C ATOM 163 O3' DA A 6 -9.326 17.263 16.170 1.00 0.00 O ATOM 164 C2' DA A 6 -6.939 16.916 16.221 1.00 0.00 C ATOM 165 C1' DA A 6 -6.672 15.775 15.282 1.00 0.00 C ATOM 166 N9 DA A 6 -5.260 15.359 15.333 1.00 0.00 N ATOM 167 C8 DA A 6 -4.124 16.099 15.353 1.00 0.00 C ATOM 168 N7 DA A 6 -3.006 15.467 15.496 1.00 0.00 N ATOM 169 C5 DA A 6 -3.444 14.143 15.584 1.00 0.00 C ATOM 170 C6 DA A 6 -2.773 12.928 15.751 1.00 0.00 C ATOM 171 N6 DA A 6 -1.451 12.837 15.887 1.00 0.00 N ATOM 172 N1 DA A 6 -3.519 11.811 15.792 1.00 0.00 N ATOM 173 C2 DA A 6 -4.848 11.883 15.677 1.00 0.00 C ATOM 174 N3 DA A 6 -5.579 12.973 15.520 1.00 0.00 N ATOM 175 C4 DA A 6 -4.812 14.075 15.481 1.00 0.00 C ATOM 0 H5' DA A 6 -7.313 18.242 12.298 1.00 0.00 H new ATOM 0 H5'' DA A 6 -8.311 19.292 13.284 1.00 0.00 H new ATOM 0 H4' DA A 6 -8.977 17.080 13.741 1.00 0.00 H new ATOM 0 H3' DA A 6 -8.003 18.751 15.797 1.00 0.00 H new ATOM 0 H2' DA A 6 -6.057 17.546 16.334 1.00 0.00 H new ATOM 0 H2'' DA A 6 -7.201 16.553 17.215 1.00 0.00 H new ATOM 0 H1' DA A 6 -7.237 14.885 15.560 1.00 0.00 H new ATOM 0 H8 DA A 6 -4.152 17.174 15.253 1.00 0.00 H new ATOM 0 H61 DA A 6 -1.012 11.924 16.006 1.00 0.00 H new ATOM 0 H62 DA A 6 -0.878 13.680 15.872 1.00 0.00 H new ATOM 0 H2 DA A 6 -5.385 10.947 15.717 1.00 0.00 H new ATOM 187 P DG A 7 -9.975 18.045 17.417 1.00 0.00 P ATOM 188 OP1 DG A 7 -11.403 18.323 17.119 1.00 0.00 O ATOM 189 OP2 DG A 7 -9.082 19.172 17.793 1.00 0.00 O ATOM 190 O5' DG A 7 -9.889 16.908 18.555 1.00 0.00 O ATOM 191 C5' DG A 7 -10.243 15.547 18.263 1.00 0.00 C ATOM 192 C4' DG A 7 -9.636 14.551 19.258 1.00 0.00 C ATOM 193 O4' DG A 7 -8.233 14.333 18.965 1.00 0.00 O ATOM 194 C3' DG A 7 -9.725 15.028 20.716 1.00 0.00 C ATOM 195 O3' DG A 7 -10.235 14.002 21.571 1.00 0.00 O ATOM 196 C2' DG A 7 -8.321 15.371 21.094 1.00 0.00 C ATOM 197 C1' DG A 7 -7.435 14.611 20.139 1.00 0.00 C ATOM 198 N9 DG A 7 -6.235 15.397 19.793 1.00 0.00 N ATOM 199 C8 DG A 7 -6.122 16.706 19.452 1.00 0.00 C ATOM 200 N7 DG A 7 -4.941 17.158 19.198 1.00 0.00 N ATOM 201 C5 DG A 7 -4.152 16.020 19.388 1.00 0.00 C ATOM 202 C6 DG A 7 -2.747 15.855 19.262 1.00 0.00 C ATOM 203 O6 DG A 7 -1.906 16.696 18.954 1.00 0.00 O ATOM 204 N1 DG A 7 -2.360 14.552 19.543 1.00 0.00 N ATOM 205 C2 DG A 7 -3.212 13.529 19.899 1.00 0.00 C ATOM 206 N2 DG A 7 -2.647 12.345 20.120 1.00 0.00 N ATOM 207 N3 DG A 7 -4.536 13.673 20.022 1.00 0.00 N ATOM 208 C4 DG A 7 -4.938 14.936 19.753 1.00 0.00 C ATOM 0 H5' DG A 7 -9.909 15.297 17.256 1.00 0.00 H new ATOM 0 H5'' DG A 7 -11.328 15.448 18.273 1.00 0.00 H new ATOM 0 H4' DG A 7 -10.217 13.635 19.147 1.00 0.00 H new ATOM 0 H3' DG A 7 -10.404 15.874 20.820 1.00 0.00 H new ATOM 0 H2' DG A 7 -8.147 16.444 21.017 1.00 0.00 H new ATOM 0 H2'' DG A 7 -8.115 15.088 22.126 1.00 0.00 H new ATOM 0 H1' DG A 7 -7.078 13.686 20.591 1.00 0.00 H new ATOM 0 H8 DG A 7 -6.990 17.346 19.395 1.00 0.00 H new ATOM 0 H1 DG A 7 -1.365 14.334 19.481 1.00 0.00 H new ATOM 0 H21 DG A 7 -3.223 11.547 20.387 1.00 0.00 H new ATOM 0 H22 DG A 7 -1.638 12.236 20.023 1.00 0.00 H new ATOM 220 P DT A 8 -10.398 14.272 23.145 1.00 0.00 P ATOM 221 OP1 DT A 8 -11.662 13.646 23.614 1.00 0.00 O ATOM 222 OP2 DT A 8 -10.162 15.715 23.409 1.00 0.00 O ATOM 223 O5' DT A 8 -9.152 13.427 23.712 1.00 0.00 O ATOM 224 C5' DT A 8 -9.208 11.993 23.754 1.00 0.00 C ATOM 225 C4' DT A 8 -7.829 11.349 23.891 1.00 0.00 C ATOM 226 O4' DT A 8 -6.819 12.134 23.211 1.00 0.00 O ATOM 227 C3' DT A 8 -7.403 11.228 25.353 1.00 0.00 C ATOM 228 O3' DT A 8 -6.917 9.908 25.641 1.00 0.00 O ATOM 229 C2' DT A 8 -6.311 12.237 25.511 1.00 0.00 C ATOM 230 C1' DT A 8 -5.751 12.458 24.127 1.00 0.00 C ATOM 231 N1 DT A 8 -5.293 13.850 23.952 1.00 0.00 N ATOM 232 C2 DT A 8 -3.980 14.043 23.563 1.00 0.00 C ATOM 233 O2 DT A 8 -3.215 13.105 23.354 1.00 0.00 O ATOM 234 N3 DT A 8 -3.578 15.358 23.419 1.00 0.00 N ATOM 235 C4 DT A 8 -4.363 16.478 23.628 1.00 0.00 C ATOM 236 O4 DT A 8 -3.900 17.605 23.471 1.00 0.00 O ATOM 237 C5 DT A 8 -5.718 16.178 24.031 1.00 0.00 C ATOM 238 C7 DT A 8 -6.692 17.317 24.307 1.00 0.00 C ATOM 239 C6 DT A 8 -6.135 14.906 24.176 1.00 0.00 C ATOM 0 H5' DT A 8 -9.686 11.626 22.846 1.00 0.00 H new ATOM 0 H5'' DT A 8 -9.833 11.683 24.591 1.00 0.00 H new ATOM 0 H4' DT A 8 -7.912 10.358 23.445 1.00 0.00 H new ATOM 0 H3' DT A 8 -8.234 11.402 26.037 1.00 0.00 H new ATOM 0 H2' DT A 8 -6.696 13.167 25.930 1.00 0.00 H new ATOM 0 H2'' DT A 8 -5.540 11.875 26.191 1.00 0.00 H new ATOM 0 H1' DT A 8 -4.876 11.833 23.948 1.00 0.00 H new ATOM 0 H3 DT A 8 -2.612 15.517 23.132 1.00 0.00 H new ATOM 0 H71 DT A 8 -7.706 16.993 24.074 1.00 0.00 H new ATOM 0 H72 DT A 8 -6.634 17.599 25.358 1.00 0.00 H new ATOM 0 H73 DT A 8 -6.434 18.175 23.686 1.00 0.00 H new ATOM 0 H6 DT A 8 -7.155 14.715 24.475 1.00 0.00 H new ATOM 252 P DT A 9 -6.612 9.451 27.154 1.00 0.00 P ATOM 253 OP1 DT A 9 -6.553 7.967 27.207 1.00 0.00 O ATOM 254 OP2 DT A 9 -7.534 10.170 28.069 1.00 0.00 O ATOM 255 O5' DT A 9 -5.127 10.040 27.345 1.00 0.00 O ATOM 256 C5' DT A 9 -3.985 9.366 26.792 1.00 0.00 C ATOM 257 C4' DT A 9 -3.196 10.251 25.832 1.00 0.00 C ATOM 258 O4' DT A 9 -3.346 11.653 26.173 1.00 0.00 O ATOM 259 C3' DT A 9 -1.707 9.932 25.876 1.00 0.00 C ATOM 260 O3' DT A 9 -1.170 9.831 24.554 1.00 0.00 O ATOM 261 C2' DT A 9 -1.095 11.081 26.619 1.00 0.00 C ATOM 262 C1' DT A 9 -2.053 12.234 26.452 1.00 0.00 C ATOM 263 N1 DT A 9 -2.106 13.067 27.670 1.00 0.00 N ATOM 264 C2 DT A 9 -1.776 14.404 27.543 1.00 0.00 C ATOM 265 O2 DT A 9 -1.427 14.893 26.472 1.00 0.00 O ATOM 266 N3 DT A 9 -1.864 15.162 28.696 1.00 0.00 N ATOM 267 C4 DT A 9 -2.247 14.706 29.945 1.00 0.00 C ATOM 268 O4 DT A 9 -2.293 15.471 30.906 1.00 0.00 O ATOM 269 C5 DT A 9 -2.571 13.297 29.980 1.00 0.00 C ATOM 270 C7 DT A 9 -3.022 12.665 31.292 1.00 0.00 C ATOM 271 C6 DT A 9 -2.492 12.536 28.871 1.00 0.00 C ATOM 0 H5' DT A 9 -4.315 8.469 26.267 1.00 0.00 H new ATOM 0 H5'' DT A 9 -3.332 9.040 27.601 1.00 0.00 H new ATOM 0 H4' DT A 9 -3.594 10.054 24.836 1.00 0.00 H new ATOM 0 H3' DT A 9 -1.503 8.976 26.359 1.00 0.00 H new ATOM 0 H2' DT A 9 -0.957 10.837 27.672 1.00 0.00 H new ATOM 0 H2'' DT A 9 -0.112 11.328 26.217 1.00 0.00 H new ATOM 0 H1' DT A 9 -1.731 12.890 25.643 1.00 0.00 H new ATOM 0 H3 DT A 9 -1.624 16.150 28.619 1.00 0.00 H new ATOM 0 H71 DT A 9 -3.699 11.836 31.083 1.00 0.00 H new ATOM 0 H72 DT A 9 -2.153 12.295 31.836 1.00 0.00 H new ATOM 0 H73 DT A 9 -3.538 13.411 31.897 1.00 0.00 H new ATOM 0 H6 DT A 9 -2.738 11.486 28.931 1.00 0.00 H new ATOM 284 P DA A 10 -0.210 8.610 24.157 1.00 0.00 P ATOM 285 OP1 DA A 10 0.629 8.257 25.330 1.00 0.00 O ATOM 286 OP2 DA A 10 0.449 8.915 22.862 1.00 0.00 O ATOM 287 O5' DA A 10 -1.299 7.451 23.928 1.00 0.00 O ATOM 288 C5' DA A 10 -0.895 6.079 23.996 1.00 0.00 C ATOM 289 C4' DA A 10 -1.575 5.203 22.947 1.00 0.00 C ATOM 290 O4' DA A 10 -2.820 5.805 22.513 1.00 0.00 O ATOM 291 C3' DA A 10 -0.686 5.076 21.717 1.00 0.00 C ATOM 292 O3' DA A 10 -0.892 3.821 21.062 1.00 0.00 O ATOM 293 C2' DA A 10 -1.145 6.198 20.858 1.00 0.00 C ATOM 294 C1' DA A 10 -2.605 6.376 21.213 1.00 0.00 C ATOM 295 N9 DA A 10 -3.072 7.768 21.182 1.00 0.00 N ATOM 296 C8 DA A 10 -2.379 8.914 21.323 1.00 0.00 C ATOM 297 N7 DA A 10 -3.042 10.016 21.385 1.00 0.00 N ATOM 298 C5 DA A 10 -4.355 9.555 21.291 1.00 0.00 C ATOM 299 C6 DA A 10 -5.587 10.209 21.289 1.00 0.00 C ATOM 300 N6 DA A 10 -5.702 11.535 21.328 1.00 0.00 N ATOM 301 N1 DA A 10 -6.693 9.450 21.185 1.00 0.00 N ATOM 302 C2 DA A 10 -6.592 8.124 21.084 1.00 0.00 C ATOM 303 N3 DA A 10 -5.475 7.403 21.070 1.00 0.00 N ATOM 304 C4 DA A 10 -4.384 8.189 21.179 1.00 0.00 C ATOM 0 H5' DA A 10 -1.120 5.689 24.988 1.00 0.00 H new ATOM 0 H5'' DA A 10 0.186 6.018 23.867 1.00 0.00 H new ATOM 0 H4' DA A 10 -1.758 4.228 23.399 1.00 0.00 H new ATOM 0 H3' DA A 10 0.378 5.116 21.951 1.00 0.00 H new ATOM 0 H2' DA A 10 -0.575 7.106 21.054 1.00 0.00 H new ATOM 0 H2'' DA A 10 -1.019 5.965 19.801 1.00 0.00 H new ATOM 0 H1' DA A 10 -3.191 5.866 20.448 1.00 0.00 H new ATOM 0 H8 DA A 10 -1.301 8.909 21.382 1.00 0.00 H new ATOM 0 H61 DA A 10 -6.626 11.967 21.325 1.00 0.00 H new ATOM 0 H62 DA A 10 -4.866 12.119 21.361 1.00 0.00 H new ATOM 0 H2 DA A 10 -7.519 7.576 21.005 1.00 0.00 H new ATOM 316 P DT A 11 -0.132 3.481 19.691 1.00 0.00 P ATOM 317 OP1 DT A 11 0.355 2.079 19.742 1.00 0.00 O ATOM 318 OP2 DT A 11 0.820 4.576 19.380 1.00 0.00 O ATOM 319 O5' DT A 11 -1.374 3.565 18.676 1.00 0.00 O ATOM 320 C5' DT A 11 -2.510 2.712 18.865 1.00 0.00 C ATOM 321 C4' DT A 11 -3.769 3.237 18.189 1.00 0.00 C ATOM 322 O4' DT A 11 -3.867 4.684 18.295 1.00 0.00 O ATOM 323 C3' DT A 11 -3.797 2.890 16.706 1.00 0.00 C ATOM 324 O3' DT A 11 -5.041 2.280 16.346 1.00 0.00 O ATOM 325 C2' DT A 11 -3.626 4.196 16.000 1.00 0.00 C ATOM 326 C1' DT A 11 -4.064 5.251 16.978 1.00 0.00 C ATOM 327 N1 DT A 11 -3.299 6.502 16.794 1.00 0.00 N ATOM 328 C2 DT A 11 -4.007 7.633 16.438 1.00 0.00 C ATOM 329 O2 DT A 11 -5.226 7.621 16.286 1.00 0.00 O ATOM 330 N3 DT A 11 -3.265 8.782 16.262 1.00 0.00 N ATOM 331 C4 DT A 11 -1.894 8.901 16.415 1.00 0.00 C ATOM 332 O4 DT A 11 -1.334 9.983 16.246 1.00 0.00 O ATOM 333 C5 DT A 11 -1.239 7.668 16.789 1.00 0.00 C ATOM 334 C7 DT A 11 0.272 7.655 16.988 1.00 0.00 C ATOM 335 C6 DT A 11 -1.941 6.532 16.963 1.00 0.00 C ATOM 0 H5' DT A 11 -2.698 2.599 19.933 1.00 0.00 H new ATOM 0 H5'' DT A 11 -2.281 1.720 18.474 1.00 0.00 H new ATOM 0 H4' DT A 11 -4.604 2.761 18.703 1.00 0.00 H new ATOM 0 H3' DT A 11 -3.018 2.175 16.442 1.00 0.00 H new ATOM 0 H2' DT A 11 -2.588 4.346 15.701 1.00 0.00 H new ATOM 0 H2'' DT A 11 -4.227 4.231 15.092 1.00 0.00 H new ATOM 0 H1' DT A 11 -5.109 5.524 16.829 1.00 0.00 H new ATOM 0 H3 DT A 11 -3.774 9.624 15.994 1.00 0.00 H new ATOM 0 H71 DT A 11 0.535 6.902 17.731 1.00 0.00 H new ATOM 0 H72 DT A 11 0.761 7.419 16.043 1.00 0.00 H new ATOM 0 H73 DT A 11 0.602 8.635 17.333 1.00 0.00 H new ATOM 0 H6 DT A 11 -1.422 5.627 17.241 1.00 0.00 H new ATOM 348 P DA A 12 -5.343 1.869 14.823 1.00 0.00 P ATOM 349 OP1 DA A 12 -6.222 0.672 14.808 1.00 0.00 O ATOM 350 OP2 DA A 12 -4.065 1.843 14.067 1.00 0.00 O ATOM 351 O5' DA A 12 -6.199 3.150 14.362 1.00 0.00 O ATOM 352 C5' DA A 12 -7.222 3.678 15.219 1.00 0.00 C ATOM 353 C4' DA A 12 -7.963 4.857 14.604 1.00 0.00 C ATOM 354 O4' DA A 12 -7.191 6.081 14.714 1.00 0.00 O ATOM 355 C3' DA A 12 -8.240 4.625 13.125 1.00 0.00 C ATOM 356 O3' DA A 12 -9.609 4.897 12.808 1.00 0.00 O ATOM 357 C2' DA A 12 -7.334 5.577 12.412 1.00 0.00 C ATOM 358 C1' DA A 12 -7.024 6.668 13.402 1.00 0.00 C ATOM 359 N9 DA A 12 -5.657 7.204 13.216 1.00 0.00 N ATOM 360 C8 DA A 12 -4.459 6.572 13.259 1.00 0.00 C ATOM 361 N7 DA A 12 -3.397 7.295 13.115 1.00 0.00 N ATOM 362 C5 DA A 12 -3.945 8.571 12.948 1.00 0.00 C ATOM 363 C6 DA A 12 -3.373 9.834 12.739 1.00 0.00 C ATOM 364 N6 DA A 12 -2.058 10.044 12.677 1.00 0.00 N ATOM 365 N1 DA A 12 -4.211 10.876 12.614 1.00 0.00 N ATOM 366 C2 DA A 12 -5.527 10.698 12.688 1.00 0.00 C ATOM 367 N3 DA A 12 -6.175 9.554 12.881 1.00 0.00 N ATOM 368 C4 DA A 12 -5.320 8.522 13.005 1.00 0.00 C ATOM 0 H5' DA A 12 -6.773 3.990 16.162 1.00 0.00 H new ATOM 0 H5'' DA A 12 -7.936 2.888 15.452 1.00 0.00 H new ATOM 0 H4' DA A 12 -8.899 4.950 15.154 1.00 0.00 H new ATOM 0 H3' DA A 12 -8.062 3.589 12.836 1.00 0.00 H new ATOM 0 H2' DA A 12 -6.423 5.077 12.083 1.00 0.00 H new ATOM 0 H2'' DA A 12 -7.815 5.982 11.522 1.00 0.00 H new ATOM 0 H1' DA A 12 -7.691 7.519 13.265 1.00 0.00 H new ATOM 0 H8 DA A 12 -4.394 5.504 13.408 1.00 0.00 H new ATOM 0 H61 DA A 12 -1.699 10.986 12.523 1.00 0.00 H new ATOM 0 H62 DA A 12 -1.411 9.263 12.784 1.00 0.00 H new ATOM 0 H2 DA A 12 -6.137 11.582 12.579 1.00 0.00 H new ATOM 380 P DG A 13 -10.140 4.751 11.299 1.00 0.00 P ATOM 381 OP1 DG A 13 -11.568 4.346 11.325 1.00 0.00 O ATOM 382 OP2 DG A 13 -9.167 3.940 10.523 1.00 0.00 O ATOM 383 O5' DG A 13 -10.042 6.284 10.818 1.00 0.00 O ATOM 384 C5' DG A 13 -10.518 7.343 11.662 1.00 0.00 C ATOM 385 C4' DG A 13 -10.457 8.707 10.985 1.00 0.00 C ATOM 386 O4' DG A 13 -9.110 9.246 11.020 1.00 0.00 O ATOM 387 C3' DG A 13 -10.864 8.604 9.524 1.00 0.00 C ATOM 388 O3' DG A 13 -11.731 9.682 9.155 1.00 0.00 O ATOM 389 C2' DG A 13 -9.580 8.688 8.770 1.00 0.00 C ATOM 390 C1' DG A 13 -8.628 9.435 9.667 1.00 0.00 C ATOM 391 N9 DG A 13 -7.248 8.939 9.521 1.00 0.00 N ATOM 392 C8 DG A 13 -6.781 7.668 9.555 1.00 0.00 C ATOM 393 N7 DG A 13 -5.507 7.494 9.474 1.00 0.00 N ATOM 394 C5 DG A 13 -5.050 8.808 9.368 1.00 0.00 C ATOM 395 C6 DG A 13 -3.727 9.300 9.246 1.00 0.00 C ATOM 396 O6 DG A 13 -2.675 8.667 9.214 1.00 0.00 O ATOM 397 N1 DG A 13 -3.707 10.681 9.162 1.00 0.00 N ATOM 398 C2 DG A 13 -4.815 11.501 9.187 1.00 0.00 C ATOM 399 N2 DG A 13 -4.583 12.808 9.054 1.00 0.00 N ATOM 400 N3 DG A 13 -6.066 11.049 9.307 1.00 0.00 N ATOM 401 C4 DG A 13 -6.112 9.700 9.392 1.00 0.00 C ATOM 0 H5' DG A 13 -9.924 7.369 12.576 1.00 0.00 H new ATOM 0 H5'' DG A 13 -11.546 7.133 11.956 1.00 0.00 H new ATOM 0 H4' DG A 13 -11.141 9.359 11.528 1.00 0.00 H new ATOM 0 H3' DG A 13 -11.412 7.685 9.317 1.00 0.00 H new ATOM 0 H2' DG A 13 -9.198 7.694 8.535 1.00 0.00 H new ATOM 0 H2'' DG A 13 -9.716 9.210 7.823 1.00 0.00 H new ATOM 0 H1' DG A 13 -8.597 10.492 9.404 1.00 0.00 H new ATOM 0 H8 DG A 13 -7.454 6.828 9.647 1.00 0.00 H new ATOM 0 H1 DG A 13 -2.796 11.130 9.074 1.00 0.00 H new ATOM 0 H21 DG A 13 -5.361 13.468 9.064 1.00 0.00 H new ATOM 0 H22 DG A 13 -3.628 13.148 8.942 1.00 0.00 H new ATOM 413 P DG A 14 -12.255 9.829 7.643 1.00 0.00 P ATOM 414 OP1 DG A 14 -13.701 10.164 7.664 1.00 0.00 O ATOM 415 OP2 DG A 14 -11.790 8.659 6.857 1.00 0.00 O ATOM 416 O5' DG A 14 -11.425 11.130 7.183 1.00 0.00 O ATOM 417 C5' DG A 14 -11.482 12.337 7.960 1.00 0.00 C ATOM 418 C4' DG A 14 -10.610 13.453 7.388 1.00 0.00 C ATOM 419 O4' DG A 14 -9.198 13.152 7.550 1.00 0.00 O ATOM 420 C3' DG A 14 -10.870 13.644 5.901 1.00 0.00 C ATOM 421 O3' DG A 14 -11.041 15.028 5.578 1.00 0.00 O ATOM 422 C2' DG A 14 -9.654 13.083 5.231 1.00 0.00 C ATOM 423 C1' DG A 14 -8.549 13.140 6.256 1.00 0.00 C ATOM 424 N9 DG A 14 -7.651 11.975 6.125 1.00 0.00 N ATOM 425 C8 DG A 14 -7.950 10.659 6.157 1.00 0.00 C ATOM 426 N7 DG A 14 -6.981 9.818 6.055 1.00 0.00 N ATOM 427 C5 DG A 14 -5.884 10.671 5.928 1.00 0.00 C ATOM 428 C6 DG A 14 -4.510 10.361 5.773 1.00 0.00 C ATOM 429 O6 DG A 14 -3.978 9.254 5.725 1.00 0.00 O ATOM 430 N1 DG A 14 -3.742 11.508 5.678 1.00 0.00 N ATOM 431 C2 DG A 14 -4.221 12.800 5.722 1.00 0.00 C ATOM 432 N2 DG A 14 -3.316 13.770 5.592 1.00 0.00 N ATOM 433 N3 DG A 14 -5.514 13.103 5.871 1.00 0.00 N ATOM 434 C4 DG A 14 -6.287 11.998 5.967 1.00 0.00 C ATOM 0 H5' DG A 14 -11.165 12.122 8.980 1.00 0.00 H new ATOM 0 H5'' DG A 14 -12.515 12.681 8.013 1.00 0.00 H new ATOM 0 H4' DG A 14 -10.867 14.359 7.936 1.00 0.00 H new ATOM 0 H3' DG A 14 -11.786 13.149 5.578 1.00 0.00 H new ATOM 0 H2' DG A 14 -9.828 12.059 4.902 1.00 0.00 H new ATOM 0 H2'' DG A 14 -9.394 13.663 4.345 1.00 0.00 H new ATOM 0 H1' DG A 14 -7.929 14.026 6.120 1.00 0.00 H new ATOM 0 H8 DG A 14 -8.970 10.322 6.265 1.00 0.00 H new ATOM 0 H1 DG A 14 -2.735 11.387 5.566 1.00 0.00 H new ATOM 0 H21 DG A 14 -3.608 14.747 5.616 1.00 0.00 H new ATOM 0 H22 DG A 14 -2.331 13.535 5.468 1.00 0.00 H new ATOM 446 P DA A 15 -11.319 15.485 4.063 1.00 0.00 P ATOM 447 OP1 DA A 15 -12.058 16.774 4.077 1.00 0.00 O ATOM 448 OP2 DA A 15 -11.880 14.336 3.307 1.00 0.00 O ATOM 449 O5' DA A 15 -9.815 15.751 3.567 1.00 0.00 O ATOM 450 C5' DA A 15 -9.171 17.001 3.848 1.00 0.00 C ATOM 451 C4' DA A 15 -7.839 17.157 3.126 1.00 0.00 C ATOM 452 O4' DA A 15 -6.928 16.070 3.448 1.00 0.00 O ATOM 453 C3' DA A 15 -8.032 17.153 1.613 1.00 0.00 C ATOM 454 O3' DA A 15 -7.357 18.255 0.998 1.00 0.00 O ATOM 455 C2' DA A 15 -7.445 15.863 1.153 1.00 0.00 C ATOM 456 C1' DA A 15 -6.467 15.454 2.222 1.00 0.00 C ATOM 457 N9 DA A 15 -6.399 13.987 2.330 1.00 0.00 N ATOM 458 C8 DA A 15 -7.402 13.078 2.397 1.00 0.00 C ATOM 459 N7 DA A 15 -7.075 11.830 2.405 1.00 0.00 N ATOM 460 C5 DA A 15 -5.681 11.906 2.341 1.00 0.00 C ATOM 461 C6 DA A 15 -4.681 10.933 2.313 1.00 0.00 C ATOM 462 N6 DA A 15 -4.933 9.625 2.323 1.00 0.00 N ATOM 463 N1 DA A 15 -3.410 11.359 2.253 1.00 0.00 N ATOM 464 C2 DA A 15 -3.133 12.665 2.220 1.00 0.00 C ATOM 465 N3 DA A 15 -3.998 13.668 2.237 1.00 0.00 N ATOM 466 C4 DA A 15 -5.265 13.216 2.300 1.00 0.00 C ATOM 0 H5' DA A 15 -9.008 17.087 4.922 1.00 0.00 H new ATOM 0 H5'' DA A 15 -9.833 17.818 3.560 1.00 0.00 H new ATOM 0 H4' DA A 15 -7.421 18.108 3.457 1.00 0.00 H new ATOM 0 H3' DA A 15 -9.084 17.252 1.344 1.00 0.00 H new ATOM 0 H2' DA A 15 -8.218 15.107 1.020 1.00 0.00 H new ATOM 0 H2'' DA A 15 -6.946 15.981 0.191 1.00 0.00 H new ATOM 0 H1' DA A 15 -5.454 15.783 1.991 1.00 0.00 H new ATOM 0 H8 DA A 15 -8.436 13.387 2.442 1.00 0.00 H new ATOM 0 H61 DA A 15 -4.162 8.957 2.301 1.00 0.00 H new ATOM 0 H62 DA A 15 -5.896 9.292 2.352 1.00 0.00 H new ATOM 0 H2 DA A 15 -2.088 12.933 2.174 1.00 0.00 H new ATOM 478 P DT A 16 -7.381 18.428 -0.598 1.00 0.00 P ATOM 479 OP1 DT A 16 -7.500 19.872 -0.925 1.00 0.00 O ATOM 480 OP2 DT A 16 -8.357 17.469 -1.173 1.00 0.00 O ATOM 481 O5' DT A 16 -5.891 17.934 -0.952 1.00 0.00 O ATOM 482 C5' DT A 16 -4.759 18.651 -0.440 1.00 0.00 C ATOM 483 C4' DT A 16 -3.426 17.966 -0.725 1.00 0.00 C ATOM 484 O4' DT A 16 -3.395 16.601 -0.225 1.00 0.00 O ATOM 485 C3' DT A 16 -3.137 17.911 -2.221 1.00 0.00 C ATOM 486 O3' DT A 16 -1.859 18.484 -2.519 1.00 0.00 O ATOM 487 C2' DT A 16 -3.168 16.452 -2.567 1.00 0.00 C ATOM 488 C1' DT A 16 -2.922 15.722 -1.272 1.00 0.00 C ATOM 489 N1 DT A 16 -3.613 14.415 -1.248 1.00 0.00 N ATOM 490 C2 DT A 16 -2.822 13.279 -1.233 1.00 0.00 C ATOM 491 O2 DT A 16 -1.594 13.336 -1.239 1.00 0.00 O ATOM 492 N3 DT A 16 -3.495 12.070 -1.220 1.00 0.00 N ATOM 493 C4 DT A 16 -4.867 11.902 -1.221 1.00 0.00 C ATOM 494 O4 DT A 16 -5.360 10.777 -1.214 1.00 0.00 O ATOM 495 C5 DT A 16 -5.609 13.142 -1.237 1.00 0.00 C ATOM 496 C7 DT A 16 -7.133 13.099 -1.238 1.00 0.00 C ATOM 497 C6 DT A 16 -4.977 14.334 -1.251 1.00 0.00 C ATOM 0 H5' DT A 16 -4.873 18.773 0.637 1.00 0.00 H new ATOM 0 H5'' DT A 16 -4.745 19.651 -0.874 1.00 0.00 H new ATOM 0 H4' DT A 16 -2.672 18.564 -0.213 1.00 0.00 H new ATOM 0 H3' DT A 16 -3.864 18.482 -2.799 1.00 0.00 H new ATOM 0 H2' DT A 16 -4.129 16.172 -2.998 1.00 0.00 H new ATOM 0 H2'' DT A 16 -2.404 16.208 -3.305 1.00 0.00 H new ATOM 0 HO3' DT A 16 -1.696 18.435 -3.484 1.00 0.00 H new ATOM 0 H1' DT A 16 -1.865 15.492 -1.140 1.00 0.00 H new ATOM 0 H3 DT A 16 -2.926 11.224 -1.209 1.00 0.00 H new ATOM 0 H71 DT A 16 -7.522 13.984 -0.736 1.00 0.00 H new ATOM 0 H72 DT A 16 -7.496 13.076 -2.266 1.00 0.00 H new ATOM 0 H73 DT A 16 -7.472 12.206 -0.714 1.00 0.00 H new ATOM 0 H6 DT A 16 -5.561 15.242 -1.265 1.00 0.00 H new TER 511 DT A 16