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= -0.0039 USER MOD Single : A 2 DT C7 :methyl -30:sc= -0.0668 (180deg=-0.555) USER MOD Single : A 5 DT C7 :methyl 150:sc= -1.4 (180deg=-1.4) 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= -0.549 (180deg=-0.955) USER MOD Single : A 16 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 4.836 2.612 -0.804 1.00 0.00 O ATOM 2 C5' DA A 1 6.022 3.132 -1.422 1.00 0.00 C ATOM 3 C4' DA A 1 6.444 4.468 -0.830 1.00 0.00 C ATOM 4 O4' DA A 1 5.581 5.539 -1.297 1.00 0.00 O ATOM 5 C3' DA A 1 6.357 4.444 0.690 1.00 0.00 C ATOM 6 O3' DA A 1 7.529 5.002 1.290 1.00 0.00 O ATOM 7 C2' DA A 1 5.157 5.269 1.014 1.00 0.00 C ATOM 8 C1' DA A 1 4.960 6.188 -0.164 1.00 0.00 C ATOM 9 N9 DA A 1 3.526 6.440 -0.401 1.00 0.00 N ATOM 10 C8 DA A 1 2.502 5.566 -0.567 1.00 0.00 C ATOM 11 N7 DA A 1 1.321 6.058 -0.741 1.00 0.00 N ATOM 12 C5 DA A 1 1.578 7.431 -0.686 1.00 0.00 C ATOM 13 C6 DA A 1 0.753 8.556 -0.797 1.00 0.00 C ATOM 14 N6 DA A 1 -0.562 8.479 -0.997 1.00 0.00 N ATOM 15 N1 DA A 1 1.339 9.764 -0.695 1.00 0.00 N ATOM 16 C2 DA A 1 2.653 9.863 -0.495 1.00 0.00 C ATOM 17 N3 DA A 1 3.524 8.867 -0.374 1.00 0.00 N ATOM 18 C4 DA A 1 2.917 7.669 -0.480 1.00 0.00 C ATOM 0 H5' DA A 1 5.850 3.250 -2.492 1.00 0.00 H new ATOM 0 H5'' DA A 1 6.834 2.414 -1.307 1.00 0.00 H new ATOM 0 H4' DA A 1 7.472 4.642 -1.148 1.00 0.00 H new ATOM 0 H3' DA A 1 6.280 3.427 1.074 1.00 0.00 H new ATOM 0 H2' DA A 1 4.281 4.640 1.170 1.00 0.00 H new ATOM 0 H2'' DA A 1 5.309 5.837 1.932 1.00 0.00 H new ATOM 0 HO5' DA A 1 4.601 1.755 -1.216 1.00 0.00 H new ATOM 0 H1' DA A 1 5.413 7.163 0.015 1.00 0.00 H new ATOM 0 H8 DA A 1 2.668 4.499 -0.554 1.00 0.00 H new ATOM 0 H61 DA A 1 -1.117 9.331 -1.071 1.00 0.00 H new ATOM 0 H62 DA A 1 -1.013 7.568 -1.077 1.00 0.00 H new ATOM 0 H2 DA A 1 3.054 10.863 -0.423 1.00 0.00 H new ATOM 31 P DT A 2 7.641 5.125 2.888 1.00 0.00 P ATOM 32 OP1 DT A 2 9.055 4.913 3.290 1.00 0.00 O ATOM 33 OP2 DT A 2 6.578 4.296 3.509 1.00 0.00 O ATOM 34 O5' DT A 2 7.271 6.681 3.074 1.00 0.00 O ATOM 35 C5' DT A 2 7.876 7.672 2.230 1.00 0.00 C ATOM 36 C4' DT A 2 7.354 9.084 2.485 1.00 0.00 C ATOM 37 O4' DT A 2 5.983 9.248 2.027 1.00 0.00 O ATOM 38 C3' DT A 2 7.378 9.424 3.969 1.00 0.00 C ATOM 39 O3' DT A 2 8.034 10.676 4.198 1.00 0.00 O ATOM 40 C2' DT A 2 5.940 9.501 4.370 1.00 0.00 C ATOM 41 C1' DT A 2 5.178 9.791 3.103 1.00 0.00 C ATOM 42 N1 DT A 2 3.822 9.199 3.123 1.00 0.00 N ATOM 43 C2 DT A 2 2.750 10.058 2.990 1.00 0.00 C ATOM 44 O2 DT A 2 2.890 11.277 2.927 1.00 0.00 O ATOM 45 N3 DT A 2 1.503 9.466 2.949 1.00 0.00 N ATOM 46 C4 DT A 2 1.236 8.112 3.030 1.00 0.00 C ATOM 47 O4 DT A 2 0.082 7.696 2.972 1.00 0.00 O ATOM 48 C5 DT A 2 2.417 7.293 3.173 1.00 0.00 C ATOM 49 C7 DT A 2 2.272 5.776 3.263 1.00 0.00 C ATOM 50 C6 DT A 2 3.645 7.846 3.218 1.00 0.00 C ATOM 0 H5' DT A 2 7.697 7.409 1.187 1.00 0.00 H new ATOM 0 H5'' DT A 2 8.955 7.658 2.382 1.00 0.00 H new ATOM 0 H4' DT A 2 8.014 9.749 1.928 1.00 0.00 H new ATOM 0 H3' DT A 2 7.928 8.681 4.547 1.00 0.00 H new ATOM 0 H2' DT A 2 5.609 8.565 4.821 1.00 0.00 H new ATOM 0 H2'' DT A 2 5.781 10.285 5.110 1.00 0.00 H new ATOM 0 H1' DT A 2 5.018 10.862 2.979 1.00 0.00 H new ATOM 0 H3 DT A 2 0.701 10.088 2.849 1.00 0.00 H new ATOM 0 H71 DT A 2 1.316 5.529 3.724 1.00 0.00 H new ATOM 0 H72 DT A 2 2.314 5.346 2.262 1.00 0.00 H new ATOM 0 H73 DT A 2 3.082 5.368 3.867 1.00 0.00 H new ATOM 0 H6 DT A 2 4.508 7.207 3.332 1.00 0.00 H new ATOM 63 P DC A 3 8.157 11.276 5.684 1.00 0.00 P ATOM 64 OP1 DC A 3 9.408 12.070 5.781 1.00 0.00 O ATOM 65 OP2 DC A 3 7.906 10.191 6.665 1.00 0.00 O ATOM 66 O5' DC A 3 6.901 12.283 5.684 1.00 0.00 O ATOM 67 C5' DC A 3 6.731 13.231 4.621 1.00 0.00 C ATOM 68 C4' DC A 3 5.633 14.250 4.903 1.00 0.00 C ATOM 69 O4' DC A 3 4.323 13.706 4.601 1.00 0.00 O ATOM 70 C3' DC A 3 5.629 14.667 6.366 1.00 0.00 C ATOM 71 O3' DC A 3 5.580 16.089 6.500 1.00 0.00 O ATOM 72 C2' DC A 3 4.401 14.036 6.942 1.00 0.00 C ATOM 73 C1' DC A 3 3.479 13.786 5.773 1.00 0.00 C ATOM 74 N1 DC A 3 2.698 12.541 5.950 1.00 0.00 N ATOM 75 C2 DC A 3 1.322 12.628 5.847 1.00 0.00 C ATOM 76 O2 DC A 3 0.780 13.716 5.664 1.00 0.00 O ATOM 77 N3 DC A 3 0.598 11.485 5.960 1.00 0.00 N ATOM 78 C4 DC A 3 1.191 10.305 6.168 1.00 0.00 C ATOM 79 N4 DC A 3 0.443 9.206 6.271 1.00 0.00 N ATOM 80 C5 DC A 3 2.610 10.211 6.281 1.00 0.00 C ATOM 81 C6 DC A 3 3.320 11.347 6.170 1.00 0.00 C ATOM 0 H5' DC A 3 6.496 12.698 3.700 1.00 0.00 H new ATOM 0 H5'' DC A 3 7.672 13.755 4.455 1.00 0.00 H new ATOM 0 H4' DC A 3 5.841 15.111 4.267 1.00 0.00 H new ATOM 0 H3' DC A 3 6.536 14.349 6.880 1.00 0.00 H new ATOM 0 H2' DC A 3 4.644 13.105 7.455 1.00 0.00 H new ATOM 0 H2'' DC A 3 3.932 14.691 7.676 1.00 0.00 H new ATOM 0 H1' DC A 3 2.747 14.588 5.681 1.00 0.00 H new ATOM 0 H41 DC A 3 0.886 8.301 6.430 1.00 0.00 H new ATOM 0 H42 DC A 3 -0.572 9.271 6.191 1.00 0.00 H new ATOM 0 H5 DC A 3 3.096 9.261 6.450 1.00 0.00 H new ATOM 0 H6 DC A 3 4.396 11.314 6.256 1.00 0.00 H new ATOM 93 P DC A 4 5.552 16.764 7.955 1.00 0.00 P ATOM 94 OP1 DC A 4 6.178 18.108 7.877 1.00 0.00 O ATOM 95 OP2 DC A 4 6.053 15.782 8.951 1.00 0.00 O ATOM 96 O5' DC A 4 3.967 16.938 8.151 1.00 0.00 O ATOM 97 C5' DC A 4 3.161 17.453 7.083 1.00 0.00 C ATOM 98 C4' DC A 4 1.725 17.726 7.506 1.00 0.00 C ATOM 99 O4' DC A 4 0.895 16.545 7.337 1.00 0.00 O ATOM 100 C3' DC A 4 1.646 18.135 8.973 1.00 0.00 C ATOM 101 O3' DC A 4 0.900 19.343 9.145 1.00 0.00 O ATOM 102 C2' DC A 4 0.968 16.992 9.656 1.00 0.00 C ATOM 103 C1' DC A 4 0.217 16.249 8.579 1.00 0.00 C ATOM 104 N1 DC A 4 0.185 14.790 8.844 1.00 0.00 N ATOM 105 C2 DC A 4 -1.054 14.171 8.854 1.00 0.00 C ATOM 106 O2 DC A 4 -2.077 14.826 8.662 1.00 0.00 O ATOM 107 N3 DC A 4 -1.102 12.833 9.082 1.00 0.00 N ATOM 108 C4 DC A 4 0.014 12.124 9.293 1.00 0.00 C ATOM 109 N4 DC A 4 -0.071 10.810 9.510 1.00 0.00 N ATOM 110 C5 DC A 4 1.294 12.756 9.285 1.00 0.00 C ATOM 111 C6 DC A 4 1.335 14.082 9.059 1.00 0.00 C ATOM 0 H5' DC A 4 3.163 16.741 6.257 1.00 0.00 H new ATOM 0 H5'' DC A 4 3.607 18.375 6.710 1.00 0.00 H new ATOM 0 H4' DC A 4 1.366 18.536 6.871 1.00 0.00 H new ATOM 0 H3' DC A 4 2.635 18.337 9.385 1.00 0.00 H new ATOM 0 H2' DC A 4 1.695 16.342 10.144 1.00 0.00 H new ATOM 0 H2'' DC A 4 0.289 17.348 10.430 1.00 0.00 H new ATOM 0 H1' DC A 4 -0.826 16.565 8.542 1.00 0.00 H new ATOM 0 H41 DC A 4 0.775 10.264 9.671 1.00 0.00 H new ATOM 0 H42 DC A 4 -0.982 10.352 9.514 1.00 0.00 H new ATOM 0 H5 DC A 4 2.198 12.190 9.454 1.00 0.00 H new ATOM 0 H6 DC A 4 2.287 14.593 9.047 1.00 0.00 H new ATOM 123 P DT A 5 0.677 19.949 10.616 1.00 0.00 P ATOM 124 OP1 DT A 5 0.657 21.432 10.533 1.00 0.00 O ATOM 125 OP2 DT A 5 1.616 19.287 11.558 1.00 0.00 O ATOM 126 O5' DT A 5 -0.811 19.425 10.912 1.00 0.00 O ATOM 127 C5' DT A 5 -1.860 19.664 9.966 1.00 0.00 C ATOM 128 C4' DT A 5 -3.172 19.007 10.367 1.00 0.00 C ATOM 129 O4' DT A 5 -3.056 17.561 10.362 1.00 0.00 O ATOM 130 C3' DT A 5 -3.593 19.430 11.768 1.00 0.00 C ATOM 131 O3' DT A 5 -4.961 19.858 11.784 1.00 0.00 O ATOM 132 C2' DT A 5 -3.395 18.207 12.613 1.00 0.00 C ATOM 133 C1' DT A 5 -3.419 17.036 11.660 1.00 0.00 C ATOM 134 N1 DT A 5 -2.488 15.958 12.071 1.00 0.00 N ATOM 135 C2 DT A 5 -3.007 14.681 12.180 1.00 0.00 C ATOM 136 O2 DT A 5 -4.204 14.447 12.030 1.00 0.00 O ATOM 137 N3 DT A 5 -2.103 13.677 12.480 1.00 0.00 N ATOM 138 C4 DT A 5 -0.746 13.836 12.679 1.00 0.00 C ATOM 139 O4 DT A 5 -0.039 12.860 12.931 1.00 0.00 O ATOM 140 C5 DT A 5 -0.289 15.203 12.554 1.00 0.00 C ATOM 141 C7 DT A 5 1.194 15.520 12.732 1.00 0.00 C ATOM 142 C6 DT A 5 -1.151 16.202 12.264 1.00 0.00 C ATOM 0 H5' DT A 5 -1.555 19.290 8.989 1.00 0.00 H new ATOM 0 H5'' DT A 5 -2.013 20.738 9.863 1.00 0.00 H new ATOM 0 H4' DT A 5 -3.916 19.328 9.638 1.00 0.00 H new ATOM 0 H3' DT A 5 -3.012 20.276 12.136 1.00 0.00 H new ATOM 0 H2' DT A 5 -2.448 18.253 13.151 1.00 0.00 H new ATOM 0 H2'' DT A 5 -4.183 18.118 13.361 1.00 0.00 H new ATOM 0 H1' DT A 5 -4.409 16.581 11.648 1.00 0.00 H new ATOM 0 H3 DT A 5 -2.474 12.730 12.562 1.00 0.00 H new ATOM 0 H71 DT A 5 1.456 16.386 12.124 1.00 0.00 H new ATOM 0 H72 DT A 5 1.396 15.738 13.781 1.00 0.00 H new ATOM 0 H73 DT A 5 1.790 14.663 12.418 1.00 0.00 H new ATOM 0 H6 DT A 5 -0.781 17.213 12.182 1.00 0.00 H new ATOM 155 P DA A 6 -5.623 20.430 13.129 1.00 0.00 P ATOM 156 OP1 DA A 6 -6.728 21.353 12.770 1.00 0.00 O ATOM 157 OP2 DA A 6 -4.544 20.906 14.033 1.00 0.00 O ATOM 158 O5' DA A 6 -6.248 19.080 13.728 1.00 0.00 O ATOM 159 C5' DA A 6 -7.515 18.594 13.262 1.00 0.00 C ATOM 160 C4' DA A 6 -8.022 17.427 14.094 1.00 0.00 C ATOM 161 O4' DA A 6 -7.106 16.304 14.011 1.00 0.00 O ATOM 162 C3' DA A 6 -8.132 17.823 15.563 1.00 0.00 C ATOM 163 O3' DA A 6 -9.384 17.402 16.126 1.00 0.00 O ATOM 164 C2' DA A 6 -6.995 17.117 16.223 1.00 0.00 C ATOM 165 C1' DA A 6 -6.691 15.937 15.341 1.00 0.00 C ATOM 166 N9 DA A 6 -5.266 15.560 15.407 1.00 0.00 N ATOM 167 C8 DA A 6 -4.149 16.331 15.454 1.00 0.00 C ATOM 168 N7 DA A 6 -3.018 15.729 15.617 1.00 0.00 N ATOM 169 C5 DA A 6 -3.422 14.391 15.685 1.00 0.00 C ATOM 170 C6 DA A 6 -2.723 13.192 15.857 1.00 0.00 C ATOM 171 N6 DA A 6 -1.403 13.133 16.029 1.00 0.00 N ATOM 172 N1 DA A 6 -3.442 12.056 15.873 1.00 0.00 N ATOM 173 C2 DA A 6 -4.768 12.092 15.730 1.00 0.00 C ATOM 174 N3 DA A 6 -5.524 13.165 15.567 1.00 0.00 N ATOM 175 C4 DA A 6 -4.786 14.287 15.552 1.00 0.00 C ATOM 0 H5' DA A 6 -7.423 18.283 12.221 1.00 0.00 H new ATOM 0 H5'' DA A 6 -8.245 19.403 13.290 1.00 0.00 H new ATOM 0 H4' DA A 6 -9.000 17.149 13.701 1.00 0.00 H new ATOM 0 H3' DA A 6 -8.092 18.904 15.699 1.00 0.00 H new ATOM 0 H2' DA A 6 -6.128 17.771 16.317 1.00 0.00 H new ATOM 0 H2'' DA A 6 -7.263 16.796 17.230 1.00 0.00 H new ATOM 0 H1' DA A 6 -7.230 15.049 15.672 1.00 0.00 H new ATOM 0 H8 DA A 6 -4.204 17.405 15.359 1.00 0.00 H new ATOM 0 H61 DA A 6 -0.944 12.230 16.150 1.00 0.00 H new ATOM 0 H62 DA A 6 -0.851 13.991 16.040 1.00 0.00 H new ATOM 0 H2 DA A 6 -5.280 11.141 15.749 1.00 0.00 H new ATOM 187 P DG A 7 -9.933 18.059 17.488 1.00 0.00 P ATOM 188 OP1 DG A 7 -11.389 18.310 17.347 1.00 0.00 O ATOM 189 OP2 DG A 7 -9.041 19.183 17.875 1.00 0.00 O ATOM 190 O5' DG A 7 -9.711 16.840 18.519 1.00 0.00 O ATOM 191 C5' DG A 7 -10.144 15.507 18.196 1.00 0.00 C ATOM 192 C4' DG A 7 -9.575 14.452 19.152 1.00 0.00 C ATOM 193 O4' DG A 7 -8.179 14.197 18.852 1.00 0.00 O ATOM 194 C3' DG A 7 -9.655 14.868 20.632 1.00 0.00 C ATOM 195 O3' DG A 7 -10.215 13.823 21.435 1.00 0.00 O ATOM 196 C2' DG A 7 -8.238 15.136 21.031 1.00 0.00 C ATOM 197 C1' DG A 7 -7.375 14.389 20.039 1.00 0.00 C ATOM 198 N9 DG A 7 -6.140 15.141 19.721 1.00 0.00 N ATOM 199 C8 DG A 7 -5.965 16.466 19.476 1.00 0.00 C ATOM 200 N7 DG A 7 -4.773 16.870 19.197 1.00 0.00 N ATOM 201 C5 DG A 7 -4.044 15.679 19.257 1.00 0.00 C ATOM 202 C6 DG A 7 -2.659 15.451 19.044 1.00 0.00 C ATOM 203 O6 DG A 7 -1.789 16.268 18.752 1.00 0.00 O ATOM 204 N1 DG A 7 -2.331 14.111 19.201 1.00 0.00 N ATOM 205 C2 DG A 7 -3.223 13.108 19.525 1.00 0.00 C ATOM 206 N2 DG A 7 -2.713 11.883 19.639 1.00 0.00 N ATOM 207 N3 DG A 7 -4.531 13.312 19.727 1.00 0.00 N ATOM 208 C4 DG A 7 -4.872 14.615 19.579 1.00 0.00 C ATOM 0 H5' DG A 7 -9.842 15.268 17.176 1.00 0.00 H new ATOM 0 H5'' DG A 7 -11.233 15.466 18.223 1.00 0.00 H new ATOM 0 H4' DG A 7 -10.188 13.563 19.003 1.00 0.00 H new ATOM 0 H3' DG A 7 -10.298 15.737 20.774 1.00 0.00 H new ATOM 0 H2' DG A 7 -8.022 16.204 21.009 1.00 0.00 H new ATOM 0 H2'' DG A 7 -8.048 14.794 22.048 1.00 0.00 H new ATOM 0 H1' DG A 7 -7.054 13.434 20.456 1.00 0.00 H new ATOM 0 H8 DG A 7 -6.795 17.156 19.514 1.00 0.00 H new ATOM 0 H1 DG A 7 -1.355 13.847 19.067 1.00 0.00 H new ATOM 0 H21 DG A 7 -3.320 11.098 19.876 1.00 0.00 H new ATOM 0 H22 DG A 7 -1.716 11.730 19.489 1.00 0.00 H new ATOM 220 P DT A 8 -10.455 14.047 23.009 1.00 0.00 P ATOM 221 OP1 DT A 8 -11.705 13.349 23.409 1.00 0.00 O ATOM 222 OP2 DT A 8 -10.303 15.492 23.317 1.00 0.00 O ATOM 223 O5' DT A 8 -9.196 13.248 23.613 1.00 0.00 O ATOM 224 C5' DT A 8 -9.282 11.837 23.868 1.00 0.00 C ATOM 225 C4' DT A 8 -7.911 11.191 24.053 1.00 0.00 C ATOM 226 O4' DT A 8 -6.904 11.921 23.311 1.00 0.00 O ATOM 227 C3' DT A 8 -7.472 11.174 25.519 1.00 0.00 C ATOM 228 O3' DT A 8 -6.967 9.878 25.883 1.00 0.00 O ATOM 229 C2' DT A 8 -6.390 12.203 25.597 1.00 0.00 C ATOM 230 C1' DT A 8 -5.837 12.320 24.198 1.00 0.00 C ATOM 231 N1 DT A 8 -5.367 13.693 23.909 1.00 0.00 N ATOM 232 C2 DT A 8 -4.066 13.832 23.458 1.00 0.00 C ATOM 233 O2 DT A 8 -3.325 12.866 23.289 1.00 0.00 O ATOM 234 N3 DT A 8 -3.643 15.123 23.209 1.00 0.00 N ATOM 235 C4 DT A 8 -4.397 16.273 23.371 1.00 0.00 C ATOM 236 O4 DT A 8 -3.918 17.376 23.118 1.00 0.00 O ATOM 237 C5 DT A 8 -5.741 16.033 23.844 1.00 0.00 C ATOM 238 C7 DT A 8 -6.675 17.213 24.075 1.00 0.00 C ATOM 239 C6 DT A 8 -6.179 14.782 24.092 1.00 0.00 C ATOM 0 H5' DT A 8 -9.799 11.352 23.040 1.00 0.00 H new ATOM 0 H5'' DT A 8 -9.883 11.669 24.762 1.00 0.00 H new ATOM 0 H4' DT A 8 -8.005 10.167 23.690 1.00 0.00 H new ATOM 0 H3' DT A 8 -8.296 11.385 26.201 1.00 0.00 H new ATOM 0 H2' DT A 8 -6.783 13.159 25.944 1.00 0.00 H new ATOM 0 H2'' DT A 8 -5.614 11.903 26.301 1.00 0.00 H new ATOM 0 H1' DT A 8 -4.962 11.683 24.068 1.00 0.00 H new ATOM 0 H3 DT A 8 -2.686 15.240 22.875 1.00 0.00 H new ATOM 0 H71 DT A 8 -7.705 16.901 23.903 1.00 0.00 H new ATOM 0 H72 DT A 8 -6.569 17.565 25.101 1.00 0.00 H new ATOM 0 H73 DT A 8 -6.420 18.019 23.386 1.00 0.00 H new ATOM 0 H6 DT A 8 -7.190 14.635 24.442 1.00 0.00 H new ATOM 252 P DT A 9 -6.619 9.517 27.412 1.00 0.00 P ATOM 253 OP1 DT A 9 -6.544 8.040 27.553 1.00 0.00 O ATOM 254 OP2 DT A 9 -7.524 10.284 28.305 1.00 0.00 O ATOM 255 O5' DT A 9 -5.133 10.124 27.528 1.00 0.00 O ATOM 256 C5' DT A 9 -4.004 9.443 26.953 1.00 0.00 C ATOM 257 C4' DT A 9 -3.247 10.315 25.959 1.00 0.00 C ATOM 258 O4' DT A 9 -3.369 11.719 26.305 1.00 0.00 O ATOM 259 C3' DT A 9 -1.763 9.978 25.933 1.00 0.00 C ATOM 260 O3' DT A 9 -1.301 9.861 24.585 1.00 0.00 O ATOM 261 C2' DT A 9 -1.100 11.128 26.627 1.00 0.00 C ATOM 262 C1' DT A 9 -2.053 12.289 26.496 1.00 0.00 C ATOM 263 N1 DT A 9 -2.010 13.151 27.696 1.00 0.00 N ATOM 264 C2 DT A 9 -1.532 14.438 27.533 1.00 0.00 C ATOM 265 O2 DT A 9 -1.145 14.859 26.446 1.00 0.00 O ATOM 266 N3 DT A 9 -1.515 15.228 28.667 1.00 0.00 N ATOM 267 C4 DT A 9 -1.929 14.846 29.931 1.00 0.00 C ATOM 268 O4 DT A 9 -1.872 15.635 30.873 1.00 0.00 O ATOM 269 C5 DT A 9 -2.411 13.485 30.006 1.00 0.00 C ATOM 270 C7 DT A 9 -2.912 12.939 31.338 1.00 0.00 C ATOM 271 C6 DT A 9 -2.435 12.694 28.915 1.00 0.00 C ATOM 0 H5' DT A 9 -4.346 8.537 26.452 1.00 0.00 H new ATOM 0 H5'' DT A 9 -3.327 9.131 27.748 1.00 0.00 H new ATOM 0 H4' DT A 9 -3.688 10.121 24.981 1.00 0.00 H new ATOM 0 H3' DT A 9 -1.544 9.027 26.418 1.00 0.00 H new ATOM 0 H2' DT A 9 -0.908 10.895 27.674 1.00 0.00 H new ATOM 0 H2'' DT A 9 -0.137 11.358 26.170 1.00 0.00 H new ATOM 0 H1' DT A 9 -1.780 12.926 25.655 1.00 0.00 H new ATOM 0 H3 DT A 9 -1.165 16.180 28.563 1.00 0.00 H new ATOM 0 H71 DT A 9 -3.682 12.188 31.157 1.00 0.00 H new ATOM 0 H72 DT A 9 -2.083 12.485 31.880 1.00 0.00 H new ATOM 0 H73 DT A 9 -3.331 13.753 31.930 1.00 0.00 H new ATOM 0 H6 DT A 9 -2.796 11.680 29.004 1.00 0.00 H new ATOM 284 P DA A 10 -0.319 8.671 24.159 1.00 0.00 P ATOM 285 OP1 DA A 10 0.547 8.326 25.315 1.00 0.00 O ATOM 286 OP2 DA A 10 0.310 9.007 22.856 1.00 0.00 O ATOM 287 O5' DA A 10 -1.386 7.490 23.937 1.00 0.00 O ATOM 288 C5' DA A 10 -0.958 6.128 24.029 1.00 0.00 C ATOM 289 C4' DA A 10 -1.653 5.216 23.023 1.00 0.00 C ATOM 290 O4' DA A 10 -2.919 5.795 22.615 1.00 0.00 O ATOM 291 C3' DA A 10 -0.793 5.074 21.775 1.00 0.00 C ATOM 292 O3' DA A 10 -0.978 3.797 21.159 1.00 0.00 O ATOM 293 C2' DA A 10 -1.299 6.165 20.900 1.00 0.00 C ATOM 294 C1' DA A 10 -2.751 6.338 21.298 1.00 0.00 C ATOM 295 N9 DA A 10 -3.229 7.729 21.254 1.00 0.00 N ATOM 296 C8 DA A 10 -2.533 8.879 21.341 1.00 0.00 C ATOM 297 N7 DA A 10 -3.199 9.982 21.385 1.00 0.00 N ATOM 298 C5 DA A 10 -4.511 9.520 21.343 1.00 0.00 C ATOM 299 C6 DA A 10 -5.742 10.175 21.355 1.00 0.00 C ATOM 300 N6 DA A 10 -5.852 11.502 21.346 1.00 0.00 N ATOM 301 N1 DA A 10 -6.850 9.414 21.308 1.00 0.00 N ATOM 302 C2 DA A 10 -6.752 8.085 21.249 1.00 0.00 C ATOM 303 N3 DA A 10 -5.636 7.362 21.225 1.00 0.00 N ATOM 304 C4 DA A 10 -4.542 8.149 21.276 1.00 0.00 C ATOM 0 H5' DA A 10 -1.149 5.760 25.037 1.00 0.00 H new ATOM 0 H5'' DA A 10 0.119 6.080 23.871 1.00 0.00 H new ATOM 0 H4' DA A 10 -1.812 4.247 23.496 1.00 0.00 H new ATOM 0 H3' DA A 10 0.275 5.142 21.981 1.00 0.00 H new ATOM 0 H2' DA A 10 -0.735 7.086 21.050 1.00 0.00 H new ATOM 0 H2'' DA A 10 -1.206 5.902 19.846 1.00 0.00 H new ATOM 0 H1' DA A 10 -3.357 5.807 20.564 1.00 0.00 H new ATOM 0 H8 DA A 10 -1.453 8.877 21.373 1.00 0.00 H new ATOM 0 H61 DA A 10 -6.774 11.937 21.355 1.00 0.00 H new ATOM 0 H62 DA A 10 -5.014 12.083 21.330 1.00 0.00 H new ATOM 0 H2 DA A 10 -7.681 7.536 21.217 1.00 0.00 H new ATOM 316 P DT A 11 -0.207 3.429 19.800 1.00 0.00 P ATOM 317 OP1 DT A 11 0.142 1.986 19.819 1.00 0.00 O ATOM 318 OP2 DT A 11 0.860 4.435 19.561 1.00 0.00 O ATOM 319 O5' DT A 11 -1.395 3.663 18.744 1.00 0.00 O ATOM 320 C5' DT A 11 -2.566 2.842 18.807 1.00 0.00 C ATOM 321 C4' DT A 11 -3.776 3.462 18.115 1.00 0.00 C ATOM 322 O4' DT A 11 -3.781 4.909 18.234 1.00 0.00 O ATOM 323 C3' DT A 11 -3.814 3.125 16.629 1.00 0.00 C ATOM 324 O3' DT A 11 -5.079 2.558 16.272 1.00 0.00 O ATOM 325 C2' DT A 11 -3.594 4.434 15.933 1.00 0.00 C ATOM 326 C1' DT A 11 -3.988 5.493 16.928 1.00 0.00 C ATOM 327 N1 DT A 11 -3.200 6.732 16.752 1.00 0.00 N ATOM 328 C2 DT A 11 -3.890 7.874 16.392 1.00 0.00 C ATOM 329 O2 DT A 11 -5.105 7.871 16.198 1.00 0.00 O ATOM 330 N3 DT A 11 -3.137 9.023 16.264 1.00 0.00 N ATOM 331 C4 DT A 11 -1.773 9.133 16.467 1.00 0.00 C ATOM 332 O4 DT A 11 -1.204 10.217 16.345 1.00 0.00 O ATOM 333 C5 DT A 11 -1.134 7.890 16.836 1.00 0.00 C ATOM 334 C7 DT A 11 0.368 7.869 17.094 1.00 0.00 C ATOM 335 C6 DT A 11 -1.847 6.751 16.963 1.00 0.00 C ATOM 0 H5' DT A 11 -2.812 2.651 19.852 1.00 0.00 H new ATOM 0 H5'' DT A 11 -2.350 1.877 18.349 1.00 0.00 H new ATOM 0 H4' DT A 11 -4.648 3.041 18.616 1.00 0.00 H new ATOM 0 H3' DT A 11 -3.061 2.387 16.353 1.00 0.00 H new ATOM 0 H2' DT A 11 -2.553 4.547 15.632 1.00 0.00 H new ATOM 0 H2'' DT A 11 -4.197 4.503 15.028 1.00 0.00 H new ATOM 0 H1' DT A 11 -5.027 5.792 16.791 1.00 0.00 H new ATOM 0 H3 DT A 11 -3.633 9.872 15.994 1.00 0.00 H new ATOM 0 H71 DT A 11 0.600 7.097 17.827 1.00 0.00 H new ATOM 0 H72 DT A 11 0.894 7.656 16.163 1.00 0.00 H new ATOM 0 H73 DT A 11 0.685 8.839 17.476 1.00 0.00 H new ATOM 0 H6 DT A 11 -1.341 5.837 17.236 1.00 0.00 H new ATOM 348 P DA A 12 -5.385 2.125 14.757 1.00 0.00 P ATOM 349 OP1 DA A 12 -6.361 1.006 14.767 1.00 0.00 O ATOM 350 OP2 DA A 12 -4.098 1.962 14.033 1.00 0.00 O ATOM 351 O5' DA A 12 -6.117 3.452 14.230 1.00 0.00 O ATOM 352 C5' DA A 12 -7.119 4.096 15.029 1.00 0.00 C ATOM 353 C4' DA A 12 -7.846 5.196 14.272 1.00 0.00 C ATOM 354 O4' DA A 12 -7.138 6.460 14.383 1.00 0.00 O ATOM 355 C3' DA A 12 -7.946 4.859 12.793 1.00 0.00 C ATOM 356 O3' DA A 12 -9.268 5.096 12.300 1.00 0.00 O ATOM 357 C2' DA A 12 -6.964 5.771 12.129 1.00 0.00 C ATOM 358 C1' DA A 12 -6.798 6.942 13.064 1.00 0.00 C ATOM 359 N9 DA A 12 -5.421 7.482 13.023 1.00 0.00 N ATOM 360 C8 DA A 12 -4.231 6.849 13.160 1.00 0.00 C ATOM 361 N7 DA A 12 -3.159 7.573 13.119 1.00 0.00 N ATOM 362 C5 DA A 12 -3.692 8.853 12.931 1.00 0.00 C ATOM 363 C6 DA A 12 -3.106 10.118 12.797 1.00 0.00 C ATOM 364 N6 DA A 12 -1.787 10.331 12.848 1.00 0.00 N ATOM 365 N1 DA A 12 -3.931 11.162 12.621 1.00 0.00 N ATOM 366 C2 DA A 12 -5.247 10.985 12.579 1.00 0.00 C ATOM 367 N3 DA A 12 -5.909 9.839 12.694 1.00 0.00 N ATOM 368 C4 DA A 12 -5.067 8.803 12.869 1.00 0.00 C ATOM 0 H5' DA A 12 -6.654 4.518 15.920 1.00 0.00 H new ATOM 0 H5'' DA A 12 -7.841 3.354 15.368 1.00 0.00 H new ATOM 0 H4' DA A 12 -8.840 5.279 14.712 1.00 0.00 H new ATOM 0 H3' DA A 12 -7.733 3.808 12.599 1.00 0.00 H new ATOM 0 H2' DA A 12 -6.013 5.266 11.961 1.00 0.00 H new ATOM 0 H2'' DA A 12 -7.329 6.096 11.155 1.00 0.00 H new ATOM 0 H1' DA A 12 -7.446 7.768 12.770 1.00 0.00 H new ATOM 0 H8 DA A 12 -4.179 5.779 13.298 1.00 0.00 H new ATOM 0 H61 DA A 12 -1.419 11.276 12.744 1.00 0.00 H new ATOM 0 H62 DA A 12 -1.149 9.548 12.991 1.00 0.00 H new ATOM 0 H2 DA A 12 -5.846 11.872 12.435 1.00 0.00 H new ATOM 380 P DG A 13 -9.623 4.836 10.757 1.00 0.00 P ATOM 381 OP1 DG A 13 -11.031 4.379 10.657 1.00 0.00 O ATOM 382 OP2 DG A 13 -8.547 4.014 10.145 1.00 0.00 O ATOM 383 O5' DG A 13 -9.519 6.336 10.187 1.00 0.00 O ATOM 384 C5' DG A 13 -10.495 7.323 10.555 1.00 0.00 C ATOM 385 C4' DG A 13 -10.291 8.651 9.836 1.00 0.00 C ATOM 386 O4' DG A 13 -8.977 9.201 10.117 1.00 0.00 O ATOM 387 C3' DG A 13 -10.398 8.472 8.328 1.00 0.00 C ATOM 388 O3' DG A 13 -11.218 9.489 7.741 1.00 0.00 O ATOM 389 C2' DG A 13 -8.993 8.578 7.836 1.00 0.00 C ATOM 390 C1' DG A 13 -8.249 9.375 8.879 1.00 0.00 C ATOM 391 N9 DG A 13 -6.854 8.910 9.014 1.00 0.00 N ATOM 392 C8 DG A 13 -6.380 7.656 9.198 1.00 0.00 C ATOM 393 N7 DG A 13 -5.109 7.510 9.347 1.00 0.00 N ATOM 394 C5 DG A 13 -4.659 8.828 9.247 1.00 0.00 C ATOM 395 C6 DG A 13 -3.341 9.345 9.326 1.00 0.00 C ATOM 396 O6 DG A 13 -2.289 8.736 9.510 1.00 0.00 O ATOM 397 N1 DG A 13 -3.328 10.721 9.172 1.00 0.00 N ATOM 398 C2 DG A 13 -4.436 11.513 8.960 1.00 0.00 C ATOM 399 N2 DG A 13 -4.208 12.818 8.802 1.00 0.00 N ATOM 400 N3 DG A 13 -5.683 11.037 8.889 1.00 0.00 N ATOM 401 C4 DG A 13 -5.723 9.694 9.038 1.00 0.00 C ATOM 0 H5' DG A 13 -10.451 7.487 11.632 1.00 0.00 H new ATOM 0 H5'' DG A 13 -11.492 6.943 10.331 1.00 0.00 H new ATOM 0 H4' DG A 13 -11.067 9.327 10.196 1.00 0.00 H new ATOM 0 H3' DG A 13 -10.862 7.522 8.063 1.00 0.00 H new ATOM 0 H2' DG A 13 -8.548 7.591 7.708 1.00 0.00 H new ATOM 0 H2'' DG A 13 -8.955 9.073 6.866 1.00 0.00 H new ATOM 0 H1' DG A 13 -8.193 10.427 8.600 1.00 0.00 H new ATOM 0 H8 DG A 13 -7.045 6.806 9.219 1.00 0.00 H new ATOM 0 H1 DG A 13 -2.422 11.188 9.219 1.00 0.00 H new ATOM 0 H21 DG A 13 -4.987 13.456 8.642 1.00 0.00 H new ATOM 0 H22 DG A 13 -3.254 13.177 8.841 1.00 0.00 H new ATOM 413 P DG A 14 -11.460 9.526 6.153 1.00 0.00 P ATOM 414 OP1 DG A 14 -12.873 9.898 5.890 1.00 0.00 O ATOM 415 OP2 DG A 14 -10.913 8.283 5.553 1.00 0.00 O ATOM 416 O5' DG A 14 -10.512 10.761 5.750 1.00 0.00 O ATOM 417 C5' DG A 14 -10.621 12.013 6.439 1.00 0.00 C ATOM 418 C4' DG A 14 -9.648 13.064 5.917 1.00 0.00 C ATOM 419 O4' DG A 14 -8.300 12.813 6.394 1.00 0.00 O ATOM 420 C3' DG A 14 -9.598 13.063 4.392 1.00 0.00 C ATOM 421 O3' DG A 14 -9.720 14.388 3.867 1.00 0.00 O ATOM 422 C2' DG A 14 -8.262 12.490 4.054 1.00 0.00 C ATOM 423 C1' DG A 14 -7.400 12.715 5.266 1.00 0.00 C ATOM 424 N9 DG A 14 -6.434 11.616 5.435 1.00 0.00 N ATOM 425 C8 DG A 14 -6.648 10.284 5.520 1.00 0.00 C ATOM 426 N7 DG A 14 -5.622 9.519 5.667 1.00 0.00 N ATOM 427 C5 DG A 14 -4.581 10.448 5.679 1.00 0.00 C ATOM 428 C6 DG A 14 -3.186 10.245 5.808 1.00 0.00 C ATOM 429 O6 DG A 14 -2.576 9.186 5.946 1.00 0.00 O ATOM 430 N1 DG A 14 -2.495 11.445 5.765 1.00 0.00 N ATOM 431 C2 DG A 14 -3.067 12.690 5.618 1.00 0.00 C ATOM 432 N2 DG A 14 -2.230 13.726 5.603 1.00 0.00 N ATOM 433 N3 DG A 14 -4.377 12.893 5.498 1.00 0.00 N ATOM 434 C4 DG A 14 -5.072 11.736 5.535 1.00 0.00 C ATOM 0 H5' DG A 14 -10.440 11.854 7.502 1.00 0.00 H new ATOM 0 H5'' DG A 14 -11.640 12.388 6.342 1.00 0.00 H new ATOM 0 H4' DG A 14 -10.008 14.026 6.283 1.00 0.00 H new ATOM 0 H3' DG A 14 -10.419 12.489 3.963 1.00 0.00 H new ATOM 0 H2' DG A 14 -8.340 11.428 3.821 1.00 0.00 H new ATOM 0 H2'' DG A 14 -7.838 12.978 3.177 1.00 0.00 H new ATOM 0 H1' DG A 14 -6.807 13.625 5.168 1.00 0.00 H new ATOM 0 H8 DG A 14 -7.646 9.875 5.466 1.00 0.00 H new ATOM 0 H1 DG A 14 -1.479 11.404 5.849 1.00 0.00 H new ATOM 0 H21 DG A 14 -2.593 14.673 5.497 1.00 0.00 H new ATOM 0 H22 DG A 14 -1.226 13.572 5.697 1.00 0.00 H new ATOM 446 P DA A 15 -9.652 14.639 2.281 1.00 0.00 P ATOM 447 OP1 DA A 15 -10.540 15.778 1.932 1.00 0.00 O ATOM 448 OP2 DA A 15 -9.826 13.341 1.581 1.00 0.00 O ATOM 449 O5' DA A 15 -8.121 15.110 2.136 1.00 0.00 O ATOM 450 C5' DA A 15 -7.585 16.113 3.012 1.00 0.00 C ATOM 451 C4' DA A 15 -6.158 16.510 2.653 1.00 0.00 C ATOM 452 O4' DA A 15 -5.206 15.526 3.134 1.00 0.00 O ATOM 453 C3' DA A 15 -5.978 16.624 1.144 1.00 0.00 C ATOM 454 O3' DA A 15 -5.331 17.852 0.785 1.00 0.00 O ATOM 455 C2' DA A 15 -5.133 15.447 0.773 1.00 0.00 C ATOM 456 C1' DA A 15 -4.405 15.043 2.032 1.00 0.00 C ATOM 457 N9 DA A 15 -4.226 13.579 2.097 1.00 0.00 N ATOM 458 C8 DA A 15 -5.143 12.587 1.991 1.00 0.00 C ATOM 459 N7 DA A 15 -4.724 11.371 2.084 1.00 0.00 N ATOM 460 C5 DA A 15 -3.354 11.564 2.274 1.00 0.00 C ATOM 461 C6 DA A 15 -2.288 10.678 2.449 1.00 0.00 C ATOM 462 N6 DA A 15 -2.435 9.353 2.470 1.00 0.00 N ATOM 463 N1 DA A 15 -1.068 11.211 2.607 1.00 0.00 N ATOM 464 C2 DA A 15 -0.896 12.533 2.597 1.00 0.00 C ATOM 465 N3 DA A 15 -1.830 13.461 2.439 1.00 0.00 N ATOM 466 C4 DA A 15 -3.045 12.905 2.283 1.00 0.00 C ATOM 0 H5' DA A 15 -7.607 15.743 4.037 1.00 0.00 H new ATOM 0 H5'' DA A 15 -8.222 16.997 2.978 1.00 0.00 H new ATOM 0 H4' DA A 15 -5.977 17.475 3.126 1.00 0.00 H new ATOM 0 H3' DA A 15 -6.934 16.630 0.621 1.00 0.00 H new ATOM 0 H2' DA A 15 -5.747 14.628 0.398 1.00 0.00 H new ATOM 0 H2'' DA A 15 -4.430 15.706 -0.018 1.00 0.00 H new ATOM 0 H1' DA A 15 -3.403 15.470 2.062 1.00 0.00 H new ATOM 0 H8 DA A 15 -6.189 12.807 1.834 1.00 0.00 H new ATOM 0 H61 DA A 15 -1.622 8.752 2.601 1.00 0.00 H new ATOM 0 H62 DA A 15 -3.361 8.941 2.355 1.00 0.00 H new ATOM 0 H2 DA A 15 0.115 12.887 2.732 1.00 0.00 H new ATOM 478 P DT A 16 -5.024 18.197 -0.755 1.00 0.00 P ATOM 479 OP1 DT A 16 -5.035 19.672 -0.930 1.00 0.00 O ATOM 480 OP2 DT A 16 -5.891 17.356 -1.620 1.00 0.00 O ATOM 481 O5' DT A 16 -3.508 17.673 -0.865 1.00 0.00 O ATOM 482 C5' DT A 16 -2.548 18.035 0.136 1.00 0.00 C ATOM 483 C4' DT A 16 -1.133 17.589 -0.208 1.00 0.00 C ATOM 484 O4' DT A 16 -0.933 16.194 0.131 1.00 0.00 O ATOM 485 C3' DT A 16 -0.841 17.751 -1.695 1.00 0.00 C ATOM 486 O3' DT A 16 0.395 18.444 -1.907 1.00 0.00 O ATOM 487 C2' DT A 16 -0.773 16.352 -2.227 1.00 0.00 C ATOM 488 C1' DT A 16 -0.476 15.473 -1.034 1.00 0.00 C ATOM 489 N1 DT A 16 -1.146 14.155 -1.132 1.00 0.00 N ATOM 490 C2 DT A 16 -0.356 13.033 -0.971 1.00 0.00 C ATOM 491 O2 DT A 16 0.855 13.107 -0.776 1.00 0.00 O ATOM 492 N3 DT A 16 -1.007 11.815 -1.042 1.00 0.00 N ATOM 493 C4 DT A 16 -2.357 11.623 -1.262 1.00 0.00 C ATOM 494 O4 DT A 16 -2.827 10.487 -1.314 1.00 0.00 O ATOM 495 C5 DT A 16 -3.106 12.849 -1.421 1.00 0.00 C ATOM 496 C7 DT A 16 -4.610 12.784 -1.666 1.00 0.00 C ATOM 497 C6 DT A 16 -2.495 14.050 -1.353 1.00 0.00 C ATOM 0 H5' DT A 16 -2.841 17.594 1.089 1.00 0.00 H new ATOM 0 H5'' DT A 16 -2.560 19.117 0.269 1.00 0.00 H new ATOM 0 H4' DT A 16 -0.460 18.221 0.371 1.00 0.00 H new ATOM 0 H3' DT A 16 -1.604 18.344 -2.199 1.00 0.00 H new ATOM 0 H2' DT A 16 -1.713 16.067 -2.699 1.00 0.00 H new ATOM 0 H2'' DT A 16 0.005 16.259 -2.985 1.00 0.00 H new ATOM 0 HO3' DT A 16 0.559 18.533 -2.869 1.00 0.00 H new ATOM 0 H1' DT A 16 0.592 15.261 -0.980 1.00 0.00 H new ATOM 0 H3 DT A 16 -0.436 10.979 -0.920 1.00 0.00 H new ATOM 0 H71 DT A 16 -4.852 11.865 -2.200 1.00 0.00 H new ATOM 0 H72 DT A 16 -5.135 12.798 -0.711 1.00 0.00 H new ATOM 0 H73 DT A 16 -4.919 13.642 -2.263 1.00 0.00 H new ATOM 0 H6 DT A 16 -3.082 14.949 -1.475 1.00 0.00 H new TER 511 DT A 16