USER MOD reduce.3.24.130724 H: found=0, std=0, add=257, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 257 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 DG O5' : rot 180:sc= 0 USER MOD Single : A 15 DT C7 :methyl -30:sc= -1.09 (180deg=-3.22!) USER MOD Single : A 16 DT C7 :methyl -30:sc= -0.55 (180deg=-1.99) USER MOD Single : A 23 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -4.049 2.425 6.296 1.00 0.36 O ATOM 2 C5' DG A 1 -2.758 1.870 6.587 1.00 0.27 C ATOM 3 C4' DG A 1 -2.850 0.502 7.249 1.00 0.15 C ATOM 4 O4' DG A 1 -3.533 -0.435 6.387 1.00 0.20 O ATOM 5 C3' DG A 1 -1.462 -0.054 7.553 1.00 0.12 C ATOM 6 O3' DG A 1 -1.335 -0.356 8.948 1.00 0.13 O ATOM 7 C2' DG A 1 -1.330 -1.297 6.719 1.00 0.10 C ATOM 8 C1' DG A 1 -2.668 -1.541 6.054 1.00 0.11 C ATOM 9 N9 DG A 1 -2.505 -1.655 4.596 1.00 0.09 N ATOM 10 C8 DG A 1 -2.651 -2.734 3.789 1.00 0.12 C ATOM 11 N7 DG A 1 -2.435 -2.570 2.528 1.00 0.13 N ATOM 12 C5 DG A 1 -2.099 -1.214 2.470 1.00 0.10 C ATOM 13 C6 DG A 1 -1.747 -0.411 1.352 1.00 0.10 C ATOM 14 O6 DG A 1 -1.661 -0.743 0.171 1.00 0.11 O ATOM 15 N1 DG A 1 -1.482 0.900 1.731 1.00 0.11 N ATOM 16 C2 DG A 1 -1.547 1.381 3.023 1.00 0.11 C ATOM 17 N2 DG A 1 -1.255 2.669 3.189 1.00 0.14 N ATOM 18 N3 DG A 1 -1.878 0.632 4.079 1.00 0.11 N ATOM 19 C4 DG A 1 -2.140 -0.648 3.733 1.00 0.08 C ATOM 0 H5' DG A 1 -2.212 2.551 7.240 1.00 0.27 H new ATOM 0 H5'' DG A 1 -2.185 1.786 5.663 1.00 0.27 H new ATOM 0 H4' DG A 1 -3.405 0.630 8.178 1.00 0.15 H new ATOM 0 H3' DG A 1 -0.678 0.666 7.319 1.00 0.12 H new ATOM 0 H2' DG A 1 -0.546 -1.176 5.971 1.00 0.10 H new ATOM 0 H2'' DG A 1 -1.049 -2.148 7.340 1.00 0.10 H new ATOM 0 HO5' DG A 1 -3.940 3.303 5.874 1.00 0.36 H new ATOM 0 H1' DG A 1 -3.103 -2.476 6.407 1.00 0.11 H new ATOM 0 H8 DG A 1 -2.938 -3.696 4.187 1.00 0.12 H new ATOM 0 H1 DG A 1 -1.219 1.558 0.997 1.00 0.11 H new ATOM 0 H21 DG A 1 -1.285 3.083 4.121 1.00 0.14 H new ATOM 0 H22 DG A 1 -1.001 3.242 2.384 1.00 0.14 H new ATOM 32 P DG A 2 0.117 -0.458 9.638 1.00 0.10 P ATOM 33 OP1 DG A 2 -0.063 -0.398 11.106 1.00 0.12 O ATOM 34 OP2 DG A 2 1.019 0.503 8.965 1.00 0.14 O ATOM 35 O5' DG A 2 0.585 -1.947 9.248 1.00 0.12 O ATOM 36 C5' DG A 2 -0.230 -3.075 9.590 1.00 0.18 C ATOM 37 C4' DG A 2 -0.053 -4.233 8.619 1.00 0.17 C ATOM 38 O4' DG A 2 -0.238 -3.791 7.251 1.00 0.14 O ATOM 39 C3' DG A 2 1.347 -4.835 8.732 1.00 0.12 C ATOM 40 O3' DG A 2 1.309 -6.174 9.258 1.00 0.13 O ATOM 41 C2' DG A 2 1.911 -4.811 7.337 1.00 0.13 C ATOM 42 C1' DG A 2 0.821 -4.307 6.415 1.00 0.10 C ATOM 43 N9 DG A 2 1.359 -3.268 5.523 1.00 0.10 N ATOM 44 C8 DG A 2 1.867 -2.058 5.841 1.00 0.15 C ATOM 45 N7 DG A 2 2.308 -1.322 4.884 1.00 0.18 N ATOM 46 C5 DG A 2 2.076 -2.127 3.770 1.00 0.15 C ATOM 47 C6 DG A 2 2.350 -1.871 2.404 1.00 0.16 C ATOM 48 O6 DG A 2 2.839 -0.857 1.906 1.00 0.19 O ATOM 49 N1 DG A 2 1.972 -2.941 1.601 1.00 0.14 N ATOM 50 C2 DG A 2 1.394 -4.110 2.051 1.00 0.15 C ATOM 51 N2 DG A 2 1.109 -5.020 1.115 1.00 0.29 N ATOM 52 N3 DG A 2 1.128 -4.357 3.344 1.00 0.12 N ATOM 53 C4 DG A 2 1.493 -3.327 4.146 1.00 0.11 C ATOM 0 H5' DG A 2 -1.277 -2.773 9.604 1.00 0.18 H new ATOM 0 H5'' DG A 2 0.019 -3.408 10.598 1.00 0.18 H new ATOM 0 H4' DG A 2 -0.802 -4.982 8.877 1.00 0.17 H new ATOM 0 H3' DG A 2 1.967 -4.267 9.426 1.00 0.12 H new ATOM 0 H2' DG A 2 2.785 -4.162 7.288 1.00 0.13 H new ATOM 0 H2'' DG A 2 2.236 -5.807 7.038 1.00 0.13 H new ATOM 0 H1' DG A 2 0.436 -5.105 5.780 1.00 0.10 H new ATOM 0 H8 DG A 2 1.902 -1.720 6.866 1.00 0.15 H new ATOM 0 H1 DG A 2 2.135 -2.855 0.598 1.00 0.14 H new ATOM 0 H21 DG A 2 0.680 -5.907 1.380 1.00 0.29 H new ATOM 0 H22 DG A 2 1.320 -4.828 0.136 1.00 0.29 H new ATOM 65 P DG A 3 0.281 -7.281 8.692 1.00 0.10 P ATOM 66 OP1 DG A 3 -1.067 -6.675 8.622 1.00 0.19 O ATOM 67 OP2 DG A 3 0.486 -8.532 9.457 1.00 0.13 O ATOM 68 O5' DG A 3 0.804 -7.521 7.192 1.00 0.07 O ATOM 69 C5' DG A 3 1.892 -8.417 6.933 1.00 0.09 C ATOM 70 C4' DG A 3 1.944 -8.842 5.477 1.00 0.07 C ATOM 71 O4' DG A 3 1.958 -7.683 4.613 1.00 0.06 O ATOM 72 C3' DG A 3 3.198 -9.663 5.191 1.00 0.07 C ATOM 73 O3' DG A 3 2.853 -10.899 4.553 1.00 0.08 O ATOM 74 C2' DG A 3 4.031 -8.801 4.287 1.00 0.10 C ATOM 75 C1' DG A 3 3.123 -7.712 3.766 1.00 0.07 C ATOM 76 N9 DG A 3 3.809 -6.416 3.766 1.00 0.08 N ATOM 77 C8 DG A 3 4.195 -5.638 4.799 1.00 0.10 C ATOM 78 N7 DG A 3 4.766 -4.511 4.518 1.00 0.12 N ATOM 79 C5 DG A 3 4.766 -4.540 3.117 1.00 0.12 C ATOM 80 C6 DG A 3 5.257 -3.592 2.180 1.00 0.14 C ATOM 81 O6 DG A 3 5.796 -2.510 2.398 1.00 0.17 O ATOM 82 N1 DG A 3 5.057 -4.023 0.872 1.00 0.14 N ATOM 83 C2 DG A 3 4.461 -5.214 0.510 1.00 0.13 C ATOM 84 N2 DG A 3 4.372 -5.461 -0.792 1.00 0.14 N ATOM 85 N3 DG A 3 3.999 -6.103 1.383 1.00 0.11 N ATOM 86 C4 DG A 3 4.182 -5.708 2.658 1.00 0.10 C ATOM 0 H5' DG A 3 1.793 -9.300 7.565 1.00 0.09 H new ATOM 0 H5'' DG A 3 2.831 -7.935 7.204 1.00 0.09 H new ATOM 0 H4' DG A 3 1.058 -9.446 5.283 1.00 0.07 H new ATOM 0 H3' DG A 3 3.736 -9.927 6.102 1.00 0.07 H new ATOM 0 H2' DG A 3 4.875 -8.374 4.829 1.00 0.10 H new ATOM 0 H2'' DG A 3 4.443 -9.387 3.465 1.00 0.10 H new ATOM 0 H1' DG A 3 2.835 -7.914 2.734 1.00 0.07 H new ATOM 0 H8 DG A 3 4.033 -5.944 5.822 1.00 0.10 H new ATOM 0 H1 DG A 3 5.376 -3.410 0.122 1.00 0.14 H new ATOM 0 H21 DG A 3 3.941 -6.326 -1.119 1.00 0.14 H new ATOM 0 H22 DG A 3 4.735 -4.786 -1.465 1.00 0.14 H new ATOM 98 P DC A 4 3.993 -11.933 4.079 1.00 0.10 P ATOM 99 OP1 DC A 4 3.474 -13.308 4.251 1.00 0.24 O ATOM 100 OP2 DC A 4 5.269 -11.541 4.720 1.00 0.21 O ATOM 101 O5' DC A 4 4.108 -11.631 2.501 1.00 0.12 O ATOM 102 C5' DC A 4 4.988 -12.401 1.678 1.00 0.11 C ATOM 103 C4' DC A 4 5.301 -11.685 0.365 1.00 0.09 C ATOM 104 O4' DC A 4 4.109 -11.534 -0.439 1.00 0.12 O ATOM 105 C3' DC A 4 5.876 -10.297 0.623 1.00 0.09 C ATOM 106 O3' DC A 4 7.242 -10.222 0.206 1.00 0.12 O ATOM 107 C2' DC A 4 5.021 -9.350 -0.176 1.00 0.12 C ATOM 108 C1' DC A 4 4.035 -10.190 -0.960 1.00 0.13 C ATOM 109 N1 DC A 4 2.665 -9.650 -0.832 1.00 0.16 N ATOM 110 C2 DC A 4 2.116 -9.011 -1.935 1.00 0.23 C ATOM 111 O2 DC A 4 2.766 -8.910 -2.974 1.00 0.27 O ATOM 112 N3 DC A 4 0.856 -8.509 -1.829 1.00 0.27 N ATOM 113 C4 DC A 4 0.162 -8.628 -0.689 1.00 0.26 C ATOM 114 N4 DC A 4 -1.070 -8.123 -0.618 1.00 0.33 N ATOM 115 C5 DC A 4 0.723 -9.286 0.449 1.00 0.19 C ATOM 116 C6 DC A 4 1.972 -9.779 0.334 1.00 0.14 C ATOM 0 H5' DC A 4 4.534 -13.369 1.466 1.00 0.11 H new ATOM 0 H5'' DC A 4 5.915 -12.595 2.217 1.00 0.11 H new ATOM 0 H4' DC A 4 6.031 -12.297 -0.164 1.00 0.09 H new ATOM 0 H3' DC A 4 5.865 -10.052 1.685 1.00 0.09 H new ATOM 0 H2' DC A 4 4.498 -8.656 0.482 1.00 0.12 H new ATOM 0 H2'' DC A 4 5.635 -8.751 -0.848 1.00 0.12 H new ATOM 0 H1' DC A 4 4.282 -10.178 -2.022 1.00 0.13 H new ATOM 0 H41 DC A 4 -1.607 -8.208 0.245 1.00 0.33 H new ATOM 0 H42 DC A 4 -1.475 -7.652 -1.427 1.00 0.33 H new ATOM 0 H5 DC A 4 0.166 -9.385 1.369 1.00 0.19 H new ATOM 0 H6 DC A 4 2.428 -10.281 1.174 1.00 0.14 H new ATOM 128 P DG A 5 8.290 -9.316 1.024 1.00 0.12 P ATOM 129 OP1 DG A 5 9.498 -9.135 0.188 1.00 0.19 O ATOM 130 OP2 DG A 5 8.415 -9.869 2.391 1.00 0.21 O ATOM 131 O5' DG A 5 7.527 -7.901 1.120 1.00 0.09 O ATOM 132 C5' DG A 5 7.567 -6.968 0.029 1.00 0.09 C ATOM 133 C4' DG A 5 8.192 -5.644 0.430 1.00 0.11 C ATOM 134 O4' DG A 5 7.426 -5.019 1.484 1.00 0.14 O ATOM 135 C3' DG A 5 9.614 -5.851 0.931 1.00 0.12 C ATOM 136 O3' DG A 5 10.550 -5.146 0.111 1.00 0.11 O ATOM 137 C2' DG A 5 9.633 -5.329 2.341 1.00 0.17 C ATOM 138 C1' DG A 5 8.217 -4.912 2.686 1.00 0.13 C ATOM 139 N9 DG A 5 7.664 -5.769 3.752 1.00 0.13 N ATOM 140 C8 DG A 5 7.002 -6.949 3.656 1.00 0.16 C ATOM 141 N7 DG A 5 6.615 -7.509 4.753 1.00 0.19 N ATOM 142 C5 DG A 5 7.068 -6.599 5.713 1.00 0.17 C ATOM 143 C6 DG A 5 6.955 -6.638 7.129 1.00 0.23 C ATOM 144 O6 DG A 5 6.424 -7.499 7.827 1.00 0.31 O ATOM 145 N1 DG A 5 7.546 -5.527 7.719 1.00 0.23 N ATOM 146 C2 DG A 5 8.170 -4.502 7.036 1.00 0.18 C ATOM 147 N2 DG A 5 8.677 -3.521 7.781 1.00 0.19 N ATOM 148 N3 DG A 5 8.281 -4.457 5.704 1.00 0.13 N ATOM 149 C4 DG A 5 7.712 -5.530 5.107 1.00 0.13 C ATOM 0 H5' DG A 5 6.555 -6.794 -0.336 1.00 0.09 H new ATOM 0 H5'' DG A 5 8.133 -7.400 -0.796 1.00 0.09 H new ATOM 0 H4' DG A 5 8.200 -5.004 -0.453 1.00 0.11 H new ATOM 0 H3' DG A 5 9.902 -6.902 0.893 1.00 0.12 H new ATOM 0 H2' DG A 5 9.986 -6.096 3.030 1.00 0.17 H new ATOM 0 H2'' DG A 5 10.315 -4.483 2.429 1.00 0.17 H new ATOM 0 H1' DG A 5 8.205 -3.888 3.058 1.00 0.13 H new ATOM 0 H8 DG A 5 6.806 -7.404 2.696 1.00 0.16 H new ATOM 0 H1 DG A 5 7.516 -5.464 8.737 1.00 0.23 H new ATOM 0 H21 DG A 5 9.150 -2.735 7.336 1.00 0.19 H new ATOM 0 H22 DG A 5 8.592 -3.556 8.797 1.00 0.19 H new ATOM 161 P DC A 6 10.706 -5.516 -1.448 1.00 0.08 P ATOM 162 OP1 DC A 6 10.580 -6.983 -1.591 1.00 0.20 O ATOM 163 OP2 DC A 6 11.906 -4.823 -1.970 1.00 0.15 O ATOM 164 O5' DC A 6 9.404 -4.832 -2.106 1.00 0.11 O ATOM 165 C5' DC A 6 9.220 -4.824 -3.527 1.00 0.13 C ATOM 166 C4' DC A 6 9.637 -3.486 -4.144 1.00 0.13 C ATOM 167 O4' DC A 6 8.995 -2.381 -3.466 1.00 0.13 O ATOM 168 C3' DC A 6 11.148 -3.271 -4.049 1.00 0.10 C ATOM 169 O3' DC A 6 11.758 -3.316 -5.348 1.00 0.18 O ATOM 170 C2' DC A 6 11.323 -1.915 -3.419 1.00 0.08 C ATOM 171 C1' DC A 6 9.943 -1.307 -3.291 1.00 0.09 C ATOM 172 N1 DC A 6 9.767 -0.639 -1.978 1.00 0.12 N ATOM 173 C2 DC A 6 9.576 0.736 -1.982 1.00 0.10 C ATOM 174 O2 DC A 6 9.574 1.353 -3.045 1.00 0.12 O ATOM 175 N3 DC A 6 9.397 1.369 -0.791 1.00 0.07 N ATOM 176 C4 DC A 6 9.402 0.684 0.360 1.00 0.09 C ATOM 177 N4 DC A 6 9.221 1.335 1.509 1.00 0.10 N ATOM 178 C5 DC A 6 9.597 -0.732 0.373 1.00 0.15 C ATOM 179 C6 DC A 6 9.779 -1.350 -0.811 1.00 0.14 C ATOM 0 H5' DC A 6 8.174 -5.022 -3.760 1.00 0.13 H new ATOM 0 H5'' DC A 6 9.804 -5.629 -3.974 1.00 0.13 H new ATOM 0 H4' DC A 6 9.332 -3.520 -5.190 1.00 0.13 H new ATOM 0 H3' DC A 6 11.628 -4.053 -3.461 1.00 0.10 H new ATOM 0 H2' DC A 6 11.799 -2.002 -2.442 1.00 0.08 H new ATOM 0 H2'' DC A 6 11.967 -1.285 -4.032 1.00 0.08 H new ATOM 0 H1' DC A 6 9.792 -0.535 -4.045 1.00 0.09 H new ATOM 0 H41 DC A 6 9.223 0.823 2.391 1.00 0.10 H new ATOM 0 H42 DC A 6 9.080 2.345 1.506 1.00 0.10 H new ATOM 0 H5 DC A 6 9.598 -1.287 1.299 1.00 0.15 H new ATOM 0 H6 DC A 6 9.936 -2.418 -0.838 1.00 0.14 H new ATOM 191 P DG A 7 11.275 -2.329 -6.526 1.00 0.18 P ATOM 192 OP1 DG A 7 12.339 -2.279 -7.554 1.00 0.25 O ATOM 193 OP2 DG A 7 10.784 -1.075 -5.911 1.00 0.15 O ATOM 194 O5' DG A 7 10.011 -3.113 -7.147 1.00 0.21 O ATOM 195 C5' DG A 7 8.886 -2.388 -7.661 1.00 0.15 C ATOM 196 C4' DG A 7 7.720 -3.299 -8.021 1.00 0.13 C ATOM 197 O4' DG A 7 7.288 -4.052 -6.862 1.00 0.22 O ATOM 198 C3' DG A 7 6.527 -2.483 -8.511 1.00 0.12 C ATOM 199 O3' DG A 7 5.941 -3.074 -9.678 1.00 0.13 O ATOM 200 C2' DG A 7 5.558 -2.507 -7.372 1.00 0.11 C ATOM 201 C1' DG A 7 5.915 -3.728 -6.554 1.00 0.16 C ATOM 202 N9 DG A 7 5.734 -3.489 -5.114 1.00 0.14 N ATOM 203 C8 DG A 7 5.189 -4.294 -4.175 1.00 0.13 C ATOM 204 N7 DG A 7 5.153 -3.857 -2.963 1.00 0.11 N ATOM 205 C5 DG A 7 5.746 -2.600 -3.093 1.00 0.12 C ATOM 206 C6 DG A 7 6.004 -1.610 -2.108 1.00 0.12 C ATOM 207 O6 DG A 7 5.760 -1.650 -0.904 1.00 0.12 O ATOM 208 N1 DG A 7 6.614 -0.489 -2.661 1.00 0.14 N ATOM 209 C2 DG A 7 6.936 -0.340 -3.998 1.00 0.17 C ATOM 210 N2 DG A 7 7.510 0.809 -4.348 1.00 0.23 N ATOM 211 N3 DG A 7 6.696 -1.270 -4.927 1.00 0.17 N ATOM 212 C4 DG A 7 6.104 -2.366 -4.410 1.00 0.14 C ATOM 0 H5' DG A 7 9.192 -1.828 -8.545 1.00 0.15 H new ATOM 0 H5'' DG A 7 8.558 -1.659 -6.920 1.00 0.15 H new ATOM 0 H4' DG A 7 8.065 -3.972 -8.806 1.00 0.13 H new ATOM 0 H3' DG A 7 6.816 -1.471 -8.793 1.00 0.12 H new ATOM 0 H2' DG A 7 5.635 -1.599 -6.774 1.00 0.11 H new ATOM 0 H2'' DG A 7 4.531 -2.565 -7.733 1.00 0.11 H new ATOM 0 H1' DG A 7 5.255 -4.559 -6.805 1.00 0.16 H new ATOM 0 H8 DG A 7 4.798 -5.268 -4.431 1.00 0.13 H new ATOM 0 H1 DG A 7 6.841 0.282 -2.033 1.00 0.14 H new ATOM 0 H21 DG A 7 7.769 0.974 -5.321 1.00 0.23 H new ATOM 0 H22 DG A 7 7.690 1.524 -3.644 1.00 0.23 H new ATOM 224 P DG A 8 5.626 -4.656 -9.734 1.00 0.18 P ATOM 225 OP1 DG A 8 6.901 -5.386 -9.558 1.00 0.26 O ATOM 226 OP2 DG A 8 4.788 -4.917 -10.926 1.00 0.19 O ATOM 227 O5' DG A 8 4.721 -4.902 -8.421 1.00 0.25 O ATOM 228 C5' DG A 8 3.288 -4.880 -8.495 1.00 0.22 C ATOM 229 C4' DG A 8 2.638 -5.945 -7.621 1.00 0.18 C ATOM 230 O4' DG A 8 3.030 -5.814 -6.232 1.00 0.19 O ATOM 231 C3' DG A 8 1.118 -5.844 -7.678 1.00 0.16 C ATOM 232 O3' DG A 8 0.553 -6.972 -8.357 1.00 0.18 O ATOM 233 C2' DG A 8 0.673 -5.795 -6.242 1.00 0.15 C ATOM 234 C1' DG A 8 1.890 -6.110 -5.405 1.00 0.16 C ATOM 235 N9 DG A 8 1.888 -5.326 -4.154 1.00 0.15 N ATOM 236 C8 DG A 8 1.493 -5.692 -2.908 1.00 0.16 C ATOM 237 N7 DG A 8 1.588 -4.812 -1.964 1.00 0.15 N ATOM 238 C5 DG A 8 2.109 -3.713 -2.658 1.00 0.12 C ATOM 239 C6 DG A 8 2.447 -2.415 -2.190 1.00 0.11 C ATOM 240 O6 DG A 8 2.352 -1.968 -1.049 1.00 0.09 O ATOM 241 N1 DG A 8 2.938 -1.615 -3.214 1.00 0.12 N ATOM 242 C2 DG A 8 3.088 -2.010 -4.529 1.00 0.10 C ATOM 243 N2 DG A 8 3.574 -1.099 -5.370 1.00 0.15 N ATOM 244 N3 DG A 8 2.773 -3.226 -4.978 1.00 0.12 N ATOM 245 C4 DG A 8 2.293 -4.024 -3.999 1.00 0.13 C ATOM 0 H5' DG A 8 2.979 -5.027 -9.530 1.00 0.22 H new ATOM 0 H5'' DG A 8 2.928 -3.897 -8.192 1.00 0.22 H new ATOM 0 H4' DG A 8 2.975 -6.906 -8.011 1.00 0.18 H new ATOM 0 H3' DG A 8 0.789 -4.965 -8.233 1.00 0.16 H new ATOM 0 H2' DG A 8 0.275 -4.812 -5.993 1.00 0.15 H new ATOM 0 H2'' DG A 8 -0.122 -6.517 -6.057 1.00 0.15 H new ATOM 0 H1' DG A 8 1.907 -7.155 -5.094 1.00 0.16 H new ATOM 0 H8 DG A 8 1.113 -6.683 -2.711 1.00 0.16 H new ATOM 0 H1 DG A 8 3.209 -0.661 -2.976 1.00 0.12 H new ATOM 0 H21 DG A 8 3.707 -1.333 -6.354 1.00 0.15 H new ATOM 0 H22 DG A 8 3.813 -0.168 -5.030 1.00 0.15 H new ATOM 257 P DG A 9 0.696 -8.453 -7.745 1.00 0.18 P ATOM 258 OP1 DG A 9 2.035 -8.572 -7.125 1.00 0.20 O ATOM 259 OP2 DG A 9 0.272 -9.424 -8.779 1.00 0.36 O ATOM 260 O5' DG A 9 -0.406 -8.455 -6.570 1.00 0.24 O ATOM 261 C5' DG A 9 -0.551 -9.598 -5.718 1.00 0.18 C ATOM 262 C4' DG A 9 -1.628 -9.407 -4.660 1.00 0.08 C ATOM 263 O4' DG A 9 -1.345 -8.259 -3.832 1.00 0.10 O ATOM 264 C3' DG A 9 -3.003 -9.194 -5.289 1.00 0.07 C ATOM 265 O3' DG A 9 -3.832 -10.349 -5.110 1.00 0.17 O ATOM 266 C2' DG A 9 -3.584 -7.998 -4.580 1.00 0.11 C ATOM 267 C1' DG A 9 -2.577 -7.578 -3.528 1.00 0.09 C ATOM 268 N9 DG A 9 -2.391 -6.113 -3.503 1.00 0.10 N ATOM 269 C8 DG A 9 -2.191 -5.237 -4.520 1.00 0.12 C ATOM 270 N7 DG A 9 -2.027 -3.990 -4.214 1.00 0.14 N ATOM 271 C5 DG A 9 -2.133 -4.026 -2.820 1.00 0.11 C ATOM 272 C6 DG A 9 -2.046 -2.971 -1.871 1.00 0.10 C ATOM 273 O6 DG A 9 -1.850 -1.775 -2.077 1.00 0.13 O ATOM 274 N1 DG A 9 -2.212 -3.437 -0.572 1.00 0.08 N ATOM 275 C2 DG A 9 -2.434 -4.755 -0.224 1.00 0.07 C ATOM 276 N2 DG A 9 -2.580 -5.008 1.076 1.00 0.11 N ATOM 277 N3 DG A 9 -2.514 -5.751 -1.109 1.00 0.06 N ATOM 278 C4 DG A 9 -2.357 -5.322 -2.379 1.00 0.10 C ATOM 0 H5' DG A 9 0.401 -9.805 -5.229 1.00 0.18 H new ATOM 0 H5'' DG A 9 -0.794 -10.470 -6.325 1.00 0.18 H new ATOM 0 H4' DG A 9 -1.632 -10.317 -4.060 1.00 0.08 H new ATOM 0 H3' DG A 9 -2.935 -9.032 -6.365 1.00 0.07 H new ATOM 0 H2' DG A 9 -3.770 -7.186 -5.282 1.00 0.11 H new ATOM 0 H2'' DG A 9 -4.540 -8.248 -4.121 1.00 0.11 H new ATOM 0 H1' DG A 9 -2.932 -7.849 -2.534 1.00 0.09 H new ATOM 0 H8 DG A 9 -2.169 -5.568 -5.548 1.00 0.12 H new ATOM 0 H1 DG A 9 -2.166 -2.752 0.183 1.00 0.08 H new ATOM 0 H21 DG A 9 -2.746 -5.963 1.394 1.00 0.11 H new ATOM 0 H22 DG A 9 -2.525 -4.247 1.753 1.00 0.11 H new ATOM 290 P DA A 10 -5.375 -10.331 -5.569 1.00 0.19 P ATOM 291 OP1 DA A 10 -5.887 -11.720 -5.529 1.00 0.22 O ATOM 292 OP2 DA A 10 -5.479 -9.543 -6.818 1.00 0.22 O ATOM 293 O5' DA A 10 -6.085 -9.499 -4.388 1.00 0.18 O ATOM 294 C5' DA A 10 -6.165 -10.040 -3.066 1.00 0.17 C ATOM 295 C4' DA A 10 -6.705 -9.016 -2.069 1.00 0.16 C ATOM 296 O4' DA A 10 -5.875 -7.830 -2.052 1.00 0.14 O ATOM 297 C3' DA A 10 -8.129 -8.591 -2.427 1.00 0.12 C ATOM 298 O3' DA A 10 -9.034 -8.898 -1.360 1.00 0.14 O ATOM 299 C2' DA A 10 -8.055 -7.105 -2.653 1.00 0.14 C ATOM 300 C1' DA A 10 -6.703 -6.654 -2.147 1.00 0.13 C ATOM 301 N9 DA A 10 -6.102 -5.643 -3.042 1.00 0.10 N ATOM 302 C8 DA A 10 -5.809 -5.710 -4.366 1.00 0.10 C ATOM 303 N7 DA A 10 -5.291 -4.664 -4.917 1.00 0.11 N ATOM 304 C5 DA A 10 -5.224 -3.779 -3.836 1.00 0.14 C ATOM 305 C6 DA A 10 -4.768 -2.462 -3.717 1.00 0.19 C ATOM 306 N6 DA A 10 -4.270 -1.768 -4.740 1.00 0.19 N ATOM 307 N1 DA A 10 -4.846 -1.887 -2.504 1.00 0.21 N ATOM 308 C2 DA A 10 -5.342 -2.565 -1.467 1.00 0.20 C ATOM 309 N3 DA A 10 -5.802 -3.812 -1.468 1.00 0.16 N ATOM 310 C4 DA A 10 -5.715 -4.367 -2.693 1.00 0.12 C ATOM 0 H5' DA A 10 -5.177 -10.372 -2.748 1.00 0.17 H new ATOM 0 H5'' DA A 10 -6.810 -10.919 -3.071 1.00 0.17 H new ATOM 0 H4' DA A 10 -6.700 -9.494 -1.089 1.00 0.16 H new ATOM 0 H3' DA A 10 -8.499 -9.117 -3.307 1.00 0.12 H new ATOM 0 H2' DA A 10 -8.171 -6.868 -3.711 1.00 0.14 H new ATOM 0 H2'' DA A 10 -8.857 -6.593 -2.122 1.00 0.14 H new ATOM 0 H1' DA A 10 -6.800 -6.175 -1.173 1.00 0.13 H new ATOM 0 H8 DA A 10 -6.002 -6.606 -4.937 1.00 0.10 H new ATOM 0 H61 DA A 10 -3.951 -0.809 -4.599 1.00 0.19 H new ATOM 0 H62 DA A 10 -4.208 -2.195 -5.664 1.00 0.19 H new ATOM 0 H2 DA A 10 -5.373 -2.043 -0.522 1.00 0.20 H new ATOM 322 P DG A 11 -8.855 -8.218 0.090 1.00 0.15 P ATOM 323 OP1 DG A 11 -7.407 -8.099 0.370 1.00 0.18 O ATOM 324 OP2 DG A 11 -9.734 -8.928 1.044 1.00 0.21 O ATOM 325 O5' DG A 11 -9.448 -6.739 -0.136 1.00 0.12 O ATOM 326 C5' DG A 11 -10.853 -6.540 -0.349 1.00 0.14 C ATOM 327 C4' DG A 11 -11.326 -5.178 0.138 1.00 0.12 C ATOM 328 O4' DG A 11 -12.739 -5.007 -0.118 1.00 0.20 O ATOM 329 C3' DG A 11 -11.090 -5.019 1.636 1.00 0.11 C ATOM 330 O3' DG A 11 -10.228 -3.906 1.899 1.00 0.12 O ATOM 331 C2' DG A 11 -12.448 -4.797 2.242 1.00 0.12 C ATOM 332 C1' DG A 11 -13.435 -4.670 1.099 1.00 0.17 C ATOM 333 N9 DG A 11 -14.594 -5.558 1.303 1.00 0.19 N ATOM 334 C8 DG A 11 -14.667 -6.911 1.255 1.00 0.19 C ATOM 335 N7 DG A 11 -15.818 -7.458 1.469 1.00 0.28 N ATOM 336 C5 DG A 11 -16.627 -6.338 1.691 1.00 0.28 C ATOM 337 C6 DG A 11 -18.015 -6.264 1.984 1.00 0.40 C ATOM 338 O6 DG A 11 -18.819 -7.186 2.109 1.00 0.50 O ATOM 339 N1 DG A 11 -18.434 -4.948 2.134 1.00 0.41 N ATOM 340 C2 DG A 11 -17.623 -3.837 2.018 1.00 0.34 C ATOM 341 N2 DG A 11 -18.213 -2.654 2.196 1.00 0.38 N ATOM 342 N3 DG A 11 -16.316 -3.898 1.742 1.00 0.25 N ATOM 343 C4 DG A 11 -15.885 -5.172 1.591 1.00 0.22 C ATOM 0 H5' DG A 11 -11.410 -7.321 0.168 1.00 0.14 H new ATOM 0 H5'' DG A 11 -11.074 -6.640 -1.412 1.00 0.14 H new ATOM 0 H4' DG A 11 -10.754 -4.426 -0.405 1.00 0.12 H new ATOM 0 H3' DG A 11 -10.602 -5.897 2.059 1.00 0.11 H new ATOM 0 H2' DG A 11 -12.719 -5.628 2.893 1.00 0.12 H new ATOM 0 H2'' DG A 11 -12.453 -3.896 2.856 1.00 0.12 H new ATOM 0 H1' DG A 11 -13.820 -3.652 1.045 1.00 0.17 H new ATOM 0 H8 DG A 11 -13.794 -7.511 1.045 1.00 0.19 H new ATOM 0 H1 DG A 11 -19.419 -4.790 2.347 1.00 0.41 H new ATOM 0 H21 DG A 11 -17.667 -1.796 2.123 1.00 0.38 H new ATOM 0 H22 DG A 11 -19.210 -2.608 2.405 1.00 0.38 H new ATOM 355 P DG A 12 -10.664 -2.414 1.478 1.00 0.10 P ATOM 356 OP1 DG A 12 -12.001 -2.142 2.049 1.00 0.18 O ATOM 357 OP2 DG A 12 -10.436 -2.258 0.023 1.00 0.11 O ATOM 358 O5' DG A 12 -9.588 -1.504 2.257 1.00 0.15 O ATOM 359 C5' DG A 12 -9.358 -1.694 3.659 1.00 0.18 C ATOM 360 C4' DG A 12 -10.278 -0.842 4.522 1.00 0.12 C ATOM 361 O4' DG A 12 -10.027 -1.089 5.923 1.00 0.21 O ATOM 362 C3' DG A 12 -10.065 0.645 4.254 1.00 0.08 C ATOM 363 O3' DG A 12 -11.297 1.272 3.879 1.00 0.19 O ATOM 364 C2' DG A 12 -9.540 1.221 5.540 1.00 0.12 C ATOM 365 C1' DG A 12 -9.530 0.104 6.567 1.00 0.13 C ATOM 366 N9 DG A 12 -8.166 -0.121 7.092 1.00 0.06 N ATOM 367 C8 DG A 12 -6.983 -0.264 6.431 1.00 0.14 C ATOM 368 N7 DG A 12 -5.923 -0.460 7.140 1.00 0.19 N ATOM 369 C5 DG A 12 -6.440 -0.450 8.439 1.00 0.09 C ATOM 370 C6 DG A 12 -5.775 -0.615 9.683 1.00 0.11 C ATOM 371 O6 DG A 12 -4.578 -0.805 9.888 1.00 0.22 O ATOM 372 N1 DG A 12 -6.661 -0.538 10.750 1.00 0.06 N ATOM 373 C2 DG A 12 -8.021 -0.329 10.640 1.00 0.12 C ATOM 374 N2 DG A 12 -8.706 -0.286 11.783 1.00 0.17 N ATOM 375 N3 DG A 12 -8.655 -0.172 9.473 1.00 0.13 N ATOM 376 C4 DG A 12 -7.811 -0.243 8.419 1.00 0.05 C ATOM 0 H5' DG A 12 -8.321 -1.451 3.890 1.00 0.18 H new ATOM 0 H5'' DG A 12 -9.502 -2.745 3.908 1.00 0.18 H new ATOM 0 H4' DG A 12 -11.303 -1.114 4.268 1.00 0.12 H new ATOM 0 H3' DG A 12 -9.369 0.809 3.431 1.00 0.08 H new ATOM 0 H2' DG A 12 -8.536 1.622 5.399 1.00 0.12 H new ATOM 0 H2'' DG A 12 -10.169 2.046 5.876 1.00 0.12 H new ATOM 0 H1' DG A 12 -10.161 0.371 7.415 1.00 0.13 H new ATOM 0 H8 DG A 12 -6.934 -0.215 5.353 1.00 0.14 H new ATOM 0 H1 DG A 12 -6.276 -0.644 11.689 1.00 0.06 H new ATOM 0 H21 DG A 12 -9.715 -0.134 11.768 1.00 0.17 H new ATOM 0 H22 DG A 12 -8.221 -0.405 12.673 1.00 0.17 H new ATOM 388 P DA A 13 -12.558 1.264 4.882 1.00 0.11 P ATOM 389 OP1 DA A 13 -12.245 0.359 6.010 1.00 0.17 O ATOM 390 OP2 DA A 13 -13.784 1.050 4.082 1.00 0.21 O ATOM 391 O5' DA A 13 -12.575 2.776 5.439 1.00 0.08 O ATOM 392 C5' DA A 13 -13.282 3.805 4.737 1.00 0.04 C ATOM 393 C4' DA A 13 -12.375 4.986 4.404 1.00 0.06 C ATOM 394 O4' DA A 13 -11.839 5.575 5.611 1.00 0.05 O ATOM 395 C3' DA A 13 -11.210 4.539 3.531 1.00 0.08 C ATOM 396 O3' DA A 13 -11.230 5.218 2.271 1.00 0.12 O ATOM 397 C2' DA A 13 -9.965 4.869 4.305 1.00 0.11 C ATOM 398 C1' DA A 13 -10.401 5.457 5.632 1.00 0.08 C ATOM 399 N9 DA A 13 -9.967 4.601 6.750 1.00 0.05 N ATOM 400 C8 DA A 13 -8.718 4.218 7.111 1.00 0.09 C ATOM 401 N7 DA A 13 -8.604 3.446 8.139 1.00 0.12 N ATOM 402 C5 DA A 13 -9.941 3.286 8.520 1.00 0.08 C ATOM 403 C6 DA A 13 -10.553 2.574 9.557 1.00 0.12 C ATOM 404 N6 DA A 13 -9.871 1.853 10.449 1.00 0.15 N ATOM 405 N1 DA A 13 -11.894 2.634 9.643 1.00 0.16 N ATOM 406 C2 DA A 13 -12.595 3.351 8.763 1.00 0.19 C ATOM 407 N3 DA A 13 -12.119 4.062 7.745 1.00 0.16 N ATOM 408 C4 DA A 13 -10.775 3.986 7.680 1.00 0.08 C ATOM 0 H5' DA A 13 -14.120 4.149 5.343 1.00 0.04 H new ATOM 0 H5'' DA A 13 -13.700 3.397 3.817 1.00 0.04 H new ATOM 0 H4' DA A 13 -12.977 5.721 3.870 1.00 0.06 H new ATOM 0 H3' DA A 13 -11.263 3.474 3.306 1.00 0.08 H new ATOM 0 H2' DA A 13 -9.361 3.975 4.461 1.00 0.11 H new ATOM 0 H2'' DA A 13 -9.347 5.579 3.755 1.00 0.11 H new ATOM 0 H1' DA A 13 -9.944 6.436 5.777 1.00 0.08 H new ATOM 0 H8 DA A 13 -7.850 4.547 6.559 1.00 0.09 H new ATOM 0 H61 DA A 13 -10.367 1.352 11.186 1.00 0.15 H new ATOM 0 H62 DA A 13 -8.854 1.803 10.393 1.00 0.15 H new ATOM 0 H2 DA A 13 -13.667 3.354 8.892 1.00 0.19 H new ATOM 420 P DA A 14 -11.150 6.827 2.201 1.00 0.11 P ATOM 421 OP1 DA A 14 -11.385 7.360 3.561 1.00 0.10 O ATOM 422 OP2 DA A 14 -11.992 7.284 1.073 1.00 0.19 O ATOM 423 O5' DA A 14 -9.607 7.084 1.818 1.00 0.14 O ATOM 424 C5' DA A 14 -9.113 6.739 0.519 1.00 0.17 C ATOM 425 C4' DA A 14 -7.850 5.890 0.606 1.00 0.18 C ATOM 426 O4' DA A 14 -8.106 4.683 1.358 1.00 0.16 O ATOM 427 C3' DA A 14 -7.372 5.481 -0.783 1.00 0.22 C ATOM 428 O3' DA A 14 -5.969 5.722 -0.930 1.00 0.22 O ATOM 429 C2' DA A 14 -7.679 4.015 -0.897 1.00 0.30 C ATOM 430 C1' DA A 14 -8.067 3.531 0.486 1.00 0.24 C ATOM 431 N9 DA A 14 -9.376 2.851 0.456 1.00 0.21 N ATOM 432 C8 DA A 14 -9.695 1.577 0.789 1.00 0.22 C ATOM 433 N7 DA A 14 -10.930 1.220 0.669 1.00 0.23 N ATOM 434 C5 DA A 14 -11.519 2.397 0.197 1.00 0.22 C ATOM 435 C6 DA A 14 -12.833 2.726 -0.150 1.00 0.24 C ATOM 436 N6 DA A 14 -13.846 1.862 -0.072 1.00 0.28 N ATOM 437 N1 DA A 14 -13.066 3.979 -0.579 1.00 0.23 N ATOM 438 C2 DA A 14 -12.067 4.859 -0.664 1.00 0.22 C ATOM 439 N3 DA A 14 -10.788 4.655 -0.363 1.00 0.23 N ATOM 440 C4 DA A 14 -10.579 3.394 0.065 1.00 0.21 C ATOM 0 H5' DA A 14 -8.903 7.648 -0.044 1.00 0.17 H new ATOM 0 H5'' DA A 14 -9.881 6.194 -0.030 1.00 0.17 H new ATOM 0 H4' DA A 14 -7.087 6.492 1.099 1.00 0.18 H new ATOM 0 H3' DA A 14 -7.866 6.057 -1.565 1.00 0.22 H new ATOM 0 H2' DA A 14 -8.490 3.845 -1.606 1.00 0.30 H new ATOM 0 H2'' DA A 14 -6.812 3.468 -1.267 1.00 0.30 H new ATOM 0 H1' DA A 14 -7.339 2.806 0.850 1.00 0.24 H new ATOM 0 H8 DA A 14 -8.944 0.886 1.142 1.00 0.22 H new ATOM 0 H61 DA A 14 -14.787 2.154 -0.338 1.00 0.28 H new ATOM 0 H62 DA A 14 -13.680 0.910 0.253 1.00 0.28 H new ATOM 0 H2 DA A 14 -12.326 5.847 -1.016 1.00 0.22 H new ATOM 452 P DT A 15 -5.431 7.165 -1.399 1.00 0.20 P ATOM 453 OP1 DT A 15 -5.620 8.115 -0.280 1.00 0.30 O ATOM 454 OP2 DT A 15 -6.008 7.466 -2.728 1.00 0.26 O ATOM 455 O5' DT A 15 -3.851 6.913 -1.582 1.00 0.15 O ATOM 456 C5' DT A 15 -3.194 7.256 -2.807 1.00 0.16 C ATOM 457 C4' DT A 15 -3.062 6.048 -3.735 1.00 0.07 C ATOM 458 O4' DT A 15 -2.650 4.878 -2.993 1.00 0.12 O ATOM 459 C3' DT A 15 -4.383 5.730 -4.431 1.00 0.15 C ATOM 460 O3' DT A 15 -4.270 5.901 -5.849 1.00 0.18 O ATOM 461 C2' DT A 15 -4.688 4.298 -4.085 1.00 0.21 C ATOM 462 C1' DT A 15 -3.497 3.757 -3.322 1.00 0.14 C ATOM 463 N1 DT A 15 -3.938 3.052 -2.105 1.00 0.17 N ATOM 464 C2 DT A 15 -4.122 1.684 -2.187 1.00 0.16 C ATOM 465 O2 DT A 15 -3.906 1.056 -3.221 1.00 0.17 O ATOM 466 N3 DT A 15 -4.565 1.062 -1.037 1.00 0.17 N ATOM 467 C4 DT A 15 -4.838 1.681 0.171 1.00 0.18 C ATOM 468 O4 DT A 15 -5.231 1.029 1.137 1.00 0.20 O ATOM 469 C5 DT A 15 -4.616 3.110 0.161 1.00 0.23 C ATOM 470 C7 DT A 15 -4.899 3.928 1.417 1.00 0.24 C ATOM 471 C6 DT A 15 -4.182 3.738 -0.949 1.00 0.23 C ATOM 0 H5' DT A 15 -2.204 7.658 -2.589 1.00 0.16 H new ATOM 0 H5'' DT A 15 -3.753 8.044 -3.312 1.00 0.16 H new ATOM 0 H4' DT A 15 -2.312 6.304 -4.483 1.00 0.07 H new ATOM 0 H3' DT A 15 -5.179 6.400 -4.105 1.00 0.15 H new ATOM 0 H2' DT A 15 -5.593 4.233 -3.481 1.00 0.21 H new ATOM 0 H2'' DT A 15 -4.864 3.713 -4.988 1.00 0.21 H new ATOM 0 H1' DT A 15 -2.948 3.035 -3.927 1.00 0.14 H new ATOM 0 H3 DT A 15 -4.704 0.053 -1.081 1.00 0.17 H new ATOM 0 H71 DT A 15 -5.701 3.457 1.985 1.00 0.24 H new ATOM 0 H72 DT A 15 -3.999 3.975 2.031 1.00 0.24 H new ATOM 0 H73 DT A 15 -5.199 4.937 1.134 1.00 0.24 H new ATOM 0 H6 DT A 15 -4.024 4.806 -0.925 1.00 0.23 H new ATOM 484 P DT A 16 -3.305 4.949 -6.719 1.00 0.19 P ATOM 485 OP1 DT A 16 -2.118 4.617 -5.897 1.00 0.22 O ATOM 486 OP2 DT A 16 -3.128 5.563 -8.054 1.00 0.22 O ATOM 487 O5' DT A 16 -4.188 3.612 -6.892 1.00 0.23 O ATOM 488 C5' DT A 16 -3.566 2.323 -6.865 1.00 0.18 C ATOM 489 C4' DT A 16 -4.304 1.316 -7.746 1.00 0.18 C ATOM 490 O4' DT A 16 -5.659 1.116 -7.275 1.00 0.17 O ATOM 491 C3' DT A 16 -4.368 1.794 -9.191 1.00 0.23 C ATOM 492 O3' DT A 16 -3.763 0.835 -10.065 1.00 0.15 O ATOM 493 C2' DT A 16 -5.830 1.957 -9.506 1.00 0.31 C ATOM 494 C1' DT A 16 -6.612 1.430 -8.317 1.00 0.25 C ATOM 495 N1 DT A 16 -7.593 2.431 -7.845 1.00 0.20 N ATOM 496 C2 DT A 16 -8.926 2.216 -8.148 1.00 0.14 C ATOM 497 O2 DT A 16 -9.300 1.239 -8.792 1.00 0.15 O ATOM 498 N3 DT A 16 -9.816 3.166 -7.682 1.00 0.10 N ATOM 499 C4 DT A 16 -9.493 4.295 -6.950 1.00 0.09 C ATOM 500 O4 DT A 16 -10.369 5.076 -6.584 1.00 0.19 O ATOM 501 C5 DT A 16 -8.080 4.437 -6.683 1.00 0.12 C ATOM 502 C7 DT A 16 -7.584 5.636 -5.877 1.00 0.15 C ATOM 503 C6 DT A 16 -7.192 3.525 -7.128 1.00 0.17 C ATOM 0 H5' DT A 16 -3.537 1.955 -5.839 1.00 0.18 H new ATOM 0 H5'' DT A 16 -2.533 2.411 -7.201 1.00 0.18 H new ATOM 0 H4' DT A 16 -3.749 0.379 -7.693 1.00 0.18 H new ATOM 0 H3' DT A 16 -3.826 2.730 -9.329 1.00 0.23 H new ATOM 0 H2' DT A 16 -6.069 3.005 -9.688 1.00 0.31 H new ATOM 0 H2'' DT A 16 -6.091 1.408 -10.411 1.00 0.31 H new ATOM 0 H1' DT A 16 -7.175 0.540 -8.599 1.00 0.25 H new ATOM 0 H3 DT A 16 -10.802 3.021 -7.898 1.00 0.10 H new ATOM 0 H71 DT A 16 -8.247 6.485 -6.043 1.00 0.15 H new ATOM 0 H72 DT A 16 -7.576 5.383 -4.817 1.00 0.15 H new ATOM 0 H73 DT A 16 -6.575 5.896 -6.196 1.00 0.15 H new ATOM 0 H6 DT A 16 -6.142 3.661 -6.914 1.00 0.17 H new ATOM 516 P DG A 17 -2.775 1.310 -11.244 1.00 0.13 P ATOM 517 OP1 DG A 17 -3.443 2.391 -12.002 1.00 0.25 O ATOM 518 OP2 DG A 17 -2.285 0.106 -11.951 1.00 0.19 O ATOM 519 O5' DG A 17 -1.542 1.954 -10.431 1.00 0.10 O ATOM 520 C5' DG A 17 -0.503 1.120 -9.895 1.00 0.12 C ATOM 521 C4' DG A 17 0.798 1.879 -9.705 1.00 0.12 C ATOM 522 O4' DG A 17 0.633 2.881 -8.676 1.00 0.15 O ATOM 523 C3' DG A 17 1.936 0.954 -9.268 1.00 0.13 C ATOM 524 O3' DG A 17 3.138 1.276 -10.001 1.00 0.13 O ATOM 525 C2' DG A 17 2.082 1.220 -7.803 1.00 0.14 C ATOM 526 C1' DG A 17 1.548 2.615 -7.596 1.00 0.14 C ATOM 527 N9 DG A 17 0.901 2.777 -6.285 1.00 0.16 N ATOM 528 C8 DG A 17 0.820 3.892 -5.539 1.00 0.31 C ATOM 529 N7 DG A 17 0.251 3.807 -4.387 1.00 0.34 N ATOM 530 C5 DG A 17 -0.104 2.456 -4.345 1.00 0.19 C ATOM 531 C6 DG A 17 -0.769 1.723 -3.327 1.00 0.14 C ATOM 532 O6 DG A 17 -1.168 2.130 -2.237 1.00 0.23 O ATOM 533 N1 DG A 17 -0.935 0.388 -3.682 1.00 0.14 N ATOM 534 C2 DG A 17 -0.512 -0.176 -4.872 1.00 0.24 C ATOM 535 N2 DG A 17 -0.771 -1.476 -5.036 1.00 0.42 N ATOM 536 N3 DG A 17 0.117 0.510 -5.836 1.00 0.20 N ATOM 537 C4 DG A 17 0.288 1.814 -5.509 1.00 0.12 C ATOM 0 H5' DG A 17 -0.335 0.276 -10.564 1.00 0.12 H new ATOM 0 H5'' DG A 17 -0.826 0.709 -8.938 1.00 0.12 H new ATOM 0 H4' DG A 17 1.048 2.332 -10.665 1.00 0.12 H new ATOM 0 H3' DG A 17 1.741 -0.100 -9.463 1.00 0.13 H new ATOM 0 H2' DG A 17 1.523 0.493 -7.214 1.00 0.14 H new ATOM 0 H2'' DG A 17 3.124 1.148 -7.492 1.00 0.14 H new ATOM 0 H1' DG A 17 2.369 3.332 -7.601 1.00 0.14 H new ATOM 0 H8 DG A 17 1.220 4.830 -5.895 1.00 0.31 H new ATOM 0 H1 DG A 17 -1.405 -0.222 -3.013 1.00 0.14 H new ATOM 0 H21 DG A 17 -0.484 -1.949 -5.893 1.00 0.42 H new ATOM 0 H22 DG A 17 -1.256 -1.996 -4.304 1.00 0.42 H new ATOM 549 P DG A 18 4.550 1.567 -9.269 1.00 0.12 P ATOM 550 OP1 DG A 18 5.553 1.886 -10.309 1.00 0.17 O ATOM 551 OP2 DG A 18 4.808 0.469 -8.310 1.00 0.17 O ATOM 552 O5' DG A 18 4.253 2.913 -8.425 1.00 0.16 O ATOM 553 C5' DG A 18 4.322 4.204 -9.055 1.00 0.11 C ATOM 554 C4' DG A 18 5.008 5.251 -8.188 1.00 0.10 C ATOM 555 O4' DG A 18 4.372 5.327 -6.893 1.00 0.11 O ATOM 556 C3' DG A 18 6.482 4.915 -7.971 1.00 0.09 C ATOM 557 O3' DG A 18 7.306 6.053 -8.264 1.00 0.12 O ATOM 558 C2' DG A 18 6.593 4.528 -6.524 1.00 0.10 C ATOM 559 C1' DG A 18 5.281 4.890 -5.862 1.00 0.11 C ATOM 560 N9 DG A 18 4.737 3.731 -5.142 1.00 0.14 N ATOM 561 C8 DG A 18 4.381 2.512 -5.613 1.00 0.18 C ATOM 562 N7 DG A 18 3.941 1.649 -4.760 1.00 0.22 N ATOM 563 C5 DG A 18 4.005 2.371 -3.564 1.00 0.21 C ATOM 564 C6 DG A 18 3.659 1.979 -2.243 1.00 0.25 C ATOM 565 O6 DG A 18 3.219 0.898 -1.859 1.00 0.34 O ATOM 566 N1 DG A 18 3.877 3.007 -1.334 1.00 0.25 N ATOM 567 C2 DG A 18 4.368 4.258 -1.652 1.00 0.21 C ATOM 568 N2 DG A 18 4.508 5.113 -0.642 1.00 0.24 N ATOM 569 N3 DG A 18 4.697 4.633 -2.891 1.00 0.17 N ATOM 570 C4 DG A 18 4.492 3.647 -3.793 1.00 0.16 C ATOM 0 H5' DG A 18 3.313 4.541 -9.293 1.00 0.11 H new ATOM 0 H5'' DG A 18 4.859 4.114 -9.999 1.00 0.11 H new ATOM 0 H4' DG A 18 4.925 6.204 -8.711 1.00 0.10 H new ATOM 0 H3' DG A 18 6.819 4.112 -8.627 1.00 0.09 H new ATOM 0 H2' DG A 18 6.792 3.461 -6.425 1.00 0.10 H new ATOM 0 H2'' DG A 18 7.422 5.052 -6.048 1.00 0.10 H new ATOM 0 H1' DG A 18 5.428 5.688 -5.134 1.00 0.11 H new ATOM 0 H8 DG A 18 4.462 2.271 -6.663 1.00 0.18 H new ATOM 0 H1 DG A 18 3.657 2.823 -0.355 1.00 0.25 H new ATOM 0 H21 DG A 18 4.866 6.052 -0.815 1.00 0.24 H new ATOM 0 H22 DG A 18 4.257 4.829 0.305 1.00 0.24 H new ATOM 582 P DG A 19 8.822 6.140 -7.720 1.00 0.18 P ATOM 583 OP1 DG A 19 9.456 7.343 -8.305 1.00 0.26 O ATOM 584 OP2 DG A 19 9.455 4.813 -7.894 1.00 0.25 O ATOM 585 O5' DG A 19 8.613 6.397 -6.141 1.00 0.17 O ATOM 586 C5' DG A 19 7.997 7.609 -5.681 1.00 0.17 C ATOM 587 C4' DG A 19 8.195 7.854 -4.197 1.00 0.15 C ATOM 588 O4' DG A 19 7.359 6.991 -3.394 1.00 0.11 O ATOM 589 C3' DG A 19 9.640 7.617 -3.795 1.00 0.18 C ATOM 590 O3' DG A 19 10.278 8.850 -3.432 1.00 0.20 O ATOM 591 C2' DG A 19 9.582 6.668 -2.627 1.00 0.16 C ATOM 592 C1' DG A 19 8.120 6.480 -2.282 1.00 0.11 C ATOM 593 N9 DG A 19 7.803 5.059 -2.035 1.00 0.11 N ATOM 594 C8 DG A 19 7.664 4.043 -2.920 1.00 0.15 C ATOM 595 N7 DG A 19 7.342 2.885 -2.455 1.00 0.19 N ATOM 596 C5 DG A 19 7.252 3.138 -1.086 1.00 0.15 C ATOM 597 C6 DG A 19 6.929 2.254 -0.020 1.00 0.15 C ATOM 598 O6 DG A 19 6.657 1.056 -0.083 1.00 0.25 O ATOM 599 N1 DG A 19 6.949 2.907 1.208 1.00 0.14 N ATOM 600 C2 DG A 19 7.244 4.246 1.389 1.00 0.17 C ATOM 601 N2 DG A 19 7.219 4.691 2.645 1.00 0.22 N ATOM 602 N3 DG A 19 7.548 5.084 0.389 1.00 0.18 N ATOM 603 C4 DG A 19 7.535 4.469 -0.816 1.00 0.13 C ATOM 0 H5' DG A 19 6.929 7.571 -5.897 1.00 0.17 H new ATOM 0 H5'' DG A 19 8.406 8.451 -6.239 1.00 0.17 H new ATOM 0 H4' DG A 19 7.919 8.893 -4.018 1.00 0.15 H new ATOM 0 H3' DG A 19 10.226 7.203 -4.616 1.00 0.18 H new ATOM 0 H2' DG A 19 10.044 5.714 -2.882 1.00 0.16 H new ATOM 0 H2'' DG A 19 10.131 7.070 -1.775 1.00 0.16 H new ATOM 0 H1' DG A 19 7.874 7.013 -1.364 1.00 0.11 H new ATOM 0 H8 DG A 19 7.818 4.198 -3.978 1.00 0.15 H new ATOM 0 H1 DG A 19 6.729 2.356 2.038 1.00 0.14 H new ATOM 0 H21 DG A 19 7.428 5.669 2.844 1.00 0.22 H new ATOM 0 H22 DG A 19 6.991 4.053 3.408 1.00 0.22 H new ATOM 615 P DC A 20 9.766 9.715 -2.169 1.00 0.15 P ATOM 616 OP1 DC A 20 10.689 10.858 -1.990 1.00 0.16 O ATOM 617 OP2 DC A 20 9.514 8.790 -1.042 1.00 0.15 O ATOM 618 O5' DC A 20 8.346 10.291 -2.672 1.00 0.22 O ATOM 619 C5' DC A 20 7.174 10.136 -1.866 1.00 0.17 C ATOM 620 C4' DC A 20 6.127 11.207 -2.170 1.00 0.16 C ATOM 621 O4' DC A 20 6.600 12.514 -1.778 1.00 0.17 O ATOM 622 C3' DC A 20 5.795 11.256 -3.660 1.00 0.11 C ATOM 623 O3' DC A 20 4.513 10.674 -3.943 1.00 0.13 O ATOM 624 C2' DC A 20 5.817 12.712 -4.028 1.00 0.15 C ATOM 625 C1' DC A 20 6.362 13.472 -2.834 1.00 0.13 C ATOM 626 N1 DC A 20 7.613 14.173 -3.190 1.00 0.08 N ATOM 627 C2 DC A 20 7.594 15.561 -3.210 1.00 0.25 C ATOM 628 O2 DC A 20 6.563 16.167 -2.933 1.00 0.40 O ATOM 629 N3 DC A 20 8.741 16.215 -3.541 1.00 0.28 N ATOM 630 C4 DC A 20 9.858 15.538 -3.840 1.00 0.15 C ATOM 631 N4 DC A 20 10.963 16.211 -4.162 1.00 0.19 N ATOM 632 C5 DC A 20 9.879 14.109 -3.820 1.00 0.12 C ATOM 633 C6 DC A 20 8.740 13.470 -3.491 1.00 0.13 C ATOM 0 H5' DC A 20 7.449 10.186 -0.812 1.00 0.17 H new ATOM 0 H5'' DC A 20 6.744 9.149 -2.037 1.00 0.17 H new ATOM 0 H4' DC A 20 5.235 10.942 -1.603 1.00 0.16 H new ATOM 0 H3' DC A 20 6.514 10.677 -4.240 1.00 0.11 H new ATOM 0 H2' DC A 20 6.442 12.877 -4.906 1.00 0.15 H new ATOM 0 H2'' DC A 20 4.815 13.060 -4.280 1.00 0.15 H new ATOM 0 H1' DC A 20 5.647 14.228 -2.508 1.00 0.13 H new ATOM 0 H41 DC A 20 11.819 15.706 -4.391 1.00 0.19 H new ATOM 0 H42 DC A 20 10.952 17.231 -4.179 1.00 0.19 H new ATOM 0 H5 DC A 20 10.778 13.560 -4.061 1.00 0.12 H new ATOM 0 H6 DC A 20 8.720 12.390 -3.466 1.00 0.13 H new ATOM 645 P DG A 21 3.207 11.067 -3.085 1.00 0.10 P ATOM 646 OP1 DG A 21 2.014 10.884 -3.943 1.00 0.08 O ATOM 647 OP2 DG A 21 3.454 12.370 -2.430 1.00 0.24 O ATOM 648 O5' DG A 21 3.194 9.924 -1.951 1.00 0.19 O ATOM 649 C5' DG A 21 1.994 9.611 -1.227 1.00 0.16 C ATOM 650 C4' DG A 21 2.158 9.815 0.273 1.00 0.13 C ATOM 651 O4' DG A 21 0.990 9.336 0.979 1.00 0.17 O ATOM 652 C3' DG A 21 3.376 9.059 0.795 1.00 0.09 C ATOM 653 O3' DG A 21 4.336 9.964 1.356 1.00 0.15 O ATOM 654 C2' DG A 21 2.852 8.107 1.835 1.00 0.11 C ATOM 655 C1' DG A 21 1.369 8.374 1.989 1.00 0.13 C ATOM 656 N9 DG A 21 0.603 7.121 1.842 1.00 0.15 N ATOM 657 C8 DG A 21 -0.054 6.390 2.778 1.00 0.18 C ATOM 658 N7 DG A 21 -0.610 5.291 2.395 1.00 0.19 N ATOM 659 C5 DG A 21 -0.297 5.271 1.032 1.00 0.15 C ATOM 660 C6 DG A 21 -0.625 4.310 0.038 1.00 0.15 C ATOM 661 O6 DG A 21 -1.263 3.267 0.167 1.00 0.20 O ATOM 662 N1 DG A 21 -0.120 4.669 -1.205 1.00 0.14 N ATOM 663 C2 DG A 21 0.613 5.813 -1.464 1.00 0.14 C ATOM 664 N2 DG A 21 1.005 5.993 -2.724 1.00 0.16 N ATOM 665 N3 DG A 21 0.926 6.719 -0.533 1.00 0.14 N ATOM 666 C4 DG A 21 0.444 6.390 0.686 1.00 0.14 C ATOM 0 H5' DG A 21 1.713 8.576 -1.423 1.00 0.16 H new ATOM 0 H5'' DG A 21 1.179 10.237 -1.590 1.00 0.16 H new ATOM 0 H4' DG A 21 2.288 10.883 0.445 1.00 0.13 H new ATOM 0 H3' DG A 21 3.891 8.526 -0.004 1.00 0.09 H new ATOM 0 H2' DG A 21 3.026 7.074 1.533 1.00 0.11 H new ATOM 0 H2'' DG A 21 3.369 8.253 2.784 1.00 0.11 H new ATOM 0 H1' DG A 21 1.151 8.770 2.981 1.00 0.13 H new ATOM 0 H8 DG A 21 -0.109 6.717 3.806 1.00 0.18 H new ATOM 0 H1 DG A 21 -0.304 4.041 -1.987 1.00 0.14 H new ATOM 0 H21 DG A 21 1.549 6.818 -2.976 1.00 0.16 H new ATOM 0 H22 DG A 21 0.762 5.305 -3.437 1.00 0.16 H new ATOM 678 P DG A 22 4.036 10.740 2.735 1.00 0.15 P ATOM 679 OP1 DG A 22 2.605 11.118 2.752 1.00 0.16 O ATOM 680 OP2 DG A 22 5.077 11.775 2.921 1.00 0.21 O ATOM 681 O5' DG A 22 4.268 9.588 3.837 1.00 0.14 O ATOM 682 C5' DG A 22 3.784 9.755 5.176 1.00 0.11 C ATOM 683 C4' DG A 22 4.001 8.516 6.035 1.00 0.11 C ATOM 684 O4' DG A 22 3.353 7.364 5.451 1.00 0.20 O ATOM 685 C3' DG A 22 5.487 8.190 6.184 1.00 0.11 C ATOM 686 O3' DG A 22 5.922 8.417 7.531 1.00 0.14 O ATOM 687 C2' DG A 22 5.618 6.737 5.808 1.00 0.17 C ATOM 688 C1' DG A 22 4.222 6.219 5.548 1.00 0.19 C ATOM 689 N9 DG A 22 4.179 5.405 4.319 1.00 0.19 N ATOM 690 C8 DG A 22 4.599 5.700 3.065 1.00 0.17 C ATOM 691 N7 DG A 22 4.463 4.790 2.160 1.00 0.14 N ATOM 692 C5 DG A 22 3.877 3.749 2.887 1.00 0.13 C ATOM 693 C6 DG A 22 3.473 2.453 2.461 1.00 0.11 C ATOM 694 O6 DG A 22 3.552 1.961 1.338 1.00 0.13 O ATOM 695 N1 DG A 22 2.930 1.719 3.510 1.00 0.13 N ATOM 696 C2 DG A 22 2.792 2.176 4.810 1.00 0.14 C ATOM 697 N2 DG A 22 2.241 1.337 5.683 1.00 0.17 N ATOM 698 N3 DG A 22 3.170 3.391 5.213 1.00 0.15 N ATOM 699 C4 DG A 22 3.702 4.120 4.210 1.00 0.16 C ATOM 0 H5' DG A 22 2.720 9.991 5.147 1.00 0.11 H new ATOM 0 H5'' DG A 22 4.287 10.605 5.637 1.00 0.11 H new ATOM 0 H4' DG A 22 3.573 8.737 7.013 1.00 0.11 H new ATOM 0 H3' DG A 22 6.108 8.823 5.551 1.00 0.11 H new ATOM 0 H2' DG A 22 6.243 6.623 4.922 1.00 0.17 H new ATOM 0 H2'' DG A 22 6.095 6.173 6.609 1.00 0.17 H new ATOM 0 H1' DG A 22 3.898 5.567 6.359 1.00 0.19 H new ATOM 0 H8 DG A 22 5.032 6.662 2.831 1.00 0.17 H new ATOM 0 H1 DG A 22 2.609 0.772 3.307 1.00 0.13 H new ATOM 0 H21 DG A 22 2.115 1.622 6.654 1.00 0.17 H new ATOM 0 H22 DG A 22 1.944 0.409 5.381 1.00 0.17 H new ATOM 711 P DG A 23 7.361 7.893 8.032 1.00 0.15 P ATOM 712 OP1 DG A 23 7.696 8.594 9.292 1.00 0.15 O ATOM 713 OP2 DG A 23 8.297 7.943 6.887 1.00 0.19 O ATOM 714 O5' DG A 23 7.068 6.346 8.377 1.00 0.18 O ATOM 715 C5' DG A 23 6.298 5.995 9.536 1.00 0.15 C ATOM 716 C4' DG A 23 6.273 4.492 9.789 1.00 0.14 C ATOM 717 O4' DG A 23 5.630 3.791 8.703 1.00 0.15 O ATOM 718 C3' DG A 23 7.687 3.931 9.928 1.00 0.16 C ATOM 719 O3' DG A 23 7.906 3.417 11.246 1.00 0.21 O ATOM 720 C2' DG A 23 7.791 2.842 8.902 1.00 0.22 C ATOM 721 C1' DG A 23 6.398 2.618 8.374 1.00 0.14 C ATOM 722 N9 DG A 23 6.415 2.376 6.919 1.00 0.12 N ATOM 723 C8 DG A 23 6.765 3.210 5.908 1.00 0.15 C ATOM 724 N7 DG A 23 6.702 2.748 4.705 1.00 0.14 N ATOM 725 C5 DG A 23 6.254 1.443 4.921 1.00 0.06 C ATOM 726 C6 DG A 23 5.983 0.411 3.983 1.00 0.11 C ATOM 727 O6 DG A 23 6.089 0.452 2.758 1.00 0.16 O ATOM 728 N1 DG A 23 5.552 -0.753 4.617 1.00 0.15 N ATOM 729 C2 DG A 23 5.401 -0.904 5.981 1.00 0.19 C ATOM 730 N2 DG A 23 4.976 -2.098 6.397 1.00 0.29 N ATOM 731 N3 DG A 23 5.654 0.064 6.868 1.00 0.16 N ATOM 732 C4 DG A 23 6.075 1.205 6.275 1.00 0.07 C ATOM 0 H5' DG A 23 5.277 6.356 9.413 1.00 0.15 H new ATOM 0 H5'' DG A 23 6.711 6.500 10.409 1.00 0.15 H new ATOM 0 H4' DG A 23 5.717 4.343 10.715 1.00 0.14 H new ATOM 0 H3' DG A 23 8.442 4.702 9.772 1.00 0.16 H new ATOM 0 H2' DG A 23 8.469 3.129 8.098 1.00 0.22 H new ATOM 0 H2'' DG A 23 8.190 1.929 9.344 1.00 0.22 H new ATOM 0 HO3' DG A 23 8.817 3.062 11.311 1.00 0.21 H new ATOM 0 H1' DG A 23 5.951 1.732 8.826 1.00 0.14 H new ATOM 0 H8 DG A 23 7.085 4.223 6.103 1.00 0.15 H new ATOM 0 H1 DG A 23 5.331 -1.556 4.028 1.00 0.15 H new ATOM 0 H21 DG A 23 4.844 -2.274 7.393 1.00 0.29 H new ATOM 0 H22 DG A 23 4.783 -2.835 5.719 1.00 0.29 H new TER 745 DG A 23